| 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 | 39.3 | Very low | 35.8 | Very low | 248 Ų | 248 | 142.6 Ų | 142.6 | 100% | 1.222 | 82% | 0.819 | S | S | * | * | 0 | 97.5 | 0 | -79.4 | 155.5 | 164.1 | 0 | 0 | 105.4 | |||||
| 2 | N | 35.1 | Very low | 36.8 | Very low | 158 Ų | 158 | 136 Ų | 136 | 85% | 0.845 | 81% | 0.805 | S | S | * | * | trans | -75.1 | 130.8 | -170 | -97.9 | 8.7 | 0 | 0 | 0 | 111.8 | ||||
| 3 | D | 30 | Very low | 38 | Very low | 153 Ų | 153 | 138.4 Ų | 138.4 | 82% | 0.818 | 80% | 0.799 | S | S | * | * | trans | 25.1 | 133.8 | 135.8 | -73.6 | -30.8 | 0 | 0 | 0 | 121.4 | ||||
| 4 | G | 34.1 | Very low | 39.2 | Very low | 66 Ų | 66 | 136.4 Ų | 136.4 | 68% | 0.68 | 78% | 0.784 | S | S | * | * | trans | -177.3 | 52.1 | 162 | 0 | 0 | 0 | 0 | 0 | 112.4 | V6 | G4-V6 PolarHBondContact O-N 3.08Å; G4-V6 VanDerWaalsContact O-N 3.08Å | ||
| 5 | T | 32.3 | Very low | 40.6 | Very low | 137 Ų | 137 | 131.9 Ų | 131.9 | 84% | 0.84 | 76% | 0.764 | S | S | * | * | trans | -61.8 | 104.6 | 162.1 | 45.3 | 0 | 0 | 0 | 0 | 108.5 | G7 | T5-G7 PolarHBondContact O-N 3.31Š| ||
| 6 | V | 38.4 | Very low | 42 | Very low | 134 Ų | 134 | 128.4 Ų | 128.4 | 81% | 0.812 | 75% | 0.749 | S | S | * | * | trans | -70.1 | 97.5 | 168 | 178.6 | 0 | 0 | 0 | 0 | 106.8 | G4 E8 | G4-V6 PolarHBondContact O-N 3.08Å; G4-V6 VanDerWaalsContact O-N 3.08Å; V6-E8 PolarHBondContact O-N 3.04Å | ||
| 7 | G | 32.9 | Very low | 43.3 | Very low | 63 Ų | 63 | 125.5 Ų | 125.5 | 65% | 0.649 | 74% | 0.735 | S | S | * | * | trans | -70.3 | 109 | 165.4 | 0 | 0 | 0 | 0 | 0 | 108.9 | T5 N9 | T5-G7 PolarHBondContact O-N 3.31Å; G7-N9 PolarHBondContact O-N 2.98Å | ||
| 8 | E | 37.7 | Very low | 44.6 | Very low | 177 Ų | 177 | 122.5 Ų | 122.5 | 83% | 0.827 | 72% | 0.721 | S | S | * | * | trans | -68.3 | 83.2 | 160.1 | -76.9 | 174.1 | 124.6 | 0 | 0 | 108.4 | V6 D10 | V6-E8 PolarHBondContact O-N 3.04Å; E8-D10 PolarHBondContact O-N 3.21Å | ||
| 9 | N | 31.8 | Very low | 45.8 | Very low | 137 Ų | 137 | 119.9 Ų | 119.9 | 73% | 0.733 | 71% | 0.709 | S | S | * | * | trans | -81.4 | 78 | 157.4 | -79.8 | -3.2 | 0 | 0 | 0 | 107.6 | G7 D11 | G7-N9 PolarHBondContact O-N 2.98Å; N9-D11 PolarHBondContact O-N 3.26Å; N9-D11 VanDerWaalsContact O-N 3.11Å | ||
| 10 | D | 41.3 | Very low | 47.3 | Very low | 152 Ų | 152 | 116.7 Ų | 116.7 | 81% | 0.813 | 70% | 0.697 | S | S | * | * | trans | -82.3 | 72.7 | 167 | -135.6 | 8.3 | 0 | 0 | 0 | 107.5 | E8 G12 | E8-D10 PolarHBondContact O-N 3.21Å; D10-G12 PolarHBondContact O-N 2.82Å | ||
| 11 | D | 41.3 | Very low | 49 | Very low | 144 Ų | 144 | 116.2 Ų | 116.2 | 77% | 0.77 | 69% | 0.69 | S | S | * | * | trans | -71.6 | 63.9 | 169.8 | -69 | -36.5 | 0 | 0 | 0 | 109 | N9 F13 | N9-D11 PolarHBondContact O-N 3.26Å; N9-D11 VanDerWaalsContact O-N 3.11Å; D11-F13 PolarHBondContact O-N 3.42Å; D11-F13 VanDerWaalsContact O-N 3.08Å | ||
| 12 | G | 47.1 | Very low | 51.2 | Low | 63 Ų | 63 | 108.3 Ų | 108.3 | 65% | 0.649 | 65% | 0.65 | S | S | * | * | trans | -62.6 | 109.1 | 171.9 | 0 | 0 | 0 | 0 | 0 | 109.2 | D10 D14 | D10-G12 PolarHBondContact O-N 2.82Å; G12-D14 PolarHBondContact O-N 3.11Å | ||
| 13 | F | 53.2 | Low | 53.6 | Low | 167 Ų | 167 | 106.2 Ų | 106.2 | 73% | 0.732 | 63% | 0.631 | S | S | * | * | trans | -59.1 | 101.9 | 175.6 | -165.3 | -92.2 | 0 | 0 | 0 | 109.4 | D11 C15 | D11-F13 PolarHBondContact O-N 3.42Å; D11-F13 VanDerWaalsContact O-N 3.08Å; F13-C15 PolarHBondContact O-N 3.37Å; F13-C15 PolarHBondContact O-SG 3.08Å; F13-C15 VanDerWaalsContact O-SG 3.39Å | ||
| 14 | D | 54.1 | Low | 56.4 | Low | 110 Ų | 110 | 105.4 Ų | 105.4 | 59% | 0.588 | 62% | 0.62 | S | S | * | * | trans | -62.4 | 101 | 178.1 | -177.9 | 12.9 | 0 | 0 | 0 | 109.4 | G12 S16 P17 | G12-D14 PolarHBondContact O-N 3.11Å; D14-S16 PolarHBondContact O-N 3.39Å; D14-S16 WeakPolarHBondContact OD1-CB 3.46Å; D14-S16 PolarHBondContact OD1-N 3.44Å; D14-P17 WeakPolarHBondContact O-CD 2.94Å | ||
| 15 | C | 60.1 | Low | 59.1 | Low | 70 Ų | 70 | 107.9 Ų | 107.9 | 47% | 0.473 | 61% | 0.609 | S | S | . | * | trans | -78 | -5.1 | 178.6 | -67.8 | 0 | 0 | 0 | 0 | 112.3 | F13 P17 C18 C19 | F13-C15 PolarHBondContact O-N 3.37Å; F13-C15 PolarHBondContact O-SG 3.08Å; F13-C15 VanDerWaalsContact O-SG 3.39Å; C15-P17 VanDerWaalsContact C-CD 3.47Å; C15-C18 PolarHBondContact O-N 2.93Å; C15-C19 PolarHBondContact O-N 2.89Å; C15-C19 PolarHBondContact O-SG 3.47Å; C15-C19 VanDerWaalsContact O-SG 3.39Å | ||
| 16 | S | 64.3 | Low | 61.9 | Low | 75 Ų | 75 | 106.1 Ų | 106.1 | 52% | 0.524 | 59% | 0.587 | S | S | . | * | H | α-helix | trans | -54.9 | -44.8 | -178.2 | -171 | 0 | 0 | 0 | 0 | 113.5 | D14 C18 C19 A20 | D14-S16 PolarHBondContact O-N 3.39Å; D14-S16 WeakPolarHBondContact OD1-CB 3.46Å; D14-S16 PolarHBondContact OD1-N 3.44Å; S16-C18 PolarHBondContact O-N 2.9Å; S16-C19 PolarHBondContact O-N 2.91Å; S16-A20 VanDerWaalsContact O-CB 3.29Å; S16-A20 WeakPolarHBondContact O-CB 3.39Å; S16-A20 PolarHBondContact O-N 3.5Å |
| 17 | P | 64.3 | Low | 64.4 | Low | 79 Ų | 79 | 100.5 Ų | 100.5 | 51% | 0.513 | 55% | 0.552 | S | S | . | * | H | α-helix | trans | -65.5 | -40 | 178.6 | -17.8 | 31.8 | 0 | 0 | 0 | 112.4 | D14 C15 A20 N21 | D14-P17 WeakPolarHBondContact O-CD 2.94Å; C15-P17 VanDerWaalsContact C-CD 3.47Å; P17-A20 PolarHBondContact O-N 2.93Å; P17-N21 WeakPolarHBondContact O-CB 3.35Å; P17-N21 PolarHBondContact O-N 3.36Å |
| 18 | C | 65.1 | Low | 67.3 | Low | 72 Ų | 72 | 99.9 Ų | 99.9 | 49% | 0.486 | 54% | 0.536 | S | S | . | . | H | α-helix | trans | -64.9 | -45.4 | 177.4 | -63.2 | 0 | 0 | 0 | 0 | 111.2 | C15 S16 N21 E22 | C15-C18 PolarHBondContact O-N 2.93Å; S16-C18 PolarHBondContact O-N 2.9Å; C18-N21 PolarHBondContact O-N 2.94Å; C18-E22 WeakPolarHBondContact O-CB 3.29Å; C18-E22 WeakPolarHBondContact O-CG 3.16Å; C18-E22 PolarHBondContact O-N 3.06Å |
| 19 | C | 67.8 | Low | 70 | Confident | 74 Ų | 74 | 96.1 Ų | 96.1 | 50% | 0.5 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -65.7 | -38.1 | 177.1 | -68.9 | 0 | 0 | 0 | 0 | 112.5 | C15 S16 R23 | C15-C19 PolarHBondContact O-N 2.89Å; C15-C19 PolarHBondContact O-SG 3.47Å; C15-C19 VanDerWaalsContact O-SG 3.39Å; S16-C19 PolarHBondContact O-N 2.91Å; C19-R23 WeakPolarHBondContact O-CB 3.25Å; C19-R23 PolarHBondContact O-N 3.45Å |
| 20 | A | 76.9 | Confident | 73 | Confident | 55 Ų | 55 | 90 Ų | 90 | 46% | 0.455 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -66 | -45.5 | 176.3 | 0 | 0 | 0 | 0 | 0 | 111.5 | S16 P17 R23 F24 | S16-A20 VanDerWaalsContact O-CB 3.29Å; S16-A20 WeakPolarHBondContact O-CB 3.39Å; S16-A20 PolarHBondContact O-N 3.5Å; P17-A20 PolarHBondContact O-N 2.93Å; A20-R23 PolarHBondContact O-N 2.92Å; A20-F24 WeakPolarHBondContact O-CB 3.34Å; A20-F24 PolarHBondContact O-N 3.12Å |
| 21 | N | 82.4 | Confident | 75.5 | Confident | 106 Ų | 106 | 83.5 Ų | 83.5 | 57% | 0.567 | 45% | 0.45 | S | S | * | . | H | α-helix | trans | -64.7 | -42.2 | 179 | -167.1 | 20.5 | 0 | 0 | 0 | 111.8 | P17 C18 F24 R25 | P17-N21 WeakPolarHBondContact O-CB 3.35Å; P17-N21 PolarHBondContact O-N 3.36Å; C18-N21 PolarHBondContact O-N 2.94Å; N21-F24 PolarHBondContact O-N 3.3Å; N21-R25 VanDerWaalsContact O-CB 3.25Å; N21-R25 WeakPolarHBondContact O-CB 3.33Å; N21-R25 PolarHBondContact O-N 3.31Å |
| 22 | E | 84.6 | Confident | 78.1 | Confident | 82 Ų | 82 | 82 Ų | 82 | 38% | 0.383 | 44% | 0.441 | S | S | . | . | H | α-helix | trans | -64.4 | -41.7 | 175.6 | -77.3 | -62.9 | 164.2 | 0 | 0 | 112.6 | C18 R25 R26 | C18-E22 WeakPolarHBondContact O-CB 3.29Å; C18-E22 WeakPolarHBondContact O-CG 3.16Å; C18-E22 PolarHBondContact O-N 3.06Å; E22-R25 IonicContact OE1-CZ 3.93Å; E22-R25 VanDerWaalsContact OE1-CZ 3.27Å; E22-R25 IonicContact OE1-NE 3.98Å; E22-R25 IonicContact OE1-NH1 3.35Å; E22-R25 IonicContact OE1-NH2 3.27Å; E22-R25 PolarHBondContact OE1-NH2 3.39Å; E22-R25 IonicContact OE2-CZ 2.71Å; E22-R25 VanDerWaalsContact OE2-CZ 3.26Å; E22-R25 IonicContact OE2-NE 3.75Å; E22-R25 PolarHBondContact OE2-NE 2.92Å; E22-R25 IonicContact OE2-NH2 2.73Å; E22-R25 PolarHBondContact OE2-NH2 2.88Å; E22-R26 WeakPolarHBondContact O-CB 3.35Å; E22-R26 PolarHBondContact O-N 3.39Å |
| 23 | R | 86.3 | Confident | 80.4 | Confident | 114 Ų | 114 | 79.9 Ų | 79.9 | 43% | 0.43 | 42% | 0.415 | S | S | . | . | H | α-helix | trans | -61.9 | -49.2 | 174.7 | -173.1 | -169.7 | -57.6 | 177.5 | 4.1 | 111 | C19 A20 R25 R26 I27 | C19-R23 WeakPolarHBondContact O-CB 3.25Å; C19-R23 PolarHBondContact O-N 3.45Å; A20-R23 PolarHBondContact O-N 2.92Å; R23-R25 PolarHBondContact O-N 2.94Å; R23-R26 WeakPolarHBondContact O-CB 3.28Å; R23-R26 PolarHBondContact O-N 3.47Å; R23-I27 HydrophobicContact CG-CD1 3.92Å; R23-I27 WeakPolarHBondContact O-CG1 3.45Å; R23-I27 PolarHBondContact O-N 3.32Å |
| 24 | F | 88.8 | Confident | 82.5 | Confident | 137 Ų | 137 | 72 Ų | 72 | 60% | 0.601 | 38% | 0.38 | S | S | * | . | H | α-helix | trans | -58.3 | -49 | 178.6 | 178.7 | -104.1 | 0 | 0 | 0 | 111 | A20 N21 R26 I27 V28 | A20-F24 WeakPolarHBondContact O-CB 3.34Å; A20-F24 PolarHBondContact O-N 3.12Å; N21-F24 PolarHBondContact O-N 3.3Å; F24-R26 VanDerWaalsContact C-N 3.26Å; F24-R26 PolarHBondContact O-N 2.88Å; F24-I27 PolarHBondContact O-N 3.07Å; F24-V28 HydrophobicContact CD1-CG2 4.14Å; F24-V28 HydrophobicContact CD2-CG2 4.2Å; F24-V28 HydrophobicContact CE1-CG2 3.75Å; F24-V28 HydrophobicContact CE2-CG2 3.81Å; F24-V28 HydrophobicContact CG-CG2 4.36Å; F24-V28 HydrophobicContact CZ-CG2 3.57Å; F24-V28 WeakPolarHBondContact O-CB 3.35Å; F24-V28 VanDerWaalsContact O-CG2 3.31Å; F24-V28 WeakPolarHBondContact O-CG2 3.45Å; F24-V28 PolarHBondContact O-N 2.95Å |
| 25 | R | 91 | Very high | 84.4 | Confident | 117 Ų | 117 | 68 Ų | 68 | 44% | 0.442 | 36% | 0.358 | S | S | . | . | H | α-helix | trans | -58.5 | -37.2 | 177.2 | -171.2 | 174.7 | 73.7 | 169.5 | 2.6 | 112.5 | N21 E22 R23 K29 | N21-R25 VanDerWaalsContact O-CB 3.25Å; N21-R25 WeakPolarHBondContact O-CB 3.33Å; N21-R25 PolarHBondContact O-N 3.31Å; E22-R25 IonicContact OE1-CZ 3.93Å; E22-R25 VanDerWaalsContact OE1-CZ 3.27Å; E22-R25 IonicContact OE1-NE 3.98Å; E22-R25 IonicContact OE1-NH1 3.35Å; E22-R25 IonicContact OE1-NH2 3.27Å; E22-R25 PolarHBondContact OE1-NH2 3.39Å; E22-R25 IonicContact OE2-CZ 2.71Å; E22-R25 VanDerWaalsContact OE2-CZ 3.26Å; E22-R25 IonicContact OE2-NE 3.75Å; E22-R25 PolarHBondContact OE2-NE 2.92Å; E22-R25 IonicContact OE2-NH2 2.73Å; E22-R25 PolarHBondContact OE2-NH2 2.88Å; R23-R25 PolarHBondContact O-N 2.94Å; R25-K29 HydrophobicContact CG-CD 4.39Å; R25-K29 WeakPolarHBondContact O-CB 3.41Å; R25-K29 VanDerWaalsContact O-CG 3.26Å; R25-K29 WeakPolarHBondContact O-CG 3.32Å; R25-K29 PolarHBondContact O-N 3.11Å |
| 26 | R | 90.3 | Very high | 86.1 | Confident | 101 Ų | 101 | 67.8 Ų | 67.8 | 38% | 0.381 | 35% | 0.352 | S | S | . | . | H | α-helix | trans | -66.5 | -51.4 | 175.5 | -172.9 | -174.8 | -53.5 | 158.6 | 3.8 | 111.4 | E22 R23 F24 V28 K29 T30 E339 | E22-R26 WeakPolarHBondContact O-CB 3.35Å; E22-R26 PolarHBondContact O-N 3.39Å; R23-R26 WeakPolarHBondContact O-CB 3.28Å; R23-R26 PolarHBondContact O-N 3.47Å; F24-R26 VanDerWaalsContact C-N 3.26Å; F24-R26 PolarHBondContact O-N 2.88Å; R26-V28 VanDerWaalsContact C-N 3.34Å; R26-V28 PolarHBondContact O-N 3.4Å; R26-K29 PolarHBondContact O-N 2.95Å; R26-T30 PolarHBondContact O-N 3.19Å; R26-T30 PolarHBondContact O-OG1 3.29Å; R26-T30 VanDerWaalsContact O-OG1 3.1Å; R26-E339 VanDerWaalsContact CD-OE1 3.24Å; R26-E339 WeakPolarHBondContact CD-OE1 3.44Å; R26-E339 IonicContact CZ-OE1 2.72Å; R26-E339 IonicContact NE-OE1 3.96Å; R26-E339 PolarHBondContact NE-OE1 2.78Å; R26-E339 IonicContact NH1-OE1 3.6Å; R26-E339 PolarHBondContact NH1-OE1 3.23Å; R26-E339 IonicContact NH1-OE2 3.35Å |
| 27 | I | 92.2 | Very high | 87.7 | Confident | 15 Ų | 15 | 64.2 Ų | 64.2 | 8% | 0.077 | 33% | 0.327 | C | S | . | . | H | α-helix | trans | -57.3 | -49.6 | 178.6 | -66.9 | 167.5 | 0 | 0 | 0 | 109.9 | R23 F24 K29 T30 V31 I333 S336 W337 | R23-I27 HydrophobicContact CG-CD1 3.92Å; R23-I27 WeakPolarHBondContact O-CG1 3.45Å; R23-I27 PolarHBondContact O-N 3.32Å; F24-I27 PolarHBondContact O-N 3.07Å; I27-K29 PolarHBondContact O-N 3.43Å; I27-T30 PolarHBondContact O-N 3.27Å; I27-V31 HydrophobicContact CG2-CG2 4.18Å; I27-V31 WeakPolarHBondContact O-CG2 3.31Å; I27-V31 PolarHBondContact O-N 2.84Å; I27-I333 HydrophobicContact CG2-CG2 4.28Å; I27-S336 WeakPolarHBondContact CG1-O 3.33Å; I27-W337 HydrophobicContact CD1-CE3 4.29Å |
| 28 | V | 93.8 | Very high | 89.1 | Confident | 51 Ų | 51 | 60.4 Ų | 60.4 | 31% | 0.309 | 30% | 0.303 | S | S | . | . | H | α-helix | trans | -58.2 | -47.1 | 178.9 | 171.1 | 0 | 0 | 0 | 0 | 111.2 | F24 R26 T30 V31 L32 | F24-V28 HydrophobicContact CD1-CG2 4.14Å; F24-V28 HydrophobicContact CD2-CG2 4.2Å; F24-V28 HydrophobicContact CE1-CG2 3.75Å; F24-V28 HydrophobicContact CE2-CG2 3.81Å; F24-V28 HydrophobicContact CG-CG2 4.36Å; F24-V28 HydrophobicContact CZ-CG2 3.57Å; F24-V28 WeakPolarHBondContact O-CB 3.35Å; F24-V28 VanDerWaalsContact O-CG2 3.31Å; F24-V28 WeakPolarHBondContact O-CG2 3.45Å; F24-V28 PolarHBondContact O-N 2.95Å; R26-V28 VanDerWaalsContact C-N 3.34Å; R26-V28 PolarHBondContact O-N 3.4Å; V28-T30 VanDerWaalsContact C-N 3.35Å; V28-T30 PolarHBondContact O-N 3.07Å; V28-V31 PolarHBondContact O-N 3.26Å; V28-L32 HydrophobicContact CG1-CD1 3.69Å; V28-L32 HydrophobicContact CG1-CG 4.19Å; V28-L32 VanDerWaalsContact O-CB 3.31Å; V28-L32 WeakPolarHBondContact O-CB 3.33Å; V28-L32 VanDerWaalsContact O-CG 3.22Å; V28-L32 WeakPolarHBondContact O-CG 3.48Å; V28-L32 PolarHBondContact O-N 3.13Å |
| 29 | K | 94.2 | Very high | 90.4 | Very high | 98 Ų | 98 | 61 Ų | 61 | 43% | 0.426 | 30% | 0.3 | S | S | . | . | H | α-helix | trans | -61.2 | -41.9 | 177.3 | -77.6 | 175.5 | 179.8 | 177.6 | 0 | 112.5 | R25 R26 I27 L33 | R25-K29 HydrophobicContact CG-CD 4.39Å; R25-K29 WeakPolarHBondContact O-CB 3.41Å; R25-K29 VanDerWaalsContact O-CG 3.26Å; R25-K29 WeakPolarHBondContact O-CG 3.32Å; R25-K29 PolarHBondContact O-N 3.11Å; R26-K29 PolarHBondContact O-N 2.95Å; I27-K29 PolarHBondContact O-N 3.43Å; K29-L33 WeakPolarHBondContact O-CB 3.48Å; K29-L33 WeakPolarHBondContact O-CD1 3.35Å; K29-L33 WeakPolarHBondContact O-CG 3.35Å; K29-L33 PolarHBondContact O-N 3.26Å |
| 30 | T | 93.5 | Very high | 91.7 | Very high | 7 Ų | 7 | 57.9 Ų | 57.9 | 4% | 0.043 | 28% | 0.279 | C | S | . | . | H | α-helix | trans | -65.5 | -46.7 | 178.6 | -62.4 | 0 | 0 | 0 | 0 | 111.2 | R26 I27 V28 L33 G34 L296 M304 | R26-T30 PolarHBondContact O-N 3.19Å; R26-T30 PolarHBondContact O-OG1 3.29Å; R26-T30 VanDerWaalsContact O-OG1 3.1Å; I27-T30 PolarHBondContact O-N 3.27Å; V28-T30 VanDerWaalsContact C-N 3.35Å; V28-T30 PolarHBondContact O-N 3.07Å; T30-L33 PolarHBondContact O-N 3.07Å; T30-G34 PolarHBondContact O-N 3.36Å; T30-L296 HydrophobicContact CG2-CD1 3.76Å; T30-M304 HydrophobicContact CG2-CE 4.11Å; T30-M304 HydrophobicContact CG2-CG 3.79Å |
| 31 | V | 94.2 | Very high | 92.4 | Very high | 17 Ų | 17 | 58.6 Ų | 58.6 | 10% | 0.103 | 27% | 0.273 | C | S | . | . | H | α-helix | trans | -65.4 | -44.7 | 179 | 173.4 | 0 | 0 | 0 | 0 | 110.9 | I27 V28 L33 G34 Q35 V329 I333 | I27-V31 HydrophobicContact CG2-CG2 4.18Å; I27-V31 WeakPolarHBondContact O-CG2 3.31Å; I27-V31 PolarHBondContact O-N 2.84Å; V28-V31 PolarHBondContact O-N 3.26Å; V31-L33 VanDerWaalsContact C-N 3.33Å; V31-L33 PolarHBondContact O-N 3.43Å; V31-G34 WeakPolarHBondContact O-CA 3.45Å; V31-G34 PolarHBondContact O-N 3.26Å; V31-G34 VanDerWaalsContact O-N 3.13Å; V31-Q35 HydrophobicContact CG1-CG 4.44Å; V31-Q35 WeakPolarHBondContact O-CG 3.33Å; V31-Q35 PolarHBondContact O-N 3.04Å; V31-V329 HydrophobicContact CG1-CG1 4.46Å; V31-I333 HydrophobicContact CG2-CG1 3.83Å |
| 32 | L | 95.9 | Very high | 92.8 | Very high | 112 Ų | 112 | 54.3 Ų | 54.3 | 59% | 0.586 | 25% | 0.251 | S | S | * | . | H | α-helix | trans | -61.3 | -40.5 | 176.4 | -72.9 | 175.1 | 0 | 0 | 0 | 112.3 | V28 G34 Q35 L36 | V28-L32 HydrophobicContact CG1-CD1 3.69Å; V28-L32 HydrophobicContact CG1-CG 4.19Å; V28-L32 VanDerWaalsContact O-CB 3.31Å; V28-L32 WeakPolarHBondContact O-CB 3.33Å; V28-L32 VanDerWaalsContact O-CG 3.22Å; V28-L32 WeakPolarHBondContact O-CG 3.48Å; V28-L32 PolarHBondContact O-N 3.13Å; L32-G34 VanDerWaalsContact C-N 3.35Å; L32-Q35 PolarHBondContact O-N 2.86Å; L32-L36 WeakPolarHBondContact O-CB 3.33Å; L32-L36 PolarHBondContact O-N 2.9Å |
| 33 | L | 96.2 | Very high | 93.1 | Very high | 19 Ų | 19 | 52 Ų | 52 | 10% | 0.099 | 25% | 0.246 | C | C | . | . | H | α-helix | trans | -63.9 | -41.1 | 173.1 | -83.7 | 164.4 | 0 | 0 | 0 | 111.9 | K29 T30 V31 L36 L37 F292 V295 L296 | K29-L33 WeakPolarHBondContact O-CB 3.48Å; K29-L33 WeakPolarHBondContact O-CD1 3.35Å; K29-L33 WeakPolarHBondContact O-CG 3.35Å; K29-L33 PolarHBondContact O-N 3.26Å; T30-L33 PolarHBondContact O-N 3.07Å; V31-L33 VanDerWaalsContact C-N 3.33Å; V31-L33 PolarHBondContact O-N 3.43Å; L33-L36 PolarHBondContact O-N 3.12Å; L33-L37 WeakPolarHBondContact O-CG 3.42Å; L33-L37 PolarHBondContact O-N 2.94Å; L33-F292 HydrophobicContact CD2-CD1 3.94Å; L33-V295 HydrophobicContact CD1-CG1 3.83Å; L33-V295 HydrophobicContact CD2-CB 4.47Å; L33-V295 HydrophobicContact CD2-CG1 4.14Å; L33-L296 HydrophobicContact CB-CD1 4Å |
| 34 | G | 95.8 | Very high | 93.4 | Very high | 0 Ų | 0 | 46.7 Ų | 46.7 | 0% | 0 | 23% | 0.227 | C | C | . | . | H | α-helix | trans | -58.7 | -47.1 | 173.8 | 0 | 0 | 0 | 0 | 0 | 112.2 | T30 V31 L32 L36 L37 S38 S308 | T30-G34 PolarHBondContact O-N 3.36Å; V31-G34 WeakPolarHBondContact O-CA 3.45Å; V31-G34 PolarHBondContact O-N 3.26Å; V31-G34 VanDerWaalsContact O-N 3.13Å; L32-G34 VanDerWaalsContact C-N 3.35Å; G34-L36 PolarHBondContact O-N 3.15Å; G34-L37 WeakPolarHBondContact O-CB 3.23Å; G34-L37 PolarHBondContact O-N 3.02Å; G34-S38 PolarHBondContact O-N 3.47Å; G34-S38 PolarHBondContact O-OG 2.59Å; G34-S38 VanDerWaalsContact O-OG 3.11Å; G34-S308 VanDerWaalsContact CA-CB 3.49Å; G34-S308 WeakPolarHBondContact CA-OG 3.17Å |
| 35 | Q | 95.3 | Very high | 93.3 | Very high | 27 Ų | 27 | 43 Ų | 43 | 13% | 0.126 | 22% | 0.222 | C | C | . | . | H | α-helix | trans | -67.4 | -35.6 | 178 | -62.1 | -44.3 | -56.7 | 0 | 0 | 112.7 | V31 L32 L37 S38 L39 T311 | V31-Q35 HydrophobicContact CG1-CG 4.44Å; V31-Q35 WeakPolarHBondContact O-CG 3.33Å; V31-Q35 PolarHBondContact O-N 3.04Å; L32-Q35 PolarHBondContact O-N 2.86Å; Q35-L37 VanDerWaalsContact C-N 3.3Å; Q35-L37 PolarHBondContact O-N 3.01Å; Q35-S38 PolarHBondContact O-N 3.32Å; Q35-L39 WeakPolarHBondContact O-CG 3.43Å; Q35-L39 PolarHBondContact O-N 3.01Å; Q35-T311 PolarHBondContact NE2-OG1 2.97Å; Q35-T311 PolarHBondContact OE1-OG1 3.13Å |
| 36 | L | 96.1 | Very high | 93 | Very high | 65 Ų | 65 | 41 Ų | 41 | 34% | 0.34 | 22% | 0.219 | S | C | . | . | H | α-helix | trans | -62.7 | -40 | 174.2 | -176 | 59.7 | 0 | 0 | 0 | 111.5 | L32 L33 G34 L39 C40 F292 | L32-L36 WeakPolarHBondContact O-CB 3.33Å; L32-L36 PolarHBondContact O-N 2.9Å; L33-L36 PolarHBondContact O-N 3.12Å; G34-L36 PolarHBondContact O-N 3.15Å; L36-L39 PolarHBondContact O-N 3.45Å; L36-C40 PolarHBondContact O-N 2.95Å; L36-C40 PolarHBondContact O-SG 3.43Å; L36-C40 VanDerWaalsContact O-SG 3.34Å; L36-F292 HydrophobicContact CD2-CD1 4.06Å; L36-F292 HydrophobicContact CD2-CD2 3.64Å; L36-F292 HydrophobicContact CD2-CE1 3.84Å; L36-F292 HydrophobicContact CD2-CE2 3.39Å; L36-F292 HydrophobicContact CD2-CG 3.99Å; L36-F292 HydrophobicContact CD2-CZ 3.5Å; L36-F292 HydrophobicContact CG-CD2 3.96Å; L36-F292 HydrophobicContact CG-CE2 3.97Å |
| 37 | L | 96.1 | Very high | 93 | Very high | 0 Ų | 0 | 36.6 Ų | 36.6 | 0% | 0 | 20% | 0.203 | C | C | . | . | H | α-helix | trans | -63.7 | -45.1 | 174.3 | -75 | 169.9 | 0 | 0 | 0 | 112.2 | L33 G34 Q35 L39 C40 Q41 F289 F292 V293 L296 F305 L309 | L33-L37 WeakPolarHBondContact O-CG 3.42Å; L33-L37 PolarHBondContact O-N 2.94Å; G34-L37 WeakPolarHBondContact O-CB 3.23Å; G34-L37 PolarHBondContact O-N 3.02Å; Q35-L37 VanDerWaalsContact C-N 3.3Å; Q35-L37 PolarHBondContact O-N 3.01Å; L37-L39 VanDerWaalsContact C-N 3.29Å; L37-L39 PolarHBondContact O-N 3.47Å; L37-C40 WeakPolarHBondContact O-CB 3.3Å; L37-C40 PolarHBondContact O-N 3.08Å; L37-Q41 WeakPolarHBondContact O-CB 3.37Å; L37-Q41 PolarHBondContact O-N 3.29Å; L37-F289 HydrophobicContact CB-CD2 4.45Å; L37-F289 HydrophobicContact CB-CE2 4.45Å; L37-F289 HydrophobicContact CD2-CD2 3.74Å; L37-F289 HydrophobicContact CD2-CE2 4.17Å; L37-F289 HydrophobicContact CD2-CG 4.18Å; L37-F289 VanDerWaalsContact CD2-O 3.27Å; L37-F289 WeakPolarHBondContact CD2-O 3.32Å; L37-F292 HydrophobicContact CD2-CB 3.57Å; L37-F292 HydrophobicContact CG-CB 4.02Å; L37-V293 HydrophobicContact CD1-CG2 4.02Å; L37-V293 HydrophobicContact CD2-CB 4.41Å; L37-V293 HydrophobicContact CD2-CG2 3.5Å; L37-V293 VanDerWaalsContact CD2-CG2 3.5Å; L37-V293 HydrophobicContact CG-CG2 4.4Å; L37-L296 HydrophobicContact CD1-CB 3.99Å; L37-L296 HydrophobicContact CD1-CD2 3.45Å; L37-L296 VanDerWaalsContact CD1-CD2 3.45Å; L37-L296 HydrophobicContact CD1-CG 4.34Å; L37-F305 HydrophobicContact CD1-CD2 3.98Å; L37-F305 HydrophobicContact CD1-CE2 4.26Å; L37-L309 HydrophobicContact CB-CD2 4.27Å |
| 38 | S | 93.8 | Very high | 92.7 | Very high | 0 Ų | 0 | 37.8 Ų | 37.8 | 0% | 0 | 21% | 0.211 | C | C | . | . | H | α-helix | trans | -62 | -38 | 177.2 | -57.3 | 0 | 0 | 0 | 0 | 112.4 | G34 Q35 Q41 C42 S308 T311 | G34-S38 PolarHBondContact O-N 3.47Å; G34-S38 PolarHBondContact O-OG 2.59Å; G34-S38 VanDerWaalsContact O-OG 3.11Å; Q35-S38 PolarHBondContact O-N 3.32Å; S38-Q41 PolarHBondContact O-N 3.22Å; S38-C42 VanDerWaalsContact O-CB 3.26Å; S38-C42 WeakPolarHBondContact O-CB 3.09Å; S38-C42 PolarHBondContact O-N 3.06Å; S38-S308 PolarHBondContact OG-O 2.86Å; S38-T311 WeakPolarHBondContact CB-OG1 3.34Å; S38-T311 PolarHBondContact OG-OG1 3.34Å |
| 39 | L | 93.1 | Very high | 92.2 | Very high | 84 Ų | 84 | 41.2 Ų | 41.2 | 44% | 0.44 | 22% | 0.224 | S | C | . | . | H | α-helix | trans | -64.2 | -44.6 | 172.9 | -75.4 | 169.1 | 0 | 0 | 0 | 112.2 | Q35 L36 L37 Q41 C42 A43 Y315 | Q35-L39 WeakPolarHBondContact O-CG 3.43Å; Q35-L39 PolarHBondContact O-N 3.01Å; L36-L39 PolarHBondContact O-N 3.45Å; L37-L39 VanDerWaalsContact C-N 3.29Å; L37-L39 PolarHBondContact O-N 3.47Å; L39-Q41 VanDerWaalsContact C-N 3.31Å; L39-Q41 PolarHBondContact O-N 3.01Å; L39-C42 PolarHBondContact O-N 3.44Å; L39-A43 WeakPolarHBondContact O-CB 3.05Å; L39-A43 PolarHBondContact O-N 3.43Å; L39-Y315 HydrophobicContact CD2-CE1 3.85Å; L39-Y315 HydrophobicContact CD2-CE2 4.31Å; L39-Y315 WeakPolarHBondContact CD2-OH 3.28Å; L39-Y315 WeakPolarHBondContact CG-OH 3.45Å |
| 40 | C | 94.9 | Very high | 91.6 | Very high | 9 Ų | 9 | 42.7 Ų | 42.7 | 6% | 0.061 | 23% | 0.228 | C | C | . | . | H | α-helix | trans | -60.2 | -42.9 | 175.1 | -71.6 | 0 | 0 | 0 | 0 | 111.6 | L36 L37 A43 A44 F289 | L36-C40 PolarHBondContact O-N 2.95Å; L36-C40 PolarHBondContact O-SG 3.43Å; L36-C40 VanDerWaalsContact O-SG 3.34Å; L37-C40 WeakPolarHBondContact O-CB 3.3Å; L37-C40 PolarHBondContact O-N 3.08Å; C40-A43 PolarHBondContact O-N 3.22Å; C40-A44 WeakPolarHBondContact O-CB 3.2Å; C40-A44 PolarHBondContact O-N 2.93Å; C40-F289 HydrophobicContact CB-CB 4.05Å; C40-F289 HydrophobicContact CB-CD2 4.31Å |
| 41 | Q | 92.3 | Very high | 91.1 | Very high | 70 Ų | 70 | 42.3 Ų | 42.3 | 33% | 0.327 | 23% | 0.226 | S | C | . | . | H | α-helix | trans | -66 | -44.8 | 178.6 | -172.2 | 66.6 | 0.9 | 0 | 0 | 111.7 | L37 S38 L39 A44 A45 F289 A312 | L37-Q41 WeakPolarHBondContact O-CB 3.37Å; L37-Q41 PolarHBondContact O-N 3.29Å; S38-Q41 PolarHBondContact O-N 3.22Å; L39-Q41 VanDerWaalsContact C-N 3.31Å; L39-Q41 PolarHBondContact O-N 3.01Å; Q41-A44 PolarHBondContact O-N 3.38Å; Q41-A45 WeakPolarHBondContact O-CB 3.49Å; Q41-A45 PolarHBondContact O-N 2.96Å; Q41-F289 HydrophobicContact CB-CD2 4.33Å; Q41-F289 HydrophobicContact CB-CE2 4.09Å; Q41-A312 HydrophobicContact CB-CB 3.97Å; Q41-A312 HydrophobicContact CG-CB 4.02Å |
| 42 | C | 90.3 | Very high | 90.3 | Very high | 15 Ų | 15 | 44.5 Ų | 44.5 | 10% | 0.101 | 24% | 0.237 | C | C | . | . | H | α-helix | trans | -60.9 | -45.2 | 175.3 | 177.5 | 0 | 0 | 0 | 0 | 111.6 | S38 L39 A44 A45 I46 Y315 | S38-C42 VanDerWaalsContact O-CB 3.26Å; S38-C42 WeakPolarHBondContact O-CB 3.09Å; S38-C42 PolarHBondContact O-N 3.06Å; L39-C42 PolarHBondContact O-N 3.44Å; C42-A44 VanDerWaalsContact C-N 3.32Å; C42-A44 PolarHBondContact O-N 2.89Å; C42-A45 PolarHBondContact O-N 3.49Å; C42-I46 WeakPolarHBondContact O-CB 3.48Å; C42-I46 WeakPolarHBondContact O-CG1 3.28Å; C42-I46 PolarHBondContact O-N 3.29Å; C42-I46 VanDerWaalsContact SG-CD1 3.54Å; C42-Y315 HydrophobicContact CB-CD2 3.66Å; C42-Y315 HydrophobicContact CB-CE2 4.02Å; C42-Y315 HydrophobicContact CB-CG 4.44Å; C42-Y315 WeakPolarHBondContact SG-CD2 3.16Å |
| 43 | A | 91.3 | Very high | 89.3 | Confident | 33 Ų | 33 | 42.4 Ų | 42.4 | 27% | 0.273 | 23% | 0.232 | S | C | . | . | H | α-helix | trans | -59.5 | -42.2 | 175.5 | 0 | 0 | 0 | 0 | 0 | 112 | L39 C40 T47 | L39-A43 WeakPolarHBondContact O-CB 3.05Å; L39-A43 PolarHBondContact O-N 3.43Å; C40-A43 PolarHBondContact O-N 3.22Å; A43-T47 WeakPolarHBondContact O-CB 3.35Å; A43-T47 PolarHBondContact O-N 3.21Å; A43-T47 PolarHBondContact O-OG1 2.97Å |
| 44 | A | 91.4 | Very high | 88.3 | Confident | 4 Ų | 4 | 49.8 Ų | 49.8 | 3% | 0.033 | 26% | 0.258 | C | S | . | . | H | α-helix | trans | -63.9 | -42.7 | 175.6 | 0 | 0 | 0 | 0 | 0 | 112.1 | C40 Q41 C42 T48 F282 M286 | C40-A44 WeakPolarHBondContact O-CB 3.2Å; C40-A44 PolarHBondContact O-N 2.93Å; Q41-A44 PolarHBondContact O-N 3.38Å; C42-A44 VanDerWaalsContact C-N 3.32Å; C42-A44 PolarHBondContact O-N 2.89Å; A44-T48 WeakPolarHBondContact O-CB 3.34Å; A44-T48 PolarHBondContact O-N 3.49Å; A44-T48 PolarHBondContact O-OG1 2.71Å; A44-F282 HydrophobicContact CB-CD2 3.96Å; A44-F282 HydrophobicContact CB-CE2 3.87Å; A44-F282 WeakPolarHBondContact O-CD2 3.25Å; A44-M286 HydrophobicContact CB-CG 4.27Å; A44-M286 HydrophobicContact CB-SD 3.81Å |
| 45 | A | 87.2 | Confident | 86.9 | Confident | 60 Ų | 60 | 51.2 Ų | 51.2 | 50% | 0.496 | 26% | 0.264 | S | S | . | . | H | α-helix | trans | -64.1 | -50.5 | 177.7 | 0 | 0 | 0 | 0 | 0 | 112 | Q41 C42 T47 T48 Q49 | Q41-A45 WeakPolarHBondContact O-CB 3.49Å; Q41-A45 PolarHBondContact O-N 2.96Å; C42-A45 PolarHBondContact O-N 3.49Å; A45-T47 VanDerWaalsContact C-N 3.34Å; A45-T47 PolarHBondContact O-N 2.85Å; A45-T48 WeakPolarHBondContact O-CB 3.48Å; A45-T48 PolarHBondContact O-N 2.81Å; A45-Q49 PolarHBondContact O-N 3.21Å |
| 46 | I | 85.7 | Confident | 85.4 | Confident | 74 Ų | 74 | 53.8 Ų | 53.8 | 38% | 0.379 | 28% | 0.278 | S | S | . | . | H | α-helix | trans | -58 | -47.7 | 177.1 | -69.5 | 170.9 | 0 | 0 | 0 | 110.4 | C42 T48 Q49 Y50 | C42-I46 WeakPolarHBondContact O-CB 3.48Å; C42-I46 WeakPolarHBondContact O-CG1 3.28Å; C42-I46 PolarHBondContact O-N 3.29Å; C42-I46 VanDerWaalsContact SG-CD1 3.54Å; I46-T48 VanDerWaalsContact C-N 3.28Å; I46-T48 PolarHBondContact O-N 2.95Å; I46-Q49 WeakPolarHBondContact O-CB 3.44Å; I46-Q49 PolarHBondContact O-N 3.44Å; I46-Q49 VanDerWaalsContact O-N 3.13Å; I46-Y50 HydrophobicContact CG2-CD2 3.6Å; I46-Y50 HydrophobicContact CG2-CE2 3.59Å; I46-Y50 VanDerWaalsContact O-CD2 3.31Å; I46-Y50 WeakPolarHBondContact O-CD2 3.28Å; I46-Y50 PolarHBondContact O-N 3.3Å |
| 47 | T | 88.9 | Confident | 83.9 | Confident | 8 Ų | 8 | 51.7 Ų | 51.7 | 5% | 0.049 | 27% | 0.266 | C | S | . | . | H | α-helix | trans | -60 | -41.5 | -180 | -59.2 | 0 | 0 | 0 | 0 | 111.3 | A43 A45 Y50 L51 L278 F282 | A43-T47 WeakPolarHBondContact O-CB 3.35Å; A43-T47 PolarHBondContact O-N 3.21Å; A43-T47 PolarHBondContact O-OG1 2.97Å; A45-T47 VanDerWaalsContact C-N 3.34Å; A45-T47 PolarHBondContact O-N 2.85Å; T47-Y50 PolarHBondContact O-N 2.9Å; T47-L51 HydrophobicContact CG2-CD1 4.03Å; T47-L51 WeakPolarHBondContact O-CB 3.48Å; T47-L51 WeakPolarHBondContact O-CD1 3.38Å; T47-L51 PolarHBondContact O-N 2.96Å; T47-L278 HydrophobicContact CG2-CB 3.89Å; T47-L278 HydrophobicContact CG2-CD2 3.98Å; T47-L278 WeakPolarHBondContact CG2-O 3.39Å; T47-F282 HydrophobicContact CG2-CB 3.87Å |
| 48 | T | 86.6 | Confident | 82.3 | Confident | 40 Ų | 40 | 54.3 Ų | 54.3 | 25% | 0.245 | 28% | 0.279 | C | S | . | . | H | α-helix | trans | -62.8 | -43.9 | 175 | -59.9 | 0 | 0 | 0 | 0 | 111.8 | A44 A45 I46 Y50 L51 D52 Q63 F282 | A44-T48 WeakPolarHBondContact O-CB 3.34Å; A44-T48 PolarHBondContact O-N 3.49Å; A44-T48 PolarHBondContact O-OG1 2.71Å; A45-T48 WeakPolarHBondContact O-CB 3.48Å; A45-T48 PolarHBondContact O-N 2.81Å; I46-T48 VanDerWaalsContact C-N 3.28Å; I46-T48 PolarHBondContact O-N 2.95Å; T48-Y50 PolarHBondContact O-N 3.18Å; T48-L51 WeakPolarHBondContact O-CB 3.24Å; T48-L51 PolarHBondContact O-N 3.28Å; T48-D52 PolarHBondContact O-N 3.18Å; T48-Q63 PolarHBondContact OG1-NE2 3.27Å; T48-F282 WeakPolarHBondContact OG1-CD2 3.45Å; T48-F282 VanDerWaalsContact OG1-CE2 3.23Å; T48-F282 WeakPolarHBondContact OG1-CE2 3.34Å |
| 49 | Q | 83 | Confident | 81.3 | Confident | 124 Ų | 124 | 54.7 Ų | 54.7 | 58% | 0.579 | 28% | 0.282 | S | S | * | . | H | α-helix | trans | -63.9 | -39.4 | 177.9 | -168.4 | -178.4 | 30.8 | 0 | 0 | 112.3 | A45 I46 S53 | A45-Q49 PolarHBondContact O-N 3.21Å; I46-Q49 WeakPolarHBondContact O-CB 3.44Å; I46-Q49 PolarHBondContact O-N 3.44Å; I46-Q49 VanDerWaalsContact O-N 3.13Å; Q49-S53 VanDerWaalsContact O-CB 3.24Å; Q49-S53 WeakPolarHBondContact O-CB 3.41Å; Q49-S53 PolarHBondContact O-N 3.35Å; Q49-S53 PolarHBondContact O-OG 3.16Å |
| 50 | Y | 82.9 | Confident | 80.7 | Confident | 128 Ų | 128 | 52.3 Ų | 52.3 | 50% | 0.502 | 27% | 0.271 | S | S | . | . | H | α-helix | trans | -68 | -40.6 | 174.7 | -86.1 | -78 | 0 | 0 | 0 | 112.3 | I46 T47 T48 D52 R54 | I46-Y50 HydrophobicContact CG2-CD2 3.6Å; I46-Y50 HydrophobicContact CG2-CE2 3.59Å; I46-Y50 VanDerWaalsContact O-CD2 3.31Å; I46-Y50 WeakPolarHBondContact O-CD2 3.28Å; I46-Y50 PolarHBondContact O-N 3.3Å; T47-Y50 PolarHBondContact O-N 2.9Å; T48-Y50 PolarHBondContact O-N 3.18Å; Y50-D52 VanDerWaalsContact C-N 3.33Å; Y50-D52 PolarHBondContact O-N 3.43Å; Y50-R54 VanDerWaalsContact O-CB 3.28Å; Y50-R54 WeakPolarHBondContact O-CB 3.49Å; Y50-R54 PolarHBondContact O-N 2.63Å |
| 51 | L | 81.6 | Confident | 80.2 | Confident | 0 Ų | 0 | 53 Ų | 53 | 0% | 0 | 28% | 0.275 | C | S | . | . | H | α-helix | trans | -58.1 | -45.5 | 174.2 | -88.1 | 154.3 | 0 | 0 | 0 | 111.4 | T47 T48 Y55 N56 F57 L278 L279 | T47-L51 HydrophobicContact CG2-CD1 4.03Å; T47-L51 WeakPolarHBondContact O-CB 3.48Å; T47-L51 WeakPolarHBondContact O-CD1 3.38Å; T47-L51 PolarHBondContact O-N 2.96Å; T48-L51 WeakPolarHBondContact O-CB 3.24Å; T48-L51 PolarHBondContact O-N 3.28Å; L51-Y55 CarbonylContact O-C 3.57Å; L51-Y55 WeakPolarHBondContact O-CA 3.37Å; L51-Y55 WeakPolarHBondContact O-CB 3.36Å; L51-Y55 PolarHBondContact O-N 2.94Å; L51-N56 PolarHBondContact O-N 3.27Å; L51-F57 HydrophobicContact CB-CB 4.36Å; L51-F57 HydrophobicContact CB-CD1 4.46Å; L51-F57 HydrophobicContact CD2-CB 4Å; L51-F57 HydrophobicContact CD2-CD1 3.95Å; L51-F57 HydrophobicContact CD2-CG 4.07Å; L51-F57 PolarHBondContact O-N 3.46Å; L51-L278 HydrophobicContact CD1-CB 4.04Å; L51-L278 HydrophobicContact CD2-CB 4.28Å; L51-L278 HydrophobicContact CG-CB 3.94Å; L51-L278 HydrophobicContact CG-CD1 4.27Å; L51-L279 HydrophobicContact CD1-CD2 3.88Å; L51-L279 HydrophobicContact CD1-CG 4.27Å; L51-L279 HydrophobicContact CD2-CD2 4.22Å; L51-L279 HydrophobicContact CD2-CG 4.07Å |
| 52 | D | 77.6 | Confident | 79.9 | Confident | 63 Ų | 63 | 50.1 Ų | 50.1 | 34% | 0.337 | 26% | 0.264 | S | S | . | . | H | α-helix | trans | -69.1 | -59.4 | 177.4 | -175.7 | 25.3 | 0 | 0 | 0 | 111.8 | T48 Y50 R54 N56 Q58 | T48-D52 PolarHBondContact O-N 3.18Å; Y50-D52 VanDerWaalsContact C-N 3.33Å; Y50-D52 PolarHBondContact O-N 3.43Å; D52-R54 PolarHBondContact O-N 3.05Å; D52-N56 WeakPolarHBondContact O-CA 3.31Å; D52-N56 PolarHBondContact O-N 2.98Å; D52-Q58 VanDerWaalsContact OD1-CD 3.29Å; D52-Q58 WeakPolarHBondContact OD1-CG 3.45Å; D52-Q58 PolarHBondContact OD1-NE2 3.4Å |
| 53 | S | 75 | Confident | 79.8 | Confident | 68 Ų | 68 | 49.7 Ų | 49.7 | 48% | 0.476 | 26% | 0.26 | S | S | . | . | H | α-helix | trans | -68.3 | -32.8 | -171 | 63.5 | 0 | 0 | 0 | 0 | 114.8 | Q49 | Q49-S53 VanDerWaalsContact O-CB 3.24Å; Q49-S53 WeakPolarHBondContact O-CB 3.41Å; Q49-S53 PolarHBondContact O-N 3.35Å; Q49-S53 PolarHBondContact O-OG 3.16Å |
| 54 | R | 74.6 | Confident | 79.7 | Confident | 174 Ų | 174 | 49.2 Ų | 49.2 | 66% | 0.657 | 26% | 0.255 | S | S | * | . | H | α-helix | trans | -103.4 | -33.8 | -174.7 | -118 | 64.9 | -175.9 | 107.7 | -2.4 | 113.8 | Y50 D52 | Y50-R54 VanDerWaalsContact O-CB 3.28Å; Y50-R54 WeakPolarHBondContact O-CB 3.49Å; Y50-R54 PolarHBondContact O-N 2.63Å; D52-R54 PolarHBondContact O-N 3.05Å |
| 55 | Y | 66.8 | Low | 79.7 | Confident | 29 Ų | 29 | 51.8 Ų | 51.8 | 11% | 0.114 | 27% | 0.265 | C | S | . | . | H | α-helix | trans | -109 | -3.7 | -176.4 | -58.8 | -92.8 | 0 | 0 | 0 | 112.8 | L51 F57 S249 Y271 L274 L278 | L51-Y55 CarbonylContact O-C 3.57Å; L51-Y55 WeakPolarHBondContact O-CA 3.37Å; L51-Y55 WeakPolarHBondContact O-CB 3.36Å; L51-Y55 PolarHBondContact O-N 2.94Å; Y55-F57 PolarHBondContact O-N 3.03Å; Y55-F57 VanDerWaalsContact O-N 3.16Å; Y55-S249 PolarHBondContact O-OG 3.42Å; Y55-Y271 HydrophobicContact CD1-CD1 4.33Å; Y55-Y271 AromaticContact CE1-CD1 3.74Å; Y55-Y271 HydrophobicContact CE1-CD1 3.74Å; Y55-L274 HydrophobicContact CE1-CB 4.08Å; Y55-L274 VanDerWaalsContact OH-CB 3.24Å; Y55-L274 WeakPolarHBondContact OH-CB 3.47Å; Y55-L278 HydrophobicContact CD2-CD1 3.9Å; Y55-L278 HydrophobicContact CE2-CD1 3.45Å; Y55-L278 VanDerWaalsContact CE2-CD1 3.45Å |
| 56 | N | 63.5 | Low | 79.9 | Confident | 82 Ų | 82 | 51.3 Ų | 51.3 | 44% | 0.439 | 26% | 0.256 | S | S | . | . | trans | 53.4 | 28.1 | -174.6 | -68 | -84.6 | 0 | 0 | 0 | 112.6 | L51 D52 Q58 | L51-N56 PolarHBondContact O-N 3.27Å; D52-N56 WeakPolarHBondContact O-CA 3.31Å; D52-N56 PolarHBondContact O-N 2.98Å; N56-Q58 PolarHBondContact O-N 3.48Å; N56-Q58 VanDerWaalsContact O-N 3.15Å | ||
| 57 | F | 64.6 | Low | 80.3 | Confident | 20 Ų | 20 | 47.9 Ų | 47.9 | 9% | 0.088 | 24% | 0.239 | C | C | . | . | trans | -85.1 | 86.2 | 177.8 | -174.7 | -91.7 | 0 | 0 | 0 | 108.8 | L51 Y55 A59 A62 Q63 M246 L279 | L51-F57 HydrophobicContact CB-CB 4.36Å; L51-F57 HydrophobicContact CB-CD1 4.46Å; L51-F57 HydrophobicContact CD2-CB 4Å; L51-F57 HydrophobicContact CD2-CD1 3.95Å; L51-F57 HydrophobicContact CD2-CG 4.07Å; L51-F57 PolarHBondContact O-N 3.46Å; Y55-F57 PolarHBondContact O-N 3.03Å; Y55-F57 VanDerWaalsContact O-N 3.16Å; F57-A59 VanDerWaalsContact C-N 3.3Å; F57-A59 HydrophobicContact CD1-CB 4.28Å; F57-A59 HydrophobicContact CE1-CB 3.7Å; F57-A59 HydrophobicContact CE2-CB 4.32Å; F57-A59 HydrophobicContact CZ-CB 3.73Å; F57-A59 PolarHBondContact O-N 3.38Å; F57-A62 HydrophobicContact CZ-CB 4.22Å; F57-Q63 HydrophobicContact CE1-CG 4.17Å; F57-M246 HydrophobicContact CD2-CG 4.24Å; F57-M246 HydrophobicContact CE2-CE 3.82Å; F57-M246 HydrophobicContact CE2-CG 3.75Å; F57-M246 HydrophobicContact CE2-SD 4.23Å; F57-M246 HydrophobicContact CZ-CE 4.02Å; F57-L279 HydrophobicContact CD1-CD2 4.45Å; F57-L279 HydrophobicContact CE1-CD2 3.83Å; F57-L279 HydrophobicContact CZ-CD1 4.25Å; F57-L279 HydrophobicContact CZ-CD2 4.18Å | ||
| 58 | Q | 62.9 | Low | 80.7 | Confident | 56 Ų | 56 | 47.6 Ų | 47.6 | 26% | 0.262 | 24% | 0.237 | S | C | . | . | trans | -92.6 | 51.4 | 179.8 | -74.6 | -175.2 | -12.3 | 0 | 0 | 112.4 | D52 N56 P60 Q242 | D52-Q58 VanDerWaalsContact OD1-CD 3.29Å; D52-Q58 WeakPolarHBondContact OD1-CG 3.45Å; D52-Q58 PolarHBondContact OD1-NE2 3.4Å; N56-Q58 PolarHBondContact O-N 3.48Å; N56-Q58 VanDerWaalsContact O-N 3.15Å; Q58-P60 VanDerWaalsContact O-CD 3.24Å; Q58-P60 WeakPolarHBondContact O-CD 3.28Å; Q58-Q242 PolarHBondContact O-NE2 2.75Å; Q58-Q242 PolarHBondContact O-OE1 3.08Å | ||
| 59 | A | 73.1 | Confident | 81.1 | Confident | 7 Ų | 7 | 49.6 Ų | 49.6 | 6% | 0.058 | 24% | 0.242 | C | C | . | . | trans | -118.1 | 66.9 | 178.3 | 0 | 0 | 0 | 0 | 0 | 113.1 | F57 T61 A62 Q63 M246 | F57-A59 VanDerWaalsContact C-N 3.3Å; F57-A59 HydrophobicContact CD1-CB 4.28Å; F57-A59 HydrophobicContact CE1-CB 3.7Å; F57-A59 HydrophobicContact CE2-CB 4.32Å; F57-A59 HydrophobicContact CZ-CB 3.73Å; F57-A59 PolarHBondContact O-N 3.38Å; A59-T61 PolarHBondContact O-N 2.86Å; A59-A62 HydrophobicContact CB-CB 3.7Å; A59-A62 WeakPolarHBondContact O-CA 3.35Å; A59-A62 WeakPolarHBondContact O-CB 3.25Å; A59-A62 PolarHBondContact O-N 3.35Å; A59-Q63 PolarHBondContact O-N 3.33Å; A59-Q63 VanDerWaalsContact O-N 3.09Å; A59-M246 HydrophobicContact CB-CE 3.71Å | ||
| 60 | P | 81.2 | Confident | 81.7 | Confident | 34 Ų | 34 | 47 Ų | 47 | 22% | 0.221 | 23% | 0.229 | C | C | . | . | H | α-helix | trans | -53.1 | -39.2 | 173.3 | -24.5 | 32.2 | 0 | 0 | 0 | 113.1 | Q58 A62 Q63 S64 V114 | Q58-P60 VanDerWaalsContact O-CD 3.24Å; Q58-P60 WeakPolarHBondContact O-CD 3.28Å; P60-A62 VanDerWaalsContact C-N 3.25Å; P60-A62 PolarHBondContact O-N 3.48Å; P60-Q63 WeakPolarHBondContact O-CB 3.04Å; P60-Q63 PolarHBondContact O-N 2.75Å; P60-Q63 VanDerWaalsContact O-N 3.1Å; P60-S64 PolarHBondContact O-N 3.04Å; P60-S64 PolarHBondContact O-OG 2.89Å; P60-V114 HydrophobicContact CB-CG1 3.43Å; P60-V114 VanDerWaalsContact CB-CG1 3.43Å; P60-V114 HydrophobicContact CB-CG2 4.45Å; P60-V114 HydrophobicContact CG-CG1 3.57Å |
| 61 | T | 83.8 | Confident | 82.4 | Confident | 23 Ų | 23 | 40.9 Ų | 40.9 | 14% | 0.141 | 21% | 0.205 | C | C | . | . | H | α-helix | trans | -62.1 | -34.5 | 177.4 | -31.4 | 0 | 0 | 0 | 0 | 111.9 | A59 F65 Q231 L232 | A59-T61 PolarHBondContact O-N 2.86Å; T61-F65 WeakPolarHBondContact O-CB 3.48Å; T61-F65 PolarHBondContact O-N 3.48Å; T61-Q231 HydrophobicContact CG2-CB 3.72Å; T61-L232 HydrophobicContact CG2-CB 4.2Å |
| 62 | A | 85.4 | Confident | 83.1 | Confident | 11 Ų | 11 | 43.3 Ų | 43.3 | 9% | 0.091 | 22% | 0.217 | C | C | . | . | H | α-helix | trans | -72.3 | -36.2 | 175.4 | 0 | 0 | 0 | 0 | 0 | 111.6 | F57 A59 P60 T66 L232 M246 | F57-A62 HydrophobicContact CZ-CB 4.22Å; A59-A62 HydrophobicContact CB-CB 3.7Å; A59-A62 WeakPolarHBondContact O-CA 3.35Å; A59-A62 WeakPolarHBondContact O-CB 3.25Å; A59-A62 PolarHBondContact O-N 3.35Å; P60-A62 VanDerWaalsContact C-N 3.25Å; P60-A62 PolarHBondContact O-N 3.48Å; A62-T66 WeakPolarHBondContact O-CB 3.49Å; A62-T66 PolarHBondContact O-N 3.18Å; A62-T66 PolarHBondContact O-OG1 2.81Å; A62-L232 HydrophobicContact CB-CD1 3.78Å; A62-L232 HydrophobicContact CB-CD2 4.42Å; A62-M246 HydrophobicContact CB-CE 4.31Å |
| 63 | Q | 89.1 | Confident | 84.1 | Confident | 6 Ų | 6 | 44.3 Ų | 44.3 | 3% | 0.028 | 22% | 0.222 | C | C | . | . | H | α-helix | trans | -63.8 | -48.6 | 173.6 | -64.4 | 178.6 | -75.5 | 0 | 0 | 111 | T48 F57 A59 P60 F65 T66 A67 L279 F282 | T48-Q63 PolarHBondContact OG1-NE2 3.27Å; F57-Q63 HydrophobicContact CE1-CG 4.17Å; A59-Q63 PolarHBondContact O-N 3.33Å; A59-Q63 VanDerWaalsContact O-N 3.09Å; P60-Q63 WeakPolarHBondContact O-CB 3.04Å; P60-Q63 PolarHBondContact O-N 2.75Å; P60-Q63 VanDerWaalsContact O-N 3.1Å; Q63-F65 PolarHBondContact O-N 3.19Å; Q63-T66 WeakPolarHBondContact O-CB 3.46Å; Q63-T66 PolarHBondContact O-N 2.99Å; Q63-A67 PolarHBondContact O-N 2.97Å; Q63-L279 HydrophobicContact CG-CD2 4.08Å; Q63-F282 HydrophobicContact CB-CD1 3.99Å; Q63-F282 HydrophobicContact CB-CE1 3.59Å; Q63-F282 HydrophobicContact CB-CE2 4.43Å; Q63-F282 HydrophobicContact CB-CZ 3.83Å; Q63-F282 WeakPolarHBondContact O-CE1 3.41Å |
| 64 | S | 88.6 | Confident | 85.1 | Confident | 22 Ų | 22 | 43.5 Ų | 43.5 | 15% | 0.154 | 21% | 0.214 | C | C | . | . | H | α-helix | trans | -58.3 | -46.2 | 175.1 | -60.4 | 0 | 0 | 0 | 0 | 111.9 | P60 T66 A67 Y68 | P60-S64 PolarHBondContact O-N 3.04Å; P60-S64 PolarHBondContact O-OG 2.89Å; S64-T66 VanDerWaalsContact C-N 3.29Å; S64-T66 PolarHBondContact O-N 3.11Å; S64-A67 PolarHBondContact O-N 2.88Å; S64-Y68 WeakPolarHBondContact O-CD2 3.27Å; S64-Y68 PolarHBondContact O-N 3.46Å; S64-Y68 VanDerWaalsContact O-N 3.14Å |
| 65 | F | 92.6 | Very high | 86.2 | Confident | 59 Ų | 59 | 37 Ų | 37 | 26% | 0.259 | 19% | 0.19 | S | C | . | . | H | α-helix | trans | -56.8 | -44.7 | 175.6 | 172.1 | -103.7 | 0 | 0 | 0 | 112 | T61 Q63 A67 Y68 F69 S225 S228 L232 | T61-F65 WeakPolarHBondContact O-CB 3.48Å; T61-F65 PolarHBondContact O-N 3.48Å; Q63-F65 PolarHBondContact O-N 3.19Å; F65-A67 VanDerWaalsContact C-N 3.33Å; F65-A67 PolarHBondContact O-N 3.41Å; F65-Y68 PolarHBondContact O-N 3.3Å; F65-F69 HydrophobicContact CE1-CB 4.39Å; F65-F69 HydrophobicContact CE1-CG 4.48Å; F65-F69 HydrophobicContact CZ-CB 4.32Å; F65-F69 AromaticContact CZ-CD2 3.96Å; F65-F69 HydrophobicContact CZ-CD2 3.96Å; F65-F69 HydrophobicContact CZ-CG 4.3Å; F65-F69 WeakPolarHBondContact O-CB 3.45Å; F65-F69 PolarHBondContact O-N 2.97Å; F65-S225 WeakPolarHBondContact CD2-O 3.34Å; F65-S225 WeakPolarHBondContact CE2-O 3.24Å; F65-S228 WeakPolarHBondContact CA-OG 3.42Å; F65-L232 HydrophobicContact CB-CD2 4.13Å; F65-L232 HydrophobicContact CD1-CD2 3.99Å; F65-L232 HydrophobicContact CG-CD2 4.07Å |
| 66 | T | 91.5 | Very high | 87.6 | Confident | 50 Ų | 50 | 36 Ų | 36 | 31% | 0.307 | 19% | 0.188 | S | C | . | . | H | α-helix | trans | -62.8 | -40.4 | -179.9 | -57.3 | 0 | 0 | 0 | 0 | 111.5 | A62 Q63 S64 F69 F70 A283 | A62-T66 WeakPolarHBondContact O-CB 3.49Å; A62-T66 PolarHBondContact O-N 3.18Å; A62-T66 PolarHBondContact O-OG1 2.81Å; Q63-T66 WeakPolarHBondContact O-CB 3.46Å; Q63-T66 PolarHBondContact O-N 2.99Å; S64-T66 VanDerWaalsContact C-N 3.29Å; S64-T66 PolarHBondContact O-N 3.11Å; T66-F69 PolarHBondContact O-N 3.47Å; T66-F70 WeakPolarHBondContact O-CB 3.48Å; T66-F70 PolarHBondContact O-N 2.87Å; T66-A283 HydrophobicContact CG2-CB 3.87Å |
| 67 | A | 93.5 | Very high | 89.1 | Confident | 2 Ų | 2 | 34.1 Ų | 34.1 | 2% | 0.017 | 18% | 0.182 | C | C | . | . | H | α-helix | trans | -61.6 | -50.6 | 176.8 | 0 | 0 | 0 | 0 | 0 | 112.1 | Q63 S64 F65 F69 F70 L71 F282 M286 | Q63-A67 PolarHBondContact O-N 2.97Å; S64-A67 PolarHBondContact O-N 2.88Å; F65-A67 VanDerWaalsContact C-N 3.33Å; F65-A67 PolarHBondContact O-N 3.41Å; A67-F69 PolarHBondContact O-N 2.86Å; A67-F70 PolarHBondContact O-N 3.21Å; A67-L71 PolarHBondContact O-N 2.88Å; A67-F282 HydrophobicContact CB-CE1 4.37Å; A67-M286 HydrophobicContact CB-CB 3.71Å; A67-M286 HydrophobicContact CB-CG 4.17Å |
| 68 | Y | 96.4 | Very high | 90.6 | Very high | 2 Ų | 2 | 36.5 Ų | 36.5 | 1% | 0.008 | 20% | 0.198 | C | C | . | . | H | α-helix | trans | -66.3 | -38.7 | 177.6 | -68.2 | -68.3 | 0 | 0 | 0 | 112.2 | S64 F65 F70 L71 M72 D106 V107 I220 S225 Y290 | S64-Y68 WeakPolarHBondContact O-CD2 3.27Å; S64-Y68 PolarHBondContact O-N 3.46Å; S64-Y68 VanDerWaalsContact O-N 3.14Å; F65-Y68 PolarHBondContact O-N 3.3Å; Y68-F70 VanDerWaalsContact C-N 3.27Å; Y68-F70 PolarHBondContact O-N 3.2Å; Y68-L71 HydrophobicContact CD1-CD1 4.4Å; Y68-L71 WeakPolarHBondContact O-CB 3.23Å; Y68-L71 PolarHBondContact O-N 2.94Å; Y68-L71 VanDerWaalsContact O-N 3.17Å; Y68-M72 PolarHBondContact O-N 2.68Å; Y68-D106 PolarHBondContact OH-OD2 3.27Å; Y68-V107 HydrophobicContact CD2-CG2 4.3Å; Y68-V107 HydrophobicContact CE2-CG2 3.57Å; Y68-I220 HydrophobicContact CE1-CG1 4.37Å; Y68-S225 PolarHBondContact O-OG 2.85Å; Y68-S225 VanDerWaalsContact O-OG 3.08Å; Y68-Y290 HydrophobicContact CE1-CE1 4.41Å; Y68-Y290 AromaticContact CE1-CZ 3.99Å; Y68-Y290 PolarHBondContact OH-OH 3.18Å; Y68-Y290 VanDerWaalsContact OH-OH 3.1Å |
| 69 | F | 95.8 | Very high | 92.1 | Very high | 81 Ų | 81 | 34 Ų | 34 | 36% | 0.355 | 19% | 0.186 | S | C | . | . | H | α-helix | trans | -60.3 | -39.6 | 177.7 | -173.5 | -102.4 | 0 | 0 | 0 | 111.5 | F65 T66 A67 M72 L73 S225 | F65-F69 HydrophobicContact CE1-CB 4.39Å; F65-F69 HydrophobicContact CE1-CG 4.48Å; F65-F69 HydrophobicContact CZ-CB 4.32Å; F65-F69 AromaticContact CZ-CD2 3.96Å; F65-F69 HydrophobicContact CZ-CD2 3.96Å; F65-F69 HydrophobicContact CZ-CG 4.3Å; F65-F69 WeakPolarHBondContact O-CB 3.45Å; F65-F69 PolarHBondContact O-N 2.97Å; T66-F69 PolarHBondContact O-N 3.47Å; A67-F69 PolarHBondContact O-N 2.86Å; F69-M72 HydrophobicContact CD2-CE 3.41Å; F69-M72 VanDerWaalsContact CD2-CE 3.41Å; F69-M72 HydrophobicContact CE2-CE 3.37Å; F69-M72 HydrophobicContact CG-CE 4.42Å; F69-M72 HydrophobicContact CZ-CE 4.38Å; F69-M72 WeakPolarHBondContact O-CB 3.45Å; F69-M72 PolarHBondContact O-N 2.72Å; F69-L73 HydrophobicContact CD1-CD1 3.82Å; F69-L73 HydrophobicContact CD1-CG 4.12Å; F69-L73 HydrophobicContact CE1-CD1 3.38Å; F69-L73 HydrophobicContact CE1-CD2 4.3Å; F69-L73 HydrophobicContact CE1-CG 3.79Å; F69-L73 HydrophobicContact CZ-CD1 4.07Å; F69-L73 HydrophobicContact CZ-CD2 4.14Å; F69-L73 HydrophobicContact CZ-CG 4.08Å; F69-L73 WeakPolarHBondContact O-CB 3.29Å; F69-L73 WeakPolarHBondContact O-CG 3.19Å; F69-L73 PolarHBondContact O-N 3.32Å; F69-S225 WeakPolarHBondContact CA-OG 3.17Å; F69-S225 PolarHBondContact N-OG 3.41Å |
| 70 | F | 95.6 | Very high | 93.1 | Very high | 69 Ų | 69 | 36.5 Ų | 36.5 | 30% | 0.303 | 21% | 0.207 | S | C | . | . | H | α-helix | trans | -69.4 | -37.1 | 176.6 | -155.9 | -133.6 | 0 | 0 | 0 | 112.5 | T66 A67 Y68 L73 V74 F287 | T66-F70 WeakPolarHBondContact O-CB 3.48Å; T66-F70 PolarHBondContact O-N 2.87Å; A67-F70 PolarHBondContact O-N 3.21Å; Y68-F70 VanDerWaalsContact C-N 3.27Å; Y68-F70 PolarHBondContact O-N 3.2Å; F70-L73 PolarHBondContact O-N 2.87Å; F70-V74 WeakPolarHBondContact O-CG2 3.5Å; F70-V74 PolarHBondContact O-N 3.4Å; F70-F287 HydrophobicContact CD1-CB 3.82Å; F70-F287 AromaticContact CD1-CD2 3.91Å; F70-F287 HydrophobicContact CD1-CD2 3.91Å; F70-F287 AromaticContact CD1-CG 3.91Å; F70-F287 HydrophobicContact CD1-CG 3.91Å; F70-F287 HydrophobicContact CE1-CB 4.34Å; F70-F287 HydrophobicContact CE1-CD2 4.4Å; F70-F287 HydrophobicContact CE1-CG 4.2Å |
| 71 | L | 97.3 | Very high | 93.7 | Very high | 0 Ų | 0 | 43.2 Ų | 43.2 | 0% | 0 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -61.1 | -45.2 | 170 | -73.4 | 168.9 | 0 | 0 | 0 | 112.2 | A67 Y68 V74 Y75 G76 L217 F287 Y290 | A67-L71 PolarHBondContact O-N 2.88Å; Y68-L71 HydrophobicContact CD1-CD1 4.4Å; Y68-L71 WeakPolarHBondContact O-CB 3.23Å; Y68-L71 PolarHBondContact O-N 2.94Å; Y68-L71 VanDerWaalsContact O-N 3.17Å; L71-V74 PolarHBondContact O-N 2.86Å; L71-Y75 HydrophobicContact CD2-CD2 3.91Å; L71-Y75 HydrophobicContact CD2-CE2 4.18Å; L71-Y75 WeakPolarHBondContact O-CB 3.38Å; L71-Y75 PolarHBondContact O-N 3.26Å; L71-G76 PolarHBondContact O-N 2.99Å; L71-L217 HydrophobicContact CD2-CD2 4.03Å; L71-F287 HydrophobicContact CD2-CD2 3.74Å; L71-F287 HydrophobicContact CD2-CE2 4.02Å; L71-F287 HydrophobicContact CG-CD2 4.3Å; L71-Y290 HydrophobicContact CD1-CD1 4.2Å; L71-Y290 HydrophobicContact CD1-CD2 3.69Å; L71-Y290 HydrophobicContact CD1-CE2 4.26Å; L71-Y290 HydrophobicContact CD1-CG 3.67Å |
| 72 | M | 97.2 | Very high | 94 | Very high | 51 Ų | 51 | 46.3 Ų | 46.3 | 25% | 0.251 | 24% | 0.242 | S | C | . | . | I | π-helix | trans | -59.8 | -46.2 | 175.7 | -177.9 | -175.2 | 72.5 | 0 | 0 | 111.1 | Y68 F69 V74 G76 S77 I222 | Y68-M72 PolarHBondContact O-N 2.68Å; F69-M72 HydrophobicContact CD2-CE 3.41Å; F69-M72 VanDerWaalsContact CD2-CE 3.41Å; F69-M72 HydrophobicContact CE2-CE 3.37Å; F69-M72 HydrophobicContact CG-CE 4.42Å; F69-M72 HydrophobicContact CZ-CE 4.38Å; F69-M72 WeakPolarHBondContact O-CB 3.45Å; F69-M72 PolarHBondContact O-N 2.72Å; M72-V74 VanDerWaalsContact C-N 3.33Å; M72-V74 PolarHBondContact O-N 3.24Å; M72-G76 CarbonylContact O-C 3.45Å; M72-G76 WeakPolarHBondContact O-CA 3.12Å; M72-G76 PolarHBondContact O-N 3.35Å; M72-S77 PolarHBondContact O-N 3.15Å; M72-S77 VanDerWaalsContact O-N 3.16Å; M72-I222 HydrophobicContact CG-CB 4.43Å; M72-I222 HydrophobicContact CG-CG1 3.75Å; M72-I222 HydrophobicContact SD-CG1 4.46Å |
| 73 | L | 97 | Very high | 93.8 | Very high | 85 Ų | 85 | 51.9 Ų | 51.9 | 45% | 0.445 | 28% | 0.28 | S | S | . | . | I | π-helix | trans | -62.2 | -38.4 | 179.8 | -80 | -175.5 | 0 | 0 | 0 | 112.8 | F69 F70 S77 | F69-L73 HydrophobicContact CD1-CD1 3.82Å; F69-L73 HydrophobicContact CD1-CG 4.12Å; F69-L73 HydrophobicContact CE1-CD1 3.38Å; F69-L73 HydrophobicContact CE1-CD2 4.3Å; F69-L73 HydrophobicContact CE1-CG 3.79Å; F69-L73 HydrophobicContact CZ-CD1 4.07Å; F69-L73 HydrophobicContact CZ-CD2 4.14Å; F69-L73 HydrophobicContact CZ-CG 4.08Å; F69-L73 WeakPolarHBondContact O-CB 3.29Å; F69-L73 WeakPolarHBondContact O-CG 3.19Å; F69-L73 PolarHBondContact O-N 3.32Å; F70-L73 PolarHBondContact O-N 2.87Å; L73-S77 WeakPolarHBondContact O-CB 3.48Å; L73-S77 PolarHBondContact O-OG 3Å |
| 74 | V | 97.1 | Very high | 93.4 | Very high | 50 Ų | 50 | 54 Ų | 54 | 30% | 0.303 | 30% | 0.295 | S | S | . | . | I | π-helix | trans | -88.5 | -59.9 | -177.6 | 178.5 | 0 | 0 | 0 | 0 | 111.4 | F70 L71 M72 S77 T78 F287 | F70-V74 WeakPolarHBondContact O-CG2 3.5Å; F70-V74 PolarHBondContact O-N 3.4Å; L71-V74 PolarHBondContact O-N 2.86Å; M72-V74 VanDerWaalsContact C-N 3.33Å; M72-V74 PolarHBondContact O-N 3.24Å; V74-S77 PolarHBondContact O-OG 3.29Å; V74-T78 WeakPolarHBondContact O-CB 3.24Å; V74-T78 PolarHBondContact O-N 3.35Å; V74-T78 VanDerWaalsContact O-N 3.13Å; V74-T78 PolarHBondContact O-OG1 3.35Å; V74-F287 HydrophobicContact CB-CE2 3.76Å; V74-F287 HydrophobicContact CB-CZ 4.13Å; V74-F287 HydrophobicContact CG1-CE2 3.98Å; V74-F287 HydrophobicContact CG1-CZ 3.84Å; V74-F287 HydrophobicContact CG2-CE2 3.9Å; V74-F287 HydrophobicContact CG2-CZ 4.24Å |
| 75 | Y | 97 | Very high | 93 | Very high | 39 Ų | 39 | 59.1 Ų | 59.1 | 15% | 0.153 | 32% | 0.317 | C | S | . | . | I | π-helix | trans | -82 | -36.3 | -174.1 | -72.1 | -73.9 | 0 | 0 | 0 | 112.7 | L71 T78 L79 T214 L217 F287 T291 | L71-Y75 HydrophobicContact CD2-CD2 3.91Å; L71-Y75 HydrophobicContact CD2-CE2 4.18Å; L71-Y75 WeakPolarHBondContact O-CB 3.38Å; L71-Y75 PolarHBondContact O-N 3.26Å; Y75-T78 PolarHBondContact O-N 3.19Å; Y75-L79 WeakPolarHBondContact O-CB 3.43Å; Y75-L79 PolarHBondContact O-N 3.33Å; Y75-T214 HydrophobicContact CD1-CG2 3.95Å; Y75-L217 HydrophobicContact CD1-CB 3.97Å; Y75-L217 HydrophobicContact CD1-CD1 4.23Å; Y75-L217 HydrophobicContact CD2-CB 3.66Å; Y75-L217 HydrophobicContact CD2-CD1 4.16Å; Y75-L217 HydrophobicContact CD2-CG 4.37Å; Y75-L217 HydrophobicContact CE1-CB 4.42Å; Y75-L217 HydrophobicContact CE1-CD1 3.82Å; Y75-L217 HydrophobicContact CE2-CB 4.12Å; Y75-L217 HydrophobicContact CE2-CD1 3.72Å; Y75-L217 HydrophobicContact CE2-CG 4.36Å; Y75-L217 HydrophobicContact CG-CB 3.57Å; Y75-L217 HydrophobicContact CG-CD1 4.4Å; Y75-F287 AromaticContact CD2-CE2 3.81Å; Y75-F287 HydrophobicContact CD2-CE2 3.81Å; Y75-F287 HydrophobicContact CD2-CZ 4.22Å; Y75-F287 AromaticContact CE2-CE2 3.48Å; Y75-F287 HydrophobicContact CE2-CE2 3.48Å; Y75-F287 VanDerWaalsContact CE2-CE2 3.48Å; Y75-F287 AromaticContact CE2-CZ 3.5Å; Y75-F287 HydrophobicContact CE2-CZ 3.5Å; Y75-F287 VanDerWaalsContact CE2-CZ 3.5Å; Y75-T291 VanDerWaalsContact OH-CG2 3.29Å; Y75-T291 WeakPolarHBondContact OH-CG2 3.4Å; Y75-T291 PolarHBondContact OH-OG1 2.82Å |
| 76 | G | 96.1 | Very high | 92.7 | Very high | 6 Ų | 6 | 57.9 Ų | 57.9 | 6% | 0.062 | 32% | 0.315 | C | S | . | . | I | π-helix | trans | -64.7 | -43.8 | 175.5 | 0 | 0 | 0 | 0 | 0 | 111.8 | L71 M72 L79 A80 | L71-G76 PolarHBondContact O-N 2.99Å; M72-G76 CarbonylContact O-C 3.45Å; M72-G76 WeakPolarHBondContact O-CA 3.12Å; M72-G76 PolarHBondContact O-N 3.35Å; G76-L79 PolarHBondContact O-N 2.95Å; G76-A80 WeakPolarHBondContact O-CB 3.27Å; G76-A80 PolarHBondContact O-N 2.78Å |
| 77 | S | 95.7 | Very high | 92.6 | Very high | 44 Ų | 44 | 57.4 Ų | 57.4 | 31% | 0.308 | 31% | 0.313 | S | S | . | . | H | α-helix | trans | -66.3 | -42.1 | 174.4 | 71.4 | 0 | 0 | 0 | 0 | 112.3 | M72 L73 V74 L79 A80 F81 | M72-S77 PolarHBondContact O-N 3.15Å; M72-S77 VanDerWaalsContact O-N 3.16Å; L73-S77 WeakPolarHBondContact O-CB 3.48Å; L73-S77 PolarHBondContact O-OG 3Å; V74-S77 PolarHBondContact O-OG 3.29Å; S77-L79 PolarHBondContact O-N 2.98Å; S77-A80 WeakPolarHBondContact O-CB 3.43Å; S77-A80 PolarHBondContact O-N 3.37Å; S77-F81 WeakPolarHBondContact O-CD2 3.48Å; S77-F81 PolarHBondContact O-N 3.11Å |
| 78 | T | 95.1 | Very high | 92.5 | Very high | 70 Ų | 70 | 59.1 Ų | 59.1 | 43% | 0.429 | 32% | 0.322 | S | S | . | . | H | α-helix | trans | -57.1 | -41.6 | 175.4 | -61.8 | 0 | 0 | 0 | 0 | 111 | V74 Y75 R82 T214 | V74-T78 WeakPolarHBondContact O-CB 3.24Å; V74-T78 PolarHBondContact O-N 3.35Å; V74-T78 VanDerWaalsContact O-N 3.13Å; V74-T78 PolarHBondContact O-OG1 3.35Å; Y75-T78 PolarHBondContact O-N 3.19Å; T78-R82 WeakPolarHBondContact O-CB 3.42Å; T78-R82 PolarHBondContact O-N 3.12Å; T78-T214 HydrophobicContact CG2-CG2 4.13Å |
| 79 | L | 94.2 | Very high | 92.3 | Very high | 2 Ų | 2 | 63.2 Ų | 63.2 | 1% | 0.01 | 35% | 0.347 | C | S | . | . | H | α-helix | trans | -71.3 | -33.2 | 177.6 | -166.1 | 67.3 | 0 | 0 | 0 | 112.4 | Y75 G76 S77 L88 I91 M219 | Y75-L79 WeakPolarHBondContact O-CB 3.43Å; Y75-L79 PolarHBondContact O-N 3.33Å; G76-L79 PolarHBondContact O-N 2.95Å; S77-L79 PolarHBondContact O-N 2.98Å; L79-L88 HydrophobicContact CB-CD1 4.21Å; L79-L88 HydrophobicContact CD2-CD1 4.32Å; L79-L88 HydrophobicContact CD2-CG 4.23Å; L79-L88 HydrophobicContact CG-CB 4.23Å; L79-L88 HydrophobicContact CG-CD1 4.32Å; L79-L88 HydrophobicContact CG-CG 4.39Å; L79-I91 HydrophobicContact CD1-CD1 3.83Å; L79-I91 HydrophobicContact CD2-CD1 3.9Å; L79-I91 HydrophobicContact CG-CD1 4.15Å; L79-M219 HydrophobicContact CD2-CG 4.45Å; L79-M219 HydrophobicContact CD2-SD 4.24Å |
| 80 | A | 93.9 | Very high | 92.2 | Very high | 60 Ų | 60 | 63.3 Ų | 63.3 | 50% | 0.496 | 35% | 0.349 | S | S | . | . | H | α-helix | trans | -69 | -39.5 | 177.5 | 0 | 0 | 0 | 0 | 0 | 112.9 | G76 S77 R82 L88 | G76-A80 WeakPolarHBondContact O-CB 3.27Å; G76-A80 PolarHBondContact O-N 2.78Å; S77-A80 WeakPolarHBondContact O-CB 3.43Å; S77-A80 PolarHBondContact O-N 3.37Å; A80-R82 VanDerWaalsContact C-N 3.34Å; A80-L88 HydrophobicContact CB-CD1 3.86Å |
| 81 | F | 93.8 | Very high | 92.1 | Very high | 175 Ų | 175 | 60 Ų | 60 | 77% | 0.768 | 33% | 0.334 | S | S | * | . | S | Bend | trans | -88.6 | -0.2 | 179.9 | -66.4 | -63.3 | 0 | 0 | 0 | 113.9 | S77 S83 | S77-F81 WeakPolarHBondContact O-CD2 3.48Å; S77-F81 PolarHBondContact O-N 3.11Å; F81-S83 PolarHBondContact O-N 3.34Å |
| 82 | R | 90.4 | Very high | 91.9 | Very high | 89 Ų | 89 | 64.7 Ų | 64.7 | 34% | 0.336 | 36% | 0.355 | S | S | . | . | trans | -76.6 | 120.6 | -179.8 | -176.3 | 172.3 | -176.9 | -172 | -9.3 | 110.7 | T78 A80 S84 E212 | T78-R82 WeakPolarHBondContact O-CB 3.42Å; T78-R82 PolarHBondContact O-N 3.12Å; A80-R82 VanDerWaalsContact C-N 3.34Å; R82-S84 VanDerWaalsContact C-N 3.3Å; R82-S84 WeakPolarHBondContact CD-OG 3.48Å; R82-S84 VanDerWaalsContact CG-OG 3.28Å; R82-S84 WeakPolarHBondContact CG-OG 2.96Å; R82-S84 PolarHBondContact NE-OG 3.3Å; R82-S84 PolarHBondContact O-N 3.31Å; R82-E212 IonicContact CZ-OE1 3.47Å; R82-E212 IonicContact CZ-OE2 3.5Å; R82-E212 IonicContact NH1-OE1 2.64Å; R82-E212 PolarHBondContact NH1-OE1 2.84Å; R82-E212 IonicContact NH1-OE2 2.94Å; R82-E212 PolarHBondContact NH1-OE2 3.08Å; R82-E212 IonicContact NH2-OE1 3.61Å; R82-E212 IonicContact NH2-OE2 3.13Å; R82-E212 PolarHBondContact NH2-OE2 2.86Å; R82-E212 VanDerWaalsContact NH2-OE2 3.13Å | ||
| 83 | S | 82.3 | Confident | 91.8 | Very high | 127 Ų | 127 | 72.3 Ų | 72.3 | 89% | 0.888 | 38% | 0.381 | S | S | * | . | trans | -78.8 | -6.2 | 178.8 | -47 | 0 | 0 | 0 | 0 | 114.9 | F81 | F81-S83 PolarHBondContact O-N 3.34Š| ||
| 84 | S | 79.9 | Confident | 91.6 | Very high | 50 Ų | 50 | 73.7 Ų | 73.7 | 35% | 0.35 | 39% | 0.388 | S | S | . | . | S | Bend | trans | -91.3 | 141.3 | -178.7 | 67.9 | 0 | 0 | 0 | 0 | 111.9 | R82 | R82-S84 VanDerWaalsContact C-N 3.3Å; R82-S84 WeakPolarHBondContact CD-OG 3.48Å; R82-S84 VanDerWaalsContact CG-OG 3.28Å; R82-S84 WeakPolarHBondContact CG-OG 2.96Å; R82-S84 PolarHBondContact NE-OG 3.3Å; R82-S84 PolarHBondContact O-N 3.31Å |
| 85 | E | 81.6 | Confident | 91.5 | Very high | 130 Ų | 130 | 73.7 Ų | 73.7 | 61% | 0.607 | 38% | 0.383 | S | S | * | . | S | Bend | trans | -69.2 | 144.1 | 173.6 | -68 | -60.8 | 157.2 | 0 | 0 | 112.6 | S87 Q90 | E85-S87 PolarHBondContact OE2-N 3.46Å; E85-Q90 PolarHBondContact OE2-OE1 3.45Å |
| 86 | P | 84.4 | Confident | 91.4 | Very high | 33 Ų | 33 | 72 Ų | 72 | 21% | 0.214 | 38% | 0.377 | C | S | . | . | S | Bend | cis | -79.8 | 135.1 | 0.9 | 29.8 | -30.7 | 0 | 0 | 0 | 113 | Q90 I91 | P86-Q90 HydrophobicContact CB-CB 4.39Å; P86-Q90 HydrophobicContact CB-CG 4.14Å; P86-I91 HydrophobicContact CB-CD1 4.5Å; P86-I91 HydrophobicContact CB-CG1 3.94Å; P86-I91 HydrophobicContact CG-CD1 4.1Å; P86-I91 HydrophobicContact CG-CG1 3.79Å; P86-I91 WeakPolarHBondContact O-CD1 3.37Å |
| 87 | S | 89.9 | Confident | 91.3 | Very high | 40 Ų | 40 | 79.7 Ų | 79.7 | 28% | 0.28 | 40% | 0.404 | S | S | . | . | P | Polyproline II helix | trans | -61.8 | 157.1 | 172.5 | 64.6 | 0 | 0 | 0 | 0 | 112.5 | E85 V89 Q90 I91 | E85-S87 PolarHBondContact OE2-N 3.46Å; S87-V89 VanDerWaalsContact C-N 3.25Å; S87-V89 PolarHBondContact O-N 3.19Å; S87-Q90 WeakPolarHBondContact O-CB 3.49Å; S87-Q90 PolarHBondContact O-N 2.99Å; S87-Q90 WeakPolarHBondContact OG-CB 3.48Å; S87-Q90 PolarHBondContact OG-N 3.38Å; S87-I91 WeakPolarHBondContact O-CG1 3.33Å; S87-I91 PolarHBondContact O-N 3.47Å |
| 88 | L | 91.6 | Very high | 91.4 | Very high | 38 Ų | 38 | 79.8 Ų | 79.8 | 20% | 0.199 | 40% | 0.399 | C | S | . | . | H | α-helix | trans | -53 | -43.2 | 178.9 | -173.9 | 155.9 | 0 | 0 | 0 | 112 | L79 A80 Q90 I91 F92 I222 | L79-L88 HydrophobicContact CB-CD1 4.21Å; L79-L88 HydrophobicContact CD2-CD1 4.32Å; L79-L88 HydrophobicContact CD2-CG 4.23Å; L79-L88 HydrophobicContact CG-CB 4.23Å; L79-L88 HydrophobicContact CG-CD1 4.32Å; L79-L88 HydrophobicContact CG-CG 4.39Å; A80-L88 HydrophobicContact CB-CD1 3.86Å; L88-Q90 VanDerWaalsContact C-N 3.32Å; L88-Q90 PolarHBondContact O-N 3.06Å; L88-I91 PolarHBondContact O-N 3.19Å; L88-F92 WeakPolarHBondContact O-CB 3.32Å; L88-F92 PolarHBondContact O-N 3.38Å; L88-I222 HydrophobicContact CD1-CD1 4.06Å |
| 89 | V | 91.9 | Very high | 91.5 | Very high | 88 Ų | 88 | 76.5 Ų | 76.5 | 53% | 0.533 | 38% | 0.379 | S | S | . | . | H | α-helix | trans | -63.5 | -39.3 | 179 | 178.6 | 0 | 0 | 0 | 0 | 111.3 | S87 F92 R93 | S87-V89 VanDerWaalsContact C-N 3.25Å; S87-V89 PolarHBondContact O-N 3.19Å; V89-F92 PolarHBondContact O-N 3.37Å; V89-R93 WeakPolarHBondContact O-CG 3.22Å; V89-R93 PolarHBondContact O-N 3.09Å |
| 90 | Q | 93.2 | Very high | 91.7 | Very high | 83 Ų | 83 | 80.2 Ų | 80.2 | 39% | 0.388 | 40% | 0.395 | S | S | . | . | H | α-helix | trans | -67.3 | -42.6 | 176.6 | 179.1 | 168.2 | -36.1 | 0 | 0 | 111.7 | E85 P86 S87 L88 F92 R93 L94 | E85-Q90 PolarHBondContact OE2-OE1 3.45Å; P86-Q90 HydrophobicContact CB-CB 4.39Å; P86-Q90 HydrophobicContact CB-CG 4.14Å; S87-Q90 WeakPolarHBondContact O-CB 3.49Å; S87-Q90 PolarHBondContact O-N 2.99Å; S87-Q90 WeakPolarHBondContact OG-CB 3.48Å; S87-Q90 PolarHBondContact OG-N 3.38Å; L88-Q90 VanDerWaalsContact C-N 3.32Å; L88-Q90 PolarHBondContact O-N 3.06Å; Q90-F92 VanDerWaalsContact C-N 3.31Å; Q90-F92 PolarHBondContact O-N 2.92Å; Q90-R93 PolarHBondContact O-N 3.31Å; Q90-L94 HydrophobicContact CG-CD1 3.54Å; Q90-L94 HydrophobicContact CG-CG 4.26Å; Q90-L94 WeakPolarHBondContact O-CB 3.31Å; Q90-L94 WeakPolarHBondContact O-CG 3.37Å; Q90-L94 PolarHBondContact O-N 3.05Å |
| 91 | I | 94.3 | Very high | 91.8 | Very high | 0 Ų | 0 | 80.4 Ų | 80.4 | 0% | 0 | 39% | 0.39 | C | S | . | . | H | α-helix | trans | -58.6 | -46.5 | 174 | -66.3 | 162.8 | 0 | 0 | 0 | 110.1 | L79 P86 S87 L88 R93 L94 R95 G96 Y99 E215 M219 | L79-I91 HydrophobicContact CD1-CD1 3.83Å; L79-I91 HydrophobicContact CD2-CD1 3.9Å; L79-I91 HydrophobicContact CG-CD1 4.15Å; P86-I91 HydrophobicContact CB-CD1 4.5Å; P86-I91 HydrophobicContact CB-CG1 3.94Å; P86-I91 HydrophobicContact CG-CD1 4.1Å; P86-I91 HydrophobicContact CG-CG1 3.79Å; P86-I91 WeakPolarHBondContact O-CD1 3.37Å; S87-I91 WeakPolarHBondContact O-CG1 3.33Å; S87-I91 PolarHBondContact O-N 3.47Å; L88-I91 PolarHBondContact O-N 3.19Å; I91-R93 VanDerWaalsContact C-N 3.35Å; I91-R93 PolarHBondContact O-N 3.42Å; I91-L94 PolarHBondContact O-N 3.27Å; I91-R95 HydrophobicContact CG2-CG 4.2Å; I91-R95 VanDerWaalsContact O-CG 3.26Å; I91-R95 WeakPolarHBondContact O-CG 3.26Å; I91-R95 PolarHBondContact O-N 3.25Å; I91-G96 PolarHBondContact O-N 3.4Å; I91-G96 VanDerWaalsContact O-N 3.15Å; I91-Y99 HydrophobicContact CG2-CE2 4.19Å; I91-E215 HydrophobicContact CD1-CG 3.95Å; I91-E215 HydrophobicContact CG1-CG 4.49Å; I91-E215 HydrophobicContact CG2-CG 3.9Å; I91-E215 WeakPolarHBondContact CG2-OE1 3.3Å; I91-M219 HydrophobicContact CG2-CE 4.07Å; I91-M219 HydrophobicContact CG2-CG 3.92Å; I91-M219 HydrophobicContact CG2-SD 3.73Å |
| 92 | F | 94.3 | Very high | 92 | Very high | 99 Ų | 99 | 72 Ų | 72 | 43% | 0.434 | 35% | 0.353 | S | S | . | . | H | α-helix | trans | -59.9 | -44.1 | 179.1 | -156.5 | -83.6 | 0 | 0 | 0 | 111.7 | L88 V89 Q90 G96 M219 F223 | L88-F92 WeakPolarHBondContact O-CB 3.32Å; L88-F92 PolarHBondContact O-N 3.38Å; V89-F92 PolarHBondContact O-N 3.37Å; Q90-F92 VanDerWaalsContact C-N 3.31Å; Q90-F92 PolarHBondContact O-N 2.92Å; F92-G96 WeakPolarHBondContact O-CA 3.28Å; F92-G96 PolarHBondContact O-N 3.35Å; F92-M219 HydrophobicContact CD2-CE 3.86Å; F92-F223 HydrophobicContact CD2-CE2 4.45Å; F92-F223 AromaticContact CD2-CZ 3.88Å; F92-F223 HydrophobicContact CD2-CZ 3.88Å; F92-F223 HydrophobicContact CE1-CZ 4.24Å; F92-F223 HydrophobicContact CE2-CD1 4.49Å; F92-F223 AromaticContact CE2-CE1 3.46Å; F92-F223 HydrophobicContact CE2-CE1 3.46Å; F92-F223 VanDerWaalsContact CE2-CE1 3.46Å; F92-F223 HydrophobicContact CE2-CE2 4.04Å; F92-F223 AromaticContact CE2-CZ 3.18Å; F92-F223 HydrophobicContact CE2-CZ 3.18Å; F92-F223 AromaticContact CZ-CE1 3.45Å; F92-F223 HydrophobicContact CZ-CE1 3.45Å; F92-F223 VanDerWaalsContact CZ-CE1 3.45Å; F92-F223 AromaticContact CZ-CZ 3.41Å; F92-F223 HydrophobicContact CZ-CZ 3.41Å; F92-F223 VanDerWaalsContact CZ-CZ 3.41Å |
| 93 | R | 93.7 | Very high | 92.4 | Very high | 211 Ų | 211 | 67.8 Ų | 67.8 | 80% | 0.796 | 34% | 0.337 | S | S | * | . | H | α-helix | trans | -69.6 | -45.2 | 179.1 | -76.5 | -175.7 | 177.6 | 174.8 | 0.5 | 113.7 | V89 Q90 I91 | V89-R93 WeakPolarHBondContact O-CG 3.22Å; V89-R93 PolarHBondContact O-N 3.09Å; Q90-R93 PolarHBondContact O-N 3.31Å; I91-R93 VanDerWaalsContact C-N 3.35Å; I91-R93 PolarHBondContact O-N 3.42Å |
| 94 | L | 93.5 | Very high | 93.1 | Very high | 113 Ų | 113 | 65.1 Ų | 65.1 | 59% | 0.592 | 31% | 0.312 | S | S | * | . | H | α-helix | trans | -76.6 | -37.3 | -173.3 | -70.4 | 170.9 | 0 | 0 | 0 | 112.6 | Q90 I91 | Q90-L94 HydrophobicContact CG-CD1 3.54Å; Q90-L94 HydrophobicContact CG-CG 4.26Å; Q90-L94 WeakPolarHBondContact O-CB 3.31Å; Q90-L94 WeakPolarHBondContact O-CG 3.37Å; Q90-L94 PolarHBondContact O-N 3.05Å; I91-L94 PolarHBondContact O-N 3.27Å |
| 95 | R | 94.1 | Very high | 94 | Very high | 51 Ų | 51 | 64.1 Ų | 64.1 | 19% | 0.192 | 30% | 0.303 | C | S | . | . | H | α-helix | trans | -144.5 | 6.3 | -167.5 | 49.4 | -177.1 | 170.5 | -155.7 | -0.3 | 114.5 | I91 W97 K98 Y99 H211 E215 | I91-R95 HydrophobicContact CG2-CG 4.2Å; I91-R95 VanDerWaalsContact O-CG 3.26Å; I91-R95 WeakPolarHBondContact O-CG 3.26Å; I91-R95 PolarHBondContact O-N 3.25Å; R95-W97 PolarHBondContact O-N 2.99Å; R95-K98 HydrophobicContact CB-CD 4.35Å; R95-K98 WeakPolarHBondContact O-CB 3.38Å; R95-K98 PolarHBondContact O-N 3.38Å; R95-Y99 HydrophobicContact CB-CE2 4.47Å; R95-Y99 HydrophobicContact CG-CE2 4.04Å; R95-Y99 WeakPolarHBondContact O-CD2 3.26Å; R95-H211 VanDerWaalsContact CD-CD2 3.48Å; R95-H211 WeakPolarHBondContact CD-CD2 3.2Å; R95-H211 WeakPolarHBondContact CD-NE2 3.34Å; R95-H211 PolarHBondContact NE-CD2 2.87Å; R95-H211 PolarHBondContact NH1-CD2 3.4Å; R95-H211 PolarHBondContact NH1-NE2 3.19Å; R95-E215 WeakPolarHBondContact CD-OE1 3.39Å; R95-E215 IonicContact CZ-OE1 3.3Å; R95-E215 IonicContact CZ-OE2 3.26Å; R95-E215 IonicContact NE-OE1 3.8Å; R95-E215 PolarHBondContact NE-OE1 3.44Å; R95-E215 IonicContact NE-OE2 3.27Å; R95-E215 IonicContact NH1-OE1 2.72Å; R95-E215 VanDerWaalsContact NH2-CD 3.35Å; R95-E215 IonicContact NH2-OE1 3.26Å; R95-E215 PolarHBondContact NH2-OE1 3.37Å; R95-E215 IonicContact NH2-OE2 2.68Å; R95-E215 PolarHBondContact NH2-OE2 3.01Å |
| 96 | G | 94.5 | Very high | 94.7 | Very high | 3 Ų | 3 | 58.2 Ų | 58.2 | 3% | 0.031 | 28% | 0.276 | C | S | . | . | H | α-helix | trans | -54.5 | -35.7 | 177.7 | 0 | 0 | 0 | 0 | 0 | 113.3 | I91 F92 K98 Y99 F100 F223 | I91-G96 PolarHBondContact O-N 3.4Å; I91-G96 VanDerWaalsContact O-N 3.15Å; F92-G96 WeakPolarHBondContact O-CA 3.28Å; F92-G96 PolarHBondContact O-N 3.35Å; G96-K98 VanDerWaalsContact C-N 3.31Å; G96-K98 PolarHBondContact O-N 3.39Å; G96-Y99 PolarHBondContact O-N 3.44Å; G96-F100 WeakPolarHBondContact O-CB 3.48Å; G96-F100 PolarHBondContact O-N 3.22Å; G96-F223 WeakPolarHBondContact O-CE2 3.28Å; G96-F223 WeakPolarHBondContact O-CZ 3.34Å |
| 97 | W | 96 | Very high | 95.3 | Very high | 168 Ų | 168 | 56.8 Ų | 56.8 | 64% | 0.636 | 27% | 0.266 | S | S | * | . | H | α-helix | trans | -61.8 | -35.3 | 178 | 77.6 | -91.3 | 0 | 0 | 0 | 113.3 | R95 F100 V101 | R95-W97 PolarHBondContact O-N 2.99Å; W97-F100 PolarHBondContact O-N 3.36Å; W97-V101 HydrophobicContact CE3-CG2 4.39Å; W97-V101 WeakPolarHBondContact O-CG2 3.38Å; W97-V101 PolarHBondContact O-N 2.96Å |
| 98 | K | 96.1 | Very high | 95.6 | Very high | 46 Ų | 46 | 57.9 Ų | 57.9 | 20% | 0.2 | 27% | 0.267 | C | S | . | . | H | α-helix | trans | -64.3 | -43.4 | 176.8 | -62.6 | 176.3 | 179.2 | 171.2 | 0 | 110.4 | R95 G96 L102 W206 | R95-K98 HydrophobicContact CB-CD 4.35Å; R95-K98 WeakPolarHBondContact O-CB 3.38Å; R95-K98 PolarHBondContact O-N 3.38Å; G96-K98 VanDerWaalsContact C-N 3.31Å; G96-K98 PolarHBondContact O-N 3.39Å; K98-L102 WeakPolarHBondContact O-CB 3.42Å; K98-L102 PolarHBondContact O-N 2.73Å; K98-L102 VanDerWaalsContact O-N 3.12Å; K98-W206 HydrophobicContact CD-CH2 3.99Å; K98-W206 HydrophobicContact CD-CZ3 4.06Å |
| 99 | Y | 97.7 | Very high | 95.8 | Very high | 0 Ų | 0 | 56.1 Ų | 56.1 | 0% | 0 | 26% | 0.257 | C | S | . | . | H | α-helix | trans | -71.4 | -34.5 | 176.8 | -64.8 | -71.3 | 0 | 0 | 0 | 112.9 | I91 R95 G96 L102 A103 L207 H211 E215 Y216 M219 | I91-Y99 HydrophobicContact CG2-CE2 4.19Å; R95-Y99 HydrophobicContact CB-CE2 4.47Å; R95-Y99 HydrophobicContact CG-CE2 4.04Å; R95-Y99 WeakPolarHBondContact O-CD2 3.26Å; G96-Y99 PolarHBondContact O-N 3.44Å; Y99-L102 PolarHBondContact O-N 2.9Å; Y99-A103 WeakPolarHBondContact O-CB 3.45Å; Y99-A103 PolarHBondContact O-N 3.43Å; Y99-L207 HydrophobicContact CD1-CD1 3.91Å; Y99-L207 HydrophobicContact CE1-CD1 3.8Å; Y99-L207 HydrophobicContact CE1-CD2 4.44Å; Y99-H211 PolarHBondContact OH-CD2 3.31Å; Y99-E215 WeakPolarHBondContact CE2-OE1 3.12Å; Y99-E215 VanDerWaalsContact OH-CD 3.31Å; Y99-E215 WeakPolarHBondContact OH-CG 3.37Å; Y99-E215 PolarHBondContact OH-OE1 3.07Å; Y99-Y216 HydrophobicContact CE1-CD2 4.16Å; Y99-M219 HydrophobicContact CD1-CB 3.67Å; Y99-M219 HydrophobicContact CD1-CG 4.42Å; Y99-M219 HydrophobicContact CD2-CB 3.81Å; Y99-M219 HydrophobicContact CD2-CE 3.96Å; Y99-M219 HydrophobicContact CD2-CG 3.84Å; Y99-M219 HydrophobicContact CE1-CB 4.11Å; Y99-M219 HydrophobicContact CE2-CB 4.21Å; Y99-M219 HydrophobicContact CE2-CG 3.92Å; Y99-M219 HydrophobicContact CG-CB 3.51Å; Y99-M219 HydrophobicContact CG-CE 4.46Å; Y99-M219 HydrophobicContact CG-CG 4.1Å |
| 100 | F | 97.9 | Very high | 95.8 | Very high | 81 Ų | 81 | 52.9 Ų | 52.9 | 36% | 0.355 | 24% | 0.238 | S | C | . | . | H | α-helix | trans | -63.4 | -48.1 | 175.6 | 178.3 | -99.1 | 0 | 0 | 0 | 111.5 | G96 W97 L102 A103 L104 F223 I227 | G96-F100 WeakPolarHBondContact O-CB 3.48Å; G96-F100 PolarHBondContact O-N 3.22Å; W97-F100 PolarHBondContact O-N 3.36Å; F100-L102 VanDerWaalsContact C-N 3.33Å; F100-L102 PolarHBondContact O-N 3Å; F100-A103 PolarHBondContact O-N 3.16Å; F100-L104 WeakPolarHBondContact O-CB 3.32Å; F100-L104 PolarHBondContact O-N 3.49Å; F100-F223 HydrophobicContact CB-CD1 4.16Å; F100-F223 HydrophobicContact CB-CD2 4.26Å; F100-F223 HydrophobicContact CB-CE1 4.08Å; F100-F223 HydrophobicContact CB-CE2 4.18Å; F100-F223 HydrophobicContact CB-CG 4.24Å; F100-F223 HydrophobicContact CB-CZ 4.08Å; F100-F223 AromaticContact CD2-CD1 3.61Å; F100-F223 HydrophobicContact CD2-CD1 3.61Å; F100-F223 AromaticContact CD2-CE1 3.91Å; F100-F223 HydrophobicContact CD2-CE1 3.91Å; F100-F223 HydrophobicContact CD2-CG 4.2Å; F100-F223 HydrophobicContact CG-CD1 4.38Å; F100-F223 HydrophobicContact CG-CE1 4.45Å; F100-I227 HydrophobicContact CD2-CD1 4.26Å; F100-I227 HydrophobicContact CE2-CD1 3.99Å; F100-I227 HydrophobicContact CE2-CG1 4.22Å |
| 101 | V | 97.8 | Very high | 95.7 | Very high | 63 Ų | 63 | 52.5 Ų | 52.5 | 38% | 0.382 | 24% | 0.235 | S | C | . | . | H | α-helix | trans | -61.1 | -43.5 | 176.3 | 172.4 | 0 | 0 | 0 | 0 | 110.8 | W97 L104 I105 | W97-V101 HydrophobicContact CE3-CG2 4.39Å; W97-V101 WeakPolarHBondContact O-CG2 3.38Å; W97-V101 PolarHBondContact O-N 2.96Å; V101-L104 PolarHBondContact O-N 2.74Å; V101-I105 HydrophobicContact CG1-CD1 3.85Å; V101-I105 VanDerWaalsContact O-CG1 3.32Å; V101-I105 WeakPolarHBondContact O-CG1 3.5Å; V101-I105 PolarHBondContact O-N 3.45Å |
| 102 | L | 97.7 | Very high | 95.7 | Very high | 0 Ų | 0 | 54.2 Ų | 54.2 | 0% | 0 | 24% | 0.244 | C | C | . | . | H | α-helix | trans | -59.6 | -49.8 | 175.8 | 176.2 | 62.1 | 0 | 0 | 0 | 112 | K98 Y99 F100 L104 I105 D106 S200 I203 L207 Y216 I220 | K98-L102 WeakPolarHBondContact O-CB 3.42Å; K98-L102 PolarHBondContact O-N 2.73Å; K98-L102 VanDerWaalsContact O-N 3.12Å; Y99-L102 PolarHBondContact O-N 2.9Å; F100-L102 VanDerWaalsContact C-N 3.33Å; F100-L102 PolarHBondContact O-N 3Å; L102-L104 VanDerWaalsContact C-N 3.27Å; L102-L104 PolarHBondContact O-N 3.38Å; L102-I105 PolarHBondContact O-N 3.38Å; L102-D106 WeakPolarHBondContact O-CB 3.27Å; L102-D106 PolarHBondContact O-N 2.93Å; L102-S200 WeakPolarHBondContact CD1-O 3.47Å; L102-S200 WeakPolarHBondContact CD1-OG 3.43Å; L102-I203 HydrophobicContact CB-CG2 4.25Å; L102-I203 HydrophobicContact CD1-CB 4.01Å; L102-I203 HydrophobicContact CD1-CG2 3.93Å; L102-I203 HydrophobicContact CD2-CG2 4.24Å; L102-I203 HydrophobicContact CG-CG2 4.37Å; L102-L207 HydrophobicContact CD2-CD1 3.69Å; L102-Y216 HydrophobicContact CD2-CD2 4.47Å; L102-Y216 HydrophobicContact CD2-CE2 3.45Å; L102-Y216 VanDerWaalsContact CD2-CE2 3.45Å; L102-I220 HydrophobicContact CB-CD1 4.44Å; L102-I220 HydrophobicContact CD2-CD1 3.93Å; L102-I220 HydrophobicContact CG-CD1 3.75Å |
| 103 | A | 98 | Very high | 95.6 | Very high | 0 Ų | 0 | 50.1 Ų | 50.1 | 0% | 0 | 23% | 0.227 | C | C | . | . | H | α-helix | trans | -60.1 | -37.9 | 179.4 | 0 | 0 | 0 | 0 | 0 | 112.1 | Y99 F100 D106 V107 I220 F223 I227 | Y99-A103 WeakPolarHBondContact O-CB 3.45Å; Y99-A103 PolarHBondContact O-N 3.43Å; F100-A103 PolarHBondContact O-N 3.16Å; A103-D106 PolarHBondContact O-N 3.4Å; A103-V107 WeakPolarHBondContact O-CB 3.36Å; A103-V107 WeakPolarHBondContact O-CG2 3.49Å; A103-V107 PolarHBondContact O-N 3.49Å; A103-I220 HydrophobicContact CB-CD1 3.85Å; A103-F223 HydrophobicContact CB-CB 3.53Å; A103-I227 HydrophobicContact CB-CD1 3.93Å |
| 104 | L | 98 | Very high | 95.3 | Very high | 70 Ų | 70 | 42.1 Ų | 42.1 | 37% | 0.366 | 20% | 0.201 | S | C | . | . | H | α-helix | trans | -62.7 | -49.2 | 175.7 | -175 | 66.7 | 0 | 0 | 0 | 111.2 | F100 V101 L102 D106 V107 E108 I227 | F100-L104 WeakPolarHBondContact O-CB 3.32Å; F100-L104 PolarHBondContact O-N 3.49Å; V101-L104 PolarHBondContact O-N 2.74Å; L102-L104 VanDerWaalsContact C-N 3.27Å; L102-L104 PolarHBondContact O-N 3.38Å; L104-D106 VanDerWaalsContact C-N 3.32Å; L104-D106 PolarHBondContact O-N 3.2Å; L104-V107 PolarHBondContact O-N 2.98Å; L104-E108 HydrophobicContact CD1-CG 4.32Å; L104-E108 WeakPolarHBondContact O-CB 3.27Å; L104-E108 VanDerWaalsContact O-CG 3.27Å; L104-E108 WeakPolarHBondContact O-CG 3.39Å; L104-E108 PolarHBondContact O-N 3.39Å; L104-I227 HydrophobicContact CB-CD1 3.91Å; L104-I227 HydrophobicContact CD1-CD1 4.21Å; L104-I227 HydrophobicContact CD1-CG2 3.95Å |
| 105 | I | 98 | Very high | 94.8 | Very high | 29 Ų | 29 | 40.4 Ų | 40.4 | 15% | 0.149 | 19% | 0.189 | C | C | . | . | H | α-helix | trans | -59.8 | -44.9 | 178.7 | -68.3 | 168.5 | 0 | 0 | 0 | 110.6 | V101 L102 E108 A109 L196 V199 I203 | V101-I105 HydrophobicContact CG1-CD1 3.85Å; V101-I105 VanDerWaalsContact O-CG1 3.32Å; V101-I105 WeakPolarHBondContact O-CG1 3.5Å; V101-I105 PolarHBondContact O-N 3.45Å; L102-I105 PolarHBondContact O-N 3.38Å; I105-E108 PolarHBondContact O-N 3.21Å; I105-A109 VanDerWaalsContact O-CB 3.27Å; I105-A109 WeakPolarHBondContact O-CB 3.3Å; I105-A109 PolarHBondContact O-N 3.04Å; I105-L196 HydrophobicContact CG2-CB 4.04Å; I105-L196 HydrophobicContact CG2-CD2 4.09Å; I105-L196 VanDerWaalsContact CG2-O 3.27Å; I105-L196 WeakPolarHBondContact CG2-O 3.44Å; I105-V199 HydrophobicContact CD1-CG1 4Å; I105-V199 HydrophobicContact CG2-CB 4.44Å; I105-V199 HydrophobicContact CG2-CG1 4.44Å; I105-I203 HydrophobicContact CD1-CD1 4.18Å |
| 106 | D | 96.7 | Very high | 94.6 | Very high | 7 Ų | 7 | 38 Ų | 38 | 4% | 0.037 | 18% | 0.18 | C | C | . | . | H | α-helix | trans | -66.3 | -43.4 | -176.9 | -155.8 | 42.1 | 0 | 0 | 0 | 112.6 | Y68 L102 A103 L104 T110 S200 Y290 | Y68-D106 PolarHBondContact OH-OD2 3.27Å; L102-D106 WeakPolarHBondContact O-CB 3.27Å; L102-D106 PolarHBondContact O-N 2.93Å; A103-D106 PolarHBondContact O-N 3.4Å; L104-D106 VanDerWaalsContact C-N 3.32Å; L104-D106 PolarHBondContact O-N 3.2Å; D106-T110 PolarHBondContact O-N 3.41Å; D106-T110 VanDerWaalsContact O-N 3.15Å; D106-T110 PolarHBondContact O-OG1 2.91Å; D106-S200 PolarHBondContact OD1-OG 3.43Å; D106-Y290 PolarHBondContact OD2-OH 2.98Å |
| 107 | V | 96.1 | Very high | 94 | Very high | 2 Ų | 2 | 42.6 Ų | 42.6 | 1% | 0.012 | 20% | 0.197 | C | C | . | . | H | α-helix | trans | -67.3 | -42.9 | 177 | 173.9 | 0 | 0 | 0 | 0 | 111.2 | Y68 A103 L104 T110 F111 I227 Q231 | Y68-V107 HydrophobicContact CD2-CG2 4.3Å; Y68-V107 HydrophobicContact CE2-CG2 3.57Å; A103-V107 WeakPolarHBondContact O-CB 3.36Å; A103-V107 WeakPolarHBondContact O-CG2 3.49Å; A103-V107 PolarHBondContact O-N 3.49Å; L104-V107 PolarHBondContact O-N 2.98Å; V107-T110 PolarHBondContact O-N 2.86Å; V107-F111 PolarHBondContact O-N 3.1Å; V107-I227 HydrophobicContact CB-CG2 4.11Å; V107-I227 HydrophobicContact CG1-CG2 3.91Å; V107-I227 HydrophobicContact CG2-CB 4.49Å; V107-I227 HydrophobicContact CG2-CG2 4.38Å; V107-Q231 VanDerWaalsContact CG1-CD 3.46Å; V107-Q231 HydrophobicContact CG1-CG 4.43Å |
| 108 | E | 95.9 | Very high | 93.4 | Very high | 64 Ų | 64 | 41.1 Ų | 41.1 | 30% | 0.299 | 20% | 0.197 | S | C | . | . | H | α-helix | trans | -68.7 | -38.8 | 177.9 | -68.7 | -58.8 | 152.5 | 0 | 0 | 112.5 | L104 I105 T110 F111 L112 L196 Q231 | L104-E108 HydrophobicContact CD1-CG 4.32Å; L104-E108 WeakPolarHBondContact O-CB 3.27Å; L104-E108 VanDerWaalsContact O-CG 3.27Å; L104-E108 WeakPolarHBondContact O-CG 3.39Å; L104-E108 PolarHBondContact O-N 3.39Å; I105-E108 PolarHBondContact O-N 3.21Å; E108-T110 VanDerWaalsContact C-N 3.31Å; E108-T110 PolarHBondContact O-N 3.4Å; E108-F111 PolarHBondContact O-N 2.92Å; E108-L112 WeakPolarHBondContact O-CG 3.2Å; E108-L112 PolarHBondContact O-N 2.95Å; E108-L196 HydrophobicContact CB-CD1 4.32Å; E108-Q231 PolarHBondContact OE1-NE2 3.4Å; E108-Q231 PolarHBondContact OE2-NE2 2.92Å |
| 109 | A | 96.2 | Very high | 92.7 | Very high | 0 Ų | 0 | 43 Ų | 43 | 0% | 0 | 20% | 0.203 | C | C | . | . | H | α-helix | trans | -56.2 | -48.8 | 173.4 | 0 | 0 | 0 | 0 | 0 | 111 | I105 F111 L112 I113 L196 Y197 | I105-A109 VanDerWaalsContact O-CB 3.27Å; I105-A109 WeakPolarHBondContact O-CB 3.3Å; I105-A109 PolarHBondContact O-N 3.04Å; A109-F111 PolarHBondContact O-N 3.32Å; A109-L112 PolarHBondContact O-N 3.43Å; A109-I113 WeakPolarHBondContact O-CG1 3.07Å; A109-I113 PolarHBondContact O-N 2.68Å; A109-I113 VanDerWaalsContact O-N 3.11Å; A109-L196 HydrophobicContact CB-CB 3.65Å; A109-Y197 HydrophobicContact CB-CD1 3.66Å; A109-Y197 HydrophobicContact CB-CD2 4.01Å; A109-Y197 HydrophobicContact CB-CE1 3.8Å; A109-Y197 HydrophobicContact CB-CE2 4.17Å; A109-Y197 HydrophobicContact CB-CG 3.75Å |
| 110 | T | 92.9 | Very high | 92.2 | Very high | 21 Ų | 21 | 43.6 Ų | 43.6 | 13% | 0.129 | 21% | 0.207 | C | C | . | . | H | α-helix | trans | -59.7 | -46.3 | 177.1 | -51.7 | 0 | 0 | 0 | 0 | 111.2 | D106 V107 E108 L112 V114 Y197 | D106-T110 PolarHBondContact O-N 3.41Å; D106-T110 VanDerWaalsContact O-N 3.15Å; D106-T110 PolarHBondContact O-OG1 2.91Å; V107-T110 PolarHBondContact O-N 2.86Å; E108-T110 VanDerWaalsContact C-N 3.31Å; E108-T110 PolarHBondContact O-N 3.4Å; T110-L112 PolarHBondContact O-N 3.19Å; T110-V114 HydrophobicContact CG2-CG2 4.36Å; T110-V114 WeakPolarHBondContact O-CB 3.48Å; T110-V114 VanDerWaalsContact O-CG2 3.22Å; T110-V114 WeakPolarHBondContact O-CG2 3.39Å; T110-V114 PolarHBondContact O-N 3.26Å; T110-Y197 VanDerWaalsContact CA-OH 3.24Å; T110-Y197 WeakPolarHBondContact CA-OH 3.47Å; T110-Y197 WeakPolarHBondContact CB-OH 3.15Å; T110-Y197 PolarHBondContact OG1-OH 3.36Å |
| 111 | F | 91.4 | Very high | 91.3 | Very high | 74 Ų | 74 | 40.4 Ų | 40.4 | 33% | 0.325 | 20% | 0.197 | S | C | . | . | H | α-helix | trans | -61.5 | -44.3 | 179.5 | 174.6 | -103.7 | 0 | 0 | 0 | 112.4 | V107 E108 A109 K115 | V107-F111 PolarHBondContact O-N 3.1Å; E108-F111 PolarHBondContact O-N 2.92Å; A109-F111 PolarHBondContact O-N 3.32Å; F111-K115 HydrophobicContact CE1-CD 3.96Å; F111-K115 HydrophobicContact CZ-CD 3.89Å; F111-K115 WeakPolarHBondContact O-CB 3.38Å; F111-K115 PolarHBondContact O-N 3.45Å |
| 112 | L | 93.8 | Very high | 90.3 | Very high | 37 Ų | 37 | 41.9 Ų | 41.9 | 19% | 0.194 | 20% | 0.203 | C | C | . | . | H | α-helix | trans | -64 | -46.6 | 179.8 | -71.7 | 177 | 0 | 0 | 0 | 112.3 | E108 A109 T110 K115 A116 M189 L196 | E108-L112 WeakPolarHBondContact O-CG 3.2Å; E108-L112 PolarHBondContact O-N 2.95Å; A109-L112 PolarHBondContact O-N 3.43Å; T110-L112 PolarHBondContact O-N 3.19Å; L112-K115 PolarHBondContact O-N 2.88Å; L112-A116 WeakPolarHBondContact O-CB 3.2Å; L112-A116 PolarHBondContact O-N 3.06Å; L112-M189 HydrophobicContact CD2-CG 4.48Å; L112-L196 HydrophobicContact CD1-CD1 3.83Å |
| 113 | I | 91 | Very high | 89.3 | Confident | 13 Ų | 13 | 42.8 Ų | 42.8 | 7% | 0.067 | 21% | 0.21 | C | C | . | . | H | α-helix | trans | -62.5 | -47.4 | 178.1 | -68.3 | -73.2 | 0 | 0 | 0 | 110.6 | A109 K115 A116 Y117 V125 C190 Y197 | A109-I113 WeakPolarHBondContact O-CG1 3.07Å; A109-I113 PolarHBondContact O-N 2.68Å; A109-I113 VanDerWaalsContact O-N 3.11Å; I113-K115 VanDerWaalsContact C-N 3.29Å; I113-K115 PolarHBondContact O-N 2.88Å; I113-A116 WeakPolarHBondContact O-CB 3.39Å; I113-A116 PolarHBondContact O-N 3.48Å; I113-A116 VanDerWaalsContact O-N 3.14Å; I113-Y117 HydrophobicContact CG2-CE2 3.98Å; I113-Y117 WeakPolarHBondContact O-CD2 3.31Å; I113-Y117 PolarHBondContact O-N 2.74Å; I113-V125 HydrophobicContact CG2-CG1 4.17Å; I113-C190 HydrophobicContact CD1-CB 4.36Å; I113-Y197 HydrophobicContact CG1-CD2 4.33Å; I113-Y197 HydrophobicContact CG1-CE2 4.03Å |
| 114 | V | 87.1 | Confident | 88.7 | Confident | 43 Ų | 43 | 43.8 Ų | 43.8 | 26% | 0.261 | 22% | 0.217 | S | C | . | . | H | α-helix | trans | -59.9 | -42.7 | 178.3 | 168.2 | 0 | 0 | 0 | 0 | 111.2 | P60 T110 A116 Y117 | P60-V114 HydrophobicContact CB-CG1 3.43Å; P60-V114 VanDerWaalsContact CB-CG1 3.43Å; P60-V114 HydrophobicContact CB-CG2 4.45Å; P60-V114 HydrophobicContact CG-CG1 3.57Å; T110-V114 HydrophobicContact CG2-CG2 4.36Å; T110-V114 WeakPolarHBondContact O-CB 3.48Å; T110-V114 VanDerWaalsContact O-CG2 3.22Å; T110-V114 WeakPolarHBondContact O-CG2 3.39Å; T110-V114 PolarHBondContact O-N 3.26Å; V114-A116 VanDerWaalsContact C-N 3.31Å; V114-A116 PolarHBondContact O-N 3.26Å; V114-Y117 PolarHBondContact O-N 3.43Å |
| 115 | K | 84.9 | Confident | 88.1 | Confident | 76 Ų | 76 | 40.5 Ų | 40.5 | 33% | 0.33 | 20% | 0.2 | S | C | . | . | H | α-helix | trans | -66.9 | -33.8 | 178.9 | -172.6 | 174.7 | -178.6 | -177.8 | 0 | 111.9 | F111 L112 I113 Y117 H118 Y119 M189 | F111-K115 HydrophobicContact CE1-CD 3.96Å; F111-K115 HydrophobicContact CZ-CD 3.89Å; F111-K115 WeakPolarHBondContact O-CB 3.38Å; F111-K115 PolarHBondContact O-N 3.45Å; L112-K115 PolarHBondContact O-N 2.88Å; I113-K115 VanDerWaalsContact C-N 3.29Å; I113-K115 PolarHBondContact O-N 2.88Å; K115-Y117 VanDerWaalsContact C-N 3.31Å; K115-Y117 PolarHBondContact O-N 3.01Å; K115-H118 PolarHBondContact O-N 3.41Å; K115-Y119 HydrophobicContact CG-CE2 4.02Å; K115-Y119 VanDerWaalsContact O-CD2 3.3Å; K115-Y119 WeakPolarHBondContact O-CD2 3.27Å; K115-M189 HydrophobicContact CB-SD 4.41Å; K115-M189 HydrophobicContact CD-CE 4.43Å; K115-M189 HydrophobicContact CD-SD 4.05Å; K115-M189 HydrophobicContact CG-SD 3.96Å |
| 116 | A | 89.2 | Confident | 87.3 | Confident | 0 Ų | 0 | 40.9 Ų | 40.9 | 0% | 0 | 20% | 0.201 | C | C | . | . | H | α-helix | trans | -64.1 | -32.5 | 179.8 | 0 | 0 | 0 | 0 | 0 | 113.3 | L112 I113 V114 H118 Y119 T120 G186 M189 C190 | L112-A116 WeakPolarHBondContact O-CB 3.2Å; L112-A116 PolarHBondContact O-N 3.06Å; I113-A116 WeakPolarHBondContact O-CB 3.39Å; I113-A116 PolarHBondContact O-N 3.48Å; I113-A116 VanDerWaalsContact O-N 3.14Å; V114-A116 VanDerWaalsContact C-N 3.31Å; V114-A116 PolarHBondContact O-N 3.26Å; A116-H118 PolarHBondContact O-N 2.92Å; A116-Y119 PolarHBondContact O-N 3.34Å; A116-T120 PolarHBondContact O-N 2.97Å; A116-G186 WeakPolarHBondContact CB-O 3.45Å; A116-M189 HydrophobicContact CB-CB 3.85Å; A116-C190 HydrophobicContact CB-CB 4.43Å; A116-C190 WeakPolarHBondContact CB-SG 3.48Å |
| 117 | Y | 81.9 | Confident | 86.7 | Confident | 101 Ų | 101 | 44.1 Ų | 44.1 | 40% | 0.396 | 22% | 0.218 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -56.8 | -20.6 | 174.8 | -74.3 | -64 | 0 | 0 | 0 | 114 | I113 V114 K115 L122 V125 | I113-Y117 HydrophobicContact CG2-CE2 3.98Å; I113-Y117 WeakPolarHBondContact O-CD2 3.31Å; I113-Y117 PolarHBondContact O-N 2.74Å; V114-Y117 PolarHBondContact O-N 3.43Å; K115-Y117 VanDerWaalsContact C-N 3.31Å; K115-Y117 PolarHBondContact O-N 3.01Å; Y117-L122 HydrophobicContact CD1-CD2 3.57Å; Y117-L122 HydrophobicContact CE1-CD2 3.55Å; Y117-V125 HydrophobicContact CD1-CB 3.98Å; Y117-V125 HydrophobicContact CD1-CG1 4.12Å; Y117-V125 HydrophobicContact CD1-CG2 3.54Å; Y117-V125 HydrophobicContact CE1-CB 3.52Å; Y117-V125 HydrophobicContact CE1-CG1 3.47Å; Y117-V125 VanDerWaalsContact CE1-CG1 3.47Å; Y117-V125 HydrophobicContact CE1-CG2 3.66Å; Y117-V125 HydrophobicContact CE2-CG1 4.1Å; Y117-V125 HydrophobicContact CG-CG2 4.25Å; Y117-V125 VanDerWaalsContact CZ-CG1 3.44Å |
| 118 | H | 82.3 | Confident | 86.3 | Confident | 137 Ų | 137 | 45.5 Ų | 45.5 | 63% | 0.634 | 23% | 0.225 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -82.1 | -16 | 174.4 | -70.3 | -67.6 | 0 | 0 | 0 | 114.1 | K115 A116 | K115-H118 PolarHBondContact O-N 3.41Å; A116-H118 PolarHBondContact O-N 2.92Å |
| 119 | Y | 82.9 | Confident | 85.9 | Confident | 84 Ų | 84 | 45.1 Ų | 45.1 | 33% | 0.329 | 23% | 0.225 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -114.4 | -25 | -174.1 | -63.8 | -77.2 | 0 | 0 | 0 | 113.5 | K115 A116 N182 R183 M189 | K115-Y119 HydrophobicContact CG-CE2 4.02Å; K115-Y119 VanDerWaalsContact O-CD2 3.3Å; K115-Y119 WeakPolarHBondContact O-CD2 3.27Å; A116-Y119 PolarHBondContact O-N 3.34Å; Y119-N182 HydrophobicContact CD1-CB 4.38Å; Y119-R183 WeakPolarHBondContact O-CA 3.25Å; Y119-M189 HydrophobicContact CD2-SD 4.12Å; Y119-M189 HydrophobicContact CE2-CE 4.33Å; Y119-M189 HydrophobicContact CE2-SD 4.25Å |
| 120 | T | 86.6 | Confident | 85.7 | Confident | 13 Ų | 13 | 45.7 Ų | 45.7 | 8% | 0.08 | 23% | 0.229 | C | C | . | . | S | Bend | trans | -131.3 | 168.4 | -179.7 | -161.2 | 0 | 0 | 0 | 0 | 111.8 | A116 S124 V125 D187 | A116-T120 PolarHBondContact O-N 2.97Å; T120-S124 WeakPolarHBondContact OG1-CB 3.3Å; T120-S124 PolarHBondContact OG1-OG 3.04Å; T120-V125 HydrophobicContact CG2-CG2 3.47Å; T120-V125 VanDerWaalsContact CG2-CG2 3.47Å; T120-D187 WeakPolarHBondContact CB-OD1 3.47Å; T120-D187 PolarHBondContact OG1-OD1 2.72Å |
| 121 | G | 78.9 | Confident | 85.7 | Confident | 15 Ų | 15 | 48.9 Ų | 48.9 | 16% | 0.155 | 24% | 0.241 | C | C | . | . | trans | -79.2 | 154.7 | -177 | 0 | 0 | 0 | 0 | 0 | 113 | A123 S124 V125 | G121-A123 VanDerWaalsContact C-N 3.32Å; G121-A123 PolarHBondContact O-N 3.39Å; G121-S124 WeakPolarHBondContact O-CA 3.47Å; G121-S124 WeakPolarHBondContact O-CB 3.27Å; G121-S124 PolarHBondContact O-N 2.84Å; G121-V125 WeakPolarHBondContact O-CG2 3.29Å; G121-V125 PolarHBondContact O-N 2.98Å | ||
| 122 | L | 77.2 | Confident | 85.9 | Confident | 94 Ų | 94 | 45.6 Ų | 45.6 | 49% | 0.492 | 23% | 0.227 | S | C | . | . | H | α-helix | trans | -51.7 | -48.4 | 178.2 | -66 | 172.7 | 0 | 0 | 0 | 112.4 | Y117 S124 V125 Q126 | Y117-L122 HydrophobicContact CD1-CD2 3.57Å; Y117-L122 HydrophobicContact CE1-CD2 3.55Å; L122-S124 VanDerWaalsContact C-N 3.28Å; L122-S124 PolarHBondContact O-N 3.37Å; L122-V125 PolarHBondContact O-N 3.19Å; L122-V125 VanDerWaalsContact O-N 3.13Å; L122-Q126 WeakPolarHBondContact O-CG 3.49Å; L122-Q126 PolarHBondContact O-N 2.89Å |
| 123 | A | 77.4 | Confident | 86 | Confident | 19 Ų | 19 | 44 Ų | 44 | 16% | 0.157 | 22% | 0.219 | C | C | . | . | H | α-helix | trans | -61.6 | -34.9 | 178.5 | 0 | 0 | 0 | 0 | 0 | 112.7 | G121 L127 V167 D170 | G121-A123 VanDerWaalsContact C-N 3.32Å; G121-A123 PolarHBondContact O-N 3.39Å; A123-L127 PolarHBondContact O-N 3.43Å; A123-L127 VanDerWaalsContact O-N 3.1Å; A123-V167 HydrophobicContact CB-CG1 4.36Å; A123-D170 HydrophobicContact CB-CB 4.34Å |
| 124 | S | 83.6 | Confident | 86.2 | Confident | 21 Ų | 21 | 45.9 Ų | 45.9 | 15% | 0.147 | 23% | 0.232 | C | C | . | . | H | α-helix | trans | -66.4 | -48.8 | 173.6 | -164.3 | 0 | 0 | 0 | 0 | 110 | T120 G121 L122 Q126 L127 L128 D187 | T120-S124 WeakPolarHBondContact OG1-CB 3.3Å; T120-S124 PolarHBondContact OG1-OG 3.04Å; G121-S124 WeakPolarHBondContact O-CA 3.47Å; G121-S124 WeakPolarHBondContact O-CB 3.27Å; G121-S124 PolarHBondContact O-N 2.84Å; L122-S124 VanDerWaalsContact C-N 3.28Å; L122-S124 PolarHBondContact O-N 3.37Å; S124-Q126 VanDerWaalsContact C-N 3.31Å; S124-Q126 PolarHBondContact O-N 3.41Å; S124-L127 PolarHBondContact O-N 3.11Å; S124-L128 WeakPolarHBondContact O-CB 3.46Å; S124-L128 WeakPolarHBondContact O-CD1 3.42Å; S124-L128 PolarHBondContact O-N 2.8Å; S124-D187 PolarHBondContact OG-OD1 2.66Å |
| 125 | V | 85.4 | Confident | 86.7 | Confident | 1 Ų | 1 | 44.9 Ų | 44.9 | 1% | 0.006 | 23% | 0.226 | C | C | . | . | H | α-helix | trans | -57.1 | -44.8 | 178.6 | -180 | 0 | 0 | 0 | 0 | 111.5 | I113 Y117 T120 G121 L122 L128 D129 C190 | I113-V125 HydrophobicContact CG2-CG1 4.17Å; Y117-V125 HydrophobicContact CD1-CB 3.98Å; Y117-V125 HydrophobicContact CD1-CG1 4.12Å; Y117-V125 HydrophobicContact CD1-CG2 3.54Å; Y117-V125 HydrophobicContact CE1-CB 3.52Å; Y117-V125 HydrophobicContact CE1-CG1 3.47Å; Y117-V125 VanDerWaalsContact CE1-CG1 3.47Å; Y117-V125 HydrophobicContact CE1-CG2 3.66Å; Y117-V125 HydrophobicContact CE2-CG1 4.1Å; Y117-V125 HydrophobicContact CG-CG2 4.25Å; Y117-V125 VanDerWaalsContact CZ-CG1 3.44Å; T120-V125 HydrophobicContact CG2-CG2 3.47Å; T120-V125 VanDerWaalsContact CG2-CG2 3.47Å; G121-V125 WeakPolarHBondContact O-CG2 3.29Å; G121-V125 PolarHBondContact O-N 2.98Å; L122-V125 PolarHBondContact O-N 3.19Å; L122-V125 VanDerWaalsContact O-N 3.13Å; V125-L128 PolarHBondContact O-N 3.43Å; V125-D129 VanDerWaalsContact O-CB 3.31Å; V125-D129 WeakPolarHBondContact O-CB 3.49Å; V125-D129 PolarHBondContact O-N 2.84Å; V125-C190 VanDerWaalsContact CG2-SG 3.56Å |
| 126 | Q | 82.6 | Confident | 87.3 | Confident | 36 Ų | 36 | 41.3 Ų | 41.3 | 17% | 0.168 | 21% | 0.21 | C | C | . | . | H | α-helix | trans | -64.5 | -43.9 | 179.7 | -71.9 | 174.1 | -44.9 | 0 | 0 | 112.9 | L122 S124 D129 C130 D313 | L122-Q126 WeakPolarHBondContact O-CG 3.49Å; L122-Q126 PolarHBondContact O-N 2.89Å; S124-Q126 VanDerWaalsContact C-N 3.31Å; S124-Q126 PolarHBondContact O-N 3.41Å; Q126-D129 PolarHBondContact O-N 3.43Å; Q126-C130 PolarHBondContact O-N 2.83Å; Q126-C130 PolarHBondContact O-SG 3.19Å; Q126-D313 PolarHBondContact NE2-OD1 2.99Å |
| 127 | L | 84 | Confident | 87.6 | Confident | 75 Ų | 75 | 42.7 Ų | 42.7 | 39% | 0.393 | 22% | 0.217 | S | C | . | . | H | α-helix | trans | -61 | -45.8 | 173.5 | -85.3 | -179.5 | 0 | 0 | 0 | 112 | A123 S124 D129 C130 V163 V167 | A123-L127 PolarHBondContact O-N 3.43Å; A123-L127 VanDerWaalsContact O-N 3.1Å; S124-L127 PolarHBondContact O-N 3.11Å; L127-D129 VanDerWaalsContact C-N 3.33Å; L127-C130 VanDerWaalsContact O-CB 3.29Å; L127-C130 WeakPolarHBondContact O-CB 3.46Å; L127-C130 PolarHBondContact O-N 3.26Å; L127-V163 HydrophobicContact CD2-CG1 4Å; L127-V167 HydrophobicContact CD1-CB 4.22Å; L127-V167 HydrophobicContact CD1-CG1 3.6Å; L127-V167 HydrophobicContact CD1-CG2 4.08Å; L127-V167 HydrophobicContact CD2-CB 4.17Å; L127-V167 HydrophobicContact CD2-CG1 4.46Å; L127-V167 HydrophobicContact CD2-CG2 3.54Å; L127-V167 HydrophobicContact CG-CB 4.09Å; L127-V167 HydrophobicContact CG-CG1 3.95Å; L127-V167 HydrophobicContact CG-CG2 3.41Å; L127-V167 VanDerWaalsContact CG-CG2 3.41Å |
| 128 | L | 86.9 | Confident | 88.3 | Confident | 31 Ų | 31 | 41.6 Ų | 41.6 | 16% | 0.162 | 22% | 0.221 | C | C | . | . | H | α-helix | trans | -72.5 | -29.3 | -175.8 | -86.1 | 69 | 0 | 0 | 0 | 111.6 | S124 V125 C130 F131 D187 C190 L191 | S124-L128 WeakPolarHBondContact O-CB 3.46Å; S124-L128 WeakPolarHBondContact O-CD1 3.42Å; S124-L128 PolarHBondContact O-N 2.8Å; V125-L128 PolarHBondContact O-N 3.43Å; L128-C130 PolarHBondContact O-N 3.2Å; L128-F131 WeakPolarHBondContact O-CB 3.41Å; L128-F131 PolarHBondContact O-N 3.13Å; L128-D187 VanDerWaalsContact CD2-CA 3.49Å; L128-D187 HydrophobicContact CD2-CB 3.61Å; L128-D187 VanDerWaalsContact CD2-O 3.28Å; L128-D187 WeakPolarHBondContact CD2-O 3.33Å; L128-C190 HydrophobicContact CB-CB 3.73Å; L128-C190 HydrophobicContact CD2-CB 3.75Å; L128-C190 HydrophobicContact CG-CB 4.42Å; L128-L191 HydrophobicContact CB-CD2 4.46Å; L128-L191 HydrophobicContact CD2-CD2 4.34Å; L128-L191 HydrophobicContact CD2-CG 3.91Å; L128-L191 HydrophobicContact CG-CD2 4.12Å; L128-L191 HydrophobicContact CG-CG 4.26Å |
| 129 | D | 87.8 | Confident | 89 | Confident | 57 Ų | 57 | 36.7 Ų | 36.7 | 31% | 0.305 | 20% | 0.2 | S | C | . | . | H | α-helix | trans | -66 | -27.4 | 174.2 | -162.8 | 34.3 | 0 | 0 | 0 | 112 | V125 Q126 L127 F131 T132 | V125-D129 VanDerWaalsContact O-CB 3.31Å; V125-D129 WeakPolarHBondContact O-CB 3.49Å; V125-D129 PolarHBondContact O-N 2.84Å; Q126-D129 PolarHBondContact O-N 3.43Å; L127-D129 VanDerWaalsContact C-N 3.33Å; D129-F131 PolarHBondContact O-N 3.27Å; D129-F131 VanDerWaalsContact O-N 3.12Å; D129-T132 WeakPolarHBondContact O-CB 3.35Å; D129-T132 PolarHBondContact O-N 3.25Å; D129-T132 PolarHBondContact O-OG1 2.8Å |
| 130 | C | 91.2 | Very high | 89.6 | Confident | 12 Ų | 12 | 32.7 Ų | 32.7 | 8% | 0.081 | 18% | 0.184 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -63.6 | -16.7 | 171.9 | -62.3 | 0 | 0 | 0 | 0 | 113.2 | Q126 L127 L128 T132 I133 P134 V163 L310 | Q126-C130 PolarHBondContact O-N 2.83Å; Q126-C130 PolarHBondContact O-SG 3.19Å; L127-C130 VanDerWaalsContact O-CB 3.29Å; L127-C130 WeakPolarHBondContact O-CB 3.46Å; L127-C130 PolarHBondContact O-N 3.26Å; L128-C130 PolarHBondContact O-N 3.2Å; C130-T132 PolarHBondContact O-N 3.5Å; C130-T132 VanDerWaalsContact O-N 3.15Å; C130-I133 WeakPolarHBondContact O-CB 3.45Å; C130-I133 PolarHBondContact O-N 3.41Å; C130-P134 VanDerWaalsContact O-CD 3.27Å; C130-P134 WeakPolarHBondContact O-CD 3.19Å; C130-V163 VanDerWaalsContact SG-CG1 3.58Å; C130-L310 WeakPolarHBondContact SG-CD2 3.23Å |
| 131 | F | 93.9 | Very high | 89.9 | Confident | 88 Ų | 88 | 35.8 Ų | 35.8 | 39% | 0.386 | 20% | 0.196 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -59.6 | -20.4 | 170.9 | -174.7 | -117 | 0 | 0 | 0 | 112.5 | L128 D129 I133 P134 V135 L191 A194 A195 | L128-F131 WeakPolarHBondContact O-CB 3.41Å; L128-F131 PolarHBondContact O-N 3.13Å; D129-F131 PolarHBondContact O-N 3.27Å; D129-F131 VanDerWaalsContact O-N 3.12Å; F131-I133 PolarHBondContact O-N 3.38Å; F131-P134 HydrophobicContact CD2-CG 4.46Å; F131-P134 VanDerWaalsContact O-CD 3.28Å; F131-P134 WeakPolarHBondContact O-CD 3.32Å; F131-V135 HydrophobicContact CD1-CG2 3.92Å; F131-V135 HydrophobicContact CE1-CG2 3.57Å; F131-V135 HydrophobicContact CE2-CG2 4.42Å; F131-V135 HydrophobicContact CG-CG2 4.49Å; F131-V135 HydrophobicContact CZ-CG2 3.84Å; F131-V135 WeakPolarHBondContact O-CG2 3.49Å; F131-V135 PolarHBondContact O-N 2.83Å; F131-L191 HydrophobicContact CB-CD2 3.97Å; F131-L191 HydrophobicContact CD1-CD2 3.89Å; F131-L191 HydrophobicContact CD2-CD2 4.46Å; F131-L191 HydrophobicContact CG-CD2 3.85Å; F131-A194 HydrophobicContact CB-CB 4.15Å; F131-A194 HydrophobicContact CD1-CB 4.36Å; F131-A195 HydrophobicContact CE1-CB 4.3Å |
| 132 | T | 96.1 | Very high | 90.7 | Very high | 4 Ų | 4 | 41.5 Ų | 41.5 | 3% | 0.025 | 22% | 0.217 | C | C | . | . | H | α-helix | trans | -55.5 | -35.3 | 170.4 | -56.4 | 0 | 0 | 0 | 0 | 111.7 | D129 C130 V135 V136 A194 N306 | D129-T132 WeakPolarHBondContact O-CB 3.35Å; D129-T132 PolarHBondContact O-N 3.25Å; D129-T132 PolarHBondContact O-OG1 2.8Å; C130-T132 PolarHBondContact O-N 3.5Å; C130-T132 VanDerWaalsContact O-N 3.15Å; T132-V135 PolarHBondContact O-N 3.34Å; T132-V136 HydrophobicContact CG2-CG2 4Å; T132-V136 WeakPolarHBondContact O-CB 2.92Å; T132-V136 VanDerWaalsContact O-CG2 3.23Å; T132-V136 WeakPolarHBondContact O-CG2 3.39Å; T132-V136 PolarHBondContact O-N 3.25Å; T132-A194 VanDerWaalsContact OG1-CA 3.3Å; T132-A194 WeakPolarHBondContact OG1-CA 3.47Å; T132-A194 WeakPolarHBondContact OG1-CB 3.41Å; T132-A194 PolarHBondContact OG1-O 2.93Å; T132-A194 VanDerWaalsContact OG1-O 3.11Å; T132-N306 WeakPolarHBondContact CG2-OD1 3.45Å |
| 133 | I | 95.1 | Very high | 91.4 | Very high | 3 Ų | 3 | 44.2 Ų | 44.2 | 2% | 0.015 | 23% | 0.225 | C | C | . | . | H | α-helix | trans | -65 | -54.9 | -177.2 | -64.6 | 159.5 | 0 | 0 | 0 | 112.1 | C130 F131 V135 V136 L137 V156 L160 N306 L307 L310 | C130-I133 WeakPolarHBondContact O-CB 3.45Å; C130-I133 PolarHBondContact O-N 3.41Å; F131-I133 PolarHBondContact O-N 3.38Å; I133-V135 VanDerWaalsContact C-N 3.28Å; I133-V135 PolarHBondContact O-N 3.25Å; I133-V136 PolarHBondContact O-N 2.72Å; I133-L137 HydrophobicContact CG2-CD1 3.99Å; I133-L137 HydrophobicContact CG2-CG 4.47Å; I133-L137 WeakPolarHBondContact O-CG 3.3Å; I133-L137 PolarHBondContact O-N 2.71Å; I133-V156 HydrophobicContact CG2-CG1 3.94Å; I133-L160 HydrophobicContact CD1-CD2 4.34Å; I133-N306 HydrophobicContact CG1-CB 4.06Å; I133-L307 HydrophobicContact CD1-CD2 3.94Å; I133-L307 HydrophobicContact CG1-CD2 4.34Å; I133-L307 HydrophobicContact CG2-CD2 4.17Å; I133-L310 HydrophobicContact CD1-CD1 3.74Å; I133-L310 HydrophobicContact CD1-CD2 4Å; I133-L310 HydrophobicContact CD1-CG 4.12Å |
| 134 | P | 95.7 | Very high | 92.1 | Very high | 54 Ų | 54 | 44 Ų | 44 | 35% | 0.351 | 22% | 0.221 | S | C | . | . | H | α-helix | trans | -52.3 | -44.9 | 171.7 | -27.5 | 31 | 0 | 0 | 0 | 113.3 | C130 F131 V136 L137 V138 | C130-P134 VanDerWaalsContact O-CD 3.27Å; C130-P134 WeakPolarHBondContact O-CD 3.19Å; F131-P134 HydrophobicContact CD2-CG 4.46Å; F131-P134 VanDerWaalsContact O-CD 3.28Å; F131-P134 WeakPolarHBondContact O-CD 3.32Å; P134-V136 PolarHBondContact O-N 2.89Å; P134-L137 PolarHBondContact O-N 2.99Å; P134-V138 WeakPolarHBondContact O-CG2 3.22Å; P134-V138 PolarHBondContact O-N 3.32Å |
| 135 | V | 97.4 | Very high | 92.4 | Very high | 22 Ų | 22 | 48.5 Ų | 48.5 | 13% | 0.133 | 24% | 0.238 | C | C | . | . | H | α-helix | trans | -61.1 | -48.3 | -179.3 | 174.9 | 0 | 0 | 0 | 0 | 110.4 | F131 T132 I133 L137 V138 L139 A195 | F131-V135 HydrophobicContact CD1-CG2 3.92Å; F131-V135 HydrophobicContact CE1-CG2 3.57Å; F131-V135 HydrophobicContact CE2-CG2 4.42Å; F131-V135 HydrophobicContact CG-CG2 4.49Å; F131-V135 HydrophobicContact CZ-CG2 3.84Å; F131-V135 WeakPolarHBondContact O-CG2 3.49Å; F131-V135 PolarHBondContact O-N 2.83Å; T132-V135 PolarHBondContact O-N 3.34Å; I133-V135 VanDerWaalsContact C-N 3.28Å; I133-V135 PolarHBondContact O-N 3.25Å; V135-L137 PolarHBondContact O-N 2.85Å; V135-V138 PolarHBondContact O-N 2.88Å; V135-L139 HydrophobicContact CG1-CD1 3.58Å; V135-L139 HydrophobicContact CG1-CG 4.17Å; V135-L139 VanDerWaalsContact O-CB 3.3Å; V135-L139 WeakPolarHBondContact O-CB 3.45Å; V135-L139 VanDerWaalsContact O-CG 3.23Å; V135-L139 WeakPolarHBondContact O-CG 3.43Å; V135-L139 PolarHBondContact O-N 3.47Å; V135-A195 HydrophobicContact CG2-CB 4.42Å |
| 136 | V | 97.3 | Very high | 92.6 | Very high | 0 Ų | 0 | 48.6 Ų | 48.6 | 0% | 0 | 24% | 0.239 | C | C | . | . | H | α-helix | trans | -63 | -40.6 | 178 | 173.5 | 0 | 0 | 0 | 0 | 111.7 | T132 I133 P134 S140 N201 V202 A302 | T132-V136 HydrophobicContact CG2-CG2 4Å; T132-V136 WeakPolarHBondContact O-CB 2.92Å; T132-V136 VanDerWaalsContact O-CG2 3.23Å; T132-V136 WeakPolarHBondContact O-CG2 3.39Å; T132-V136 PolarHBondContact O-N 3.25Å; I133-V136 PolarHBondContact O-N 2.72Å; P134-V136 PolarHBondContact O-N 2.89Å; V136-S140 WeakPolarHBondContact O-CB 3.48Å; V136-S140 PolarHBondContact O-N 3.27Å; V136-S140 PolarHBondContact O-OG 3.41Å; V136-N201 HydrophobicContact CG2-CB 4.17Å; V136-V202 HydrophobicContact CB-CG2 4.31Å; V136-V202 HydrophobicContact CG1-CG2 3.93Å; V136-V202 HydrophobicContact CG2-CG2 4.34Å; V136-A302 HydrophobicContact CG1-CB 3.67Å |
| 137 | L | 95.5 | Very high | 92.8 | Very high | 29 Ų | 29 | 51.9 Ų | 51.9 | 15% | 0.152 | 25% | 0.25 | C | C | . | . | H | α-helix | trans | -61.4 | -48.6 | 177.5 | -74.8 | 169.6 | 0 | 0 | 0 | 111.5 | I133 P134 V135 F141 Y148 V156 T303 | I133-L137 HydrophobicContact CG2-CD1 3.99Å; I133-L137 HydrophobicContact CG2-CG 4.47Å; I133-L137 WeakPolarHBondContact O-CG 3.3Å; I133-L137 PolarHBondContact O-N 2.71Å; P134-L137 PolarHBondContact O-N 2.99Å; V135-L137 PolarHBondContact O-N 2.85Å; L137-F141 WeakPolarHBondContact O-CB 3.5Å; L137-F141 PolarHBondContact O-N 3.48Å; L137-Y148 HydrophobicContact CD2-CD1 3.97Å; L137-Y148 HydrophobicContact CD2-CD2 4.42Å; L137-Y148 HydrophobicContact CD2-CE1 3.44Å; L137-Y148 VanDerWaalsContact CD2-CE1 3.44Å; L137-Y148 HydrophobicContact CD2-CE2 3.96Å; L137-Y148 HydrophobicContact CD2-CG 4.42Å; L137-Y148 VanDerWaalsContact CD2-CZ 3.43Å; L137-Y148 WeakPolarHBondContact O-CE2 3.48Å; L137-V156 HydrophobicContact CD1-CG1 4.18Å; L137-V156 HydrophobicContact CD1-CG2 4.22Å; L137-T303 HydrophobicContact CD2-CG2 3.54Å; L137-T303 HydrophobicContact CG-CG2 4.11Å |
| 138 | V | 96.6 | Very high | 93.1 | Very high | 79 Ų | 79 | 50.6 Ų | 50.6 | 48% | 0.479 | 24% | 0.24 | S | C | . | . | H | α-helix | trans | -65.1 | -49.6 | -179.9 | 171.5 | 0 | 0 | 0 | 0 | 110.7 | P134 V135 S140 F141 F142 | P134-V138 WeakPolarHBondContact O-CG2 3.22Å; P134-V138 PolarHBondContact O-N 3.32Å; V135-V138 PolarHBondContact O-N 2.88Å; V138-S140 PolarHBondContact O-N 3.1Å; V138-F141 WeakPolarHBondContact O-CB 3.39Å; V138-F141 PolarHBondContact O-N 2.84Å; V138-F142 HydrophobicContact CG1-CD2 3.79Å; V138-F142 HydrophobicContact CG1-CE2 3.83Å; V138-F142 VanDerWaalsContact O-CD2 3.25Å; V138-F142 WeakPolarHBondContact O-CD2 3.46Å; V138-F142 PolarHBondContact O-N 3.16Å |
| 139 | L | 96.8 | Very high | 93.2 | Very high | 34 Ų | 34 | 51.4 Ų | 51.4 | 18% | 0.178 | 24% | 0.244 | C | C | . | . | H | α-helix | trans | -65 | -41.3 | -179.5 | -68.7 | 178.8 | 0 | 0 | 0 | 111.8 | V135 F141 F142 F143 V199 V202 | V135-L139 HydrophobicContact CG1-CD1 3.58Å; V135-L139 HydrophobicContact CG1-CG 4.17Å; V135-L139 VanDerWaalsContact O-CB 3.3Å; V135-L139 WeakPolarHBondContact O-CB 3.45Å; V135-L139 VanDerWaalsContact O-CG 3.23Å; V135-L139 WeakPolarHBondContact O-CG 3.43Å; V135-L139 PolarHBondContact O-N 3.47Å; L139-F141 VanDerWaalsContact C-N 3.31Å; L139-F141 PolarHBondContact O-N 2.82Å; L139-F142 PolarHBondContact O-N 2.99Å; L139-F143 HydrophobicContact CB-CD2 4.25Å; L139-F143 HydrophobicContact CD2-CD2 3.81Å; L139-F143 HydrophobicContact CD2-CE2 3.51Å; L139-F143 WeakPolarHBondContact O-CB 3.4Å; L139-F143 WeakPolarHBondContact O-CD2 3.39Å; L139-F143 PolarHBondContact O-N 3.28Å; L139-V199 HydrophobicContact CD1-CB 4.31Å; L139-V199 HydrophobicContact CD1-CG2 3.63Å; L139-V202 HydrophobicContact CB-CB 4.29Å; L139-V202 HydrophobicContact CB-CG1 4.19Å; L139-V202 HydrophobicContact CB-CG2 3.86Å |
| 140 | S | 95.5 | Very high | 93.4 | Very high | 0 Ų | 0 | 53.3 Ų | 53.3 | 0% | 0 | 26% | 0.26 | C | S | . | . | H | α-helix | trans | -64.5 | -35.2 | 175 | -64.4 | 0 | 0 | 0 | 0 | 112.3 | V136 V138 L144 K145 I146 Y148 V202 | V136-S140 WeakPolarHBondContact O-CB 3.48Å; V136-S140 PolarHBondContact O-N 3.27Å; V136-S140 PolarHBondContact O-OG 3.41Å; V138-S140 PolarHBondContact O-N 3.1Å; S140-L144 CarbonylContact O-C 3.55Å; S140-L144 WeakPolarHBondContact O-CA 3.42Å; S140-L144 VanDerWaalsContact O-CB 3.32Å; S140-L144 WeakPolarHBondContact O-CB 3.41Å; S140-L144 PolarHBondContact O-N 2.8Å; S140-K145 PolarHBondContact O-N 2.95Å; S140-K145 VanDerWaalsContact O-N 3.13Å; S140-I146 PolarHBondContact O-N 3.25Å; S140-Y148 WeakPolarHBondContact CB-OH 3.48Å; S140-V202 WeakPolarHBondContact OG-CG2 3.1Å |
| 141 | F | 94 | Very high | 93.5 | Very high | 78 Ų | 78 | 54.9 Ų | 54.9 | 34% | 0.342 | 27% | 0.269 | S | S | . | . | H | α-helix | trans | -64.1 | -45.7 | 174.5 | 176.2 | -99 | 0 | 0 | 0 | 111.9 | L137 V138 L139 K145 I146 Y148 | L137-F141 WeakPolarHBondContact O-CB 3.5Å; L137-F141 PolarHBondContact O-N 3.48Å; V138-F141 WeakPolarHBondContact O-CB 3.39Å; V138-F141 PolarHBondContact O-N 2.84Å; L139-F141 VanDerWaalsContact C-N 3.31Å; L139-F141 PolarHBondContact O-N 2.82Å; F141-K145 VanDerWaalsContact O-CA 3.28Å; F141-K145 WeakPolarHBondContact O-CA 3.42Å; F141-K145 PolarHBondContact O-N 3.48Å; F141-I146 WeakPolarHBondContact CD2-O 3.38Å; F141-Y148 HydrophobicContact CB-CE2 4.25Å |
| 142 | F | 93.9 | Very high | 93.4 | Very high | 135 Ų | 135 | 50.8 Ų | 50.8 | 59% | 0.592 | 25% | 0.251 | S | S | * | . | H | α-helix | trans | -79.9 | -51.5 | -176.7 | -75.2 | -66.6 | 0 | 0 | 0 | 113.4 | V138 L139 | V138-F142 HydrophobicContact CG1-CD2 3.79Å; V138-F142 HydrophobicContact CG1-CE2 3.83Å; V138-F142 VanDerWaalsContact O-CD2 3.25Å; V138-F142 WeakPolarHBondContact O-CD2 3.46Å; V138-F142 PolarHBondContact O-N 3.16Å; L139-F142 PolarHBondContact O-N 2.99Å |
| 143 | F | 93.2 | Very high | 93.3 | Very high | 151 Ų | 151 | 54.5 Ų | 54.5 | 66% | 0.662 | 27% | 0.27 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -84.7 | -42.9 | -172.6 | -68.8 | -78 | 0 | 0 | 0 | 113 | L139 | L139-F143 HydrophobicContact CB-CD2 4.25Å; L139-F143 HydrophobicContact CD2-CD2 3.81Å; L139-F143 HydrophobicContact CD2-CE2 3.51Å; L139-F143 WeakPolarHBondContact O-CB 3.4Å; L139-F143 WeakPolarHBondContact O-CD2 3.39Å; L139-F143 PolarHBondContact O-N 3.28Å |
| 144 | L | 90.9 | Very high | 93.4 | Very high | 13 Ų | 13 | 58.9 Ų | 58.9 | 7% | 0.068 | 29% | 0.292 | C | S | . | . | S | Bend | trans | -90.1 | -5.2 | 178.6 | -65.2 | 177.9 | 0 | 0 | 0 | 113.2 | S140 I146 V202 E205 W206 | S140-L144 CarbonylContact O-C 3.55Å; S140-L144 WeakPolarHBondContact O-CA 3.42Å; S140-L144 VanDerWaalsContact O-CB 3.32Å; S140-L144 WeakPolarHBondContact O-CB 3.41Å; S140-L144 PolarHBondContact O-N 2.8Å; L144-I146 HydrophobicContact CB-CD1 4.16Å; L144-I146 HydrophobicContact CB-CG1 3.77Å; L144-I146 PolarHBondContact O-N 2.76Å; L144-V202 HydrophobicContact CD1-CG1 4.03Å; L144-V202 HydrophobicContact CG-CG1 4.12Å; L144-E205 HydrophobicContact CD1-CB 4.02Å; L144-E205 VanDerWaalsContact CD1-CD 3.43Å; L144-E205 HydrophobicContact CD1-CG 3.62Å; L144-W206 HydrophobicContact CD2-CB 3.79Å; L144-W206 HydrophobicContact CD2-CG 4.25Å |
| 145 | K | 90.8 | Very high | 93.3 | Very high | 117 Ų | 117 | 56.3 Ų | 56.3 | 51% | 0.509 | 28% | 0.276 | S | S | . | . | trans | 53.6 | 40 | -179.9 | -60.7 | 178.6 | -177.2 | 172.2 | 0 | 112.3 | S140 F141 R343 | S140-K145 PolarHBondContact O-N 2.95Å; S140-K145 VanDerWaalsContact O-N 3.13Å; F141-K145 VanDerWaalsContact O-CA 3.28Å; F141-K145 WeakPolarHBondContact O-CA 3.42Å; F141-K145 PolarHBondContact O-N 3.48Å; K145-R343 HydrophobicContact CB-CB 4.21Å; K145-R343 HydrophobicContact CB-CG 4.29Å; K145-R343 WeakPolarHBondContact O-CG 3.5Å; K145-R343 PolarHBondContact O-N 2.87Å | ||
| 146 | I | 88.8 | Confident | 93.2 | Very high | 2 Ų | 2 | 55.8 Ų | 55.8 | 1% | 0.01 | 27% | 0.273 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -75.2 | 141.9 | 177.9 | -58.4 | -58.1 | 0 | 0 | 0 | 110.5 | S140 F141 L144 Y148 T340 | S140-I146 PolarHBondContact O-N 3.25Å; F141-I146 WeakPolarHBondContact CD2-O 3.38Å; L144-I146 HydrophobicContact CB-CD1 4.16Å; L144-I146 HydrophobicContact CB-CG1 3.77Å; L144-I146 PolarHBondContact O-N 2.76Å; I146-Y148 HydrophobicContact CB-CE2 4.36Å; I146-Y148 HydrophobicContact CG2-CD1 4.34Å; I146-Y148 HydrophobicContact CG2-CE1 3.98Å; I146-Y148 HydrophobicContact CG2-CE2 4.14Å; I146-T340 HydrophobicContact CG2-CG2 3.49Å; I146-T340 VanDerWaalsContact CG2-CG2 3.49Å |
| 147 | R | 88 | Confident | 93.1 | Very high | 106 Ų | 106 | 59 Ų | 59 | 40% | 0.4 | 29% | 0.294 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -106.2 | 112.5 | 169.3 | -68.8 | -165.6 | 178.9 | 176.1 | 5.6 | 110.8 | A341 R343 L346 | R147-A341 PolarHBondContact N-O 3.34Å; R147-R343 HydrophobicContact CG-CG 3.95Å; R147-L346 VanDerWaalsContact NH1-CD2 3.25Å |
| 148 | Y | 89.2 | Confident | 93.1 | Very high | 47 Ų | 47 | 60.5 Ų | 60.5 | 18% | 0.184 | 30% | 0.302 | C | S | . | . | trans | -82.2 | 118.2 | 174.5 | -62.5 | -75 | 0 | 0 | 0 | 110.7 | L137 S140 F141 I146 H152 T303 T340 | L137-Y148 HydrophobicContact CD2-CD1 3.97Å; L137-Y148 HydrophobicContact CD2-CD2 4.42Å; L137-Y148 HydrophobicContact CD2-CE1 3.44Å; L137-Y148 VanDerWaalsContact CD2-CE1 3.44Å; L137-Y148 HydrophobicContact CD2-CE2 3.96Å; L137-Y148 HydrophobicContact CD2-CG 4.42Å; L137-Y148 VanDerWaalsContact CD2-CZ 3.43Å; L137-Y148 WeakPolarHBondContact O-CE2 3.48Å; S140-Y148 WeakPolarHBondContact CB-OH 3.48Å; F141-Y148 HydrophobicContact CB-CE2 4.25Å; I146-Y148 HydrophobicContact CB-CE2 4.36Å; I146-Y148 HydrophobicContact CG2-CD1 4.34Å; I146-Y148 HydrophobicContact CG2-CE1 3.98Å; I146-Y148 HydrophobicContact CG2-CE2 4.14Å; Y148-H152 HydrophobicContact CD1-CB 4.13Å; Y148-T303 PolarHBondContact OH-OG1 3.03Å; Y148-T340 HydrophobicContact CD1-CG2 3.96Å; Y148-T340 HydrophobicContact CE1-CG2 3.9Å | ||
| 149 | L | 90.3 | Very high | 93 | Very high | 48 Ų | 48 | 56.8 Ų | 56.8 | 25% | 0.251 | 28% | 0.279 | S | S | . | . | trans | -75.1 | 159.8 | 167.9 | -81.3 | 71.1 | 0 | 0 | 0 | 111.8 | T151 H152 I153 K338 | L149-T151 PolarHBondContact O-N 3.38Å; L149-T151 VanDerWaalsContact O-N 3.12Å; L149-H152 WeakPolarHBondContact CB-ND1 3.23Å; L149-H152 PolarHBondContact N-ND1 3.11Å; L149-H152 WeakPolarHBondContact O-CB 3.49Å; L149-H152 PolarHBondContact O-N 3.09Å; L149-H152 PolarHBondContact O-ND1 3.04Å; L149-I153 PolarHBondContact O-N 3.35Å; L149-K338 HydrophobicContact CD2-CD 3.45Å; L149-K338 VanDerWaalsContact CD2-CD 3.45Å; L149-K338 HydrophobicContact CD2-CG 4.16Å; L149-K338 VanDerWaalsContact CD2-NZ 3.35Å | ||
| 150 | P | 92.1 | Very high | 92.7 | Very high | 98 Ų | 98 | 58.6 Ų | 58.6 | 64% | 0.636 | 29% | 0.289 | S | S | * | . | H | α-helix | trans | -52.7 | -34.7 | 176.6 | -27.8 | 35.3 | 0 | 0 | 0 | 114 | H152 I153 I154 | P150-H152 VanDerWaalsContact C-N 3.26Å; P150-H152 PolarHBondContact O-N 3.26Å; P150-I153 PolarHBondContact O-N 2.87Å; P150-I153 VanDerWaalsContact O-N 3.12Å; P150-I154 WeakPolarHBondContact O-CG1 3.27Å; P150-I154 PolarHBondContact O-N 3.36Å |
| 151 | T | 92 | Very high | 92.5 | Very high | 45 Ų | 45 | 62.7 Ų | 62.7 | 28% | 0.276 | 31% | 0.314 | S | S | . | . | H | α-helix | trans | -57.9 | -37.8 | 175.7 | 54.6 | 0 | 0 | 0 | 0 | 112.5 | L149 G155 | L149-T151 PolarHBondContact O-N 3.38Å; L149-T151 VanDerWaalsContact O-N 3.12Å; T151-G155 PolarHBondContact O-N 3.46Å |
| 152 | H | 93.2 | Very high | 92.3 | Very high | 1 Ų | 1 | 59 Ų | 59 | 1% | 0.005 | 30% | 0.298 | C | S | . | . | H | α-helix | trans | -68 | -41.8 | 176.8 | -55.8 | 102.2 | 0 | 0 | 0 | 111.2 | Y148 L149 P150 G155 V156 Y335 K338 | Y148-H152 HydrophobicContact CD1-CB 4.13Å; L149-H152 WeakPolarHBondContact CB-ND1 3.23Å; L149-H152 PolarHBondContact N-ND1 3.11Å; L149-H152 WeakPolarHBondContact O-CB 3.49Å; L149-H152 PolarHBondContact O-N 3.09Å; L149-H152 PolarHBondContact O-ND1 3.04Å; P150-H152 VanDerWaalsContact C-N 3.26Å; P150-H152 PolarHBondContact O-N 3.26Å; H152-G155 PolarHBondContact O-N 3.46Å; H152-V156 WeakPolarHBondContact O-CG2 3.43Å; H152-V156 PolarHBondContact O-N 3.1Å; H152-Y335 HydrophobicContact CB-CD2 3.74Å; H152-Y335 HydrophobicContact CB-CE2 3.64Å; H152-Y335 AromaticContact CD2-CD2 3.91Å; H152-Y335 AromaticContact CD2-CE2 3.71Å; H152-Y335 AromaticContact CD2-CZ 3.8Å; H152-Y335 PolarHBondContact CD2-O 3.12Å; H152-Y335 VanDerWaalsContact CD2-O 3.29Å; H152-K338 PolarHBondContact NE2-O 3.41Å; H152-K338 VanDerWaalsContact NE2-O 3.08Å |
| 153 | I | 94 | Very high | 92 | Very high | 83 Ų | 83 | 53.1 Ų | 53.1 | 43% | 0.426 | 27% | 0.273 | S | S | . | . | H | α-helix | trans | -63.9 | -44.7 | 179.1 | -53.8 | -54.7 | 0 | 0 | 0 | 110.2 | L149 P150 G155 V156 C157 | L149-I153 PolarHBondContact O-N 3.35Å; P150-I153 PolarHBondContact O-N 2.87Å; P150-I153 VanDerWaalsContact O-N 3.12Å; I153-G155 VanDerWaalsContact C-N 3.33Å; I153-G155 PolarHBondContact O-N 3.19Å; I153-V156 PolarHBondContact O-N 3.3Å; I153-C157 PolarHBondContact O-N 2.74Å; I153-C157 PolarHBondContact O-SG 3.41Å |
| 154 | I | 95.8 | Very high | 91.6 | Very high | 95 Ų | 95 | 47.7 Ų | 47.7 | 49% | 0.487 | 26% | 0.26 | S | S | . | . | H | α-helix | trans | -58.9 | -45.7 | 175.1 | -64.5 | 165 | 0 | 0 | 0 | 110.7 | P150 V156 C157 L158 V334 | P150-I154 WeakPolarHBondContact O-CG1 3.27Å; P150-I154 PolarHBondContact O-N 3.36Å; I154-V156 PolarHBondContact O-N 2.91Å; I154-C157 PolarHBondContact O-N 3Å; I154-L158 HydrophobicContact CG2-CD1 4.22Å; I154-L158 WeakPolarHBondContact O-CG 3.32Å; I154-L158 PolarHBondContact O-N 3.04Å; I154-V334 HydrophobicContact CB-CG1 4.35Å; I154-V334 HydrophobicContact CG2-CG1 4.08Å |
| 155 | G | 94.9 | Very high | 91.4 | Very high | 0 Ų | 0 | 49.1 Ų | 49.1 | 0% | 0 | 27% | 0.27 | C | S | . | . | H | α-helix | trans | -59.1 | -44.7 | 177 | 0 | 0 | 0 | 0 | 0 | 113 | T151 H152 I153 L158 C159 G331 | T151-G155 PolarHBondContact O-N 3.46Å; H152-G155 PolarHBondContact O-N 3.46Å; I153-G155 VanDerWaalsContact C-N 3.33Å; I153-G155 PolarHBondContact O-N 3.19Å; G155-L158 PolarHBondContact O-N 3.18Å; G155-C159 PolarHBondContact O-N 2.77Å; G155-C159 VanDerWaalsContact O-N 3.08Å; G155-C159 PolarHBondContact O-SG 3.04Å; G155-C159 VanDerWaalsContact O-SG 3.38Å; G155-G331 WeakPolarHBondContact CA-O 3.24Å; G155-G331 WeakPolarHBondContact O-CA 3.32Å |
| 156 | V | 94.7 | Very high | 90.9 | Very high | 11 Ų | 11 | 43.8 Ų | 43.8 | 7% | 0.067 | 25% | 0.247 | C | C | . | . | H | α-helix | trans | -62.5 | -45.8 | 175.5 | 173.1 | 0 | 0 | 0 | 0 | 111.1 | I133 L137 H152 I153 I154 L158 C159 L160 L307 Y335 | I133-V156 HydrophobicContact CG2-CG1 3.94Å; L137-V156 HydrophobicContact CD1-CG1 4.18Å; L137-V156 HydrophobicContact CD1-CG2 4.22Å; H152-V156 WeakPolarHBondContact O-CG2 3.43Å; H152-V156 PolarHBondContact O-N 3.1Å; I153-V156 PolarHBondContact O-N 3.3Å; I154-V156 PolarHBondContact O-N 2.91Å; V156-L158 VanDerWaalsContact C-N 3.33Å; V156-L158 PolarHBondContact O-N 2.88Å; V156-C159 WeakPolarHBondContact O-CB 3.27Å; V156-C159 PolarHBondContact O-N 3.49Å; V156-L160 HydrophobicContact CG1-CD1 4.07Å; V156-L160 HydrophobicContact CG1-CG 4.36Å; V156-L160 WeakPolarHBondContact O-CG 3.35Å; V156-L160 PolarHBondContact O-N 2.83Å; V156-L307 HydrophobicContact CG2-CD1 3.94Å; V156-L307 HydrophobicContact CG2-CD2 4.21Å; V156-Y335 HydrophobicContact CG2-CD2 4.09Å; V156-Y335 HydrophobicContact CG2-CE2 4.27Å |
| 157 | C | 95 | Very high | 90.6 | Very high | 67 Ų | 67 | 44.3 Ų | 44.3 | 45% | 0.453 | 25% | 0.251 | S | S | . | . | H | α-helix | trans | -59.5 | -43.5 | 178.1 | -69.6 | 0 | 0 | 0 | 0 | 111.9 | I153 I154 C159 L160 V161 | I153-C157 PolarHBondContact O-N 2.74Å; I153-C157 PolarHBondContact O-SG 3.41Å; I154-C157 PolarHBondContact O-N 3Å; C157-C159 VanDerWaalsContact C-N 3.35Å; C157-C159 PolarHBondContact O-N 2.93Å; C157-L160 PolarHBondContact O-N 3.38Å; C157-V161 WeakPolarHBondContact O-CG2 3.48Å; C157-V161 PolarHBondContact O-N 3Å |
| 158 | L | 95.4 | Very high | 90.3 | Very high | 61 Ų | 61 | 47.1 Ų | 47.1 | 32% | 0.319 | 26% | 0.261 | S | S | . | . | H | α-helix | trans | -59.2 | -46.1 | 174.9 | -73.7 | 171.1 | 0 | 0 | 0 | 111.3 | I154 G155 V156 L160 V161 G162 V327 V334 | I154-L158 HydrophobicContact CG2-CD1 4.22Å; I154-L158 WeakPolarHBondContact O-CG 3.32Å; I154-L158 PolarHBondContact O-N 3.04Å; G155-L158 PolarHBondContact O-N 3.18Å; V156-L158 VanDerWaalsContact C-N 3.33Å; V156-L158 PolarHBondContact O-N 2.88Å; L158-L160 PolarHBondContact O-N 3.06Å; L158-V161 PolarHBondContact O-N 3.36Å; L158-G162 PolarHBondContact O-N 2.87Å; L158-V327 WeakPolarHBondContact O-CG1 3.49Å; L158-V334 HydrophobicContact CD1-CB 4.43Å; L158-V334 HydrophobicContact CD1-CG2 4.11Å |
| 159 | C | 93.8 | Very high | 89.9 | Confident | 0 Ų | 0 | 44.9 Ų | 44.9 | 0% | 0 | 25% | 0.253 | C | S | . | . | H | α-helix | trans | -59.8 | -44.2 | 177 | -70.8 | 0 | 0 | 0 | 0 | 112.8 | G155 V156 C157 V161 G162 V163 L307 L310 V328 | G155-C159 PolarHBondContact O-N 2.77Å; G155-C159 VanDerWaalsContact O-N 3.08Å; G155-C159 PolarHBondContact O-SG 3.04Å; G155-C159 VanDerWaalsContact O-SG 3.38Å; V156-C159 WeakPolarHBondContact O-CB 3.27Å; V156-C159 PolarHBondContact O-N 3.49Å; C157-C159 VanDerWaalsContact C-N 3.35Å; C157-C159 PolarHBondContact O-N 2.93Å; C159-V161 VanDerWaalsContact C-N 3.34Å; C159-V161 PolarHBondContact O-N 3.26Å; C159-G162 PolarHBondContact O-N 2.88Å; C159-G162 VanDerWaalsContact O-N 3.16Å; C159-V163 WeakPolarHBondContact O-CG2 3.49Å; C159-V163 PolarHBondContact O-N 2.87Å; C159-L307 HydrophobicContact CB-CD2 3.76Å; C159-L310 HydrophobicContact CB-CD1 3.65Å; C159-V328 PolarHBondContact SG-O 2.99Å |
| 160 | L | 91.4 | Very high | 89.2 | Confident | 73 Ų | 73 | 43.6 Ų | 43.6 | 38% | 0.382 | 25% | 0.246 | S | C | . | . | H | α-helix | trans | -64.9 | -36.2 | 178.2 | -68 | 175.6 | 0 | 0 | 0 | 112.5 | I133 V156 C157 L158 G162 V163 G164 | I133-L160 HydrophobicContact CD1-CD2 4.34Å; V156-L160 HydrophobicContact CG1-CD1 4.07Å; V156-L160 HydrophobicContact CG1-CG 4.36Å; V156-L160 WeakPolarHBondContact O-CG 3.35Å; V156-L160 PolarHBondContact O-N 2.83Å; C157-L160 PolarHBondContact O-N 3.38Å; L158-L160 PolarHBondContact O-N 3.06Å; L160-G162 VanDerWaalsContact C-N 3.34Å; L160-V163 PolarHBondContact O-N 2.69Å; L160-G164 PolarHBondContact O-N 3.02Å |
| 161 | V | 91.7 | Very high | 88.5 | Confident | 86 Ų | 86 | 43.5 Ų | 43.5 | 52% | 0.521 | 24% | 0.239 | S | C | . | . | H | α-helix | trans | -62 | -43.6 | 172 | 170.2 | 0 | 0 | 0 | 0 | 110.6 | C157 L158 C159 V163 G164 C165 | C157-V161 WeakPolarHBondContact O-CG2 3.48Å; C157-V161 PolarHBondContact O-N 3Å; L158-V161 PolarHBondContact O-N 3.36Å; C159-V161 VanDerWaalsContact C-N 3.34Å; C159-V161 PolarHBondContact O-N 3.26Å; V161-V163 VanDerWaalsContact C-N 3.35Å; V161-V163 PolarHBondContact O-N 2.81Å; V161-G164 PolarHBondContact O-N 3.36Å; V161-C165 PolarHBondContact O-N 2.93Å; V161-C165 PolarHBondContact O-SG 3.11Å; V161-C165 VanDerWaalsContact O-SG 3.35Å |
| 162 | G | 90 | Very high | 87.9 | Confident | 0 Ų | 0 | 47.8 Ų | 47.8 | 0% | 0 | 26% | 0.256 | C | S | . | . | H | α-helix | trans | -58.5 | -43.4 | 176 | 0 | 0 | 0 | 0 | 0 | 112.9 | L158 C159 L160 C165 V166 S324 | L158-G162 PolarHBondContact O-N 2.87Å; C159-G162 PolarHBondContact O-N 2.88Å; C159-G162 VanDerWaalsContact O-N 3.16Å; L160-G162 VanDerWaalsContact C-N 3.34Å; G162-C165 PolarHBondContact O-N 3.16Å; G162-V166 PolarHBondContact O-N 3.45Å; G162-S324 VanDerWaalsContact O-CB 3.27Å; G162-S324 WeakPolarHBondContact O-CB 3.5Å; G162-S324 PolarHBondContact O-OG 3.4Å |
| 163 | V | 86.4 | Confident | 86.9 | Confident | 11 Ų | 11 | 51.7 Ų | 51.7 | 7% | 0.067 | 28% | 0.276 | C | S | . | . | H | α-helix | trans | -62.7 | -44.8 | 174.5 | 175.8 | 0 | 0 | 0 | 0 | 111.5 | L127 C130 C159 L160 V161 C165 V166 V167 L310 | L127-V163 HydrophobicContact CD2-CG1 4Å; C130-V163 VanDerWaalsContact SG-CG1 3.58Å; C159-V163 WeakPolarHBondContact O-CG2 3.49Å; C159-V163 PolarHBondContact O-N 2.87Å; L160-V163 PolarHBondContact O-N 2.69Å; V161-V163 VanDerWaalsContact C-N 3.35Å; V161-V163 PolarHBondContact O-N 2.81Å; V163-C165 VanDerWaalsContact C-N 3.28Å; V163-C165 PolarHBondContact O-N 3.25Å; V163-V166 WeakPolarHBondContact O-CB 3.15Å; V163-V166 PolarHBondContact O-N 3.48Å; V163-V167 PolarHBondContact O-N 3.13Å; V163-V167 VanDerWaalsContact O-N 3.09Å; V163-L310 HydrophobicContact CG2-CB 4.31Å; V163-L310 HydrophobicContact CG2-CD1 3.86Å; V163-L310 HydrophobicContact CG2-CD2 3.68Å; V163-L310 HydrophobicContact CG2-CG 4.15Å |
| 164 | G | 85.3 | Confident | 85.6 | Confident | 38 Ų | 38 | 50.1 Ų | 50.1 | 39% | 0.392 | 28% | 0.281 | S | S | . | . | H | α-helix | trans | -58.4 | -40.4 | 178.1 | 0 | 0 | 0 | 0 | 0 | 112.6 | L160 V161 V166 V167 W168 | L160-G164 PolarHBondContact O-N 3.02Å; V161-G164 PolarHBondContact O-N 3.36Å; G164-V166 VanDerWaalsContact C-N 3.31Å; G164-V166 PolarHBondContact O-N 3.43Å; G164-V167 PolarHBondContact O-N 3.03Å; G164-W168 WeakPolarHBondContact O-CB 3.2Å; G164-W168 PolarHBondContact O-N 2.98Å |
| 165 | C | 86 | Confident | 83.9 | Confident | 43 Ų | 43 | 51.8 Ų | 51.8 | 29% | 0.291 | 29% | 0.286 | S | S | . | . | H | α-helix | trans | -63.2 | -34.7 | 174.4 | -69.5 | 0 | 0 | 0 | 0 | 112.9 | V161 G162 V163 G169 S324 | V161-C165 PolarHBondContact O-N 2.93Å; V161-C165 PolarHBondContact O-SG 3.11Å; V161-C165 VanDerWaalsContact O-SG 3.35Å; G162-C165 PolarHBondContact O-N 3.16Å; V163-C165 VanDerWaalsContact C-N 3.28Å; V163-C165 PolarHBondContact O-N 3.25Å; C165-G169 PolarHBondContact O-N 3.17Å; C165-S324 WeakPolarHBondContact CB-OG 3.36Å |
| 166 | V | 81.9 | Confident | 82 | Confident | 5 Ų | 5 | 59.9 Ų | 59.9 | 3% | 0.03 | 32% | 0.324 | C | S | . | . | H | α-helix | trans | -67 | -46.6 | 175.3 | 145.8 | 0 | 0 | 0 | 0 | 112.7 | G162 V163 G164 W168 G169 D170 F314 F321 S324 | G162-V166 PolarHBondContact O-N 3.45Å; V163-V166 WeakPolarHBondContact O-CB 3.15Å; V163-V166 PolarHBondContact O-N 3.48Å; G164-V166 VanDerWaalsContact C-N 3.31Å; G164-V166 PolarHBondContact O-N 3.43Å; V166-W168 PolarHBondContact O-N 2.96Å; V166-G169 CarbonylContact O-C 3.4Å; V166-G169 VanDerWaalsContact O-CA 3.32Å; V166-G169 WeakPolarHBondContact O-CA 3.42Å; V166-G169 PolarHBondContact O-N 3.05Å; V166-D170 PolarHBondContact O-N 2.97Å; V166-F314 HydrophobicContact CB-CD1 4.26Å; V166-F314 HydrophobicContact CB-CE1 3.84Å; V166-F314 HydrophobicContact CG2-CD1 3.12Å; V166-F314 HydrophobicContact CG2-CE1 3.11Å; V166-F314 HydrophobicContact CG2-CG 4.44Å; V166-F314 HydrophobicContact CG2-CZ 4.43Å; V166-F321 HydrophobicContact CB-CD1 4.48Å; V166-F321 HydrophobicContact CB-CE1 4.37Å; V166-F321 HydrophobicContact CG1-CD1 4.44Å; V166-F321 HydrophobicContact CG1-CE1 3.94Å; V166-F321 HydrophobicContact CG2-CD1 3.32Å; V166-F321 HydrophobicContact CG2-CE1 3.62Å; V166-F321 HydrophobicContact CG2-CG 4.35Å; V166-S324 PolarHBondContact N-OG 3.41Å |
| 167 | V | 80.9 | Confident | 80.1 | Confident | 13 Ų | 13 | 64.5 Ų | 64.5 | 8% | 0.079 | 35% | 0.348 | C | S | . | . | H | α-helix | trans | -68.1 | -33.7 | -175.9 | 175.5 | 0 | 0 | 0 | 0 | 109.8 | A123 L127 V163 G164 G169 D170 I171 | A123-V167 HydrophobicContact CB-CG1 4.36Å; L127-V167 HydrophobicContact CD1-CB 4.22Å; L127-V167 HydrophobicContact CD1-CG1 3.6Å; L127-V167 HydrophobicContact CD1-CG2 4.08Å; L127-V167 HydrophobicContact CD2-CB 4.17Å; L127-V167 HydrophobicContact CD2-CG1 4.46Å; L127-V167 HydrophobicContact CD2-CG2 3.54Å; L127-V167 HydrophobicContact CG-CB 4.09Å; L127-V167 HydrophobicContact CG-CG1 3.95Å; L127-V167 HydrophobicContact CG-CG2 3.41Å; L127-V167 VanDerWaalsContact CG-CG2 3.41Å; V163-V167 PolarHBondContact O-N 3.13Å; V163-V167 VanDerWaalsContact O-N 3.09Å; G164-V167 PolarHBondContact O-N 3.03Å; V167-G169 VanDerWaalsContact C-N 3.34Å; V167-D170 PolarHBondContact O-N 3.33Å; V167-I171 HydrophobicContact CG1-CD1 4.21Å; V167-I171 WeakPolarHBondContact O-CD1 3.4Å; V167-I171 VanDerWaalsContact O-CG1 3.27Å; V167-I171 WeakPolarHBondContact O-CG1 3.26Å; V167-I171 PolarHBondContact O-N 3.24Å; V167-I171 VanDerWaalsContact O-N 3.11Å |
| 168 | W | 82.2 | Confident | 78.2 | Confident | 165 Ų | 165 | 64.9 Ų | 64.9 | 63% | 0.625 | 35% | 0.351 | S | S | * | . | H | α-helix | trans | -57.7 | -46.5 | 167 | -169.1 | -83.1 | 0 | 0 | 0 | 112.2 | G164 V166 D170 I171 E172 | G164-W168 WeakPolarHBondContact O-CB 3.2Å; G164-W168 PolarHBondContact O-N 2.98Å; V166-W168 PolarHBondContact O-N 2.96Å; W168-D170 PolarHBondContact O-N 3.44Å; W168-I171 PolarHBondContact O-N 3.44Å; W168-E172 PolarHBondContact NE1-OE2 2.89Å; W168-E172 PolarHBondContact O-N 3.2Å |
| 169 | G | 81 | Confident | 76.3 | Confident | 0 Ų | 0 | 68.7 Ų | 68.7 | 0% | 0 | 37% | 0.372 | C | S | . | . | H | α-helix | trans | -60.4 | -40.2 | 176.5 | 0 | 0 | 0 | 0 | 0 | 114 | C165 V166 V167 E172 L173 | C165-G169 PolarHBondContact O-N 3.17Å; V166-G169 CarbonylContact O-C 3.4Å; V166-G169 VanDerWaalsContact O-CA 3.32Å; V166-G169 WeakPolarHBondContact O-CA 3.42Å; V166-G169 PolarHBondContact O-N 3.05Å; V167-G169 VanDerWaalsContact C-N 3.34Å; G169-E172 PolarHBondContact O-N 3.21Å; G169-L173 WeakPolarHBondContact O-CB 3.39Å; G169-L173 WeakPolarHBondContact O-CG 3.35Å; G169-L173 PolarHBondContact O-N 3.48Å |
| 170 | D | 76.3 | Confident | 74.5 | Confident | 21 Ų | 21 | 69.7 Ų | 69.7 | 11% | 0.112 | 38% | 0.382 | C | S | . | . | H | α-helix | trans | -64.8 | -39.3 | 176.4 | -83.6 | -24.8 | 0 | 0 | 0 | 112.5 | A123 V166 V167 W168 L173 H175 F321 | A123-D170 HydrophobicContact CB-CB 4.34Å; V166-D170 PolarHBondContact O-N 2.97Å; V167-D170 PolarHBondContact O-N 3.33Å; W168-D170 PolarHBondContact O-N 3.44Å; D170-L173 PolarHBondContact O-N 2.88Å; D170-H175 PolarHBondContact O-N 3.46Å; D170-F321 WeakPolarHBondContact OD1-CZ 3.44Å |
| 171 | I | 76.7 | Confident | 73.2 | Confident | 96 Ų | 96 | 71.7 Ų | 71.7 | 49% | 0.492 | 40% | 0.403 | S | S | . | . | H | α-helix | trans | -64.6 | -44.7 | 176.2 | -66.9 | 164.7 | 0 | 0 | 0 | 110.1 | V167 W168 L173 G174 | V167-I171 HydrophobicContact CG1-CD1 4.21Å; V167-I171 WeakPolarHBondContact O-CD1 3.4Å; V167-I171 VanDerWaalsContact O-CG1 3.27Å; V167-I171 WeakPolarHBondContact O-CG1 3.26Å; V167-I171 PolarHBondContact O-N 3.24Å; V167-I171 VanDerWaalsContact O-N 3.11Å; W168-I171 PolarHBondContact O-N 3.44Å; I171-L173 VanDerWaalsContact C-N 3.29Å; I171-L173 PolarHBondContact O-N 2.89Å; I171-G174 PolarHBondContact O-N 2.87Å; I171-G174 VanDerWaalsContact O-N 3.11Å |
| 172 | E | 78.9 | Confident | 72.7 | Confident | 135 Ų | 135 | 72.1 Ų | 72.1 | 63% | 0.631 | 40% | 0.402 | S | S | * | . | H | α-helix | trans | -61.9 | -37.3 | 178.8 | -161.8 | 80.4 | -143.2 | 0 | 0 | 112 | W168 G169 G174 | W168-E172 PolarHBondContact NE1-OE2 2.89Å; W168-E172 PolarHBondContact O-N 3.2Å; G169-E172 PolarHBondContact O-N 3.21Å; E172-G174 PolarHBondContact O-N 3.2Å; E172-G174 VanDerWaalsContact O-N 3.11Å |
| 173 | L | 73.4 | Confident | 72.5 | Confident | 82 Ų | 82 | 75.5 Ų | 75.5 | 43% | 0.429 | 41% | 0.414 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -70.6 | -0.4 | 177.7 | -81.9 | 164 | 0 | 0 | 0 | 113.9 | G169 D170 I171 H175 H318 F321 | G169-L173 WeakPolarHBondContact O-CB 3.39Å; G169-L173 WeakPolarHBondContact O-CG 3.35Å; G169-L173 PolarHBondContact O-N 3.48Å; D170-L173 PolarHBondContact O-N 2.88Å; I171-L173 VanDerWaalsContact C-N 3.29Å; I171-L173 PolarHBondContact O-N 2.89Å; L173-H175 PolarHBondContact O-N 3.43Å; L173-H318 HydrophobicContact CD1-CB 4.29Å; L173-F321 HydrophobicContact CD1-CE2 3.97Å; L173-F321 HydrophobicContact CD1-CZ 4.45Å |
| 174 | G | 65.6 | Low | 72.6 | Confident | 50 Ų | 50 | 79.9 Ų | 79.9 | 52% | 0.515 | 44% | 0.441 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 67.8 | 20.3 | 178.1 | 0 | 0 | 0 | 0 | 0 | 112.8 | I171 E172 Q176 | I171-G174 PolarHBondContact O-N 2.87Å; I171-G174 VanDerWaalsContact O-N 3.11Å; E172-G174 PolarHBondContact O-N 3.2Å; E172-G174 VanDerWaalsContact O-N 3.11Å; G174-Q176 PolarHBondContact O-N 3.05Å |
| 175 | H | 60.9 | Low | 72.8 | Confident | 130 Ų | 130 | 79.8 Ų | 79.8 | 60% | 0.602 | 44% | 0.436 | S | S | * | . | trans | -65 | 86.9 | 164.8 | -111.3 | -146.1 | 0 | 0 | 0 | 106.7 | D170 L173 L177 | D170-H175 PolarHBondContact O-N 3.46Å; L173-H175 PolarHBondContact O-N 3.43Å; H175-L177 PolarHBondContact O-N 3.12Å; H175-L177 VanDerWaalsContact O-N 3.15Å | ||
| 176 | Q | 53.9 | Low | 73 | Confident | 171 Ų | 171 | 77.7 Ų | 77.7 | 80% | 0.799 | 42% | 0.423 | S | S | * | . | trans | -52.4 | 129 | -172.7 | -70 | -146.9 | -11 | 0 | 0 | 108.4 | G174 S178 | G174-Q176 PolarHBondContact O-N 3.05Å; Q176-S178 PolarHBondContact O-N 3.35Å | ||
| 177 | L | 55.7 | Low | 73.5 | Confident | 108 Ų | 108 | 79.7 Ų | 79.7 | 57% | 0.565 | 43% | 0.433 | S | S | * | . | trans | -47.1 | 92.2 | 151.1 | -76.2 | 163.2 | 0 | 0 | 0 | 105.2 | H175 D179 R183 | H175-L177 PolarHBondContact O-N 3.12Å; H175-L177 VanDerWaalsContact O-N 3.15Å; L177-D179 PolarHBondContact O-N 2.97Å; L177-R183 VanDerWaalsContact CA-NH2 3.34Å; L177-R183 PolarHBondContact O-NH2 3.33Å | ||
| 178 | S | 54.1 | Low | 74.1 | Confident | 74 Ų | 74 | 83.9 Ų | 83.9 | 52% | 0.517 | 46% | 0.455 | S | S | . | . | trans | -62.7 | 121.5 | 177.8 | 173.1 | 0 | 0 | 0 | 0 | 108.3 | Q176 G180 R183 | Q176-S178 PolarHBondContact O-N 3.35Å; S178-G180 PolarHBondContact O-N 3.32Å; S178-R183 PolarHBondContact O-NE 2.87Å; S178-R183 PolarHBondContact O-NH2 3.04Å | ||
| 179 | D | 55.3 | Low | 74.7 | Confident | 141 Ų | 141 | 78 Ų | 78 | 75% | 0.754 | 43% | 0.434 | S | S | * | . | trans | -67.1 | 74.5 | 174.4 | -105 | -11.6 | 0 | 0 | 0 | 109.4 | L177 R183 | L177-D179 PolarHBondContact O-N 2.97Å; D179-R183 IonicContact OD1-CZ 3.25Å; D179-R183 IonicContact OD1-NE 3.1Å; D179-R183 IonicContact OD1-NH1 3.91Å; D179-R183 PolarHBondContact OD1-NH1 3.19Å; D179-R183 IonicContact OD1-NH2 3.93Å | ||
| 180 | G | 57.8 | Low | 75.3 | Confident | 22 Ų | 22 | 78 Ų | 78 | 23% | 0.227 | 43% | 0.434 | C | S | . | . | trans | -63.9 | 132.9 | 169.2 | 0 | 0 | 0 | 0 | 0 | 109.2 | S178 N182 R183 | S178-G180 PolarHBondContact O-N 3.32Å; G180-N182 PolarHBondContact O-N 3.03Å; G180-R183 PolarHBondContact O-N 3.36Å | ||
| 181 | S | 63.8 | Low | 76.3 | Confident | 115 Ų | 115 | 80 Ų | 80 | 80% | 0.804 | 45% | 0.445 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -52.4 | -19.3 | -175.8 | 173 | 0 | 0 | 0 | 0 | 114.6 | ||
| 182 | N | 81.4 | Confident | 77.3 | Confident | 95 Ų | 95 | 78.3 Ų | 78.3 | 51% | 0.508 | 44% | 0.441 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -146.6 | 60.6 | 177.9 | -70.8 | -45.5 | 0 | 0 | 0 | 111.9 | Y119 G180 V184 A185 G186 | Y119-N182 HydrophobicContact CD1-CB 4.38Å; G180-N182 PolarHBondContact O-N 3.03Å; N182-V184 VanDerWaalsContact C-N 3.26Å; N182-V184 PolarHBondContact O-N 3.17Å; N182-A185 HydrophobicContact CB-CB 4.02Å; N182-A185 WeakPolarHBondContact O-CB 3.42Å; N182-A185 PolarHBondContact O-N 3Å; N182-G186 PolarHBondContact O-N 2.93Å |
| 183 | R | 84 | Confident | 78.1 | Confident | 70 Ų | 70 | 71.9 Ų | 71.9 | 26% | 0.264 | 41% | 0.411 | S | S | . | . | H | α-helix | trans | -46.9 | -45.9 | 178.3 | -80.2 | 175.7 | 160.1 | 168.5 | -13.3 | 114.5 | Y119 L177 S178 D179 G180 A185 G186 D187 | Y119-R183 WeakPolarHBondContact O-CA 3.25Å; L177-R183 VanDerWaalsContact CA-NH2 3.34Å; L177-R183 PolarHBondContact O-NH2 3.33Å; S178-R183 PolarHBondContact O-NE 2.87Å; S178-R183 PolarHBondContact O-NH2 3.04Å; D179-R183 IonicContact OD1-CZ 3.25Å; D179-R183 IonicContact OD1-NE 3.1Å; D179-R183 IonicContact OD1-NH1 3.91Å; D179-R183 PolarHBondContact OD1-NH1 3.19Å; D179-R183 IonicContact OD1-NH2 3.93Å; G180-R183 PolarHBondContact O-N 3.36Å; R183-A185 PolarHBondContact O-N 3.49Å; R183-G186 WeakPolarHBondContact O-CA 3.47Å; R183-G186 PolarHBondContact O-N 3.43Å; R183-D187 PolarHBondContact O-N 2.84Å |
| 184 | V | 88.9 | Confident | 79.2 | Confident | 104 Ų | 104 | 68 Ų | 68 | 63% | 0.63 | 39% | 0.391 | S | S | * | . | H | α-helix | trans | -57.2 | -38.8 | 179.6 | 179.9 | 0 | 0 | 0 | 0 | 111.7 | N182 G186 D187 L188 | N182-V184 VanDerWaalsContact C-N 3.26Å; N182-V184 PolarHBondContact O-N 3.17Å; V184-G186 VanDerWaalsContact C-N 3.35Å; V184-D187 PolarHBondContact O-N 2.99Å; V184-L188 HydrophobicContact CG1-CD1 4.08Å; V184-L188 HydrophobicContact CG1-CG 4.4Å; V184-L188 WeakPolarHBondContact O-CB 3.44Å; V184-L188 VanDerWaalsContact O-CG 3.28Å; V184-L188 WeakPolarHBondContact O-CG 3.48Å; V184-L188 PolarHBondContact O-N 3.15Å |
| 185 | A | 90.2 | Very high | 80.8 | Confident | 35 Ų | 35 | 67 Ų | 67 | 29% | 0.289 | 38% | 0.378 | S | S | . | . | H | α-helix | trans | -66.8 | -39 | 177.1 | 0 | 0 | 0 | 0 | 0 | 111.4 | N182 R183 M189 | N182-A185 HydrophobicContact CB-CB 4.02Å; N182-A185 WeakPolarHBondContact O-CB 3.42Å; N182-A185 PolarHBondContact O-N 3Å; R183-A185 PolarHBondContact O-N 3.49Å; A185-M189 WeakPolarHBondContact O-CB 3.44Å; A185-M189 VanDerWaalsContact O-CG 3.23Å; A185-M189 WeakPolarHBondContact O-CG 3.49Å; A185-M189 PolarHBondContact O-N 2.88Å |
| 186 | G | 90.5 | Very high | 82.5 | Confident | 0 Ų | 0 | 63.4 Ų | 63.4 | 0% | 0 | 36% | 0.363 | C | S | . | . | H | α-helix | trans | -63 | -47.6 | 173.8 | 0 | 0 | 0 | 0 | 0 | 112.2 | A116 N182 R183 V184 L188 M189 C190 | A116-G186 WeakPolarHBondContact CB-O 3.45Å; N182-G186 PolarHBondContact O-N 2.93Å; R183-G186 WeakPolarHBondContact O-CA 3.47Å; R183-G186 PolarHBondContact O-N 3.43Å; V184-G186 VanDerWaalsContact C-N 3.35Å; G186-L188 PolarHBondContact O-N 3.05Å; G186-M189 WeakPolarHBondContact O-CB 3.35Å; G186-M189 PolarHBondContact O-N 2.72Å; G186-C190 PolarHBondContact O-N 3.3Å |
| 187 | D | 91.4 | Very high | 84.6 | Confident | 46 Ų | 46 | 57.8 Ų | 57.8 | 25% | 0.246 | 34% | 0.335 | C | S | . | . | H | α-helix | trans | -63.7 | -41.2 | -179.7 | -64.8 | -15.6 | 0 | 0 | 0 | 111.7 | T120 S124 L128 R183 V184 M189 C190 L191 | T120-D187 WeakPolarHBondContact CB-OD1 3.47Å; T120-D187 PolarHBondContact OG1-OD1 2.72Å; S124-D187 PolarHBondContact OG-OD1 2.66Å; L128-D187 VanDerWaalsContact CD2-CA 3.49Å; L128-D187 HydrophobicContact CD2-CB 3.61Å; L128-D187 VanDerWaalsContact CD2-O 3.28Å; L128-D187 WeakPolarHBondContact CD2-O 3.33Å; R183-D187 PolarHBondContact O-N 2.84Å; V184-D187 PolarHBondContact O-N 2.99Å; D187-M189 PolarHBondContact O-N 2.98Å; D187-C190 PolarHBondContact O-N 3.45Å; D187-L191 WeakPolarHBondContact O-CG 3.45Å; D187-L191 PolarHBondContact O-N 2.73Å |
| 188 | L | 94.6 | Very high | 86.6 | Confident | 102 Ų | 102 | 52.6 Ų | 52.6 | 53% | 0.534 | 31% | 0.308 | S | S | . | . | H | α-helix | trans | -64.3 | -38.6 | 174.1 | -72.4 | 174.3 | 0 | 0 | 0 | 112.6 | V184 G186 S192 | V184-L188 HydrophobicContact CG1-CD1 4.08Å; V184-L188 HydrophobicContact CG1-CG 4.4Å; V184-L188 WeakPolarHBondContact O-CB 3.44Å; V184-L188 VanDerWaalsContact O-CG 3.28Å; V184-L188 WeakPolarHBondContact O-CG 3.48Å; V184-L188 PolarHBondContact O-N 3.15Å; G186-L188 PolarHBondContact O-N 3.05Å; L188-S192 WeakPolarHBondContact O-CB 3.43Å; L188-S192 PolarHBondContact O-N 3.46Å; L188-S192 PolarHBondContact O-OG 2.67Å |
| 189 | M | 94.5 | Very high | 88.7 | Confident | 40 Ų | 40 | 51.3 Ų | 51.3 | 20% | 0.197 | 30% | 0.297 | C | S | . | . | H | α-helix | trans | -64.4 | -41.6 | 174.2 | -73.8 | 177.7 | -166.9 | 0 | 0 | 111.1 | L112 K115 A116 Y119 A185 G186 D187 S192 G193 | L112-M189 HydrophobicContact CD2-CG 4.48Å; K115-M189 HydrophobicContact CB-SD 4.41Å; K115-M189 HydrophobicContact CD-CE 4.43Å; K115-M189 HydrophobicContact CD-SD 4.05Å; K115-M189 HydrophobicContact CG-SD 3.96Å; A116-M189 HydrophobicContact CB-CB 3.85Å; Y119-M189 HydrophobicContact CD2-SD 4.12Å; Y119-M189 HydrophobicContact CE2-CE 4.33Å; Y119-M189 HydrophobicContact CE2-SD 4.25Å; A185-M189 WeakPolarHBondContact O-CB 3.44Å; A185-M189 VanDerWaalsContact O-CG 3.23Å; A185-M189 WeakPolarHBondContact O-CG 3.49Å; A185-M189 PolarHBondContact O-N 2.88Å; G186-M189 WeakPolarHBondContact O-CB 3.35Å; G186-M189 PolarHBondContact O-N 2.72Å; D187-M189 PolarHBondContact O-N 2.98Å; M189-S192 PolarHBondContact O-N 3.11Å; M189-G193 PolarHBondContact O-N 3.29Å |
| 190 | C | 94.1 | Very high | 90.7 | Very high | 0 Ų | 0 | 44.6 Ų | 44.6 | 0% | 0 | 26% | 0.261 | C | S | . | . | H | α-helix | trans | -62.3 | -50.1 | 175.5 | -82.9 | 0 | 0 | 0 | 0 | 112.6 | I113 A116 V125 L128 G186 D187 S192 G193 A194 | I113-C190 HydrophobicContact CD1-CB 4.36Å; A116-C190 HydrophobicContact CB-CB 4.43Å; A116-C190 WeakPolarHBondContact CB-SG 3.48Å; V125-C190 VanDerWaalsContact CG2-SG 3.56Å; L128-C190 HydrophobicContact CB-CB 3.73Å; L128-C190 HydrophobicContact CD2-CB 3.75Å; L128-C190 HydrophobicContact CG-CB 4.42Å; G186-C190 PolarHBondContact O-N 3.3Å; D187-C190 PolarHBondContact O-N 3.45Å; C190-S192 VanDerWaalsContact C-N 3.27Å; C190-S192 PolarHBondContact O-N 2.91Å; C190-G193 PolarHBondContact O-N 2.94Å; C190-A194 WeakPolarHBondContact O-CB 3.29Å; C190-A194 PolarHBondContact O-N 3.27Å |
| 191 | L | 96.1 | Very high | 92.6 | Very high | 65 Ų | 65 | 44 Ų | 44 | 34% | 0.34 | 25% | 0.252 | S | S | . | . | H | α-helix | trans | -60.2 | -39.6 | 178.1 | -72.8 | 173.1 | 0 | 0 | 0 | 111.9 | L128 F131 D187 A195 | L128-L191 HydrophobicContact CB-CD2 4.46Å; L128-L191 HydrophobicContact CD2-CD2 4.34Å; L128-L191 HydrophobicContact CD2-CG 3.91Å; L128-L191 HydrophobicContact CG-CD2 4.12Å; L128-L191 HydrophobicContact CG-CG 4.26Å; F131-L191 HydrophobicContact CB-CD2 3.97Å; F131-L191 HydrophobicContact CD1-CD2 3.89Å; F131-L191 HydrophobicContact CD2-CD2 4.46Å; F131-L191 HydrophobicContact CG-CD2 3.85Å; D187-L191 WeakPolarHBondContact O-CG 3.45Å; D187-L191 PolarHBondContact O-N 2.73Å; L191-A195 WeakPolarHBondContact O-CB 3.49Å; L191-A195 PolarHBondContact O-N 3.44Å |
| 192 | S | 97.1 | Very high | 94.2 | Very high | 59 Ų | 59 | 38.9 Ų | 38.9 | 41% | 0.413 | 22% | 0.216 | S | C | . | . | H | α-helix | trans | -66.5 | -44.2 | 176.8 | -57.1 | 0 | 0 | 0 | 0 | 111.6 | L188 M189 C190 A195 L196 | L188-S192 WeakPolarHBondContact O-CB 3.43Å; L188-S192 PolarHBondContact O-N 3.46Å; L188-S192 PolarHBondContact O-OG 2.67Å; M189-S192 PolarHBondContact O-N 3.11Å; C190-S192 VanDerWaalsContact C-N 3.27Å; C190-S192 PolarHBondContact O-N 2.91Å; S192-A195 PolarHBondContact O-N 3.5Å; S192-L196 WeakPolarHBondContact O-CG 3.33Å; S192-L196 PolarHBondContact O-N 2.94Å |
| 193 | G | 96.7 | Very high | 94.9 | Very high | 0 Ų | 0 | 36.5 Ų | 36.5 | 0% | 0 | 20% | 0.203 | C | C | . | . | H | α-helix | trans | -62.6 | -46.2 | 176.3 | 0 | 0 | 0 | 0 | 0 | 112.5 | M189 C190 A195 L196 Y197 | M189-G193 PolarHBondContact O-N 3.29Å; C190-G193 PolarHBondContact O-N 2.94Å; G193-A195 VanDerWaalsContact C-N 3.34Å; G193-A195 PolarHBondContact O-N 3Å; G193-L196 PolarHBondContact O-N 3.32Å; G193-Y197 PolarHBondContact O-N 2.98Å |
| 194 | A | 96.6 | Very high | 95.6 | Very high | 0 Ų | 0 | 33.5 Ų | 33.5 | 0% | 0 | 19% | 0.192 | C | C | . | . | H | α-helix | trans | -60.7 | -41.3 | 175.8 | 0 | 0 | 0 | 0 | 0 | 112 | F131 T132 C190 Y197 G198 | F131-A194 HydrophobicContact CB-CB 4.15Å; F131-A194 HydrophobicContact CD1-CB 4.36Å; T132-A194 VanDerWaalsContact OG1-CA 3.3Å; T132-A194 WeakPolarHBondContact OG1-CA 3.47Å; T132-A194 WeakPolarHBondContact OG1-CB 3.41Å; T132-A194 PolarHBondContact OG1-O 2.93Å; T132-A194 VanDerWaalsContact OG1-O 3.11Å; C190-A194 WeakPolarHBondContact O-CB 3.29Å; C190-A194 PolarHBondContact O-N 3.27Å; A194-Y197 PolarHBondContact O-N 3.32Å; A194-G198 PolarHBondContact O-N 3.24Å |
| 195 | A | 98 | Very high | 95.9 | Very high | 30 Ų | 30 | 28.5 Ų | 28.5 | 25% | 0.248 | 16% | 0.162 | C | C | . | . | H | α-helix | trans | -63.1 | -44.2 | 174.4 | 0 | 0 | 0 | 0 | 0 | 112.1 | F131 V135 L191 S192 G193 G198 V199 | F131-A195 HydrophobicContact CE1-CB 4.3Å; V135-A195 HydrophobicContact CG2-CB 4.42Å; L191-A195 WeakPolarHBondContact O-CB 3.49Å; L191-A195 PolarHBondContact O-N 3.44Å; S192-A195 PolarHBondContact O-N 3.5Å; G193-A195 VanDerWaalsContact C-N 3.34Å; G193-A195 PolarHBondContact O-N 3Å; A195-G198 PolarHBondContact O-N 3.25Å; A195-V199 WeakPolarHBondContact O-CG2 3.37Å; A195-V199 PolarHBondContact O-N 3.33Å |
| 196 | L | 98.1 | Very high | 96.1 | Very high | 54 Ų | 54 | 31.6 Ų | 31.6 | 28% | 0.283 | 17% | 0.166 | S | C | . | . | H | α-helix | trans | -65.3 | -40.9 | 176.4 | -70.9 | 176.1 | 0 | 0 | 0 | 112.1 | I105 E108 A109 L112 S192 G193 G198 V199 S200 | I105-L196 HydrophobicContact CG2-CB 4.04Å; I105-L196 HydrophobicContact CG2-CD2 4.09Å; I105-L196 VanDerWaalsContact CG2-O 3.27Å; I105-L196 WeakPolarHBondContact CG2-O 3.44Å; E108-L196 HydrophobicContact CB-CD1 4.32Å; A109-L196 HydrophobicContact CB-CB 3.65Å; L112-L196 HydrophobicContact CD1-CD1 3.83Å; S192-L196 WeakPolarHBondContact O-CG 3.33Å; S192-L196 PolarHBondContact O-N 2.94Å; G193-L196 PolarHBondContact O-N 3.32Å; L196-G198 VanDerWaalsContact C-N 3.27Å; L196-G198 PolarHBondContact O-N 2.87Å; L196-V199 PolarHBondContact O-N 3.38Å; L196-S200 WeakPolarHBondContact O-CB 3.42Å; L196-S200 PolarHBondContact O-N 2.92Å |
| 197 | Y | 97.3 | Very high | 96.4 | Very high | 53 Ų | 53 | 31.6 Ų | 31.6 | 21% | 0.208 | 17% | 0.166 | C | C | . | . | H | α-helix | trans | -60.7 | -39.4 | 171.6 | -87 | -44.6 | 0 | 0 | 0 | 111.5 | A109 T110 I113 G193 A194 V199 S200 N201 | A109-Y197 HydrophobicContact CB-CD1 3.66Å; A109-Y197 HydrophobicContact CB-CD2 4.01Å; A109-Y197 HydrophobicContact CB-CE1 3.8Å; A109-Y197 HydrophobicContact CB-CE2 4.17Å; A109-Y197 HydrophobicContact CB-CG 3.75Å; T110-Y197 VanDerWaalsContact CA-OH 3.24Å; T110-Y197 WeakPolarHBondContact CA-OH 3.47Å; T110-Y197 WeakPolarHBondContact CB-OH 3.15Å; T110-Y197 PolarHBondContact OG1-OH 3.36Å; I113-Y197 HydrophobicContact CG1-CD2 4.33Å; I113-Y197 HydrophobicContact CG1-CE2 4.03Å; G193-Y197 PolarHBondContact O-N 2.98Å; A194-Y197 PolarHBondContact O-N 3.32Å; Y197-V199 VanDerWaalsContact C-N 3.32Å; Y197-V199 PolarHBondContact O-N 3.46Å; Y197-S200 WeakPolarHBondContact O-CB 3.28Å; Y197-S200 PolarHBondContact O-N 3.28Å; Y197-N201 VanDerWaalsContact O-CB 3.27Å; Y197-N201 WeakPolarHBondContact O-CB 3.34Å; Y197-N201 PolarHBondContact O-N 2.94Å; Y197-N201 PolarHBondContact O-ND2 3.13Å; Y197-N201 VanDerWaalsContact O-ND2 3.13Å |
| 198 | G | 97.8 | Very high | 96.5 | Very high | 0 Ų | 0 | 29.4 Ų | 29.4 | 0% | 0 | 15% | 0.154 | C | C | . | . | H | α-helix | trans | -60.8 | -42.1 | 175.2 | 0 | 0 | 0 | 0 | 0 | 112.6 | A194 A195 L196 V202 | A194-G198 PolarHBondContact O-N 3.24Å; A195-G198 PolarHBondContact O-N 3.25Å; L196-G198 VanDerWaalsContact C-N 3.27Å; L196-G198 PolarHBondContact O-N 2.87Å; G198-V202 WeakPolarHBondContact O-CG2 3.49Å; G198-V202 PolarHBondContact O-N 3.4Å |
| 199 | V | 98.2 | Very high | 96.4 | Very high | 47 Ų | 47 | 28 Ų | 28 | 29% | 0.285 | 14% | 0.142 | S | C | . | . | H | α-helix | trans | -64.3 | -48.6 | 173.1 | 176 | 0 | 0 | 0 | 0 | 111.2 | I105 L139 A195 L196 Y197 N201 V202 I203 | I105-V199 HydrophobicContact CD1-CG1 4Å; I105-V199 HydrophobicContact CG2-CB 4.44Å; I105-V199 HydrophobicContact CG2-CG1 4.44Å; L139-V199 HydrophobicContact CD1-CB 4.31Å; L139-V199 HydrophobicContact CD1-CG2 3.63Å; A195-V199 WeakPolarHBondContact O-CG2 3.37Å; A195-V199 PolarHBondContact O-N 3.33Å; L196-V199 PolarHBondContact O-N 3.38Å; Y197-V199 VanDerWaalsContact C-N 3.32Å; Y197-V199 PolarHBondContact O-N 3.46Å; V199-N201 VanDerWaalsContact C-N 3.32Å; V199-N201 PolarHBondContact O-N 3.14Å; V199-V202 PolarHBondContact O-N 3.31Å; V199-I203 HydrophobicContact CG1-CD1 3.67Å; V199-I203 HydrophobicContact CG1-CG1 4.35Å; V199-I203 WeakPolarHBondContact O-CG1 3.48Å; V199-I203 PolarHBondContact O-N 3.3Å |
| 200 | S | 97.9 | Very high | 96.2 | Very high | 0 Ų | 0 | 30.3 Ų | 30.3 | 0% | 0 | 15% | 0.154 | C | C | . | . | H | α-helix | trans | -53.5 | -49.6 | 177.8 | -173.9 | 0 | 0 | 0 | 0 | 110.8 | L102 D106 L196 Y197 V202 I203 Q204 | L102-S200 WeakPolarHBondContact CD1-O 3.47Å; L102-S200 WeakPolarHBondContact CD1-OG 3.43Å; D106-S200 PolarHBondContact OD1-OG 3.43Å; L196-S200 WeakPolarHBondContact O-CB 3.42Å; L196-S200 PolarHBondContact O-N 2.92Å; Y197-S200 WeakPolarHBondContact O-CB 3.28Å; Y197-S200 PolarHBondContact O-N 3.28Å; S200-V202 PolarHBondContact O-N 3.36Å; S200-I203 PolarHBondContact O-N 2.92Å; S200-Q204 VanDerWaalsContact O-CB 3.27Å; S200-Q204 WeakPolarHBondContact O-CB 3.5Å; S200-Q204 PolarHBondContact O-N 3.49Å |
| 201 | N | 97.5 | Very high | 96.1 | Very high | 8 Ų | 8 | 31 Ų | 31 | 4% | 0.043 | 16% | 0.158 | C | C | . | . | H | α-helix | trans | -63.8 | -39.5 | -177.9 | -69.5 | -23.8 | 0 | 0 | 0 | 113 | V136 Y197 V199 Q204 E205 A302 F305 N306 | V136-N201 HydrophobicContact CG2-CB 4.17Å; Y197-N201 VanDerWaalsContact O-CB 3.27Å; Y197-N201 WeakPolarHBondContact O-CB 3.34Å; Y197-N201 PolarHBondContact O-N 2.94Å; Y197-N201 PolarHBondContact O-ND2 3.13Å; Y197-N201 VanDerWaalsContact O-ND2 3.13Å; V199-N201 VanDerWaalsContact C-N 3.32Å; V199-N201 PolarHBondContact O-N 3.14Å; N201-Q204 PolarHBondContact O-N 3.49Å; N201-E205 PolarHBondContact O-N 3.25Å; N201-A302 HydrophobicContact CB-CB 4.1Å; N201-A302 WeakPolarHBondContact O-CB 3.48Å; N201-F305 WeakPolarHBondContact OD1-CE1 3.45Å; N201-N306 PolarHBondContact ND2-ND2 3.1Å; N201-N306 PolarHBondContact ND2-OD1 2.76Å; N201-N306 VanDerWaalsContact ND2-OD1 3.16Å |
| 202 | V | 97.4 | Very high | 95.9 | Very high | 8 Ų | 8 | 30.8 Ų | 30.8 | 5% | 0.048 | 16% | 0.155 | C | C | . | . | H | α-helix | trans | -73.5 | -39.2 | 178.4 | 173.9 | 0 | 0 | 0 | 0 | 111.7 | V136 L139 S140 L144 G198 V199 S200 Q204 E205 W206 | V136-V202 HydrophobicContact CB-CG2 4.31Å; V136-V202 HydrophobicContact CG1-CG2 3.93Å; V136-V202 HydrophobicContact CG2-CG2 4.34Å; L139-V202 HydrophobicContact CB-CB 4.29Å; L139-V202 HydrophobicContact CB-CG1 4.19Å; L139-V202 HydrophobicContact CB-CG2 3.86Å; S140-V202 WeakPolarHBondContact OG-CG2 3.1Å; L144-V202 HydrophobicContact CD1-CG1 4.03Å; L144-V202 HydrophobicContact CG-CG1 4.12Å; G198-V202 WeakPolarHBondContact O-CG2 3.49Å; G198-V202 PolarHBondContact O-N 3.4Å; V199-V202 PolarHBondContact O-N 3.31Å; S200-V202 PolarHBondContact O-N 3.36Å; V202-Q204 VanDerWaalsContact C-N 3.32Å; V202-E205 PolarHBondContact O-N 3.11Å; V202-W206 WeakPolarHBondContact O-CB 3.26Å; V202-W206 PolarHBondContact O-N 3.4Å |
| 203 | I | 96.9 | Very high | 95.8 | Very high | 46 Ų | 46 | 33.6 Ų | 33.6 | 24% | 0.236 | 16% | 0.156 | C | C | . | . | H | α-helix | trans | -64 | -41.2 | 172.7 | -65.6 | 171.7 | 0 | 0 | 0 | 110 | L102 I105 V199 S200 E205 W206 L207 | L102-I203 HydrophobicContact CB-CG2 4.25Å; L102-I203 HydrophobicContact CD1-CB 4.01Å; L102-I203 HydrophobicContact CD1-CG2 3.93Å; L102-I203 HydrophobicContact CD2-CG2 4.24Å; L102-I203 HydrophobicContact CG-CG2 4.37Å; I105-I203 HydrophobicContact CD1-CD1 4.18Å; V199-I203 HydrophobicContact CG1-CD1 3.67Å; V199-I203 HydrophobicContact CG1-CG1 4.35Å; V199-I203 WeakPolarHBondContact O-CG1 3.48Å; V199-I203 PolarHBondContact O-N 3.3Å; S200-I203 PolarHBondContact O-N 2.92Å; I203-E205 PolarHBondContact O-N 3.26Å; I203-W206 WeakPolarHBondContact O-CB 3.44Å; I203-W206 PolarHBondContact O-N 3.39Å; I203-L207 HydrophobicContact CG2-CD1 3.9Å; I203-L207 HydrophobicContact CG2-CG 4.24Å; I203-L207 WeakPolarHBondContact O-CB 3.49Å; I203-L207 WeakPolarHBondContact O-CG 3.46Å; I203-L207 PolarHBondContact O-N 3.41Å |
| 204 | Q | 97.1 | Very high | 95.7 | Very high | 6 Ų | 6 | 35.4 Ų | 35.4 | 3% | 0.028 | 17% | 0.168 | C | C | . | . | H | α-helix | trans | -58.7 | -47.1 | 174.5 | 173 | 170.7 | 28.6 | 0 | 0 | 111.4 | S200 N201 V202 W206 L207 L208 Y216 I297 | S200-Q204 VanDerWaalsContact O-CB 3.27Å; S200-Q204 WeakPolarHBondContact O-CB 3.5Å; S200-Q204 PolarHBondContact O-N 3.49Å; N201-Q204 PolarHBondContact O-N 3.49Å; V202-Q204 VanDerWaalsContact C-N 3.32Å; Q204-W206 VanDerWaalsContact C-N 3.34Å; Q204-W206 PolarHBondContact O-N 2.64Å; Q204-L207 PolarHBondContact O-N 3.11Å; Q204-L208 HydrophobicContact CG-CD1 3.62Å; Q204-L208 HydrophobicContact CG-CG 4.23Å; Q204-L208 VanDerWaalsContact O-CB 3.3Å; Q204-L208 WeakPolarHBondContact O-CB 3.38Å; Q204-L208 VanDerWaalsContact O-CG 3.27Å; Q204-L208 WeakPolarHBondContact O-CG 3.42Å; Q204-L208 PolarHBondContact O-N 3.43Å; Q204-Y216 HydrophobicContact CB-CE2 3.98Å; Q204-Y216 WeakPolarHBondContact CB-OH 3.27Å; Q204-Y216 HydrophobicContact CG-CE1 4.09Å; Q204-Y216 HydrophobicContact CG-CE2 3.72Å; Q204-Y216 VanDerWaalsContact CG-CZ 3.42Å; Q204-Y216 WeakPolarHBondContact CG-OH 3.46Å; Q204-Y216 VanDerWaalsContact NE2-CE1 3.32Å; Q204-Y216 PolarHBondContact NE2-OH 2.91Å; Q204-I297 HydrophobicContact CG-CD1 3.9Å |
| 205 | E | 96 | Very high | 95.6 | Very high | 0 Ų | 0 | 35.6 Ų | 35.6 | 0% | 0 | 17% | 0.169 | C | C | . | . | H | α-helix | trans | -59.5 | -44.8 | 175.1 | 177.6 | 170.1 | -172.4 | 0 | 0 | 112.2 | L144 N201 V202 I203 R209 I297 A302 | L144-E205 HydrophobicContact CD1-CB 4.02Å; L144-E205 VanDerWaalsContact CD1-CD 3.43Å; L144-E205 HydrophobicContact CD1-CG 3.62Å; N201-E205 PolarHBondContact O-N 3.25Å; V202-E205 PolarHBondContact O-N 3.11Å; I203-E205 PolarHBondContact O-N 3.26Å; E205-R209 VanDerWaalsContact O-CG 3.24Å; E205-R209 WeakPolarHBondContact O-CG 3.4Å; E205-R209 PolarHBondContact O-N 3.37Å; E205-R209 VanDerWaalsContact O-N 3.11Å; E205-R209 IonicContact OE1-CZ 2.59Å; E205-R209 VanDerWaalsContact OE1-CZ 3.23Å; E205-R209 IonicContact OE1-NE 3.23Å; E205-R209 PolarHBondContact OE1-NE 3.41Å; E205-R209 IonicContact OE1-NH2 3.25Å; E205-R209 PolarHBondContact OE1-NH2 2.94Å; E205-I297 HydrophobicContact CB-CG2 3.65Å; E205-I297 HydrophobicContact CG-CG2 3.85Å; E205-A302 HydrophobicContact CB-CB 4.11Å; E205-A302 WeakPolarHBondContact OE2-CB 3.38Å; E205-A302 PolarHBondContact OE2-N 3.13Å |
| 206 | W | 95.2 | Very high | 95.6 | Very high | 99 Ų | 99 | 34.2 Ų | 34.2 | 38% | 0.375 | 16% | 0.157 | S | C | . | . | H | α-helix | trans | -59.7 | -48.3 | 176.1 | 179.9 | 68 | 0 | 0 | 0 | 112.2 | K98 L144 V202 I203 Q204 R209 L210 | K98-W206 HydrophobicContact CD-CH2 3.99Å; K98-W206 HydrophobicContact CD-CZ3 4.06Å; L144-W206 HydrophobicContact CD2-CB 3.79Å; L144-W206 HydrophobicContact CD2-CG 4.25Å; V202-W206 WeakPolarHBondContact O-CB 3.26Å; V202-W206 PolarHBondContact O-N 3.4Å; I203-W206 WeakPolarHBondContact O-CB 3.44Å; I203-W206 PolarHBondContact O-N 3.39Å; Q204-W206 VanDerWaalsContact C-N 3.34Å; Q204-W206 PolarHBondContact O-N 2.64Å; W206-R209 PolarHBondContact O-N 3.49Å; W206-L210 HydrophobicContact CD2-CD1 4.03Å; W206-L210 VanDerWaalsContact CE2-CD1 3.41Å; W206-L210 HydrophobicContact CG-CD1 4.5Å; W206-L210 HydrophobicContact CH2-CD1 4.25Å; W206-L210 HydrophobicContact CZ2-CD1 3.54Å; W206-L210 WeakPolarHBondContact O-CG 3.45Å; W206-L210 PolarHBondContact O-N 2.69Å |
| 207 | L | 95 | Very high | 95.6 | Very high | 0 Ų | 0 | 31.8 Ų | 31.8 | 0% | 0 | 14% | 0.144 | C | C | . | . | H | α-helix | trans | -65.5 | -43.8 | -179.9 | -73.1 | 174.2 | 0 | 0 | 0 | 111.8 | Y99 L102 I203 Q204 R209 L210 H211 Y216 | Y99-L207 HydrophobicContact CD1-CD1 3.91Å; Y99-L207 HydrophobicContact CE1-CD1 3.8Å; Y99-L207 HydrophobicContact CE1-CD2 4.44Å; L102-L207 HydrophobicContact CD2-CD1 3.69Å; I203-L207 HydrophobicContact CG2-CD1 3.9Å; I203-L207 HydrophobicContact CG2-CG 4.24Å; I203-L207 WeakPolarHBondContact O-CB 3.49Å; I203-L207 WeakPolarHBondContact O-CG 3.46Å; I203-L207 PolarHBondContact O-N 3.41Å; Q204-L207 PolarHBondContact O-N 3.11Å; L207-R209 PolarHBondContact O-N 3.49Å; L207-L210 CarbonylContact O-C 3.53Å; L207-L210 PolarHBondContact O-N 2.77Å; L207-H211 WeakPolarHBondContact O-CA 3.46Å; L207-H211 VanDerWaalsContact O-CB 3.29Å; L207-H211 WeakPolarHBondContact O-CB 3.47Å; L207-H211 PolarHBondContact O-N 3.11Å; L207-H211 PolarHBondContact O-ND1 2.9Å; L207-Y216 HydrophobicContact CB-CD2 4.08Å; L207-Y216 HydrophobicContact CB-CE2 4.46Å; L207-Y216 HydrophobicContact CD1-CD2 4.32Å; L207-Y216 HydrophobicContact CD1-CE2 4.29Å |
| 208 | L | 94.8 | Very high | 95.6 | Very high | 1 Ų | 1 | 29.3 Ų | 29.3 | 1% | 0.005 | 14% | 0.135 | C | C | . | . | H | α-helix | trans | -68.4 | -21.1 | -179.9 | -73.9 | 173.9 | 0 | 0 | 0 | 114 | Q204 H211 R213 Y216 C294 I297 R298 | Q204-L208 HydrophobicContact CG-CD1 3.62Å; Q204-L208 HydrophobicContact CG-CG 4.23Å; Q204-L208 VanDerWaalsContact O-CB 3.3Å; Q204-L208 WeakPolarHBondContact O-CB 3.38Å; Q204-L208 VanDerWaalsContact O-CG 3.27Å; Q204-L208 WeakPolarHBondContact O-CG 3.42Å; Q204-L208 PolarHBondContact O-N 3.43Å; L208-H211 VanDerWaalsContact O-O 3.13Å; L208-R213 HydrophobicContact CD2-CG 4.2Å; L208-Y216 HydrophobicContact CD2-CD1 4.05Å; L208-Y216 HydrophobicContact CD2-CD2 4.24Å; L208-Y216 HydrophobicContact CD2-CG 3.71Å; L208-Y216 HydrophobicContact CG-CD2 4.23Å; L208-Y216 HydrophobicContact CG-CG 4.17Å; L208-C294 HydrophobicContact CD1-CB 4.07Å; L208-C294 HydrophobicContact CD2-CB 4.04Å; L208-I297 HydrophobicContact CD1-CB 4.02Å; L208-I297 HydrophobicContact CD1-CG2 3.92Å; L208-R298 HydrophobicContact CB-CG 3.95Å; L208-R298 VanDerWaalsContact O-CZ 3.29Å; L208-R298 PolarHBondContact O-NH1 3.04Å |
| 209 | R | 91.6 | Very high | 95.5 | Very high | 73 Ų | 73 | 29.3 Ų | 29.3 | 28% | 0.275 | 14% | 0.135 | S | C | . | . | H | α-helix | trans | -75.8 | -32.8 | 170.2 | -74.4 | 172.7 | 178 | -146 | -0.8 | 112.1 | E205 W206 L207 T342 | E205-R209 VanDerWaalsContact O-CG 3.24Å; E205-R209 WeakPolarHBondContact O-CG 3.4Å; E205-R209 PolarHBondContact O-N 3.37Å; E205-R209 VanDerWaalsContact O-N 3.11Å; E205-R209 IonicContact OE1-CZ 2.59Å; E205-R209 VanDerWaalsContact OE1-CZ 3.23Å; E205-R209 IonicContact OE1-NE 3.23Å; E205-R209 PolarHBondContact OE1-NE 3.41Å; E205-R209 IonicContact OE1-NH2 3.25Å; E205-R209 PolarHBondContact OE1-NH2 2.94Å; W206-R209 PolarHBondContact O-N 3.49Å; L207-R209 PolarHBondContact O-N 3.49Å; R209-T342 PolarHBondContact NH1-OG1 2.91Å; R209-T342 VanDerWaalsContact NH1-OG1 3.07Å |
| 210 | L | 91.5 | Very high | 95.5 | Very high | 87 Ų | 87 | 27 Ų | 27 | 46% | 0.455 | 12% | 0.121 | S | C | . | . | H | α-helix | trans | -92.1 | -28 | -177.8 | -68.4 | 178.7 | 0 | 0 | 0 | 113.7 | W206 L207 | W206-L210 HydrophobicContact CD2-CD1 4.03Å; W206-L210 VanDerWaalsContact CE2-CD1 3.41Å; W206-L210 HydrophobicContact CG-CD1 4.5Å; W206-L210 HydrophobicContact CH2-CD1 4.25Å; W206-L210 HydrophobicContact CZ2-CD1 3.54Å; W206-L210 WeakPolarHBondContact O-CG 3.45Å; W206-L210 PolarHBondContact O-N 2.69Å; L207-L210 CarbonylContact O-C 3.53Å; L207-L210 PolarHBondContact O-N 2.77Å |
| 211 | H | 91.4 | Very high | 95.5 | Very high | 16 Ų | 16 | 27 Ų | 27 | 7% | 0.074 | 12% | 0.121 | C | C | . | . | S | Bend | trans | -127.9 | 159.7 | -167.7 | -53.4 | 72.5 | 0 | 0 | 0 | 110.4 | R95 Y99 L207 L208 E215 R298 | R95-H211 VanDerWaalsContact CD-CD2 3.48Å; R95-H211 WeakPolarHBondContact CD-CD2 3.2Å; R95-H211 WeakPolarHBondContact CD-NE2 3.34Å; R95-H211 PolarHBondContact NE-CD2 2.87Å; R95-H211 PolarHBondContact NH1-CD2 3.4Å; R95-H211 PolarHBondContact NH1-NE2 3.19Å; Y99-H211 PolarHBondContact OH-CD2 3.31Å; L207-H211 WeakPolarHBondContact O-CA 3.46Å; L207-H211 VanDerWaalsContact O-CB 3.29Å; L207-H211 WeakPolarHBondContact O-CB 3.47Å; L207-H211 PolarHBondContact O-N 3.11Å; L207-H211 PolarHBondContact O-ND1 2.9Å; L208-H211 VanDerWaalsContact O-O 3.13Å; H211-E215 IonicContact CD2-OE1 2.63Å; H211-E215 PolarHBondContact CD2-OE1 3.02Å; H211-E215 VanDerWaalsContact CD2-OE1 3.25Å; H211-E215 IonicContact CD2-OE2 3.09Å; H211-R298 PolarHBondContact O-NH1 2.9Å |
| 212 | E | 92 | Very high | 95.5 | Very high | 60 Ų | 60 | 28.4 Ų | 28.4 | 28% | 0.28 | 13% | 0.128 | S | C | . | . | trans | -74.1 | 155.8 | 174.7 | 66.3 | -170.9 | 162.5 | 0 | 0 | 112.4 | R82 T214 E215 Y216 | R82-E212 IonicContact CZ-OE1 3.47Å; R82-E212 IonicContact CZ-OE2 3.5Å; R82-E212 IonicContact NH1-OE1 2.64Å; R82-E212 PolarHBondContact NH1-OE1 2.84Å; R82-E212 IonicContact NH1-OE2 2.94Å; R82-E212 PolarHBondContact NH1-OE2 3.08Å; R82-E212 IonicContact NH2-OE1 3.61Å; R82-E212 IonicContact NH2-OE2 3.13Å; R82-E212 PolarHBondContact NH2-OE2 2.86Å; R82-E212 VanDerWaalsContact NH2-OE2 3.13Å; E212-T214 PolarHBondContact O-N 3.41Å; E212-E215 HydrophobicContact CG-CB 3.64Å; E212-E215 PolarHBondContact O-N 2.94Å; E212-Y216 PolarHBondContact O-N 3.47Å; E212-Y216 VanDerWaalsContact O-N 3.14Å | ||
| 213 | R | 94.6 | Very high | 95.5 | Very high | 117 Ų | 117 | 28.9 Ų | 28.9 | 44% | 0.442 | 13% | 0.129 | S | C | . | . | H | α-helix | trans | -64 | -39.7 | -176.5 | -61.2 | 170.1 | -70.1 | 162.5 | 2.8 | 112.4 | L208 E215 Y216 L217 C294 R298 | L208-R213 HydrophobicContact CD2-CG 4.2Å; R213-E215 VanDerWaalsContact C-N 3.32Å; R213-E215 PolarHBondContact O-N 2.81Å; R213-Y216 PolarHBondContact O-N 3Å; R213-L217 WeakPolarHBondContact O-CB 3.4Å; R213-L217 WeakPolarHBondContact O-CG 3.38Å; R213-L217 PolarHBondContact O-N 3.49Å; R213-C294 HydrophobicContact CB-CB 4.29Å; R213-C294 HydrophobicContact CG-CB 4.14Å; R213-R298 VanDerWaalsContact CG-CD 3.5Å; R213-R298 HydrophobicContact CG-CG 4.49Å |
| 214 | T | 95 | Very high | 95.5 | Very high | 39 Ų | 39 | 26.7 Ų | 26.7 | 24% | 0.239 | 12% | 0.118 | C | C | . | . | H | α-helix | trans | -63 | -41 | -179.6 | -48.5 | 0 | 0 | 0 | 0 | 111.1 | Y75 T78 E212 G218 | Y75-T214 HydrophobicContact CD1-CG2 3.95Å; T78-T214 HydrophobicContact CG2-CG2 4.13Å; E212-T214 PolarHBondContact O-N 3.41Å; T214-G218 PolarHBondContact O-N 3.44Å |
| 215 | E | 95.3 | Very high | 95.5 | Very high | 4 Ų | 4 | 26.7 Ų | 26.7 | 2% | 0.019 | 12% | 0.119 | C | C | . | . | H | α-helix | trans | -61.8 | -52.8 | 173.6 | 178.7 | -178.5 | 151.4 | 0 | 0 | 110.4 | I91 R95 Y99 H211 E212 R213 L217 G218 M219 | I91-E215 HydrophobicContact CD1-CG 3.95Å; I91-E215 HydrophobicContact CG1-CG 4.49Å; I91-E215 HydrophobicContact CG2-CG 3.9Å; I91-E215 WeakPolarHBondContact CG2-OE1 3.3Å; R95-E215 WeakPolarHBondContact CD-OE1 3.39Å; R95-E215 IonicContact CZ-OE1 3.3Å; R95-E215 IonicContact CZ-OE2 3.26Å; R95-E215 IonicContact NE-OE1 3.8Å; R95-E215 PolarHBondContact NE-OE1 3.44Å; R95-E215 IonicContact NE-OE2 3.27Å; R95-E215 IonicContact NH1-OE1 2.72Å; R95-E215 VanDerWaalsContact NH2-CD 3.35Å; R95-E215 IonicContact NH2-OE1 3.26Å; R95-E215 PolarHBondContact NH2-OE1 3.37Å; R95-E215 IonicContact NH2-OE2 2.68Å; R95-E215 PolarHBondContact NH2-OE2 3.01Å; Y99-E215 WeakPolarHBondContact CE2-OE1 3.12Å; Y99-E215 VanDerWaalsContact OH-CD 3.31Å; Y99-E215 WeakPolarHBondContact OH-CG 3.37Å; Y99-E215 PolarHBondContact OH-OE1 3.07Å; H211-E215 IonicContact CD2-OE1 2.63Å; H211-E215 PolarHBondContact CD2-OE1 3.02Å; H211-E215 VanDerWaalsContact CD2-OE1 3.25Å; H211-E215 IonicContact CD2-OE2 3.09Å; E212-E215 HydrophobicContact CG-CB 3.64Å; E212-E215 PolarHBondContact O-N 2.94Å; R213-E215 VanDerWaalsContact C-N 3.32Å; R213-E215 PolarHBondContact O-N 2.81Å; E215-L217 PolarHBondContact O-N 3.35Å; E215-G218 PolarHBondContact O-N 2.93Å; E215-M219 HydrophobicContact CG-CG 4.22Å; E215-M219 WeakPolarHBondContact O-CB 3.4Å; E215-M219 VanDerWaalsContact O-CG 3.23Å; E215-M219 WeakPolarHBondContact O-CG 3.41Å; E215-M219 PolarHBondContact O-N 3.42Å |
| 216 | Y | 96.7 | Very high | 95.6 | Very high | 0 Ų | 0 | 32.7 Ų | 32.7 | 0% | 0 | 15% | 0.145 | C | C | . | . | H | α-helix | trans | -54.3 | -52 | 178.9 | 175.3 | -86.5 | 0 | 0 | 0 | 112 | Y99 L102 Q204 L207 L208 E212 R213 G218 M219 I220 C294 | Y99-Y216 HydrophobicContact CE1-CD2 4.16Å; L102-Y216 HydrophobicContact CD2-CD2 4.47Å; L102-Y216 HydrophobicContact CD2-CE2 3.45Å; L102-Y216 VanDerWaalsContact CD2-CE2 3.45Å; Q204-Y216 HydrophobicContact CB-CE2 3.98Å; Q204-Y216 WeakPolarHBondContact CB-OH 3.27Å; Q204-Y216 HydrophobicContact CG-CE1 4.09Å; Q204-Y216 HydrophobicContact CG-CE2 3.72Å; Q204-Y216 VanDerWaalsContact CG-CZ 3.42Å; Q204-Y216 WeakPolarHBondContact CG-OH 3.46Å; Q204-Y216 VanDerWaalsContact NE2-CE1 3.32Å; Q204-Y216 PolarHBondContact NE2-OH 2.91Å; L207-Y216 HydrophobicContact CB-CD2 4.08Å; L207-Y216 HydrophobicContact CB-CE2 4.46Å; L207-Y216 HydrophobicContact CD1-CD2 4.32Å; L207-Y216 HydrophobicContact CD1-CE2 4.29Å; L208-Y216 HydrophobicContact CD2-CD1 4.05Å; L208-Y216 HydrophobicContact CD2-CD2 4.24Å; L208-Y216 HydrophobicContact CD2-CG 3.71Å; L208-Y216 HydrophobicContact CG-CD2 4.23Å; L208-Y216 HydrophobicContact CG-CG 4.17Å; E212-Y216 PolarHBondContact O-N 3.47Å; E212-Y216 VanDerWaalsContact O-N 3.14Å; R213-Y216 PolarHBondContact O-N 3Å; Y216-G218 PolarHBondContact O-N 3.36Å; Y216-M219 PolarHBondContact O-N 2.85Å; Y216-I220 HydrophobicContact CD1-CG2 4.45Å; Y216-I220 HydrophobicContact CE1-CG2 4.13Å; Y216-I220 WeakPolarHBondContact O-CB 3.18Å; Y216-I220 WeakPolarHBondContact O-CG2 3.37Å; Y216-I220 PolarHBondContact O-N 2.97Å; Y216-C294 WeakPolarHBondContact CD1-SG 3.27Å |
| 217 | L | 97.6 | Very high | 95.7 | Very high | 4 Ų | 4 | 28.6 Ų | 28.6 | 2% | 0.021 | 13% | 0.13 | C | C | . | . | H | α-helix | trans | -65 | -37.6 | -178 | -73.3 | 164.6 | 0 | 0 | 0 | 112.3 | L71 Y75 R213 E215 I220 G221 C294 | L71-L217 HydrophobicContact CD2-CD2 4.03Å; Y75-L217 HydrophobicContact CD1-CB 3.97Å; Y75-L217 HydrophobicContact CD1-CD1 4.23Å; Y75-L217 HydrophobicContact CD2-CB 3.66Å; Y75-L217 HydrophobicContact CD2-CD1 4.16Å; Y75-L217 HydrophobicContact CD2-CG 4.37Å; Y75-L217 HydrophobicContact CE1-CB 4.42Å; Y75-L217 HydrophobicContact CE1-CD1 3.82Å; Y75-L217 HydrophobicContact CE2-CB 4.12Å; Y75-L217 HydrophobicContact CE2-CD1 3.72Å; Y75-L217 HydrophobicContact CE2-CG 4.36Å; Y75-L217 HydrophobicContact CG-CB 3.57Å; Y75-L217 HydrophobicContact CG-CD1 4.4Å; R213-L217 WeakPolarHBondContact O-CB 3.4Å; R213-L217 WeakPolarHBondContact O-CG 3.38Å; R213-L217 PolarHBondContact O-N 3.49Å; E215-L217 PolarHBondContact O-N 3.35Å; L217-I220 WeakPolarHBondContact O-CG2 3.4Å; L217-G221 PolarHBondContact O-N 3.49Å; L217-G221 VanDerWaalsContact O-N 3.07Å; L217-C294 HydrophobicContact CD1-CB 4.41Å |
| 218 | G | 97.1 | Very high | 95.7 | Very high | 0 Ų | 0 | 28.6 Ų | 28.6 | 0% | 0 | 13% | 0.13 | C | C | . | . | H | α-helix | trans | -66.9 | -46.7 | 176.4 | 0 | 0 | 0 | 0 | 0 | 111.8 | T214 E215 Y216 G221 I222 | T214-G218 PolarHBondContact O-N 3.44Å; E215-G218 PolarHBondContact O-N 2.93Å; Y216-G218 PolarHBondContact O-N 3.36Å; G218-G221 PolarHBondContact O-N 3.43Å; G218-I222 WeakPolarHBondContact O-CD1 3.38Å; G218-I222 VanDerWaalsContact O-CG1 3.26Å; G218-I222 WeakPolarHBondContact O-CG1 3.42Å; G218-I222 PolarHBondContact O-N 3.34Å |
| 219 | M | 96.9 | Very high | 95.6 | Very high | 0 Ų | 0 | 29.5 Ų | 29.5 | 0% | 0 | 14% | 0.14 | C | C | . | . | H | α-helix | trans | -70.6 | -42.3 | -177.1 | -64.7 | -59.7 | -64.9 | 0 | 0 | 112.6 | L79 I91 F92 Y99 E215 Y216 G221 I222 F223 | L79-M219 HydrophobicContact CD2-CG 4.45Å; L79-M219 HydrophobicContact CD2-SD 4.24Å; I91-M219 HydrophobicContact CG2-CE 4.07Å; I91-M219 HydrophobicContact CG2-CG 3.92Å; I91-M219 HydrophobicContact CG2-SD 3.73Å; F92-M219 HydrophobicContact CD2-CE 3.86Å; Y99-M219 HydrophobicContact CD1-CB 3.67Å; Y99-M219 HydrophobicContact CD1-CG 4.42Å; Y99-M219 HydrophobicContact CD2-CB 3.81Å; Y99-M219 HydrophobicContact CD2-CE 3.96Å; Y99-M219 HydrophobicContact CD2-CG 3.84Å; Y99-M219 HydrophobicContact CE1-CB 4.11Å; Y99-M219 HydrophobicContact CE2-CB 4.21Å; Y99-M219 HydrophobicContact CE2-CG 3.92Å; Y99-M219 HydrophobicContact CG-CB 3.51Å; Y99-M219 HydrophobicContact CG-CE 4.46Å; Y99-M219 HydrophobicContact CG-CG 4.1Å; E215-M219 HydrophobicContact CG-CG 4.22Å; E215-M219 WeakPolarHBondContact O-CB 3.4Å; E215-M219 VanDerWaalsContact O-CG 3.23Å; E215-M219 WeakPolarHBondContact O-CG 3.41Å; E215-M219 PolarHBondContact O-N 3.42Å; Y216-M219 PolarHBondContact O-N 2.85Å; M219-G221 VanDerWaalsContact C-N 3.3Å; M219-G221 PolarHBondContact O-N 3.23Å; M219-I222 PolarHBondContact O-N 3.42Å; M219-F223 HydrophobicContact CE-CD2 4.27Å; M219-F223 HydrophobicContact CE-CE2 3.54Å; M219-F223 HydrophobicContact CE-CZ 4.28Å; M219-F223 WeakPolarHBondContact O-CD2 3.36Å; M219-F223 PolarHBondContact O-N 2.75Å |
| 220 | I | 97.3 | Very high | 95.8 | Very high | 0 Ų | 0 | 29.8 Ų | 29.8 | 0% | 0 | 15% | 0.146 | C | C | . | . | H | α-helix | trans | -65 | -36.4 | 174.1 | -161.7 | 75 | 0 | 0 | 0 | 110.9 | Y68 L102 A103 Y216 L217 G224 | Y68-I220 HydrophobicContact CE1-CG1 4.37Å; L102-I220 HydrophobicContact CB-CD1 4.44Å; L102-I220 HydrophobicContact CD2-CD1 3.93Å; L102-I220 HydrophobicContact CG-CD1 3.75Å; A103-I220 HydrophobicContact CB-CD1 3.85Å; Y216-I220 HydrophobicContact CD1-CG2 4.45Å; Y216-I220 HydrophobicContact CE1-CG2 4.13Å; Y216-I220 WeakPolarHBondContact O-CB 3.18Å; Y216-I220 WeakPolarHBondContact O-CG2 3.37Å; Y216-I220 PolarHBondContact O-N 2.97Å; L217-I220 WeakPolarHBondContact O-CG2 3.4Å; I220-G224 VanDerWaalsContact O-CA 3.23Å; I220-G224 WeakPolarHBondContact O-CA 3.46Å; I220-G224 PolarHBondContact O-N 2.77Å |
| 221 | G | 97.7 | Very high | 95.8 | Very high | 0 Ų | 0 | 26.9 Ų | 26.9 | 0% | 0 | 13% | 0.131 | C | C | . | . | H | α-helix | trans | -60.4 | -53.8 | 173.2 | 0 | 0 | 0 | 0 | 0 | 111.7 | L217 G218 M219 S225 | L217-G221 PolarHBondContact O-N 3.49Å; L217-G221 VanDerWaalsContact O-N 3.07Å; G218-G221 PolarHBondContact O-N 3.43Å; M219-G221 VanDerWaalsContact C-N 3.3Å; M219-G221 PolarHBondContact O-N 3.23Å; G221-S225 VanDerWaalsContact O-CB 3.3Å; G221-S225 WeakPolarHBondContact O-CB 3.22Å; G221-S225 PolarHBondContact O-N 2.98Å; G221-S225 PolarHBondContact O-OG 3.46Å |
| 222 | I | 97.8 | Very high | 95.8 | Very high | 37 Ų | 37 | 28.4 Ų | 28.4 | 19% | 0.19 | 14% | 0.139 | C | C | . | . | H | α-helix | trans | -58.7 | -54.7 | -178.6 | -68.2 | 161.5 | 0 | 0 | 0 | 111.5 | M72 L88 G218 M219 F226 | M72-I222 HydrophobicContact CG-CB 4.43Å; M72-I222 HydrophobicContact CG-CG1 3.75Å; M72-I222 HydrophobicContact SD-CG1 4.46Å; L88-I222 HydrophobicContact CD1-CD1 4.06Å; G218-I222 WeakPolarHBondContact O-CD1 3.38Å; G218-I222 VanDerWaalsContact O-CG1 3.26Å; G218-I222 WeakPolarHBondContact O-CG1 3.42Å; G218-I222 PolarHBondContact O-N 3.34Å; M219-I222 PolarHBondContact O-N 3.42Å; I222-F226 PolarHBondContact O-N 3.41Å |
| 223 | F | 98.1 | Very high | 95.7 | Very high | 17 Ų | 17 | 33.1 Ų | 33.1 | 8% | 0.075 | 16% | 0.155 | C | C | . | . | H | α-helix | trans | -71.3 | -38.4 | -177.8 | -72 | -56.8 | 0 | 0 | 0 | 112.2 | F92 G96 F100 A103 M219 S225 F226 I227 | F92-F223 HydrophobicContact CD2-CE2 4.45Å; F92-F223 AromaticContact CD2-CZ 3.88Å; F92-F223 HydrophobicContact CD2-CZ 3.88Å; F92-F223 HydrophobicContact CE1-CZ 4.24Å; F92-F223 HydrophobicContact CE2-CD1 4.49Å; F92-F223 AromaticContact CE2-CE1 3.46Å; F92-F223 HydrophobicContact CE2-CE1 3.46Å; F92-F223 VanDerWaalsContact CE2-CE1 3.46Å; F92-F223 HydrophobicContact CE2-CE2 4.04Å; F92-F223 AromaticContact CE2-CZ 3.18Å; F92-F223 HydrophobicContact CE2-CZ 3.18Å; F92-F223 AromaticContact CZ-CE1 3.45Å; F92-F223 HydrophobicContact CZ-CE1 3.45Å; F92-F223 VanDerWaalsContact CZ-CE1 3.45Å; F92-F223 AromaticContact CZ-CZ 3.41Å; F92-F223 HydrophobicContact CZ-CZ 3.41Å; F92-F223 VanDerWaalsContact CZ-CZ 3.41Å; G96-F223 WeakPolarHBondContact O-CE2 3.28Å; G96-F223 WeakPolarHBondContact O-CZ 3.34Å; F100-F223 HydrophobicContact CB-CD1 4.16Å; F100-F223 HydrophobicContact CB-CD2 4.26Å; F100-F223 HydrophobicContact CB-CE1 4.08Å; F100-F223 HydrophobicContact CB-CE2 4.18Å; F100-F223 HydrophobicContact CB-CG 4.24Å; F100-F223 HydrophobicContact CB-CZ 4.08Å; F100-F223 AromaticContact CD2-CD1 3.61Å; F100-F223 HydrophobicContact CD2-CD1 3.61Å; F100-F223 AromaticContact CD2-CE1 3.91Å; F100-F223 HydrophobicContact CD2-CE1 3.91Å; F100-F223 HydrophobicContact CD2-CG 4.2Å; F100-F223 HydrophobicContact CG-CD1 4.38Å; F100-F223 HydrophobicContact CG-CE1 4.45Å; A103-F223 HydrophobicContact CB-CB 3.53Å; M219-F223 HydrophobicContact CE-CD2 4.27Å; M219-F223 HydrophobicContact CE-CE2 3.54Å; M219-F223 HydrophobicContact CE-CZ 4.28Å; M219-F223 WeakPolarHBondContact O-CD2 3.36Å; M219-F223 PolarHBondContact O-N 2.75Å; F223-S225 PolarHBondContact O-N 2.9Å; F223-F226 PolarHBondContact O-N 3.41Å; F223-I227 VanDerWaalsContact O-CG1 3.3Å; F223-I227 WeakPolarHBondContact O-CG1 3.34Å; F223-I227 PolarHBondContact O-N 3.14Å |
| 224 | G | 97.5 | Very high | 95.4 | Very high | 0 Ų | 0 | 31.3 Ų | 31.3 | 0% | 0 | 15% | 0.153 | C | C | . | . | H | α-helix | trans | -60.8 | -43.7 | 176 | 0 | 0 | 0 | 0 | 0 | 111.6 | I220 F226 I227 S228 | I220-G224 VanDerWaalsContact O-CA 3.23Å; I220-G224 WeakPolarHBondContact O-CA 3.46Å; I220-G224 PolarHBondContact O-N 2.77Å; G224-F226 VanDerWaalsContact C-N 3.34Å; G224-F226 PolarHBondContact O-N 3.29Å; G224-I227 PolarHBondContact O-N 2.93Å; G224-S228 WeakPolarHBondContact O-CB 3.23Å; G224-S228 PolarHBondContact O-N 2.91Å; G224-S228 PolarHBondContact O-OG 3.01Å |
| 225 | S | 97 | Very high | 94.8 | Very high | 6 Ų | 6 | 30.9 Ų | 30.9 | 4% | 0.042 | 15% | 0.154 | C | C | . | . | H | α-helix | trans | -61.1 | -42.2 | 174.8 | -67.8 | 0 | 0 | 0 | 0 | 112.3 | F65 Y68 F69 G221 F223 S228 G229 | F65-S225 WeakPolarHBondContact CD2-O 3.34Å; F65-S225 WeakPolarHBondContact CE2-O 3.24Å; Y68-S225 PolarHBondContact O-OG 2.85Å; Y68-S225 VanDerWaalsContact O-OG 3.08Å; F69-S225 WeakPolarHBondContact CA-OG 3.17Å; F69-S225 PolarHBondContact N-OG 3.41Å; G221-S225 VanDerWaalsContact O-CB 3.3Å; G221-S225 WeakPolarHBondContact O-CB 3.22Å; G221-S225 PolarHBondContact O-N 2.98Å; G221-S225 PolarHBondContact O-OG 3.46Å; F223-S225 PolarHBondContact O-N 2.9Å; S225-S228 PolarHBondContact O-OG 2.98Å; S225-G229 WeakPolarHBondContact O-CA 3.44Å; S225-G229 PolarHBondContact O-N 3.42Å |
| 226 | F | 97.3 | Very high | 94 | Very high | 127 Ų | 127 | 35.6 Ų | 35.6 | 56% | 0.557 | 17% | 0.172 | S | C | * | . | H | α-helix | trans | -63.7 | -51 | 178.9 | -179.7 | -105.4 | 0 | 0 | 0 | 111.5 | I222 F223 G224 G229 I230 | I222-F226 PolarHBondContact O-N 3.41Å; F223-F226 PolarHBondContact O-N 3.41Å; G224-F226 VanDerWaalsContact C-N 3.34Å; G224-F226 PolarHBondContact O-N 3.29Å; F226-G229 PolarHBondContact O-N 3.02Å; F226-I230 HydrophobicContact CD1-CD1 4.07Å; F226-I230 HydrophobicContact CE1-CD1 3.58Å; F226-I230 HydrophobicContact CE2-CD1 4.27Å; F226-I230 HydrophobicContact CZ-CD1 3.71Å; F226-I230 WeakPolarHBondContact O-CG1 3.48Å; F226-I230 PolarHBondContact O-N 3.47Å |
| 227 | I | 97.1 | Very high | 93.3 | Very high | 12 Ų | 12 | 39.4 Ų | 39.4 | 6% | 0.062 | 20% | 0.196 | C | C | . | . | H | α-helix | trans | -68.3 | -48.7 | -177.1 | -62.3 | 168.3 | 0 | 0 | 0 | 110.9 | F100 A103 L104 V107 F223 G224 G229 I230 Q231 | F100-I227 HydrophobicContact CD2-CD1 4.26Å; F100-I227 HydrophobicContact CE2-CD1 3.99Å; F100-I227 HydrophobicContact CE2-CG1 4.22Å; A103-I227 HydrophobicContact CB-CD1 3.93Å; L104-I227 HydrophobicContact CB-CD1 3.91Å; L104-I227 HydrophobicContact CD1-CD1 4.21Å; L104-I227 HydrophobicContact CD1-CG2 3.95Å; V107-I227 HydrophobicContact CB-CG2 4.11Å; V107-I227 HydrophobicContact CG1-CG2 3.91Å; V107-I227 HydrophobicContact CG2-CB 4.49Å; V107-I227 HydrophobicContact CG2-CG2 4.38Å; F223-I227 VanDerWaalsContact O-CG1 3.3Å; F223-I227 WeakPolarHBondContact O-CG1 3.34Å; F223-I227 PolarHBondContact O-N 3.14Å; G224-I227 PolarHBondContact O-N 2.93Å; I227-G229 PolarHBondContact O-N 3.21Å; I227-I230 WeakPolarHBondContact O-CB 3.38Å; I227-I230 PolarHBondContact O-N 3.36Å; I227-I230 VanDerWaalsContact O-N 3.16Å; I227-Q231 PolarHBondContact O-N 3.32Å |
| 228 | S | 95 | Very high | 92.4 | Very high | 0 Ų | 0 | 45.3 Ų | 45.3 | 0% | 0 | 23% | 0.226 | C | C | . | . | H | α-helix | trans | -65.3 | -29 | 177.2 | 61.9 | 0 | 0 | 0 | 0 | 112.5 | F65 G224 S225 Q231 L232 | F65-S228 WeakPolarHBondContact CA-OG 3.42Å; G224-S228 WeakPolarHBondContact O-CB 3.23Å; G224-S228 PolarHBondContact O-N 2.91Å; G224-S228 PolarHBondContact O-OG 3.01Å; S225-S228 PolarHBondContact O-OG 2.98Å; S228-Q231 PolarHBondContact O-N 3.15Å; S228-L232 VanDerWaalsContact O-CB 3.27Å; S228-L232 WeakPolarHBondContact O-CB 3.23Å; S228-L232 PolarHBondContact O-N 2.8Å |
| 229 | G | 94.2 | Very high | 91 | Very high | 21 Ų | 21 | 48.2 Ų | 48.2 | 22% | 0.216 | 25% | 0.247 | C | C | . | . | H | α-helix | trans | -65.5 | -41.9 | 171.8 | 0 | 0 | 0 | 0 | 0 | 112.5 | S225 F226 I227 L232 Y233 | S225-G229 WeakPolarHBondContact O-CA 3.44Å; S225-G229 PolarHBondContact O-N 3.42Å; F226-G229 PolarHBondContact O-N 3.02Å; I227-G229 PolarHBondContact O-N 3.21Å; G229-L232 PolarHBondContact O-N 2.76Å; G229-Y233 PolarHBondContact O-N 3.1Å |
| 230 | I | 94.3 | Very high | 89.3 | Confident | 78 Ų | 78 | 52.3 Ų | 52.3 | 40% | 0.4 | 27% | 0.273 | S | S | . | . | H | α-helix | trans | -63.3 | -47.8 | 172.6 | -67.2 | 166.4 | 0 | 0 | 0 | 110.3 | F226 I227 L232 Y233 I234 | F226-I230 HydrophobicContact CD1-CD1 4.07Å; F226-I230 HydrophobicContact CE1-CD1 3.58Å; F226-I230 HydrophobicContact CE2-CD1 4.27Å; F226-I230 HydrophobicContact CZ-CD1 3.71Å; F226-I230 WeakPolarHBondContact O-CG1 3.48Å; F226-I230 PolarHBondContact O-N 3.47Å; I227-I230 WeakPolarHBondContact O-CB 3.38Å; I227-I230 PolarHBondContact O-N 3.36Å; I227-I230 VanDerWaalsContact O-N 3.16Å; I230-L232 VanDerWaalsContact C-N 3.27Å; I230-L232 PolarHBondContact O-N 3.01Å; I230-Y233 PolarHBondContact O-N 3Å; I230-I234 HydrophobicContact CG2-CD1 3.71Å; I230-I234 HydrophobicContact CG2-CG1 4.33Å; I230-I234 WeakPolarHBondContact O-CG1 3.27Å; I230-I234 PolarHBondContact O-N 2.93Å |
| 231 | Q | 92.9 | Very high | 87.4 | Confident | 27 Ų | 27 | 62 Ų | 62 | 13% | 0.126 | 31% | 0.31 | C | S | . | . | H | α-helix | trans | -58.7 | -40.6 | 176.4 | -73.8 | -169.3 | -15.1 | 0 | 0 | 111.7 | T61 V107 E108 I227 S228 I234 A235 | T61-Q231 HydrophobicContact CG2-CB 3.72Å; V107-Q231 VanDerWaalsContact CG1-CD 3.46Å; V107-Q231 HydrophobicContact CG1-CG 4.43Å; E108-Q231 PolarHBondContact OE1-NE2 3.4Å; E108-Q231 PolarHBondContact OE2-NE2 2.92Å; I227-Q231 PolarHBondContact O-N 3.32Å; S228-Q231 PolarHBondContact O-N 3.15Å; Q231-I234 PolarHBondContact O-N 3.05Å; Q231-A235 WeakPolarHBondContact O-CB 3.35Å; Q231-A235 PolarHBondContact O-N 3.47Å |
| 232 | L | 89.9 | Confident | 85.5 | Confident | 47 Ų | 47 | 64.7 Ų | 64.7 | 25% | 0.246 | 32% | 0.322 | C | S | . | . | H | α-helix | trans | -62.1 | -44.6 | 176.2 | 177.1 | 60.1 | 0 | 0 | 0 | 111.4 | T61 A62 F65 S228 G229 I230 A235 Y236 | T61-L232 HydrophobicContact CG2-CB 4.2Å; A62-L232 HydrophobicContact CB-CD1 3.78Å; A62-L232 HydrophobicContact CB-CD2 4.42Å; F65-L232 HydrophobicContact CB-CD2 4.13Å; F65-L232 HydrophobicContact CD1-CD2 3.99Å; F65-L232 HydrophobicContact CG-CD2 4.07Å; S228-L232 VanDerWaalsContact O-CB 3.27Å; S228-L232 WeakPolarHBondContact O-CB 3.23Å; S228-L232 PolarHBondContact O-N 2.8Å; G229-L232 PolarHBondContact O-N 2.76Å; I230-L232 VanDerWaalsContact C-N 3.27Å; I230-L232 PolarHBondContact O-N 3.01Å; L232-A235 PolarHBondContact O-N 3Å; L232-Y236 VanDerWaalsContact O-CB 3.31Å; L232-Y236 WeakPolarHBondContact O-CB 3.47Å; L232-Y236 PolarHBondContact O-N 3.22Å |
| 233 | Y | 89.9 | Confident | 83.4 | Confident | 159 Ų | 159 | 66.9 Ų | 66.9 | 62% | 0.624 | 33% | 0.334 | S | S | * | . | H | α-helix | trans | -62.3 | -44.7 | 176.3 | 174.5 | -101.5 | 0 | 0 | 0 | 112.4 | G229 I230 Y236 T237 | G229-Y233 PolarHBondContact O-N 3.1Å; I230-Y233 PolarHBondContact O-N 3Å; Y233-Y236 PolarHBondContact O-N 2.79Å; Y233-T237 WeakPolarHBondContact O-CB 3.34Å; Y233-T237 PolarHBondContact O-N 2.68Å; Y233-T237 PolarHBondContact O-OG1 3.15Å |
| 234 | I | 88.8 | Confident | 81.2 | Confident | 79 Ų | 79 | 68.6 Ų | 68.6 | 41% | 0.405 | 35% | 0.348 | S | S | . | . | H | α-helix | trans | -65.1 | -47.4 | 177.4 | -67.4 | 171 | 0 | 0 | 0 | 110.5 | I230 Q231 Y236 T237 I238 | I230-I234 HydrophobicContact CG2-CD1 3.71Å; I230-I234 HydrophobicContact CG2-CG1 4.33Å; I230-I234 WeakPolarHBondContact O-CG1 3.27Å; I230-I234 PolarHBondContact O-N 2.93Å; Q231-I234 PolarHBondContact O-N 3.05Å; I234-Y236 PolarHBondContact O-N 3.41Å; I234-T237 PolarHBondContact O-N 3.49Å; I234-T237 VanDerWaalsContact O-N 3.07Å; I234-I238 HydrophobicContact CG2-CD1 3.45Å; I234-I238 VanDerWaalsContact CG2-CD1 3.45Å; I234-I238 HydrophobicContact CG2-CG1 4.08Å; I234-I238 WeakPolarHBondContact O-CG1 3.34Å; I234-I238 PolarHBondContact O-N 3.44Å |
| 235 | A | 82.8 | Confident | 79.1 | Confident | 31 Ų | 31 | 72.3 Ų | 72.3 | 26% | 0.256 | 36% | 0.364 | S | S | . | . | H | α-helix | trans | -58.4 | -39.9 | 178.4 | 0 | 0 | 0 | 0 | 0 | 111.5 | Q231 L232 S239 | Q231-A235 WeakPolarHBondContact O-CB 3.35Å; Q231-A235 PolarHBondContact O-N 3.47Å; L232-A235 PolarHBondContact O-N 3Å; A235-S239 PolarHBondContact O-N 3.07Å; A235-S239 VanDerWaalsContact O-N 3.08Å |
| 236 | Y | 78.5 | Confident | 76.9 | Confident | 102 Ų | 102 | 74.9 Ų | 74.9 | 40% | 0.4 | 38% | 0.376 | S | S | . | . | H | α-helix | trans | -64.2 | -43.6 | 174 | 171.4 | -123.8 | 0 | 0 | 0 | 112.5 | L232 Y233 I234 S239 L243 | L232-Y236 VanDerWaalsContact O-CB 3.31Å; L232-Y236 WeakPolarHBondContact O-CB 3.47Å; L232-Y236 PolarHBondContact O-N 3.22Å; Y233-Y236 PolarHBondContact O-N 2.79Å; I234-Y236 PolarHBondContact O-N 3.41Å; Y236-S239 CarbonylContact O-C 3.58Å; Y236-L243 HydrophobicContact CD2-CB 3.7Å; Y236-L243 HydrophobicContact CD2-CD1 3.91Å; Y236-L243 HydrophobicContact CD2-CG 4.34Å; Y236-L243 HydrophobicContact CE2-CB 3.21Å; Y236-L243 HydrophobicContact CE2-CD1 3.39Å; Y236-L243 HydrophobicContact CE2-CD2 3.79Å; Y236-L243 HydrophobicContact CE2-CG 3.61Å; Y236-L243 WeakPolarHBondContact OH-CD2 3.34Å |
| 237 | T | 82.3 | Confident | 74.6 | Confident | 80 Ų | 80 | 70.7 Ų | 70.7 | 49% | 0.491 | 37% | 0.369 | S | S | . | . | H | α-helix | trans | -70.2 | -43.1 | -177.9 | -54.7 | 0 | 0 | 0 | 0 | 112.4 | Y233 I234 | Y233-T237 WeakPolarHBondContact O-CB 3.34Å; Y233-T237 PolarHBondContact O-N 2.68Å; Y233-T237 PolarHBondContact O-OG1 3.15Å; I234-T237 PolarHBondContact O-N 3.49Å; I234-T237 VanDerWaalsContact O-N 3.07Å |
| 238 | I | 77.9 | Confident | 72.4 | Confident | 129 Ų | 129 | 76.2 Ų | 76.2 | 66% | 0.662 | 39% | 0.392 | S | S | * | . | H | α-helix | trans | -72.6 | -40.1 | -178.9 | -64.7 | 176.1 | 0 | 0 | 0 | 111.3 | I234 P240 | I234-I238 HydrophobicContact CG2-CD1 3.45Å; I234-I238 VanDerWaalsContact CG2-CD1 3.45Å; I234-I238 HydrophobicContact CG2-CG1 4.08Å; I234-I238 WeakPolarHBondContact O-CG1 3.34Å; I234-I238 PolarHBondContact O-N 3.44Å; I238-P240 VanDerWaalsContact C-CD 3.43Å; I238-P240 VanDerWaalsContact O-CD 3.23Å; I238-P240 WeakPolarHBondContact O-CD 3.48Å |
| 239 | S | 68.9 | Low | 70.3 | Confident | 61 Ų | 61 | 76.6 Ų | 76.6 | 43% | 0.427 | 40% | 0.395 | S | S | . | . | trans | -116.2 | 77 | 179.4 | -83.2 | 0 | 0 | 0 | 0 | 110.7 | A235 Y236 R241 Q242 | A235-S239 PolarHBondContact O-N 3.07Å; A235-S239 VanDerWaalsContact O-N 3.08Å; Y236-S239 CarbonylContact O-C 3.58Å; S239-R241 PolarHBondContact O-N 3.37Å; S239-Q242 VanDerWaalsContact O-CB 3.22Å; S239-Q242 WeakPolarHBondContact O-CB 3.34Å; S239-Q242 PolarHBondContact O-N 3.44Å | ||
| 240 | P | 59.8 | Low | 68.2 | Low | 86 Ų | 86 | 81.1 Ų | 81.1 | 56% | 0.558 | 41% | 0.414 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -60.5 | -17.5 | 176.4 | 23.1 | -32.2 | 0 | 0 | 0 | 112.6 | I238 Q242 L243 S244 | I238-P240 VanDerWaalsContact C-CD 3.43Å; I238-P240 VanDerWaalsContact O-CD 3.23Å; I238-P240 WeakPolarHBondContact O-CD 3.48Å; P240-Q242 PolarHBondContact O-N 3.42Å; P240-L243 PolarHBondContact O-N 2.92Å; P240-S244 PolarHBondContact O-N 2.97Å |
| 241 | R | 58.9 | Low | 65.9 | Low | 204 Ų | 204 | 86.4 Ų | 86.4 | 77% | 0.77 | 43% | 0.429 | S | S | * | . | H | α-helix | trans | -56.7 | -28.9 | 168.7 | -70.9 | -175.6 | 178.5 | 162.9 | 0.3 | 112.7 | S239 S244 K245 | S239-R241 PolarHBondContact O-N 3.37Å; R241-S244 PolarHBondContact O-N 3.4Å; R241-S244 PolarHBondContact O-OG 3.33Å; R241-K245 PolarHBondContact O-N 3.11Å |
| 242 | Q | 57.7 | Low | 63.7 | Low | 56 Ų | 56 | 88.1 Ų | 88.1 | 26% | 0.262 | 44% | 0.442 | S | S | . | . | H | α-helix | trans | -61.9 | -43.3 | 177.3 | -75 | -72.6 | 13.1 | 0 | 0 | 112.2 | Q58 S239 P240 K245 M246 | Q58-Q242 PolarHBondContact O-NE2 2.75Å; Q58-Q242 PolarHBondContact O-OE1 3.08Å; S239-Q242 VanDerWaalsContact O-CB 3.22Å; S239-Q242 WeakPolarHBondContact O-CB 3.34Å; S239-Q242 PolarHBondContact O-N 3.44Å; P240-Q242 PolarHBondContact O-N 3.42Å; Q242-K245 WeakPolarHBondContact O-CB 3.3Å; Q242-K245 PolarHBondContact O-N 3.17Å; Q242-K245 VanDerWaalsContact O-N 3.15Å; Q242-M246 WeakPolarHBondContact O-CB 3.06Å; Q242-M246 PolarHBondContact O-N 3.48Å |
| 243 | L | 52.8 | Low | 61.9 | Low | 82 Ų | 82 | 91.2 Ų | 91.2 | 43% | 0.429 | 46% | 0.458 | S | S | . | . | H | α-helix | trans | -74.1 | -28.6 | 176.8 | -166.4 | 102.8 | 0 | 0 | 0 | 112.4 | Y236 P240 K245 M246 G247 | Y236-L243 HydrophobicContact CD2-CB 3.7Å; Y236-L243 HydrophobicContact CD2-CD1 3.91Å; Y236-L243 HydrophobicContact CD2-CG 4.34Å; Y236-L243 HydrophobicContact CE2-CB 3.21Å; Y236-L243 HydrophobicContact CE2-CD1 3.39Å; Y236-L243 HydrophobicContact CE2-CD2 3.79Å; Y236-L243 HydrophobicContact CE2-CG 3.61Å; Y236-L243 WeakPolarHBondContact OH-CD2 3.34Å; P240-L243 PolarHBondContact O-N 2.92Å; L243-K245 PolarHBondContact O-N 2.97Å; L243-M246 PolarHBondContact O-N 3.41Å; L243-G247 WeakPolarHBondContact O-CA 3.48Å; L243-G247 PolarHBondContact O-N 3.2Å |
| 244 | S | 51.9 | Low | 60.1 | Low | 54 Ų | 54 | 86.2 Ų | 86.2 | 38% | 0.378 | 46% | 0.455 | S | S | . | . | H | α-helix | trans | -62.7 | -35.7 | 169 | 92.4 | 0 | 0 | 0 | 0 | 111.4 | P240 R241 K248 | P240-S244 PolarHBondContact O-N 2.97Å; R241-S244 PolarHBondContact O-N 3.4Å; R241-S244 PolarHBondContact O-OG 3.33Å; S244-K248 WeakPolarHBondContact O-CB 3.38Å; S244-K248 WeakPolarHBondContact O-CD 3.34Å; S244-K248 WeakPolarHBondContact O-CG 3.29Å; S244-K248 PolarHBondContact O-N 3.27Å |
| 245 | K | 52.5 | Low | 57.9 | Low | 77 Ų | 77 | 88.6 Ų | 88.6 | 34% | 0.335 | 48% | 0.475 | S | S | . | . | H | α-helix | trans | -73.9 | -44.3 | 175.7 | -72.8 | -179.6 | 176.1 | 179.1 | 0 | 111.4 | R241 Q242 L243 K248 S249 | R241-K245 PolarHBondContact O-N 3.11Å; Q242-K245 WeakPolarHBondContact O-CB 3.3Å; Q242-K245 PolarHBondContact O-N 3.17Å; Q242-K245 VanDerWaalsContact O-N 3.15Å; L243-K245 PolarHBondContact O-N 2.97Å; K245-K248 CarbonylContact O-C 3.59Å; K245-K248 PolarHBondContact O-N 3.24Å; K245-S249 PolarHBondContact O-N 3.46Å |
| 246 | M | 51.1 | Low | 56.2 | Low | 60 Ų | 60 | 94.8 Ų | 94.8 | 30% | 0.296 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -62.8 | -45.6 | 176.4 | -163.4 | 178.7 | -70.1 | 0 | 0 | 112.1 | F57 A59 A62 Q242 L243 S249 L250 | F57-M246 HydrophobicContact CD2-CG 4.24Å; F57-M246 HydrophobicContact CE2-CE 3.82Å; F57-M246 HydrophobicContact CE2-CG 3.75Å; F57-M246 HydrophobicContact CE2-SD 4.23Å; F57-M246 HydrophobicContact CZ-CE 4.02Å; A59-M246 HydrophobicContact CB-CE 3.71Å; A62-M246 HydrophobicContact CB-CE 4.31Å; Q242-M246 WeakPolarHBondContact O-CB 3.06Å; Q242-M246 PolarHBondContact O-N 3.48Å; L243-M246 PolarHBondContact O-N 3.41Å; M246-S249 WeakPolarHBondContact O-CB 3.21Å; M246-S249 PolarHBondContact O-N 2.88Å; M246-L250 PolarHBondContact O-N 2.87Å |
| 247 | G | 50.5 | Low | 55 | Low | 39 Ų | 39 | 94.9 Ų | 94.9 | 40% | 0.402 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -71.9 | -26.4 | 175.3 | 0 | 0 | 0 | 0 | 0 | 113.9 | L243 | L243-G247 WeakPolarHBondContact O-CA 3.48Å; L243-G247 PolarHBondContact O-N 3.2Å |
| 248 | K | 50.1 | Low | 53.1 | Low | 128 Ų | 128 | 101.4 Ų | 101.4 | 56% | 0.557 | 53% | 0.532 | S | S | * | . | H | α-helix | trans | -75.6 | -27.5 | 168.1 | -79.7 | 171.4 | -177.1 | 177.6 | 0 | 112.3 | S244 K245 L250 R251 | S244-K248 WeakPolarHBondContact O-CB 3.38Å; S244-K248 WeakPolarHBondContact O-CD 3.34Å; S244-K248 WeakPolarHBondContact O-CG 3.29Å; S244-K248 PolarHBondContact O-N 3.27Å; K245-K248 CarbonylContact O-C 3.59Å; K245-K248 PolarHBondContact O-N 3.24Å; K248-L250 PolarHBondContact O-N 2.91Å; K248-R251 CarbonylContact O-C 3.48Å; K248-R251 PolarHBondContact O-N 3.39Å |
| 249 | S | 50.7 | Low | 51.8 | Low | 9 Ų | 9 | 106.4 Ų | 106.4 | 6% | 0.063 | 54% | 0.542 | C | S | . | . | H | α-helix | trans | -64.8 | -26.1 | 172.6 | -168.4 | 0 | 0 | 0 | 0 | 112.3 | Y55 K245 M246 | Y55-S249 PolarHBondContact O-OG 3.42Å; K245-S249 PolarHBondContact O-N 3.46Å; M246-S249 WeakPolarHBondContact O-CB 3.21Å; M246-S249 PolarHBondContact O-N 2.88Å |
| 250 | L | 51.2 | Low | 51 | Low | 115 Ų | 115 | 107.2 Ų | 107.2 | 60% | 0.602 | 55% | 0.545 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -82.6 | -9.8 | 170.4 | -92.3 | 92.8 | 0 | 0 | 0 | 114 | M246 K248 | M246-L250 PolarHBondContact O-N 2.87Å; K248-L250 PolarHBondContact O-N 2.91Å |
| 251 | R | 45.5 | Very low | 50.5 | Low | 189 Ų | 189 | 109.9 Ų | 109.9 | 71% | 0.713 | 56% | 0.564 | S | S | * | * | S | Bend | trans | -102.6 | 141 | 173.1 | -66.2 | -165 | -147.6 | -140.9 | 5.7 | 109.9 | K248 I253 | K248-R251 CarbonylContact O-C 3.48Å; K248-R251 PolarHBondContact O-N 3.39Å; R251-I253 PolarHBondContact O-N 3.26Å |
| 252 | P | 45.3 | Very low | 50.5 | Low | 64 Ų | 64 | 103.2 Ų | 103.2 | 42% | 0.416 | 54% | 0.543 | S | S | . | . | trans | -66.6 | 113.2 | 177.2 | 29.1 | -31.1 | 0 | 0 | 0 | 108.4 | K267 A268 | P252-K267 HydrophobicContact CB-CB 4.46Å; P252-A268 HydrophobicContact CB-CB 4.17Å; P252-A268 HydrophobicContact CG-CB 3.77Å | ||
| 253 | I | 53.7 | Low | 50.5 | Low | 111 Ų | 111 | 104.6 Ų | 104.6 | 57% | 0.569 | 56% | 0.557 | S | S | * | * | trans | -67.9 | 136.1 | 177.8 | -61.6 | 173 | 0 | 0 | 0 | 108.8 | R251 | R251-I253 PolarHBondContact O-N 3.26Š| ||
| 254 | G | 51.4 | Low | 50.7 | Low | 54 Ų | 54 | 107.3 Ų | 107.3 | 56% | 0.557 | 57% | 0.571 | S | S | * | * | trans | -63.5 | -170.2 | -171.3 | 0 | 0 | 0 | 0 | 0 | 117.3 | N256 | G254-N256 PolarHBondContact O-N 3.47Å; G254-N256 VanDerWaalsContact O-N 3.16Å | ||
| 255 | P | 43.2 | Very low | 51.2 | Low | 130 Ų | 130 | 109.8 Ų | 109.8 | 84% | 0.844 | 59% | 0.586 | S | S | * | * | S | Bend | trans | -87.5 | 93.8 | -137.9 | 34.6 | -34.7 | 0 | 0 | 0 | 112.4 | ||
| 256 | N | 46.8 | Very low | 51.9 | Low | 161 Ų | 161 | 111.2 Ų | 111.2 | 86% | 0.861 | 60% | 0.596 | S | S | * | * | trans | -134.8 | 20.4 | 163.5 | -102.6 | -55.9 | 0 | 0 | 0 | 114.6 | G254 | G254-N256 PolarHBondContact O-N 3.47Å; G254-N256 VanDerWaalsContact O-N 3.16Å | ||
| 257 | I | 51.8 | Low | 52.7 | Low | 103 Ų | 103 | 110.7 Ų | 110.7 | 53% | 0.528 | 59% | 0.592 | S | S | . | * | trans | -130.5 | 85.7 | 174.4 | -55.3 | 177.5 | 0 | 0 | 0 | 109.4 | R259 | I257-R259 PolarHBondContact O-N 3Å; I257-R259 VanDerWaalsContact O-N 3.14Å | ||
| 258 | K | 43.4 | Very low | 53.4 | Low | 217 Ų | 217 | 110.1 Ų | 110.1 | 94% | 0.943 | 58% | 0.584 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -70.8 | 17.8 | 170.6 | -79.3 | -171 | 175.5 | -178.1 | 0 | 114 | ||
| 259 | R | 49.8 | Very low | 54.7 | Low | 234 Ų | 234 | 107.7 Ų | 107.7 | 88% | 0.883 | 58% | 0.581 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -122.9 | 10.9 | -170.3 | -91.4 | -157.5 | -89.2 | -165.8 | -4.9 | 117.8 | I257 | I257-R259 PolarHBondContact O-N 3Å; I257-R259 VanDerWaalsContact O-N 3.14Å |
| 260 | V | 52.1 | Low | 56 | Low | 78 Ų | 78 | 111 Ų | 111 | 47% | 0.473 | 60% | 0.598 | S | S | . | * | trans | -130.9 | 108.1 | 173.4 | -176.9 | 0 | 0 | 0 | 0 | 110.3 | I262 | V260-I262 HydrophobicContact CG1-CB 4.32Å; V260-I262 HydrophobicContact CG1-CD1 3.43Å; V260-I262 VanDerWaalsContact CG1-CD1 3.43Å; V260-I262 HydrophobicContact CG1-CG1 3.63Å; V260-I262 PolarHBondContact O-N 2.88Å | ||
| 261 | C | 51 | Low | 57 | Low | 143 Ų | 143 | 109.7 Ų | 109.7 | 97% | 0.966 | 59% | 0.586 | S | S | * | * | trans | -73.4 | 73.6 | 173.5 | -70.2 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 262 | I | 58.8 | Low | 58.5 | Low | 63 Ų | 63 | 102 Ų | 102 | 32% | 0.323 | 56% | 0.563 | S | S | . | * | trans | -120.5 | 135.5 | 167.5 | -65.5 | 168.8 | 0 | 0 | 0 | 107.3 | V260 L264 L266 K267 L270 | V260-I262 HydrophobicContact CG1-CB 4.32Å; V260-I262 HydrophobicContact CG1-CD1 3.43Å; V260-I262 VanDerWaalsContact CG1-CD1 3.43Å; V260-I262 HydrophobicContact CG1-CG1 3.63Å; V260-I262 PolarHBondContact O-N 2.88Å; I262-L264 PolarHBondContact O-N 3.46Å; I262-L266 HydrophobicContact CG2-CB 4.12Å; I262-K267 HydrophobicContact CG2-CG 4.38Å; I262-K267 WeakPolarHBondContact O-CE 3.15Å; I262-L270 HydrophobicContact CD1-CD2 4.32Å | ||
| 263 | P | 56.4 | Low | 60.3 | Low | 85 Ų | 85 | 105.5 Ų | 105.5 | 55% | 0.552 | 57% | 0.572 | S | S | * | * | trans | -57.9 | 135.7 | 178.1 | 21.5 | -31.6 | 0 | 0 | 0 | 111.4 | L266 | P263-L266 PolarHBondContact O-N 2.92Å; P263-L266 VanDerWaalsContact O-N 3.09Å | ||
| 264 | L | 57.9 | Low | 61.9 | Low | 140 Ų | 140 | 103.2 Ų | 103.2 | 73% | 0.733 | 56% | 0.56 | S | S | * | * | H | α-helix | trans | -46.5 | -39.9 | -175.7 | -143.5 | 73.4 | 0 | 0 | 0 | 115.8 | I262 L266 K267 | I262-L264 PolarHBondContact O-N 3.46Å; L264-L266 VanDerWaalsContact C-N 3.32Å; L264-L266 PolarHBondContact O-N 3.34Å; L264-K267 PolarHBondContact O-N 2.79Å |
| 265 | P | 62.5 | Low | 63.2 | Low | 106 Ų | 106 | 101.2 Ų | 101.2 | 69% | 0.688 | 54% | 0.538 | S | S | * | . | H | α-helix | trans | -70.9 | -19.2 | -179 | 26.6 | -35.7 | 0 | 0 | 0 | 114.9 | P269 | P265-P269 WeakPolarHBondContact O-CD 3.38Å |
| 266 | L | 67.3 | Low | 65.1 | Low | 106 Ų | 106 | 97.6 Ų | 97.6 | 56% | 0.555 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -87 | -14.4 | 177.7 | -100.4 | 91.3 | 0 | 0 | 0 | 113.9 | I262 P263 L264 P269 L270 | I262-L266 HydrophobicContact CG2-CB 4.12Å; P263-L266 PolarHBondContact O-N 2.92Å; P263-L266 VanDerWaalsContact O-N 3.09Å; L264-L266 VanDerWaalsContact C-N 3.32Å; L264-L266 PolarHBondContact O-N 3.34Å; L266-P269 WeakPolarHBondContact O-CD 3.3Å; L266-P269 WeakPolarHBondContact O-CG 3.09Å; L266-L270 WeakPolarHBondContact O-CB 3.48Å; L266-L270 PolarHBondContact O-N 2.85Å |
| 267 | K | 66.5 | Low | 67.1 | Low | 49 Ų | 49 | 94.1 Ų | 94.1 | 21% | 0.213 | 50% | 0.499 | C | S | . | . | H | α-helix | trans | -66.2 | -44.4 | -175.1 | -68.2 | -173.1 | 179.9 | -177.9 | 0 | 111.8 | P252 I262 L264 L270 Y271 | P252-K267 HydrophobicContact CB-CB 4.46Å; I262-K267 HydrophobicContact CG2-CG 4.38Å; I262-K267 WeakPolarHBondContact O-CE 3.15Å; L264-K267 PolarHBondContact O-N 2.79Å; K267-L270 PolarHBondContact O-N 3.35Å; K267-Y271 HydrophobicContact CB-CD2 4.34Å; K267-Y271 HydrophobicContact CB-CE2 4.11Å; K267-Y271 WeakPolarHBondContact O-CD2 3.41Å; K267-Y271 PolarHBondContact O-N 3.35Å |
| 268 | A | 66.8 | Low | 68.9 | Low | 27 Ų | 27 | 90.9 Ų | 90.9 | 22% | 0.223 | 48% | 0.483 | C | S | . | . | H | α-helix | trans | -58.1 | -55.1 | -179.4 | 0 | 0 | 0 | 0 | 0 | 114.1 | P252 L270 Y271 A272 | P252-A268 HydrophobicContact CB-CB 4.17Å; P252-A268 HydrophobicContact CG-CB 3.77Å; A268-L270 VanDerWaalsContact C-N 3.26Å; A268-L270 PolarHBondContact O-N 3.16Å; A268-Y271 PolarHBondContact O-N 2.95Å; A268-A272 PolarHBondContact O-N 2.95Å |
| 269 | P | 76 | Confident | 71 | Confident | 77 Ų | 77 | 82.6 Ų | 82.6 | 50% | 0.5 | 45% | 0.449 | S | S | . | . | H | α-helix | trans | -64 | -33.7 | 179.3 | 24.9 | -34.5 | 0 | 0 | 0 | 112 | P265 L266 F273 | P265-P269 WeakPolarHBondContact O-CD 3.38Å; L266-P269 WeakPolarHBondContact O-CD 3.3Å; L266-P269 WeakPolarHBondContact O-CG 3.09Å; P269-F273 WeakPolarHBondContact O-CB 3.44Å; P269-F273 PolarHBondContact O-N 3.45Å |
| 270 | L | 79.4 | Confident | 72.9 | Confident | 78 Ų | 78 | 75.7 Ų | 75.7 | 41% | 0.408 | 43% | 0.429 | S | S | . | . | H | α-helix | trans | -63.7 | -46.3 | 176.2 | -176.5 | 65.8 | 0 | 0 | 0 | 112 | I262 L266 K267 A268 F273 L274 | I262-L270 HydrophobicContact CD1-CD2 4.32Å; L266-L270 WeakPolarHBondContact O-CB 3.48Å; L266-L270 PolarHBondContact O-N 2.85Å; K267-L270 PolarHBondContact O-N 3.35Å; A268-L270 VanDerWaalsContact C-N 3.26Å; A268-L270 PolarHBondContact O-N 3.16Å; L270-F273 PolarHBondContact O-N 3.07Å; L270-L274 HydrophobicContact CD1-CD1 4.13Å; L270-L274 HydrophobicContact CG-CD1 3.81Å; L270-L274 WeakPolarHBondContact O-CB 3.49Å; L270-L274 WeakPolarHBondContact O-CD1 3.49Å; L270-L274 WeakPolarHBondContact O-CG 3.26Å; L270-L274 PolarHBondContact O-N 3.48Å |
| 271 | Y | 71.6 | Confident | 74.9 | Confident | 89 Ų | 89 | 74.6 Ų | 74.6 | 35% | 0.349 | 42% | 0.423 | S | S | . | . | H | α-helix | trans | -64.3 | -43.5 | 177.1 | -76.8 | -70 | 0 | 0 | 0 | 112.2 | Y55 K267 A268 F273 L274 S275 | Y55-Y271 HydrophobicContact CD1-CD1 4.33Å; Y55-Y271 AromaticContact CE1-CD1 3.74Å; Y55-Y271 HydrophobicContact CE1-CD1 3.74Å; K267-Y271 HydrophobicContact CB-CD2 4.34Å; K267-Y271 HydrophobicContact CB-CE2 4.11Å; K267-Y271 WeakPolarHBondContact O-CD2 3.41Å; K267-Y271 PolarHBondContact O-N 3.35Å; A268-Y271 PolarHBondContact O-N 2.95Å; Y271-F273 VanDerWaalsContact C-N 3.32Å; Y271-F273 PolarHBondContact O-N 3.37Å; Y271-L274 PolarHBondContact O-N 3.23Å; Y271-S275 WeakPolarHBondContact O-CB 3.42Å; Y271-S275 PolarHBondContact O-N 3.48Å; Y271-S275 PolarHBondContact O-OG 3.08Å |
| 272 | A | 76.6 | Confident | 76.9 | Confident | 28 Ų | 28 | 68.6 Ų | 68.6 | 23% | 0.231 | 38% | 0.38 | C | S | . | . | H | α-helix | trans | -59.8 | -45.3 | 175.4 | 0 | 0 | 0 | 0 | 0 | 110.9 | A268 S275 A276 | A268-A272 PolarHBondContact O-N 2.95Å; A272-S275 PolarHBondContact O-N 2.86Å; A272-S275 PolarHBondContact O-OG 2.99Å; A272-A276 WeakPolarHBondContact O-CB 3.08Å; A272-A276 PolarHBondContact O-N 2.95Å |
| 273 | F | 84.2 | Confident | 78.5 | Confident | 137 Ų | 137 | 65.9 Ų | 65.9 | 60% | 0.601 | 37% | 0.367 | S | S | * | . | H | α-helix | trans | -60.7 | -47.3 | 176.2 | 179.9 | -99.4 | 0 | 0 | 0 | 112.7 | P269 L270 Y271 S275 A276 L277 | P269-F273 WeakPolarHBondContact O-CB 3.44Å; P269-F273 PolarHBondContact O-N 3.45Å; L270-F273 PolarHBondContact O-N 3.07Å; Y271-F273 VanDerWaalsContact C-N 3.32Å; Y271-F273 PolarHBondContact O-N 3.37Å; F273-S275 PolarHBondContact O-N 3.45Å; F273-A276 PolarHBondContact O-N 3.26Å; F273-L277 WeakPolarHBondContact O-CB 3.47Å; F273-L277 PolarHBondContact O-N 3.36Å |
| 274 | L | 85.7 | Confident | 80.3 | Confident | 63 Ų | 63 | 65.3 Ų | 65.3 | 33% | 0.33 | 36% | 0.359 | S | S | . | . | H | α-helix | trans | -61.5 | -43.1 | 176.4 | -78.7 | 149.3 | 0 | 0 | 0 | 112.1 | Y55 L270 Y271 A276 L277 L278 | Y55-L274 HydrophobicContact CE1-CB 4.08Å; Y55-L274 VanDerWaalsContact OH-CB 3.24Å; Y55-L274 WeakPolarHBondContact OH-CB 3.47Å; L270-L274 HydrophobicContact CD1-CD1 4.13Å; L270-L274 HydrophobicContact CG-CD1 3.81Å; L270-L274 WeakPolarHBondContact O-CB 3.49Å; L270-L274 WeakPolarHBondContact O-CD1 3.49Å; L270-L274 WeakPolarHBondContact O-CG 3.26Å; L270-L274 PolarHBondContact O-N 3.48Å; Y271-L274 PolarHBondContact O-N 3.23Å; L274-A276 VanDerWaalsContact C-N 3.35Å; L274-L277 PolarHBondContact O-N 2.59Å; L274-L278 WeakPolarHBondContact O-CG 3.23Å; L274-L278 PolarHBondContact O-N 3.21Å |
| 275 | S | 78.9 | Confident | 82.1 | Confident | 12 Ų | 12 | 59.3 Ų | 59.3 | 8% | 0.084 | 33% | 0.328 | C | S | . | . | H | α-helix | trans | -65.2 | -38.5 | 177.5 | 69 | 0 | 0 | 0 | 0 | 112.1 | Y271 A272 F273 L278 L279 | Y271-S275 WeakPolarHBondContact O-CB 3.42Å; Y271-S275 PolarHBondContact O-N 3.48Å; Y271-S275 PolarHBondContact O-OG 3.08Å; A272-S275 PolarHBondContact O-N 2.86Å; A272-S275 PolarHBondContact O-OG 2.99Å; F273-S275 PolarHBondContact O-N 3.45Å; S275-L278 PolarHBondContact O-N 3.19Å; S275-L279 WeakPolarHBondContact O-CG 3.36Å; S275-L279 PolarHBondContact O-N 2.92Å |
| 276 | A | 83.8 | Confident | 83.7 | Confident | 54 Ų | 54 | 55.4 Ų | 55.4 | 45% | 0.446 | 30% | 0.301 | S | S | . | . | H | α-helix | trans | -66 | -39.1 | 174.4 | 0 | 0 | 0 | 0 | 0 | 111.6 | A272 F273 L274 L279 L280 | A272-A276 WeakPolarHBondContact O-CB 3.08Å; A272-A276 PolarHBondContact O-N 2.95Å; F273-A276 PolarHBondContact O-N 3.26Å; L274-A276 VanDerWaalsContact C-N 3.35Å; A276-L279 PolarHBondContact O-N 2.83Å; A276-L280 WeakPolarHBondContact O-CB 3.47Å; A276-L280 PolarHBondContact O-N 3.36Å |
| 277 | L | 89.4 | Confident | 85.1 | Confident | 87 Ų | 87 | 51.9 Ų | 51.9 | 46% | 0.455 | 28% | 0.281 | S | S | . | . | H | α-helix | trans | -63.2 | -43.3 | 174.7 | -175.2 | 63.5 | 0 | 0 | 0 | 111.4 | F273 L274 L280 T281 | F273-L277 WeakPolarHBondContact O-CB 3.47Å; F273-L277 PolarHBondContact O-N 3.36Å; L274-L277 PolarHBondContact O-N 2.59Å; L277-L280 WeakPolarHBondContact O-CB 3.47Å; L277-L280 PolarHBondContact O-N 3.18Å; L277-T281 PolarHBondContact O-N 3.42Å; L277-T281 PolarHBondContact O-OG1 3.14Å |
| 278 | L | 89.2 | Confident | 86.5 | Confident | 36 Ų | 36 | 52.7 Ų | 52.7 | 19% | 0.188 | 29% | 0.287 | C | S | . | . | H | α-helix | trans | -62.1 | -46 | 174.3 | -72.3 | 171.3 | 0 | 0 | 0 | 111.4 | T47 L51 Y55 L274 S275 L280 T281 F282 | T47-L278 HydrophobicContact CG2-CB 3.89Å; T47-L278 HydrophobicContact CG2-CD2 3.98Å; T47-L278 WeakPolarHBondContact CG2-O 3.39Å; L51-L278 HydrophobicContact CD1-CB 4.04Å; L51-L278 HydrophobicContact CD2-CB 4.28Å; L51-L278 HydrophobicContact CG-CB 3.94Å; L51-L278 HydrophobicContact CG-CD1 4.27Å; Y55-L278 HydrophobicContact CD2-CD1 3.9Å; Y55-L278 HydrophobicContact CE2-CD1 3.45Å; Y55-L278 VanDerWaalsContact CE2-CD1 3.45Å; L274-L278 WeakPolarHBondContact O-CG 3.23Å; L274-L278 PolarHBondContact O-N 3.21Å; S275-L278 PolarHBondContact O-N 3.19Å; L278-L280 VanDerWaalsContact C-N 3.26Å; L278-L280 PolarHBondContact O-N 2.88Å; L278-T281 PolarHBondContact O-N 3.5Å; L278-T281 VanDerWaalsContact O-N 3.16Å; L278-F282 PolarHBondContact O-N 3.45Å |
| 279 | L | 87.4 | Confident | 88 | Confident | 43 Ų | 43 | 52.2 Ų | 52.2 | 23% | 0.225 | 28% | 0.28 | C | S | . | . | H | α-helix | trans | -59.8 | -38.2 | 175.5 | -74.9 | 171.9 | 0 | 0 | 0 | 112.3 | L51 F57 Q63 S275 A276 F282 A283 | L51-L279 HydrophobicContact CD1-CD2 3.88Å; L51-L279 HydrophobicContact CD1-CG 4.27Å; L51-L279 HydrophobicContact CD2-CD2 4.22Å; L51-L279 HydrophobicContact CD2-CG 4.07Å; F57-L279 HydrophobicContact CD1-CD2 4.45Å; F57-L279 HydrophobicContact CE1-CD2 3.83Å; F57-L279 HydrophobicContact CZ-CD1 4.25Å; F57-L279 HydrophobicContact CZ-CD2 4.18Å; Q63-L279 HydrophobicContact CG-CD2 4.08Å; S275-L279 WeakPolarHBondContact O-CG 3.36Å; S275-L279 PolarHBondContact O-N 2.92Å; A276-L279 PolarHBondContact O-N 2.83Å; L279-F282 PolarHBondContact O-N 3.39Å; L279-A283 WeakPolarHBondContact O-CB 3.16Å; L279-A283 PolarHBondContact O-N 3.37Å |
| 280 | L | 90.4 | Very high | 89 | Confident | 88 Ų | 88 | 49.4 Ų | 49.4 | 46% | 0.461 | 26% | 0.26 | S | S | . | . | H | α-helix | trans | -66 | -43.7 | 174.6 | -177.9 | 63 | 0 | 0 | 0 | 111.7 | A276 L277 L278 F282 A283 I284 | A276-L280 WeakPolarHBondContact O-CB 3.47Å; A276-L280 PolarHBondContact O-N 3.36Å; L277-L280 WeakPolarHBondContact O-CB 3.47Å; L277-L280 PolarHBondContact O-N 3.18Å; L278-L280 VanDerWaalsContact C-N 3.26Å; L278-L280 PolarHBondContact O-N 2.88Å; L280-F282 VanDerWaalsContact C-N 3.31Å; L280-F282 PolarHBondContact O-N 3.03Å; L280-A283 PolarHBondContact O-N 3.16Å; L280-I284 HydrophobicContact CD1-CD1 4.02Å; L280-I284 HydrophobicContact CD1-CG1 4.24Å; L280-I284 HydrophobicContact CG-CD1 3.84Å; L280-I284 HydrophobicContact CG-CG1 4.45Å; L280-I284 WeakPolarHBondContact O-CB 3.27Å; L280-I284 VanDerWaalsContact O-CG1 3.3Å; L280-I284 WeakPolarHBondContact O-CG1 3.48Å; L280-I284 PolarHBondContact O-N 2.97Å |
| 281 | T | 92.7 | Very high | 89.9 | Confident | 56 Ų | 56 | 46.8 Ų | 46.8 | 34% | 0.344 | 25% | 0.248 | S | C | . | . | H | α-helix | trans | -60.6 | -40.5 | 174.8 | -59.4 | 0 | 0 | 0 | 0 | 111.7 | L277 L278 S285 | L277-T281 PolarHBondContact O-N 3.42Å; L277-T281 PolarHBondContact O-OG1 3.14Å; L278-T281 PolarHBondContact O-N 3.5Å; L278-T281 VanDerWaalsContact O-N 3.16Å; T281-S285 VanDerWaalsContact O-CB 3.27Å; T281-S285 WeakPolarHBondContact O-CB 3.48Å; T281-S285 PolarHBondContact O-N 3.43Å; T281-S285 PolarHBondContact O-OG 3.07Å |
| 282 | F | 92.5 | Very high | 91.1 | Very high | 17 Ų | 17 | 45 Ų | 45 | 8% | 0.075 | 24% | 0.242 | C | C | . | . | H | α-helix | trans | -61.7 | -50 | 173.4 | -179.7 | -86.2 | 0 | 0 | 0 | 111 | A44 T47 T48 Q63 A67 L278 L279 L280 I284 S285 M286 | A44-F282 HydrophobicContact CB-CD2 3.96Å; A44-F282 HydrophobicContact CB-CE2 3.87Å; A44-F282 WeakPolarHBondContact O-CD2 3.25Å; T47-F282 HydrophobicContact CG2-CB 3.87Å; T48-F282 WeakPolarHBondContact OG1-CD2 3.45Å; T48-F282 VanDerWaalsContact OG1-CE2 3.23Å; T48-F282 WeakPolarHBondContact OG1-CE2 3.34Å; Q63-F282 HydrophobicContact CB-CD1 3.99Å; Q63-F282 HydrophobicContact CB-CE1 3.59Å; Q63-F282 HydrophobicContact CB-CE2 4.43Å; Q63-F282 HydrophobicContact CB-CZ 3.83Å; Q63-F282 WeakPolarHBondContact O-CE1 3.41Å; A67-F282 HydrophobicContact CB-CE1 4.37Å; L278-F282 PolarHBondContact O-N 3.45Å; L279-F282 PolarHBondContact O-N 3.39Å; L280-F282 VanDerWaalsContact C-N 3.31Å; L280-F282 PolarHBondContact O-N 3.03Å; F282-I284 PolarHBondContact O-N 2.84Å; F282-S285 PolarHBondContact O-N 3.34Å; F282-M286 HydrophobicContact CD1-CG 4.12Å; F282-M286 HydrophobicContact CE1-CG 3.59Å; F282-M286 HydrophobicContact CE2-CG 4.19Å; F282-M286 HydrophobicContact CZ-CG 3.64Å; F282-M286 HydrophobicContact CZ-SD 4.32Å; F282-M286 WeakPolarHBondContact O-CG 3.36Å; F282-M286 PolarHBondContact O-N 3.17Å |
| 283 | A | 93.2 | Very high | 92.1 | Very high | 5 Ų | 5 | 43.8 Ų | 43.8 | 4% | 0.041 | 23% | 0.231 | C | C | . | . | H | α-helix | trans | -60.8 | -43.5 | -178.9 | 0 | 0 | 0 | 0 | 0 | 112.3 | T66 L279 L280 F287 | T66-A283 HydrophobicContact CG2-CB 3.87Å; L279-A283 WeakPolarHBondContact O-CB 3.16Å; L279-A283 PolarHBondContact O-N 3.37Å; L280-A283 PolarHBondContact O-N 3.16Å; A283-F287 VanDerWaalsContact O-CB 3.25Å; A283-F287 WeakPolarHBondContact O-CB 3.22Å; A283-F287 PolarHBondContact O-N 3.19Å |
| 284 | I | 95.2 | Very high | 92.7 | Very high | 74 Ų | 74 | 37.3 Ų | 37.3 | 38% | 0.379 | 20% | 0.203 | S | C | . | . | H | α-helix | trans | -65 | -46.2 | 176.4 | -68.1 | 168.6 | 0 | 0 | 0 | 110.5 | L280 F282 M286 F287 L288 | L280-I284 HydrophobicContact CD1-CD1 4.02Å; L280-I284 HydrophobicContact CD1-CG1 4.24Å; L280-I284 HydrophobicContact CG-CD1 3.84Å; L280-I284 HydrophobicContact CG-CG1 4.45Å; L280-I284 WeakPolarHBondContact O-CB 3.27Å; L280-I284 VanDerWaalsContact O-CG1 3.3Å; L280-I284 WeakPolarHBondContact O-CG1 3.48Å; L280-I284 PolarHBondContact O-N 2.97Å; F282-I284 PolarHBondContact O-N 2.84Å; I284-M286 PolarHBondContact O-N 3.36Å; I284-F287 PolarHBondContact O-N 3.41Å; I284-L288 HydrophobicContact CG2-CD1 4.02Å; I284-L288 HydrophobicContact CG2-CG 4.38Å; I284-L288 WeakPolarHBondContact O-CB 3.49Å; I284-L288 WeakPolarHBondContact O-CG 3.27Å; I284-L288 PolarHBondContact O-N 2.96Å |
| 285 | S | 95.5 | Very high | 93.2 | Very high | 13 Ų | 13 | 35.1 Ų | 35.1 | 9% | 0.091 | 19% | 0.192 | C | C | . | . | H | α-helix | trans | -58.8 | -46.6 | 178.8 | -62.3 | 0 | 0 | 0 | 0 | 111.5 | T281 F282 L288 F289 | T281-S285 VanDerWaalsContact O-CB 3.27Å; T281-S285 WeakPolarHBondContact O-CB 3.48Å; T281-S285 PolarHBondContact O-N 3.43Å; T281-S285 PolarHBondContact O-OG 3.07Å; F282-S285 PolarHBondContact O-N 3.34Å; S285-L288 PolarHBondContact O-N 3.41Å; S285-F289 WeakPolarHBondContact O-CB 3.42Å; S285-F289 PolarHBondContact O-N 2.96Å |
| 286 | M | 94.9 | Very high | 94 | Very high | 24 Ų | 24 | 34.6 Ų | 34.6 | 12% | 0.118 | 19% | 0.188 | C | C | . | . | H | α-helix | trans | -68.3 | -38.9 | 177.6 | -70.1 | -55.7 | -61.5 | 0 | 0 | 112.6 | A44 A67 F282 I284 L288 F289 Y290 | A44-M286 HydrophobicContact CB-CG 4.27Å; A44-M286 HydrophobicContact CB-SD 3.81Å; A67-M286 HydrophobicContact CB-CB 3.71Å; A67-M286 HydrophobicContact CB-CG 4.17Å; F282-M286 HydrophobicContact CD1-CG 4.12Å; F282-M286 HydrophobicContact CE1-CG 3.59Å; F282-M286 HydrophobicContact CE2-CG 4.19Å; F282-M286 HydrophobicContact CZ-CG 3.64Å; F282-M286 HydrophobicContact CZ-SD 4.32Å; F282-M286 WeakPolarHBondContact O-CG 3.36Å; F282-M286 PolarHBondContact O-N 3.17Å; I284-M286 PolarHBondContact O-N 3.36Å; M286-L288 PolarHBondContact O-N 2.96Å; M286-F289 HydrophobicContact CE-CD1 4.32Å; M286-F289 WeakPolarHBondContact O-CB 3.41Å; M286-F289 PolarHBondContact O-N 2.91Å; M286-Y290 HydrophobicContact CE-CD2 4.29Å; M286-Y290 HydrophobicContact CE-CE2 3.67Å; M286-Y290 VanDerWaalsContact O-CD2 3.27Å; M286-Y290 WeakPolarHBondContact O-CD2 3.24Å; M286-Y290 PolarHBondContact O-N 2.99Å |
| 287 | F | 96.7 | Very high | 94.5 | Very high | 32 Ų | 32 | 32.1 Ų | 32.1 | 14% | 0.14 | 17% | 0.168 | C | C | . | . | H | α-helix | trans | -60.5 | -45.9 | 175.2 | 174.9 | -91.2 | 0 | 0 | 0 | 112.2 | F70 L71 V74 Y75 A283 I284 F289 T291 | F70-F287 HydrophobicContact CD1-CB 3.82Å; F70-F287 AromaticContact CD1-CD2 3.91Å; F70-F287 HydrophobicContact CD1-CD2 3.91Å; F70-F287 AromaticContact CD1-CG 3.91Å; F70-F287 HydrophobicContact CD1-CG 3.91Å; F70-F287 HydrophobicContact CE1-CB 4.34Å; F70-F287 HydrophobicContact CE1-CD2 4.4Å; F70-F287 HydrophobicContact CE1-CG 4.2Å; L71-F287 HydrophobicContact CD2-CD2 3.74Å; L71-F287 HydrophobicContact CD2-CE2 4.02Å; L71-F287 HydrophobicContact CG-CD2 4.3Å; V74-F287 HydrophobicContact CB-CE2 3.76Å; V74-F287 HydrophobicContact CB-CZ 4.13Å; V74-F287 HydrophobicContact CG1-CE2 3.98Å; V74-F287 HydrophobicContact CG1-CZ 3.84Å; V74-F287 HydrophobicContact CG2-CE2 3.9Å; V74-F287 HydrophobicContact CG2-CZ 4.24Å; Y75-F287 AromaticContact CD2-CE2 3.81Å; Y75-F287 HydrophobicContact CD2-CE2 3.81Å; Y75-F287 HydrophobicContact CD2-CZ 4.22Å; Y75-F287 AromaticContact CE2-CE2 3.48Å; Y75-F287 HydrophobicContact CE2-CE2 3.48Å; Y75-F287 VanDerWaalsContact CE2-CE2 3.48Å; Y75-F287 AromaticContact CE2-CZ 3.5Å; Y75-F287 HydrophobicContact CE2-CZ 3.5Å; Y75-F287 VanDerWaalsContact CE2-CZ 3.5Å; A283-F287 VanDerWaalsContact O-CB 3.25Å; A283-F287 WeakPolarHBondContact O-CB 3.22Å; A283-F287 PolarHBondContact O-N 3.19Å; I284-F287 PolarHBondContact O-N 3.41Å; F287-F289 VanDerWaalsContact C-N 3.33Å; F287-T291 WeakPolarHBondContact O-CB 3.43Å; F287-T291 PolarHBondContact O-N 3.43Å; F287-T291 VanDerWaalsContact O-N 3.11Å; F287-T291 PolarHBondContact O-OG1 2.79Å |
| 288 | L | 97.4 | Very high | 94.6 | Very high | 66 Ų | 66 | 33.8 Ų | 33.8 | 35% | 0.346 | 17% | 0.168 | S | C | . | . | H | α-helix | trans | -62.9 | -42.2 | 174.6 | -70.4 | 177.2 | 0 | 0 | 0 | 111 | I284 S285 M286 T291 F292 | I284-L288 HydrophobicContact CG2-CD1 4.02Å; I284-L288 HydrophobicContact CG2-CG 4.38Å; I284-L288 WeakPolarHBondContact O-CB 3.49Å; I284-L288 WeakPolarHBondContact O-CG 3.27Å; I284-L288 PolarHBondContact O-N 2.96Å; S285-L288 PolarHBondContact O-N 3.41Å; M286-L288 PolarHBondContact O-N 2.96Å; L288-T291 PolarHBondContact O-N 2.9Å; L288-F292 HydrophobicContact CB-CD2 4.14Å; L288-F292 HydrophobicContact CB-CE2 4.01Å; L288-F292 HydrophobicContact CD2-CE2 4Å; L288-F292 HydrophobicContact CD2-CZ 4.5Å; L288-F292 HydrophobicContact CG-CE2 4.48Å; L288-F292 WeakPolarHBondContact O-CB 3.49Å; L288-F292 WeakPolarHBondContact O-CD2 3.19Å; L288-F292 WeakPolarHBondContact O-CG 3.42Å; L288-F292 PolarHBondContact O-N 3.38Å |
| 289 | F | 97.1 | Very high | 94.7 | Very high | 17 Ų | 17 | 38.7 Ų | 38.7 | 8% | 0.075 | 18% | 0.184 | C | C | . | . | H | α-helix | trans | -53.9 | -62 | 175.7 | -179.4 | -93.1 | 0 | 0 | 0 | 111.3 | L37 C40 Q41 S285 M286 F287 T291 F292 V293 F305 L309 | L37-F289 HydrophobicContact CB-CD2 4.45Å; L37-F289 HydrophobicContact CB-CE2 4.45Å; L37-F289 HydrophobicContact CD2-CD2 3.74Å; L37-F289 HydrophobicContact CD2-CE2 4.17Å; L37-F289 HydrophobicContact CD2-CG 4.18Å; L37-F289 VanDerWaalsContact CD2-O 3.27Å; L37-F289 WeakPolarHBondContact CD2-O 3.32Å; C40-F289 HydrophobicContact CB-CB 4.05Å; C40-F289 HydrophobicContact CB-CD2 4.31Å; Q41-F289 HydrophobicContact CB-CD2 4.33Å; Q41-F289 HydrophobicContact CB-CE2 4.09Å; S285-F289 WeakPolarHBondContact O-CB 3.42Å; S285-F289 PolarHBondContact O-N 2.96Å; M286-F289 HydrophobicContact CE-CD1 4.32Å; M286-F289 WeakPolarHBondContact O-CB 3.41Å; M286-F289 PolarHBondContact O-N 2.91Å; F287-F289 VanDerWaalsContact C-N 3.33Å; F289-T291 PolarHBondContact O-N 3.29Å; F289-F292 PolarHBondContact O-N 3.06Å; F289-F292 VanDerWaalsContact O-N 3.08Å; F289-V293 HydrophobicContact CD1-CG2 3.93Å; F289-V293 HydrophobicContact CD2-CG2 4.49Å; F289-V293 HydrophobicContact CE1-CG2 3.7Å; F289-V293 HydrophobicContact CE2-CG2 4.31Å; F289-V293 HydrophobicContact CG-CG2 4.32Å; F289-V293 HydrophobicContact CZ-CG2 3.92Å; F289-V293 VanDerWaalsContact O-CG2 3.29Å; F289-V293 WeakPolarHBondContact O-CG2 3.47Å; F289-V293 PolarHBondContact O-N 3.14Å; F289-F305 HydrophobicContact CE1-CE2 4.45Å; F289-F305 HydrophobicContact CE1-CZ 4.13Å; F289-F305 HydrophobicContact CE2-CE2 4.21Å; F289-F305 AromaticContact CZ-CE2 3.73Å; F289-F305 HydrophobicContact CZ-CE2 3.73Å; F289-F305 AromaticContact CZ-CZ 3.65Å; F289-F305 HydrophobicContact CZ-CZ 3.65Å; F289-L309 HydrophobicContact CE2-CD2 3.59Å; F289-L309 HydrophobicContact CZ-CD1 4.14Å; F289-L309 HydrophobicContact CZ-CD2 4.03Å |
| 290 | Y | 97.1 | Very high | 94.9 | Very high | 18 Ų | 18 | 37.9 Ų | 37.9 | 7% | 0.071 | 18% | 0.182 | C | C | . | . | H | α-helix | trans | -55.9 | -40.1 | -179.3 | -83 | -80.7 | 0 | 0 | 0 | 112.5 | Y68 L71 D106 M286 V293 C294 | Y68-Y290 HydrophobicContact CE1-CE1 4.41Å; Y68-Y290 AromaticContact CE1-CZ 3.99Å; Y68-Y290 PolarHBondContact OH-OH 3.18Å; Y68-Y290 VanDerWaalsContact OH-OH 3.1Å; L71-Y290 HydrophobicContact CD1-CD1 4.2Å; L71-Y290 HydrophobicContact CD1-CD2 3.69Å; L71-Y290 HydrophobicContact CD1-CE2 4.26Å; L71-Y290 HydrophobicContact CD1-CG 3.67Å; D106-Y290 PolarHBondContact OD2-OH 2.98Å; M286-Y290 HydrophobicContact CE-CD2 4.29Å; M286-Y290 HydrophobicContact CE-CE2 3.67Å; M286-Y290 VanDerWaalsContact O-CD2 3.27Å; M286-Y290 WeakPolarHBondContact O-CD2 3.24Å; M286-Y290 PolarHBondContact O-N 2.99Å; Y290-V293 PolarHBondContact O-N 2.91Å; Y290-C294 PolarHBondContact O-N 3.24Å; Y290-C294 PolarHBondContact O-SG 3.26Å |
| 291 | T | 97.5 | Very high | 95 | Very high | 24 Ų | 24 | 33.9 Ų | 33.9 | 15% | 0.147 | 16% | 0.161 | C | C | . | . | H | α-helix | trans | -61.8 | -49.2 | 177.4 | -59.3 | 0 | 0 | 0 | 0 | 111.6 | Y75 F287 L288 F289 C294 V295 | Y75-T291 VanDerWaalsContact OH-CG2 3.29Å; Y75-T291 WeakPolarHBondContact OH-CG2 3.4Å; Y75-T291 PolarHBondContact OH-OG1 2.82Å; F287-T291 WeakPolarHBondContact O-CB 3.43Å; F287-T291 PolarHBondContact O-N 3.43Å; F287-T291 VanDerWaalsContact O-N 3.11Å; F287-T291 PolarHBondContact O-OG1 2.79Å; L288-T291 PolarHBondContact O-N 2.9Å; F289-T291 PolarHBondContact O-N 3.29Å; T291-C294 PolarHBondContact O-N 2.98Å; T291-V295 WeakPolarHBondContact O-CG2 3.39Å; T291-V295 PolarHBondContact O-N 3.44Å |
| 292 | F | 97.6 | Very high | 95.1 | Very high | 52 Ų | 52 | 31.2 Ų | 31.2 | 23% | 0.228 | 15% | 0.145 | C | C | . | . | H | α-helix | trans | -73 | -29.8 | -179.3 | -70.5 | -52.5 | 0 | 0 | 0 | 112.9 | L33 L36 L37 L288 F289 C294 V295 L296 | L33-F292 HydrophobicContact CD2-CD1 3.94Å; L36-F292 HydrophobicContact CD2-CD1 4.06Å; L36-F292 HydrophobicContact CD2-CD2 3.64Å; L36-F292 HydrophobicContact CD2-CE1 3.84Å; L36-F292 HydrophobicContact CD2-CE2 3.39Å; L36-F292 HydrophobicContact CD2-CG 3.99Å; L36-F292 HydrophobicContact CD2-CZ 3.5Å; L36-F292 HydrophobicContact CG-CD2 3.96Å; L36-F292 HydrophobicContact CG-CE2 3.97Å; L37-F292 HydrophobicContact CD2-CB 3.57Å; L37-F292 HydrophobicContact CG-CB 4.02Å; L288-F292 HydrophobicContact CB-CD2 4.14Å; L288-F292 HydrophobicContact CB-CE2 4.01Å; L288-F292 HydrophobicContact CD2-CE2 4Å; L288-F292 HydrophobicContact CD2-CZ 4.5Å; L288-F292 HydrophobicContact CG-CE2 4.48Å; L288-F292 WeakPolarHBondContact O-CB 3.49Å; L288-F292 WeakPolarHBondContact O-CD2 3.19Å; L288-F292 WeakPolarHBondContact O-CG 3.42Å; L288-F292 PolarHBondContact O-N 3.38Å; F289-F292 PolarHBondContact O-N 3.06Å; F289-F292 VanDerWaalsContact O-N 3.08Å; F292-C294 VanDerWaalsContact C-N 3.26Å; F292-C294 PolarHBondContact O-N 2.66Å; F292-V295 WeakPolarHBondContact O-CB 2.87Å; F292-V295 PolarHBondContact O-N 2.76Å; F292-L296 PolarHBondContact O-N 2.94Å |
| 293 | V | 97.4 | Very high | 95.3 | Very high | 2 Ų | 2 | 30.4 Ų | 30.4 | 1% | 0.012 | 14% | 0.141 | C | C | . | . | H | α-helix | trans | -59.3 | -44.7 | 173.9 | 171.7 | 0 | 0 | 0 | 0 | 109.2 | L37 F289 Y290 V295 L296 I297 F305 | L37-V293 HydrophobicContact CD1-CG2 4.02Å; L37-V293 HydrophobicContact CD2-CB 4.41Å; L37-V293 HydrophobicContact CD2-CG2 3.5Å; L37-V293 VanDerWaalsContact CD2-CG2 3.5Å; L37-V293 HydrophobicContact CG-CG2 4.4Å; F289-V293 HydrophobicContact CD1-CG2 3.93Å; F289-V293 HydrophobicContact CD2-CG2 4.49Å; F289-V293 HydrophobicContact CE1-CG2 3.7Å; F289-V293 HydrophobicContact CE2-CG2 4.31Å; F289-V293 HydrophobicContact CG-CG2 4.32Å; F289-V293 HydrophobicContact CZ-CG2 3.92Å; F289-V293 VanDerWaalsContact O-CG2 3.29Å; F289-V293 WeakPolarHBondContact O-CG2 3.47Å; F289-V293 PolarHBondContact O-N 3.14Å; Y290-V293 PolarHBondContact O-N 2.91Å; V293-V295 VanDerWaalsContact C-N 3.25Å; V293-V295 PolarHBondContact O-N 2.67Å; V293-L296 PolarHBondContact O-N 3.13Å; V293-I297 HydrophobicContact CG1-CD1 3.56Å; V293-I297 HydrophobicContact CG1-CG1 4.11Å; V293-I297 WeakPolarHBondContact O-CB 3.36Å; V293-I297 WeakPolarHBondContact O-CG1 3.48Å; V293-I297 PolarHBondContact O-N 3.3Å; V293-F305 HydrophobicContact CB-CE2 4.29Å; V293-F305 HydrophobicContact CB-CZ 4.5Å; V293-F305 HydrophobicContact CG1-CD1 4.29Å; V293-F305 HydrophobicContact CG1-CD2 4.22Å; V293-F305 HydrophobicContact CG1-CE1 4.11Å; V293-F305 HydrophobicContact CG1-CE2 4.04Å; V293-F305 HydrophobicContact CG1-CG 4.32Å; V293-F305 HydrophobicContact CG1-CZ 3.96Å; V293-F305 HydrophobicContact CG2-CD2 3.95Å; V293-F305 HydrophobicContact CG2-CE2 3.27Å; V293-F305 HydrophobicContact CG2-CZ 3.6Å |
| 294 | C | 97.2 | Very high | 95.3 | Very high | 0 Ų | 0 | 30.1 Ų | 30.1 | 0% | 0 | 14% | 0.139 | C | C | . | . | H | α-helix | trans | -62.6 | -33.5 | 177.5 | -64.7 | 0 | 0 | 0 | 0 | 112.8 | L208 R213 Y216 L217 Y290 T291 F292 R298 | L208-C294 HydrophobicContact CD1-CB 4.07Å; L208-C294 HydrophobicContact CD2-CB 4.04Å; R213-C294 HydrophobicContact CB-CB 4.29Å; R213-C294 HydrophobicContact CG-CB 4.14Å; Y216-C294 WeakPolarHBondContact CD1-SG 3.27Å; L217-C294 HydrophobicContact CD1-CB 4.41Å; Y290-C294 PolarHBondContact O-N 3.24Å; Y290-C294 PolarHBondContact O-SG 3.26Å; T291-C294 PolarHBondContact O-N 2.98Å; F292-C294 VanDerWaalsContact C-N 3.26Å; F292-C294 PolarHBondContact O-N 2.66Å; C294-R298 WeakPolarHBondContact O-CG 3.44Å; C294-R298 PolarHBondContact O-N 3.32Å |
| 295 | V | 96.5 | Very high | 95.4 | Very high | 18 Ų | 18 | 27 Ų | 27 | 11% | 0.109 | 12% | 0.122 | C | C | . | . | H | α-helix | trans | -71.3 | -44.7 | 175.1 | -179.3 | 0 | 0 | 0 | 0 | 111 | L33 T291 F292 V293 R299 | L33-V295 HydrophobicContact CD1-CG1 3.83Å; L33-V295 HydrophobicContact CD2-CB 4.47Å; L33-V295 HydrophobicContact CD2-CG1 4.14Å; T291-V295 WeakPolarHBondContact O-CG2 3.39Å; T291-V295 PolarHBondContact O-N 3.44Å; F292-V295 WeakPolarHBondContact O-CB 2.87Å; F292-V295 PolarHBondContact O-N 2.76Å; V293-V295 VanDerWaalsContact C-N 3.25Å; V293-V295 PolarHBondContact O-N 2.67Å; V295-R299 VanDerWaalsContact CG1-NH1 3.3Å; V295-R299 WeakPolarHBondContact O-CG 3.44Å; V295-R299 PolarHBondContact O-N 3.47Å |
| 296 | L | 95.9 | Very high | 95.4 | Very high | 0 Ų | 0 | 27 Ų | 27 | 0% | 0 | 12% | 0.122 | C | C | . | . | H | α-helix | trans | -65.5 | -50.7 | -178.3 | 179.1 | 64.3 | 0 | 0 | 0 | 111.2 | T30 L33 L37 F292 V293 R298 R299 S300 F305 | T30-L296 HydrophobicContact CG2-CD1 3.76Å; L33-L296 HydrophobicContact CB-CD1 4Å; L37-L296 HydrophobicContact CD1-CB 3.99Å; L37-L296 HydrophobicContact CD1-CD2 3.45Å; L37-L296 VanDerWaalsContact CD1-CD2 3.45Å; L37-L296 HydrophobicContact CD1-CG 4.34Å; F292-L296 PolarHBondContact O-N 2.94Å; V293-L296 PolarHBondContact O-N 3.13Å; L296-R298 VanDerWaalsContact C-N 3.32Å; L296-R298 PolarHBondContact O-N 3.4Å; L296-R299 CarbonylContact O-C 3.4Å; L296-R299 PolarHBondContact O-N 2.88Å; L296-S300 WeakPolarHBondContact CD1-OG 3.17Å; L296-S300 PolarHBondContact O-N 2.82Å; L296-S300 PolarHBondContact O-OG 3.17Å; L296-F305 HydrophobicContact CD2-CB 4.03Å; L296-F305 HydrophobicContact CD2-CD2 4.3Å |
| 297 | I | 94.3 | Very high | 95.3 | Very high | 3 Ų | 3 | 25.9 Ų | 25.9 | 2% | 0.015 | 12% | 0.116 | C | C | . | . | H | α-helix | trans | -61.7 | -40.5 | -177.1 | -71.9 | -179.3 | 0 | 0 | 0 | 111.1 | Q204 E205 L208 V293 R299 S300 F305 | Q204-I297 HydrophobicContact CG-CD1 3.9Å; E205-I297 HydrophobicContact CB-CG2 3.65Å; E205-I297 HydrophobicContact CG-CG2 3.85Å; L208-I297 HydrophobicContact CD1-CB 4.02Å; L208-I297 HydrophobicContact CD1-CG2 3.92Å; V293-I297 HydrophobicContact CG1-CD1 3.56Å; V293-I297 HydrophobicContact CG1-CG1 4.11Å; V293-I297 WeakPolarHBondContact O-CB 3.36Å; V293-I297 WeakPolarHBondContact O-CG1 3.48Å; V293-I297 PolarHBondContact O-N 3.3Å; I297-R299 PolarHBondContact O-N 2.86Å; I297-S300 CarbonylContact O-C 3.52Å; I297-S300 PolarHBondContact O-N 3.07Å; I297-F305 HydrophobicContact CD1-CB 4.43Å; I297-F305 HydrophobicContact CD1-CD1 4.18Å; I297-F305 HydrophobicContact CD1-CG 4.44Å; I297-F305 HydrophobicContact CG1-CB 4.05Å; I297-F305 HydrophobicContact CG1-CG 4.49Å |
| 298 | R | 91.9 | Very high | 95.2 | Very high | 122 Ų | 122 | 24.3 Ų | 24.3 | 46% | 0.46 | 11% | 0.109 | S | C | . | . | H | α-helix | trans | -64.3 | -24.7 | 175.3 | -77.8 | -167.6 | 78.1 | 125 | -0.9 | 114.1 | L208 H211 R213 C294 L296 | L208-R298 HydrophobicContact CB-CG 3.95Å; L208-R298 VanDerWaalsContact O-CZ 3.29Å; L208-R298 PolarHBondContact O-NH1 3.04Å; H211-R298 PolarHBondContact O-NH1 2.9Å; R213-R298 VanDerWaalsContact CG-CD 3.5Å; R213-R298 HydrophobicContact CG-CG 4.49Å; C294-R298 WeakPolarHBondContact O-CG 3.44Å; C294-R298 PolarHBondContact O-N 3.32Å; L296-R298 VanDerWaalsContact C-N 3.32Å; L296-R298 PolarHBondContact O-N 3.4Å |
| 299 | R | 89.9 | Confident | 95 | Very high | 139 Ų | 139 | 22.8 Ų | 22.8 | 53% | 0.525 | 10% | 0.101 | S | C | . | . | H | α-helix | trans | -94.8 | -16.2 | 178.6 | -72.8 | -174.6 | 174.9 | 142 | 2.9 | 113.4 | V295 L296 I297 | V295-R299 VanDerWaalsContact CG1-NH1 3.3Å; V295-R299 WeakPolarHBondContact O-CG 3.44Å; V295-R299 PolarHBondContact O-N 3.47Å; L296-R299 CarbonylContact O-C 3.4Å; L296-R299 PolarHBondContact O-N 2.88Å; I297-R299 PolarHBondContact O-N 2.86Å |
| 300 | S | 91.6 | Very high | 94.7 | Very high | 26 Ų | 26 | 22.4 Ų | 22.4 | 18% | 0.182 | 10% | 0.1 | C | C | . | . | S | Bend | trans | -141 | -106.9 | -171.9 | 63.4 | 0 | 0 | 0 | 0 | 110.9 | L296 I297 | L296-S300 WeakPolarHBondContact CD1-OG 3.17Å; L296-S300 PolarHBondContact O-N 2.82Å; L296-S300 PolarHBondContact O-OG 3.17Å; I297-S300 CarbonylContact O-C 3.52Å; I297-S300 PolarHBondContact O-N 3.07Å |
| 301 | S | 93.5 | Very high | 94.3 | Very high | 3 Ų | 3 | 21.6 Ų | 21.6 | 2% | 0.021 | 10% | 0.097 | C | C | . | . | trans | -163.7 | 165.9 | -179.9 | 55.1 | 0 | 0 | 0 | 0 | 111.3 | T303 M304 F305 Y335 | S301-T303 PolarHBondContact O-N 3.36Å; S301-M304 PolarHBondContact O-N 2.88Å; S301-M304 PolarHBondContact OG-N 2.95Å; S301-M304 VanDerWaalsContact OG-N 3.16Å; S301-F305 PolarHBondContact O-N 2.87Å; S301-F305 VanDerWaalsContact O-N 3.09Å; S301-Y335 PolarHBondContact OG-OH 3.22Å | ||
| 302 | A | 95 | Very high | 93.8 | Very high | 0 Ų | 0 | 21 Ų | 21 | 0% | 0 | 9% | 0.094 | C | C | . | . | H | α-helix | trans | -59.6 | -35.3 | 168.2 | 0 | 0 | 0 | 0 | 0 | 111.8 | V136 N201 E205 F305 N306 | V136-A302 HydrophobicContact CG1-CB 3.67Å; N201-A302 HydrophobicContact CB-CB 4.1Å; N201-A302 WeakPolarHBondContact O-CB 3.48Å; E205-A302 HydrophobicContact CB-CB 4.11Å; E205-A302 WeakPolarHBondContact OE2-CB 3.38Å; E205-A302 PolarHBondContact OE2-N 3.13Å; A302-F305 WeakPolarHBondContact O-CB 3.45Å; A302-F305 PolarHBondContact O-N 3.31Å; A302-N306 PolarHBondContact O-N 3.35Å; A302-N306 PolarHBondContact O-ND2 3.09Å |
| 303 | T | 95.3 | Very high | 92.7 | Very high | 0 Ų | 0 | 21.3 Ų | 21.3 | 0% | 0 | 10% | 0.098 | C | C | . | . | H | α-helix | trans | -62.5 | -47.9 | 176.1 | -52.6 | 0 | 0 | 0 | 0 | 110.8 | L137 Y148 S301 F305 N306 L307 Y335 | L137-T303 HydrophobicContact CD2-CG2 3.54Å; L137-T303 HydrophobicContact CG-CG2 4.11Å; Y148-T303 PolarHBondContact OH-OG1 3.03Å; S301-T303 PolarHBondContact O-N 3.36Å; T303-F305 VanDerWaalsContact C-N 3.28Å; T303-F305 PolarHBondContact O-N 2.83Å; T303-N306 PolarHBondContact O-N 3.45Å; T303-L307 HydrophobicContact CG2-CD1 4.25Å; T303-L307 HydrophobicContact CG2-CG 4.4Å; T303-L307 WeakPolarHBondContact O-CG 3.4Å; T303-L307 PolarHBondContact O-N 3.17Å; T303-Y335 VanDerWaalsContact CB-OH 3.28Å; T303-Y335 WeakPolarHBondContact CB-OH 3Å; T303-Y335 HydrophobicContact CG2-CE2 3.67Å |
| 304 | M | 94.5 | Very high | 91.3 | Very high | 0 Ų | 0 | 21.7 Ų | 21.7 | 0% | 0 | 10% | 0.1 | C | C | . | . | H | α-helix | trans | -63.2 | -37 | 178.6 | 179.9 | 49.6 | -153.8 | 0 | 0 | 112 | T30 S301 L307 S308 T332 Y335 | T30-M304 HydrophobicContact CG2-CE 4.11Å; T30-M304 HydrophobicContact CG2-CG 3.79Å; S301-M304 PolarHBondContact O-N 2.88Å; S301-M304 PolarHBondContact OG-N 2.95Å; S301-M304 VanDerWaalsContact OG-N 3.16Å; M304-L307 PolarHBondContact O-N 2.99Å; M304-S308 WeakPolarHBondContact CE-OG 3.47Å; M304-S308 WeakPolarHBondContact O-CB 3.24Å; M304-S308 PolarHBondContact O-N 2.99Å; M304-S308 PolarHBondContact O-OG 2.8Å; M304-T332 HydrophobicContact CE-CG2 3.93Å; M304-T332 HydrophobicContact SD-CG2 4.35Å; M304-Y335 HydrophobicContact CB-CD1 4.11Å; M304-Y335 HydrophobicContact CB-CE1 3.82Å; M304-Y335 HydrophobicContact CG-CD1 4.48Å; M304-Y335 HydrophobicContact SD-CD1 4.03Å |
| 305 | F | 95.8 | Very high | 89.4 | Confident | 7 Ų | 7 | 26.3 Ų | 26.3 | 3% | 0.031 | 12% | 0.118 | C | C | . | . | H | α-helix | trans | -55.9 | -52.9 | 171.7 | 164.3 | -125 | 0 | 0 | 0 | 111.7 | L37 N201 F289 V293 L296 I297 S301 A302 T303 L307 S308 L309 | L37-F305 HydrophobicContact CD1-CD2 3.98Å; L37-F305 HydrophobicContact CD1-CE2 4.26Å; N201-F305 WeakPolarHBondContact OD1-CE1 3.45Å; F289-F305 HydrophobicContact CE1-CE2 4.45Å; F289-F305 HydrophobicContact CE1-CZ 4.13Å; F289-F305 HydrophobicContact CE2-CE2 4.21Å; F289-F305 AromaticContact CZ-CE2 3.73Å; F289-F305 HydrophobicContact CZ-CE2 3.73Å; F289-F305 AromaticContact CZ-CZ 3.65Å; F289-F305 HydrophobicContact CZ-CZ 3.65Å; V293-F305 HydrophobicContact CB-CE2 4.29Å; V293-F305 HydrophobicContact CB-CZ 4.5Å; V293-F305 HydrophobicContact CG1-CD1 4.29Å; V293-F305 HydrophobicContact CG1-CD2 4.22Å; V293-F305 HydrophobicContact CG1-CE1 4.11Å; V293-F305 HydrophobicContact CG1-CE2 4.04Å; V293-F305 HydrophobicContact CG1-CG 4.32Å; V293-F305 HydrophobicContact CG1-CZ 3.96Å; V293-F305 HydrophobicContact CG2-CD2 3.95Å; V293-F305 HydrophobicContact CG2-CE2 3.27Å; V293-F305 HydrophobicContact CG2-CZ 3.6Å; L296-F305 HydrophobicContact CD2-CB 4.03Å; L296-F305 HydrophobicContact CD2-CD2 4.3Å; I297-F305 HydrophobicContact CD1-CB 4.43Å; I297-F305 HydrophobicContact CD1-CD1 4.18Å; I297-F305 HydrophobicContact CD1-CG 4.44Å; I297-F305 HydrophobicContact CG1-CB 4.05Å; I297-F305 HydrophobicContact CG1-CG 4.49Å; S301-F305 PolarHBondContact O-N 2.87Å; S301-F305 VanDerWaalsContact O-N 3.09Å; A302-F305 WeakPolarHBondContact O-CB 3.45Å; A302-F305 PolarHBondContact O-N 3.31Å; T303-F305 VanDerWaalsContact C-N 3.28Å; T303-F305 PolarHBondContact O-N 2.83Å; F305-L307 PolarHBondContact O-N 3.46Å; F305-S308 WeakPolarHBondContact O-CB 3.44Å; F305-S308 PolarHBondContact O-N 2.95Å; F305-S308 VanDerWaalsContact O-N 3.12Å; F305-L309 HydrophobicContact CD2-CD1 4.28Å; F305-L309 HydrophobicContact CD2-CD2 4.33Å; F305-L309 HydrophobicContact CD2-CG 4.06Å; F305-L309 HydrophobicContact CE1-CD1 4.18Å; F305-L309 HydrophobicContact CE2-CD1 3.54Å; F305-L309 HydrophobicContact CE2-CD2 3.74Å; F305-L309 HydrophobicContact CE2-CG 3.65Å; F305-L309 HydrophobicContact CZ-CD1 3.5Å; F305-L309 HydrophobicContact CZ-CD2 4.49Å; F305-L309 HydrophobicContact CZ-CG 4.16Å; F305-L309 WeakPolarHBondContact O-CG 2.98Å; F305-L309 PolarHBondContact O-N 3.23Å; F305-L309 VanDerWaalsContact O-N 3.1Å |
| 306 | N | 95.5 | Very high | 87.7 | Confident | 14 Ų | 14 | 27.9 Ų | 27.9 | 8% | 0.075 | 13% | 0.133 | C | C | . | . | H | α-helix | trans | -65.1 | -39.1 | -179.9 | -75.4 | -85.6 | 0 | 0 | 0 | 112.9 | T132 I133 N201 A302 T303 S308 L309 L310 | T132-N306 WeakPolarHBondContact CG2-OD1 3.45Å; I133-N306 HydrophobicContact CG1-CB 4.06Å; N201-N306 PolarHBondContact ND2-ND2 3.1Å; N201-N306 PolarHBondContact ND2-OD1 2.76Å; N201-N306 VanDerWaalsContact ND2-OD1 3.16Å; A302-N306 PolarHBondContact O-N 3.35Å; A302-N306 PolarHBondContact O-ND2 3.09Å; T303-N306 PolarHBondContact O-N 3.45Å; N306-S308 VanDerWaalsContact C-N 3.25Å; N306-S308 PolarHBondContact O-N 2.98Å; N306-L309 PolarHBondContact O-N 2.78Å; N306-L310 PolarHBondContact O-N 3.28Å |
| 307 | L | 94.5 | Very high | 85.9 | Confident | 0 Ų | 0 | 38.4 Ų | 38.4 | 0% | 0 | 18% | 0.179 | C | C | . | . | H | α-helix | trans | -63.2 | -32.6 | 174.2 | -68.2 | 179.3 | 0 | 0 | 0 | 112.6 | I133 V156 C159 T303 M304 F305 L310 T332 Y335 | I133-L307 HydrophobicContact CD1-CD2 3.94Å; I133-L307 HydrophobicContact CG1-CD2 4.34Å; I133-L307 HydrophobicContact CG2-CD2 4.17Å; V156-L307 HydrophobicContact CG2-CD1 3.94Å; V156-L307 HydrophobicContact CG2-CD2 4.21Å; C159-L307 HydrophobicContact CB-CD2 3.76Å; T303-L307 HydrophobicContact CG2-CD1 4.25Å; T303-L307 HydrophobicContact CG2-CG 4.4Å; T303-L307 WeakPolarHBondContact O-CG 3.4Å; T303-L307 PolarHBondContact O-N 3.17Å; M304-L307 PolarHBondContact O-N 2.99Å; F305-L307 PolarHBondContact O-N 3.46Å; L307-L310 HydrophobicContact CD2-CD1 4.32Å; L307-T332 HydrophobicContact CB-CG2 4.07Å; L307-Y335 HydrophobicContact CD1-CD1 4.18Å; L307-Y335 HydrophobicContact CD1-CD2 3.54Å; L307-Y335 HydrophobicContact CD1-CE2 4.08Å; L307-Y335 HydrophobicContact CD1-CG 3.61Å |
| 308 | S | 93.9 | Very high | 84.7 | Confident | 0 Ų | 0 | 42 Ų | 42 | 0% | 0 | 20% | 0.195 | C | C | . | . | H | α-helix | trans | -68.7 | -43.2 | 175.7 | -55.5 | 0 | 0 | 0 | 0 | 111.3 | G34 S38 M304 F305 N306 L310 T311 | G34-S308 VanDerWaalsContact CA-CB 3.49Å; G34-S308 WeakPolarHBondContact CA-OG 3.17Å; S38-S308 PolarHBondContact OG-O 2.86Å; M304-S308 WeakPolarHBondContact CE-OG 3.47Å; M304-S308 WeakPolarHBondContact O-CB 3.24Å; M304-S308 PolarHBondContact O-N 2.99Å; M304-S308 PolarHBondContact O-OG 2.8Å; F305-S308 WeakPolarHBondContact O-CB 3.44Å; F305-S308 PolarHBondContact O-N 2.95Å; F305-S308 VanDerWaalsContact O-N 3.12Å; N306-S308 VanDerWaalsContact C-N 3.25Å; N306-S308 PolarHBondContact O-N 2.98Å; S308-L310 PolarHBondContact O-N 2.87Å; S308-T311 PolarHBondContact O-N 3.48Å; S308-T311 PolarHBondContact O-OG1 3.37Å |
| 309 | L | 92.7 | Very high | 84 | Confident | 33 Ų | 33 | 43.6 Ų | 43.6 | 17% | 0.173 | 21% | 0.206 | C | C | . | . | H | α-helix | trans | -61.9 | -25.5 | -176.6 | -69.7 | -170 | 0 | 0 | 0 | 114 | L37 F289 F305 N306 T311 A312 | L37-L309 HydrophobicContact CB-CD2 4.27Å; F289-L309 HydrophobicContact CE2-CD2 3.59Å; F289-L309 HydrophobicContact CZ-CD1 4.14Å; F289-L309 HydrophobicContact CZ-CD2 4.03Å; F305-L309 HydrophobicContact CD2-CD1 4.28Å; F305-L309 HydrophobicContact CD2-CD2 4.33Å; F305-L309 HydrophobicContact CD2-CG 4.06Å; F305-L309 HydrophobicContact CE1-CD1 4.18Å; F305-L309 HydrophobicContact CE2-CD1 3.54Å; F305-L309 HydrophobicContact CE2-CD2 3.74Å; F305-L309 HydrophobicContact CE2-CG 3.65Å; F305-L309 HydrophobicContact CZ-CD1 3.5Å; F305-L309 HydrophobicContact CZ-CD2 4.49Å; F305-L309 HydrophobicContact CZ-CG 4.16Å; F305-L309 WeakPolarHBondContact O-CG 2.98Å; F305-L309 PolarHBondContact O-N 3.23Å; F305-L309 VanDerWaalsContact O-N 3.1Å; N306-L309 PolarHBondContact O-N 2.78Å; L309-T311 PolarHBondContact O-N 3.29Å; L309-A312 WeakPolarHBondContact O-CB 3.31Å; L309-A312 PolarHBondContact O-N 2.7Å |
| 310 | L | 90.4 | Very high | 83.4 | Confident | 10 Ų | 10 | 39.6 Ų | 39.6 | 5% | 0.052 | 20% | 0.195 | C | C | . | . | G | 310 helix | trans | -52.6 | -26.4 | 171.4 | -62.6 | 178.8 | 0 | 0 | 0 | 112 | C130 I133 C159 V163 N306 L307 S308 A312 F314 V328 | C130-L310 WeakPolarHBondContact SG-CD2 3.23Å; I133-L310 HydrophobicContact CD1-CD1 3.74Å; I133-L310 HydrophobicContact CD1-CD2 4Å; I133-L310 HydrophobicContact CD1-CG 4.12Å; C159-L310 HydrophobicContact CB-CD1 3.65Å; V163-L310 HydrophobicContact CG2-CB 4.31Å; V163-L310 HydrophobicContact CG2-CD1 3.86Å; V163-L310 HydrophobicContact CG2-CD2 3.68Å; V163-L310 HydrophobicContact CG2-CG 4.15Å; N306-L310 PolarHBondContact O-N 3.28Å; L307-L310 HydrophobicContact CD2-CD1 4.32Å; S308-L310 PolarHBondContact O-N 2.87Å; L310-A312 VanDerWaalsContact C-N 3.28Å; L310-A312 PolarHBondContact O-N 2.96Å; L310-F314 WeakPolarHBondContact O-CD2 3.3Å; L310-F314 WeakPolarHBondContact O-CE2 3.22Å; L310-F314 WeakPolarHBondContact O-CZ 3.31Å; L310-V328 HydrophobicContact CB-CG1 3.78Å; L310-V328 HydrophobicContact CD1-CG1 4.38Å |
| 311 | T | 90.4 | Very high | 82.8 | Confident | 0 Ų | 0 | 38.8 Ų | 38.8 | 0% | 0 | 19% | 0.188 | C | C | . | . | G | 310 helix | trans | -73.2 | -15.6 | 177 | 70.2 | 0 | 0 | 0 | 0 | 115.5 | Q35 S38 S308 L309 D313 F314 Y315 F325 V328 V329 | Q35-T311 PolarHBondContact NE2-OG1 2.97Å; Q35-T311 PolarHBondContact OE1-OG1 3.13Å; S38-T311 WeakPolarHBondContact CB-OG1 3.34Å; S38-T311 PolarHBondContact OG-OG1 3.34Å; S308-T311 PolarHBondContact O-N 3.48Å; S308-T311 PolarHBondContact O-OG1 3.37Å; L309-T311 PolarHBondContact O-N 3.29Å; T311-D313 VanDerWaalsContact C-N 3.26Å; T311-D313 PolarHBondContact O-N 3.46Å; T311-F314 VanDerWaalsContact CA-CD2 3.44Å; T311-F314 HydrophobicContact CG2-CD2 4.36Å; T311-F314 HydrophobicContact CG2-CE2 4.27Å; T311-F314 PolarHBondContact O-N 3.41Å; T311-Y315 WeakPolarHBondContact O-CE2 3.38Å; T311-F325 HydrophobicContact CG2-CD2 4.26Å; T311-F325 HydrophobicContact CG2-CE2 4.19Å; T311-V328 HydrophobicContact CG2-CB 4.07Å; T311-V328 HydrophobicContact CG2-CG1 3.5Å; T311-V329 HydrophobicContact CG2-CG2 4.01Å |
| 312 | A | 86.1 | Confident | 82.5 | Confident | 11 Ų | 11 | 45.2 Ų | 45.2 | 9% | 0.091 | 22% | 0.216 | C | C | . | . | G | 310 helix | trans | -68.4 | -26.4 | 179.6 | 0 | 0 | 0 | 0 | 0 | 112.7 | Q41 L309 L310 Y315 | Q41-A312 HydrophobicContact CB-CB 3.97Å; Q41-A312 HydrophobicContact CG-CB 4.02Å; L309-A312 WeakPolarHBondContact O-CB 3.31Å; L309-A312 PolarHBondContact O-N 2.7Å; L310-A312 VanDerWaalsContact C-N 3.28Å; L310-A312 PolarHBondContact O-N 2.96Å; A312-Y315 WeakPolarHBondContact O-CD2 3.49Å |
| 313 | D | 74.9 | Confident | 82.1 | Confident | 59 Ų | 59 | 47.8 Ų | 47.8 | 32% | 0.316 | 23% | 0.231 | S | C | . | . | G | 310 helix | trans | -80.7 | -14.8 | -177 | -66.7 | -52.4 | 0 | 0 | 0 | 113.5 | Q126 T311 Y315 | Q126-D313 PolarHBondContact NE2-OD1 2.99Å; T311-D313 VanDerWaalsContact C-N 3.26Å; T311-D313 PolarHBondContact O-N 3.46Å; D313-Y315 PolarHBondContact O-N 3.35Å |
| 314 | F | 68.3 | Low | 81.7 | Confident | 11 Ų | 11 | 47.8 Ų | 47.8 | 5% | 0.048 | 23% | 0.231 | C | C | . | . | G | 310 helix | trans | -86 | 0.1 | -172.7 | -57.7 | -65.3 | 0 | 0 | 0 | 115.7 | V166 L310 T311 A316 F321 F325 V328 | V166-F314 HydrophobicContact CB-CD1 4.26Å; V166-F314 HydrophobicContact CB-CE1 3.84Å; V166-F314 HydrophobicContact CG2-CD1 3.12Å; V166-F314 HydrophobicContact CG2-CE1 3.11Å; V166-F314 HydrophobicContact CG2-CG 4.44Å; V166-F314 HydrophobicContact CG2-CZ 4.43Å; L310-F314 WeakPolarHBondContact O-CD2 3.3Å; L310-F314 WeakPolarHBondContact O-CE2 3.22Å; L310-F314 WeakPolarHBondContact O-CZ 3.31Å; T311-F314 VanDerWaalsContact CA-CD2 3.44Å; T311-F314 HydrophobicContact CG2-CD2 4.36Å; T311-F314 HydrophobicContact CG2-CE2 4.27Å; T311-F314 PolarHBondContact O-N 3.41Å; F314-A316 PolarHBondContact O-N 2.92Å; F314-F321 HydrophobicContact CB-CB 4.49Å; F314-F321 HydrophobicContact CD1-CD1 4.33Å; F314-F325 HydrophobicContact CB-CB 3.98Å; F314-F325 HydrophobicContact CB-CD2 4.16Å; F314-F325 HydrophobicContact CD2-CB 3.91Å; F314-F325 AromaticContact CD2-CD2 3.92Å; F314-F325 HydrophobicContact CD2-CD2 3.92Å; F314-F325 HydrophobicContact CD2-CG 4.4Å; F314-F325 HydrophobicContact CG-CB 3.95Å; F314-F325 HydrophobicContact CG-CD2 4.42Å; F314-V328 HydrophobicContact CE2-CB 3.82Å; F314-V328 HydrophobicContact CE2-CG1 4.2Å; F314-V328 HydrophobicContact CE2-CG2 3.5Å; F314-V328 VanDerWaalsContact CE2-CG2 3.5Å; F314-V328 HydrophobicContact CZ-CB 4.23Å; F314-V328 HydrophobicContact CZ-CG2 3.39Å |
| 315 | Y | 57.4 | Low | 81.4 | Confident | 96 Ų | 96 | 50.5 Ų | 50.5 | 38% | 0.376 | 24% | 0.243 | S | C | . | . | trans | -75.6 | 31.9 | -172.1 | -71.4 | -79.3 | 0 | 0 | 0 | 114.7 | L39 C42 T311 A312 D313 | L39-Y315 HydrophobicContact CD2-CE1 3.85Å; L39-Y315 HydrophobicContact CD2-CE2 4.31Å; L39-Y315 WeakPolarHBondContact CD2-OH 3.28Å; L39-Y315 WeakPolarHBondContact CG-OH 3.45Å; C42-Y315 HydrophobicContact CB-CD2 3.66Å; C42-Y315 HydrophobicContact CB-CE2 4.02Å; C42-Y315 HydrophobicContact CB-CG 4.44Å; C42-Y315 WeakPolarHBondContact SG-CD2 3.16Å; T311-Y315 WeakPolarHBondContact O-CE2 3.38Å; A312-Y315 WeakPolarHBondContact O-CD2 3.49Å; D313-Y315 PolarHBondContact O-N 3.35Å | ||
| 316 | A | 60.1 | Low | 81.3 | Confident | 51 Ų | 51 | 52.8 Ų | 52.8 | 42% | 0.421 | 26% | 0.258 | S | S | . | . | S | Bend | trans | -101 | 143.6 | 171.5 | 0 | 0 | 0 | 0 | 0 | 111.5 | F314 H318 F321 | F314-A316 PolarHBondContact O-N 2.92Å; A316-H318 VanDerWaalsContact C-N 3.31Å; A316-H318 PolarHBondContact O-N 3.23Å; A316-F321 HydrophobicContact CB-CD1 4.3Å; A316-F321 HydrophobicContact CB-CD2 3.68Å; A316-F321 HydrophobicContact CB-CE1 4.19Å; A316-F321 HydrophobicContact CB-CE2 3.58Å; A316-F321 HydrophobicContact CB-CG 4.12Å; A316-F321 HydrophobicContact CB-CZ 3.87Å; A316-F321 WeakPolarHBondContact O-CD2 3.38Å |
| 317 | F | 58.3 | Low | 81.1 | Confident | 222 Ų | 222 | 53.8 Ų | 53.8 | 97% | 0.974 | 27% | 0.265 | S | S | * | . | S | Bend | trans | -80.1 | 68.1 | -175.8 | -71.4 | -84.5 | 0 | 0 | 0 | 112.7 | ||
| 318 | H | 69.4 | Low | 81.1 | Confident | 77 Ų | 77 | 53.8 Ų | 53.8 | 36% | 0.356 | 27% | 0.265 | S | S | . | . | S | Bend | trans | -135.3 | 146.6 | 170.3 | -144.4 | -104.8 | 0 | 0 | 0 | 111 | L173 A316 L320 F321 F322 | L173-H318 HydrophobicContact CD1-CB 4.29Å; A316-H318 VanDerWaalsContact C-N 3.31Å; A316-H318 PolarHBondContact O-N 3.23Å; H318-L320 VanDerWaalsContact C-N 3.27Å; H318-L320 PolarHBondContact O-N 2.55Å; H318-F321 HydrophobicContact CB-CD2 3.23Å; H318-F321 HydrophobicContact CB-CE2 3.51Å; H318-F321 HydrophobicContact CB-CG 4.43Å; H318-F321 WeakPolarHBondContact O-CB 3.47Å; H318-F321 PolarHBondContact O-N 2.92Å; H318-F322 PolarHBondContact O-N 2.87Å |
| 319 | F | 76.3 | Confident | 81.1 | Confident | 157 Ų | 157 | 55 Ų | 55 | 69% | 0.689 | 27% | 0.272 | S | S | * | . | H | α-helix | trans | -57.9 | -39.1 | -176.5 | 177.9 | -100.1 | 0 | 0 | 0 | 112.8 | F321 F322 V323 | F319-F321 VanDerWaalsContact C-N 3.28Å; F319-F321 PolarHBondContact O-N 3.33Å; F319-F322 WeakPolarHBondContact O-CB 3.47Å; F319-F322 PolarHBondContact O-N 3.42Å; F319-F322 VanDerWaalsContact O-N 3.11Å; F319-V323 HydrophobicContact CD1-CG2 4.26Å; F319-V323 HydrophobicContact CE1-CG2 3.76Å; F319-V323 HydrophobicContact CZ-CG2 3.94Å; F319-V323 PolarHBondContact O-N 3.16Å; F319-V323 VanDerWaalsContact O-N 3.16Å |
| 320 | L | 77 | Confident | 81.2 | Confident | 54 Ų | 54 | 57.9 Ų | 57.9 | 28% | 0.283 | 29% | 0.287 | S | S | . | . | H | α-helix | trans | -61.3 | -33.2 | 175.9 | -79.2 | 163.9 | 0 | 0 | 0 | 112.8 | H318 F322 S324 | H318-L320 VanDerWaalsContact C-N 3.27Å; H318-L320 PolarHBondContact O-N 2.55Å; L320-F322 VanDerWaalsContact C-N 3.35Å; L320-S324 VanDerWaalsContact O-CB 3.3Å; L320-S324 WeakPolarHBondContact O-CB 3.49Å; L320-S324 PolarHBondContact O-N 2.85Å; L320-S324 PolarHBondContact O-OG 2.83Å |
| 321 | F | 80.1 | Confident | 81.4 | Confident | 10 Ų | 10 | 57.4 Ų | 57.4 | 4% | 0.044 | 28% | 0.284 | C | S | . | . | H | α-helix | trans | -66.9 | -37.4 | 174.5 | -66.5 | -75.2 | 0 | 0 | 0 | 111.4 | V166 D170 L173 F314 A316 H318 F319 S324 F325 | V166-F321 HydrophobicContact CB-CD1 4.48Å; V166-F321 HydrophobicContact CB-CE1 4.37Å; V166-F321 HydrophobicContact CG1-CD1 4.44Å; V166-F321 HydrophobicContact CG1-CE1 3.94Å; V166-F321 HydrophobicContact CG2-CD1 3.32Å; V166-F321 HydrophobicContact CG2-CE1 3.62Å; V166-F321 HydrophobicContact CG2-CG 4.35Å; D170-F321 WeakPolarHBondContact OD1-CZ 3.44Å; L173-F321 HydrophobicContact CD1-CE2 3.97Å; L173-F321 HydrophobicContact CD1-CZ 4.45Å; F314-F321 HydrophobicContact CB-CB 4.49Å; F314-F321 HydrophobicContact CD1-CD1 4.33Å; A316-F321 HydrophobicContact CB-CD1 4.3Å; A316-F321 HydrophobicContact CB-CD2 3.68Å; A316-F321 HydrophobicContact CB-CE1 4.19Å; A316-F321 HydrophobicContact CB-CE2 3.58Å; A316-F321 HydrophobicContact CB-CG 4.12Å; A316-F321 HydrophobicContact CB-CZ 3.87Å; A316-F321 WeakPolarHBondContact O-CD2 3.38Å; H318-F321 HydrophobicContact CB-CD2 3.23Å; H318-F321 HydrophobicContact CB-CE2 3.51Å; H318-F321 HydrophobicContact CB-CG 4.43Å; H318-F321 WeakPolarHBondContact O-CB 3.47Å; H318-F321 PolarHBondContact O-N 2.92Å; F319-F321 VanDerWaalsContact C-N 3.28Å; F319-F321 PolarHBondContact O-N 3.33Å; F321-S324 PolarHBondContact O-N 3.08Å; F321-F325 VanDerWaalsContact O-CB 3.22Å; F321-F325 WeakPolarHBondContact O-CB 3.46Å; F321-F325 PolarHBondContact O-N 3.41Å |
| 322 | F | 85.5 | Confident | 81.6 | Confident | 138 Ų | 138 | 57.4 Ų | 57.4 | 61% | 0.605 | 28% | 0.284 | S | S | * | . | H | α-helix | trans | -66.6 | -42.8 | 177.8 | -173.6 | -95.3 | 0 | 0 | 0 | 112.5 | H318 F319 L320 T326 | H318-F322 PolarHBondContact O-N 2.87Å; F319-F322 WeakPolarHBondContact O-CB 3.47Å; F319-F322 PolarHBondContact O-N 3.42Å; F319-F322 VanDerWaalsContact O-N 3.11Å; L320-F322 VanDerWaalsContact C-N 3.35Å; F322-T326 PolarHBondContact O-N 2.83Å; F322-T326 PolarHBondContact O-OG1 2.95Å |
| 323 | V | 87 | Confident | 82 | Confident | 54 Ų | 54 | 59.3 Ų | 59.3 | 33% | 0.327 | 29% | 0.292 | S | S | . | . | H | α-helix | trans | -60.8 | -49 | 174.3 | 175 | 0 | 0 | 0 | 0 | 110 | F319 F325 T326 V327 | F319-V323 HydrophobicContact CD1-CG2 4.26Å; F319-V323 HydrophobicContact CE1-CG2 3.76Å; F319-V323 HydrophobicContact CZ-CG2 3.94Å; F319-V323 PolarHBondContact O-N 3.16Å; F319-V323 VanDerWaalsContact O-N 3.16Å; V323-F325 PolarHBondContact O-N 3.43Å; V323-T326 PolarHBondContact O-N 3.23Å; V323-V327 WeakPolarHBondContact O-CG2 3.05Å; V323-V327 PolarHBondContact O-N 3.15Å |
| 324 | S | 87.1 | Confident | 82.9 | Confident | 0 Ų | 0 | 58.6 Ų | 58.6 | 0% | 0 | 29% | 0.29 | C | S | . | . | H | α-helix | trans | -61.6 | -45.4 | -179.7 | -56.8 | 0 | 0 | 0 | 0 | 112.3 | G162 C165 V166 L320 F321 T326 V327 V328 | G162-S324 VanDerWaalsContact O-CB 3.27Å; G162-S324 WeakPolarHBondContact O-CB 3.5Å; G162-S324 PolarHBondContact O-OG 3.4Å; C165-S324 WeakPolarHBondContact CB-OG 3.36Å; V166-S324 PolarHBondContact N-OG 3.41Å; L320-S324 VanDerWaalsContact O-CB 3.3Å; L320-S324 WeakPolarHBondContact O-CB 3.49Å; L320-S324 PolarHBondContact O-N 2.85Å; L320-S324 PolarHBondContact O-OG 2.83Å; F321-S324 PolarHBondContact O-N 3.08Å; S324-T326 VanDerWaalsContact C-N 3.32Å; S324-T326 PolarHBondContact O-N 2.98Å; S324-V327 PolarHBondContact O-N 3.16Å; S324-V328 WeakPolarHBondContact O-CG2 3.48Å; S324-V328 PolarHBondContact O-N 2.97Å |
| 325 | F | 89.5 | Confident | 84.1 | Confident | 57 Ų | 57 | 58.3 Ų | 58.3 | 25% | 0.25 | 29% | 0.289 | C | S | . | . | H | α-helix | trans | -55 | -47.6 | 174 | 176.6 | -90.9 | 0 | 0 | 0 | 111.4 | T311 F314 F321 V323 V327 V328 V329 | T311-F325 HydrophobicContact CG2-CD2 4.26Å; T311-F325 HydrophobicContact CG2-CE2 4.19Å; F314-F325 HydrophobicContact CB-CB 3.98Å; F314-F325 HydrophobicContact CB-CD2 4.16Å; F314-F325 HydrophobicContact CD2-CB 3.91Å; F314-F325 AromaticContact CD2-CD2 3.92Å; F314-F325 HydrophobicContact CD2-CD2 3.92Å; F314-F325 HydrophobicContact CD2-CG 4.4Å; F314-F325 HydrophobicContact CG-CB 3.95Å; F314-F325 HydrophobicContact CG-CD2 4.42Å; F321-F325 VanDerWaalsContact O-CB 3.22Å; F321-F325 WeakPolarHBondContact O-CB 3.46Å; F321-F325 PolarHBondContact O-N 3.41Å; V323-F325 PolarHBondContact O-N 3.43Å; F325-V327 VanDerWaalsContact C-N 3.34Å; F325-V327 PolarHBondContact O-N 3.02Å; F325-V328 PolarHBondContact O-N 2.96Å; F325-V329 HydrophobicContact CD1-CG2 4.17Å; F325-V329 HydrophobicContact CE1-CG2 3.75Å; F325-V329 HydrophobicContact CE2-CG2 4.22Å; F325-V329 HydrophobicContact CZ-CG2 3.77Å; F325-V329 WeakPolarHBondContact O-CG2 3.09Å; F325-V329 PolarHBondContact O-N 3.23Å |
| 326 | T | 91.8 | Very high | 85.8 | Confident | 55 Ų | 55 | 54.7 Ų | 54.7 | 34% | 0.337 | 28% | 0.278 | S | S | . | . | H | α-helix | trans | -62.3 | -43.5 | 179.6 | -57.5 | 0 | 0 | 0 | 0 | 111.3 | F322 V323 S324 V329 L330 | F322-T326 PolarHBondContact O-N 2.83Å; F322-T326 PolarHBondContact O-OG1 2.95Å; V323-T326 PolarHBondContact O-N 3.23Å; S324-T326 VanDerWaalsContact C-N 3.32Å; S324-T326 PolarHBondContact O-N 2.98Å; T326-V329 PolarHBondContact O-N 3.23Å; T326-L330 HydrophobicContact CG2-CD1 4.1Å; T326-L330 HydrophobicContact CG2-CG 4.49Å; T326-L330 WeakPolarHBondContact O-CB 3.33Å; T326-L330 VanDerWaalsContact O-CG 3.26Å; T326-L330 WeakPolarHBondContact O-CG 3.34Å; T326-L330 PolarHBondContact O-N 3.37Å |
| 327 | V | 93.4 | Very high | 87.1 | Confident | 35 Ų | 35 | 59 Ų | 59 | 21% | 0.212 | 28% | 0.283 | C | S | . | . | H | α-helix | trans | -62.6 | -43.9 | 177.9 | 171 | 0 | 0 | 0 | 0 | 111.4 | L158 V323 S324 F325 L330 G331 | L158-V327 WeakPolarHBondContact O-CG1 3.49Å; V323-V327 WeakPolarHBondContact O-CG2 3.05Å; V323-V327 PolarHBondContact O-N 3.15Å; S324-V327 PolarHBondContact O-N 3.16Å; F325-V327 VanDerWaalsContact C-N 3.34Å; F325-V327 PolarHBondContact O-N 3.02Å; V327-L330 PolarHBondContact O-N 2.97Å; V327-G331 PolarHBondContact O-N 3.37Å |
| 328 | V | 93 | Very high | 88.5 | Confident | 0 Ų | 0 | 54 Ų | 54 | 0% | 0 | 26% | 0.261 | C | S | . | . | H | α-helix | trans | -65.4 | -44.8 | 176.9 | 175.6 | 0 | 0 | 0 | 0 | 111.4 | C159 L310 T311 F314 S324 F325 L330 G331 T332 | C159-V328 PolarHBondContact SG-O 2.99Å; L310-V328 HydrophobicContact CB-CG1 3.78Å; L310-V328 HydrophobicContact CD1-CG1 4.38Å; T311-V328 HydrophobicContact CG2-CB 4.07Å; T311-V328 HydrophobicContact CG2-CG1 3.5Å; F314-V328 HydrophobicContact CE2-CB 3.82Å; F314-V328 HydrophobicContact CE2-CG1 4.2Å; F314-V328 HydrophobicContact CE2-CG2 3.5Å; F314-V328 VanDerWaalsContact CE2-CG2 3.5Å; F314-V328 HydrophobicContact CZ-CB 4.23Å; F314-V328 HydrophobicContact CZ-CG2 3.39Å; S324-V328 WeakPolarHBondContact O-CG2 3.48Å; S324-V328 PolarHBondContact O-N 2.97Å; F325-V328 PolarHBondContact O-N 2.96Å; V328-L330 VanDerWaalsContact C-N 3.32Å; V328-L330 PolarHBondContact O-N 2.94Å; V328-G331 WeakPolarHBondContact O-CA 3.43Å; V328-G331 PolarHBondContact O-N 3.36Å; V328-G331 VanDerWaalsContact O-N 3.11Å; V328-T332 WeakPolarHBondContact O-CG2 3.48Å; V328-T332 PolarHBondContact O-N 2.89Å |
| 329 | V | 93.7 | Very high | 89.1 | Confident | 26 Ų | 26 | 54.9 Ų | 54.9 | 16% | 0.158 | 27% | 0.265 | C | S | . | . | H | α-helix | trans | -59.7 | -44.3 | 176.7 | 172 | 0 | 0 | 0 | 0 | 110.7 | V31 T311 F325 T326 G331 T332 I333 | V31-V329 HydrophobicContact CG1-CG1 4.46Å; T311-V329 HydrophobicContact CG2-CG2 4.01Å; F325-V329 HydrophobicContact CD1-CG2 4.17Å; F325-V329 HydrophobicContact CE1-CG2 3.75Å; F325-V329 HydrophobicContact CE2-CG2 4.22Å; F325-V329 HydrophobicContact CZ-CG2 3.77Å; F325-V329 WeakPolarHBondContact O-CG2 3.09Å; F325-V329 PolarHBondContact O-N 3.23Å; T326-V329 PolarHBondContact O-N 3.23Å; V329-G331 VanDerWaalsContact C-N 3.34Å; V329-G331 PolarHBondContact O-N 2.96Å; V329-T332 PolarHBondContact O-N 3.04Å; V329-T332 PolarHBondContact O-OG1 2.81Å; V329-I333 HydrophobicContact CG1-CD1 3.99Å; V329-I333 WeakPolarHBondContact O-CG1 3.46Å; V329-I333 PolarHBondContact O-N 2.76Å |
| 330 | L | 95.4 | Very high | 89.1 | Confident | 92 Ų | 92 | 48.5 Ų | 48.5 | 48% | 0.482 | 24% | 0.239 | S | C | . | . | H | α-helix | trans | -61 | -42.8 | 174.3 | -71.7 | 172.3 | 0 | 0 | 0 | 111.9 | T326 V327 V328 T332 I333 V334 | T326-L330 HydrophobicContact CG2-CD1 4.1Å; T326-L330 HydrophobicContact CG2-CG 4.49Å; T326-L330 WeakPolarHBondContact O-CB 3.33Å; T326-L330 VanDerWaalsContact O-CG 3.26Å; T326-L330 WeakPolarHBondContact O-CG 3.34Å; T326-L330 PolarHBondContact O-N 3.37Å; V327-L330 PolarHBondContact O-N 2.97Å; V328-L330 VanDerWaalsContact C-N 3.32Å; V328-L330 PolarHBondContact O-N 2.94Å; L330-T332 VanDerWaalsContact C-N 3.33Å; L330-T332 PolarHBondContact O-N 2.89Å; L330-I333 WeakPolarHBondContact O-CB 3.21Å; L330-I333 PolarHBondContact O-N 3.44Å; L330-V334 WeakPolarHBondContact O-CG2 3.32Å; L330-V334 PolarHBondContact O-N 3.42Å |
| 331 | G | 95.3 | Very high | 88.8 | Confident | 0 Ų | 0 | 48.2 Ų | 48.2 | 0% | 0 | 24% | 0.244 | C | C | . | . | H | α-helix | trans | -57.1 | -43.4 | 173.8 | 0 | 0 | 0 | 0 | 0 | 112.7 | G155 V327 V328 V329 I333 V334 Y335 | G155-G331 WeakPolarHBondContact CA-O 3.24Å; G155-G331 WeakPolarHBondContact O-CA 3.32Å; V327-G331 PolarHBondContact O-N 3.37Å; V328-G331 WeakPolarHBondContact O-CA 3.43Å; V328-G331 PolarHBondContact O-N 3.36Å; V328-G331 VanDerWaalsContact O-N 3.11Å; V329-G331 VanDerWaalsContact C-N 3.34Å; V329-G331 PolarHBondContact O-N 2.96Å; G331-I333 PolarHBondContact O-N 3.27Å; G331-V334 PolarHBondContact O-N 3.25Å; G331-Y335 WeakPolarHBondContact O-CB 3.43Å; G331-Y335 PolarHBondContact O-N 2.94Å |
| 332 | T | 93.9 | Very high | 88.3 | Confident | 0 Ų | 0 | 49.7 Ų | 49.7 | 0% | 0 | 25% | 0.254 | C | S | . | . | H | α-helix | trans | -66.4 | -35.1 | 176.1 | 66.3 | 0 | 0 | 0 | 0 | 113.3 | M304 L307 V328 V329 L330 S336 | M304-T332 HydrophobicContact CE-CG2 3.93Å; M304-T332 HydrophobicContact SD-CG2 4.35Å; L307-T332 HydrophobicContact CB-CG2 4.07Å; V328-T332 WeakPolarHBondContact O-CG2 3.48Å; V328-T332 PolarHBondContact O-N 2.89Å; V329-T332 PolarHBondContact O-N 3.04Å; V329-T332 PolarHBondContact O-OG1 2.81Å; L330-T332 VanDerWaalsContact C-N 3.33Å; L330-T332 PolarHBondContact O-N 2.89Å; T332-S336 VanDerWaalsContact O-CB 3.28Å; T332-S336 WeakPolarHBondContact O-CB 3.47Å; T332-S336 PolarHBondContact O-N 3.35Å; T332-S336 PolarHBondContact O-OG 3.25Å |
| 333 | I | 94.9 | Very high | 86.7 | Confident | 51 Ų | 51 | 48.1 Ų | 48.1 | 26% | 0.262 | 25% | 0.245 | S | C | . | . | H | α-helix | trans | -66.3 | -47.4 | 174.4 | -69.5 | 164.1 | 0 | 0 | 0 | 110 | I27 V31 V329 L330 G331 Y335 S336 W337 | I27-I333 HydrophobicContact CG2-CG2 4.28Å; V31-I333 HydrophobicContact CG2-CG1 3.83Å; V329-I333 HydrophobicContact CG1-CD1 3.99Å; V329-I333 WeakPolarHBondContact O-CG1 3.46Å; V329-I333 PolarHBondContact O-N 2.76Å; L330-I333 WeakPolarHBondContact O-CB 3.21Å; L330-I333 PolarHBondContact O-N 3.44Å; G331-I333 PolarHBondContact O-N 3.27Å; I333-Y335 VanDerWaalsContact C-N 3.34Å; I333-Y335 PolarHBondContact O-N 3.27Å; I333-S336 PolarHBondContact O-N 2.83Å; I333-W337 PolarHBondContact O-N 3.29Å |
| 334 | V | 94.4 | Very high | 84.9 | Confident | 44 Ų | 44 | 52.9 Ų | 52.9 | 27% | 0.267 | 26% | 0.263 | S | S | . | . | H | α-helix | trans | -62.1 | -43 | 178.3 | 171.8 | 0 | 0 | 0 | 0 | 110.8 | I154 L158 L330 G331 S336 W337 | I154-V334 HydrophobicContact CB-CG1 4.35Å; I154-V334 HydrophobicContact CG2-CG1 4.08Å; L158-V334 HydrophobicContact CD1-CB 4.43Å; L158-V334 HydrophobicContact CD1-CG2 4.11Å; L330-V334 WeakPolarHBondContact O-CG2 3.32Å; L330-V334 PolarHBondContact O-N 3.42Å; G331-V334 PolarHBondContact O-N 3.25Å; V334-S336 VanDerWaalsContact C-N 3.34Å; V334-S336 PolarHBondContact O-N 3.15Å; V334-W337 VanDerWaalsContact O-CB 3.31Å; V334-W337 WeakPolarHBondContact O-CB 3.38Å; V334-W337 PolarHBondContact O-N 3.04Å |
| 335 | Y | 93.3 | Very high | 83 | Confident | 5 Ų | 5 | 56.5 Ų | 56.5 | 2% | 0.02 | 29% | 0.293 | C | S | . | . | H | α-helix | trans | -60.4 | -43.6 | 174.4 | -177.5 | -85.7 | 0 | 0 | 0 | 111.6 | H152 V156 S301 T303 M304 L307 G331 I333 W337 | H152-Y335 HydrophobicContact CB-CD2 3.74Å; H152-Y335 HydrophobicContact CB-CE2 3.64Å; H152-Y335 AromaticContact CD2-CD2 3.91Å; H152-Y335 AromaticContact CD2-CE2 3.71Å; H152-Y335 AromaticContact CD2-CZ 3.8Å; H152-Y335 PolarHBondContact CD2-O 3.12Å; H152-Y335 VanDerWaalsContact CD2-O 3.29Å; V156-Y335 HydrophobicContact CG2-CD2 4.09Å; V156-Y335 HydrophobicContact CG2-CE2 4.27Å; S301-Y335 PolarHBondContact OG-OH 3.22Å; T303-Y335 VanDerWaalsContact CB-OH 3.28Å; T303-Y335 WeakPolarHBondContact CB-OH 3Å; T303-Y335 HydrophobicContact CG2-CE2 3.67Å; M304-Y335 HydrophobicContact CB-CD1 4.11Å; M304-Y335 HydrophobicContact CB-CE1 3.82Å; M304-Y335 HydrophobicContact CG-CD1 4.48Å; M304-Y335 HydrophobicContact SD-CD1 4.03Å; L307-Y335 HydrophobicContact CD1-CD1 4.18Å; L307-Y335 HydrophobicContact CD1-CD2 3.54Å; L307-Y335 HydrophobicContact CD1-CE2 4.08Å; L307-Y335 HydrophobicContact CD1-CG 3.61Å; G331-Y335 WeakPolarHBondContact O-CB 3.43Å; G331-Y335 PolarHBondContact O-N 2.94Å; I333-Y335 VanDerWaalsContact C-N 3.34Å; I333-Y335 PolarHBondContact O-N 3.27Å; Y335-W337 PolarHBondContact O-N 2.84Å |
| 336 | S | 91.8 | Very high | 80.6 | Confident | 21 Ų | 21 | 59 Ų | 59 | 15% | 0.147 | 31% | 0.309 | C | S | . | . | H | α-helix | trans | -77.5 | -5.5 | -177.3 | -59.5 | 0 | 0 | 0 | 0 | 114.1 | I27 T332 I333 V334 K338 | I27-S336 WeakPolarHBondContact CG1-O 3.33Å; T332-S336 VanDerWaalsContact O-CB 3.28Å; T332-S336 WeakPolarHBondContact O-CB 3.47Å; T332-S336 PolarHBondContact O-N 3.35Å; T332-S336 PolarHBondContact O-OG 3.25Å; I333-S336 PolarHBondContact O-N 2.83Å; V334-S336 VanDerWaalsContact C-N 3.34Å; V334-S336 PolarHBondContact O-N 3.15Å; S336-K338 PolarHBondContact O-N 3.46Å |
| 337 | W | 88.9 | Confident | 77.9 | Confident | 140 Ų | 140 | 62.9 Ų | 62.9 | 53% | 0.53 | 32% | 0.323 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -60.2 | -32.8 | -175.2 | -166.1 | -86.1 | 0 | 0 | 0 | 113.1 | I27 I333 V334 Y335 | I27-W337 HydrophobicContact CD1-CE3 4.29Å; I333-W337 PolarHBondContact O-N 3.29Å; V334-W337 VanDerWaalsContact O-CB 3.31Å; V334-W337 WeakPolarHBondContact O-CB 3.38Å; V334-W337 PolarHBondContact O-N 3.04Å; Y335-W337 PolarHBondContact O-N 2.84Å |
| 338 | K | 86.6 | Confident | 75.1 | Confident | 118 Ų | 118 | 66.7 Ų | 66.7 | 51% | 0.513 | 35% | 0.348 | S | S | . | . | S | Bend | trans | -130.6 | 145.7 | 176.9 | -168.1 | 151.1 | 171.3 | -174.8 | 0 | 109.2 | L149 H152 S336 | L149-K338 HydrophobicContact CD2-CD 3.45Å; L149-K338 VanDerWaalsContact CD2-CD 3.45Å; L149-K338 HydrophobicContact CD2-CG 4.16Å; L149-K338 VanDerWaalsContact CD2-NZ 3.35Å; H152-K338 PolarHBondContact NE2-O 3.41Å; H152-K338 VanDerWaalsContact NE2-O 3.08Å; S336-K338 PolarHBondContact O-N 3.46Å |
| 339 | E | 81.6 | Confident | 72.1 | Confident | 96 Ų | 96 | 69.9 Ų | 69.9 | 45% | 0.449 | 38% | 0.381 | S | S | . | . | trans | -75.1 | 140.2 | 179.5 | -66.8 | -176.1 | 158.6 | 0 | 0 | 111.4 | R26 A341 | R26-E339 VanDerWaalsContact CD-OE1 3.24Å; R26-E339 WeakPolarHBondContact CD-OE1 3.44Å; R26-E339 IonicContact CZ-OE1 2.72Å; R26-E339 IonicContact NE-OE1 3.96Å; R26-E339 PolarHBondContact NE-OE1 2.78Å; R26-E339 IonicContact NH1-OE1 3.6Å; R26-E339 PolarHBondContact NH1-OE1 3.23Å; R26-E339 IonicContact NH1-OE2 3.35Å; E339-A341 PolarHBondContact O-N 3.27Å; E339-A341 VanDerWaalsContact O-N 3.15Å | ||
| 340 | T | 77.7 | Confident | 69 | Low | 22 Ų | 22 | 73.9 Ų | 73.9 | 14% | 0.135 | 41% | 0.405 | C | S | . | . | trans | -68.2 | 105.3 | 166.7 | 23.2 | 0 | 0 | 0 | 0 | 109.8 | I146 Y148 | I146-T340 HydrophobicContact CG2-CG2 3.49Å; I146-T340 VanDerWaalsContact CG2-CG2 3.49Å; Y148-T340 HydrophobicContact CD1-CG2 3.96Å; Y148-T340 HydrophobicContact CE1-CG2 3.9Å | ||
| 341 | A | 69.5 | Low | 65.8 | Low | 48 Ų | 48 | 75.6 Ų | 75.6 | 40% | 0.397 | 43% | 0.425 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -81.5 | 134.6 | 177.8 | 0 | 0 | 0 | 0 | 0 | 111.7 | R147 E339 | R147-A341 PolarHBondContact N-O 3.34Å; E339-A341 PolarHBondContact O-N 3.27Å; E339-A341 VanDerWaalsContact O-N 3.15Å |
| 342 | T | 70.5 | Confident | 62.9 | Low | 41 Ų | 41 | 81 Ų | 81 | 25% | 0.252 | 46% | 0.458 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -74.8 | 137 | 167 | -52.8 | 0 | 0 | 0 | 0 | 109.2 | R209 Q344 A345 | R209-T342 PolarHBondContact NH1-OG1 2.91Å; R209-T342 VanDerWaalsContact NH1-OG1 3.07Å; T342-Q344 PolarHBondContact O-N 2.89Å; T342-A345 PolarHBondContact O-N 3.31Å |
| 343 | R | 52.3 | Low | 59.8 | Low | 106 Ų | 106 | 84.3 Ų | 84.3 | 40% | 0.4 | 49% | 0.492 | S | S | . | . | G | 310 helix | trans | -47.6 | -28.9 | -177.9 | -83.5 | -176.1 | -172.2 | -147.4 | 4.9 | 115.5 | K145 R147 A345 L346 | K145-R343 HydrophobicContact CB-CB 4.21Å; K145-R343 HydrophobicContact CB-CG 4.29Å; K145-R343 WeakPolarHBondContact O-CG 3.5Å; K145-R343 PolarHBondContact O-N 2.87Å; R147-R343 HydrophobicContact CG-CG 3.95Å; R343-A345 VanDerWaalsContact C-N 3.33Å; R343-A345 PolarHBondContact O-N 3.48Å; R343-L346 PolarHBondContact O-N 3.35Å |
| 344 | Q | 49.3 | Very low | 56.8 | Low | 153 Ų | 153 | 93.2 Ų | 93.2 | 72% | 0.715 | 52% | 0.522 | S | S | * | . | G | 310 helix | trans | -70.3 | -23.3 | 179.4 | -72.8 | 174.9 | -23.2 | 0 | 0 | 114.1 | T342 L346 | T342-Q344 PolarHBondContact O-N 2.89Å; Q344-L346 VanDerWaalsContact C-N 3.25Å; Q344-L346 PolarHBondContact O-N 3.36Å |
| 345 | A | 45.9 | Very low | 53.5 | Low | 77 Ų | 77 | 98.8 Ų | 98.8 | 64% | 0.636 | 55% | 0.551 | S | S | * | * | G | 310 helix | trans | -74.9 | -12.9 | 179.4 | 0 | 0 | 0 | 0 | 0 | 113.6 | T342 R343 | T342-A345 PolarHBondContact O-N 3.31Å; R343-A345 VanDerWaalsContact C-N 3.33Å; R343-A345 PolarHBondContact O-N 3.48Å |
| 346 | L | 39.2 | Very low | 50.6 | Low | 109 Ų | 109 | 106.9 Ų | 106.9 | 57% | 0.571 | 59% | 0.591 | S | S | * | * | G | 310 helix | trans | -91.2 | -1.5 | -175.3 | -156.5 | 71.5 | 0 | 0 | 0 | 114 | R147 R343 Q344 P348 | R147-L346 VanDerWaalsContact NH1-CD2 3.25Å; R343-L346 PolarHBondContact O-N 3.35Å; Q344-L346 VanDerWaalsContact C-N 3.25Å; Q344-L346 PolarHBondContact O-N 3.36Å; L346-P348 WeakPolarHBondContact O-CD 3.34Å |
| 347 | H | 36.3 | Very low | 47.5 | Very low | 137 Ų | 137 | 111.5 Ų | 111.5 | 63% | 0.634 | 62% | 0.623 | S | S | * | * | trans | -117.6 | 70.6 | 173.7 | -69.3 | -79 | 0 | 0 | 0 | 112.9 | G349 | H347-G349 VanDerWaalsContact C-N 3.35Å; H347-G349 PolarHBondContact O-N 2.89Å | ||
| 348 | P | 34.2 | Very low | 44.6 | Very low | 114 Ų | 114 | 110.3 Ų | 110.3 | 74% | 0.74 | 63% | 0.633 | S | S | * | * | trans | -86.1 | 75 | 157.4 | 34.4 | -27.2 | 0 | 0 | 0 | 108.5 | L346 | L346-P348 WeakPolarHBondContact O-CD 3.34Š| ||
| 349 | G | 30.5 | Very low | 42 | Very low | 67 Ų | 67 | 110.6 Ų | 110.6 | 69% | 0.691 | 65% | 0.648 | S | S | * | * | trans | 172.7 | 30.7 | -177.1 | 0 | 0 | 0 | 0 | 0 | 121.2 | H347 | H347-G349 VanDerWaalsContact C-N 3.35Å; H347-G349 PolarHBondContact O-N 2.89Å | ||
| 350 | T | 28.4 | Very low | 39.7 | Very low | 110 Ų | 110 | 113 Ų | 113 | 68% | 0.675 | 67% | 0.668 | S | S | * | * | trans | -142.4 | 83.9 | 164.2 | 9.4 | 0 | 0 | 0 | 0 | 110.4 | V352 | T350-V352 HydrophobicContact CG2-CG2 4.05Å; T350-V352 PolarHBondContact O-N 3.47Å | ||
| 351 | S | 27.3 | Very low | 37.2 | Very low | 128 Ų | 128 | 116.9 Ų | 116.9 | 90% | 0.895 | 70% | 0.696 | S | S | * | * | trans | -70.5 | 95.6 | 151.3 | 48.7 | 0 | 0 | 0 | 0 | 107.5 | ||||
| 352 | V | 33.8 | Very low | 35.2 | Very low | 114 Ų | 114 | 119.4 Ų | 119.4 | 69% | 0.691 | 71% | 0.711 | S | S | * | * | trans | -112.6 | 111.9 | 162.1 | 177.9 | 0 | 0 | 0 | 0 | 106 | T350 | T350-V352 HydrophobicContact CG2-CG2 4.05Å; T350-V352 PolarHBondContact O-N 3.47Å | ||
| 353 | G | 29.7 | Very low | 33.4 | Very low | 70 Ų | 70 | 125.3 Ų | 125.3 | 72% | 0.722 | 74% | 0.736 | S | S | * | * | trans | -57.6 | 138.1 | 176.2 | 0 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 354 | R | 31.7 | Very low | 32.3 | Very low | 237 Ų | 237 | 128 Ų | 128 | 89% | 0.894 | 76% | 0.759 | S | S | * | * | trans | -151.7 | 110.2 | 151.6 | -114.6 | -179.3 | -127.6 | 163.9 | 1 | 108.4 | M356 | R354-M356 PolarHBondContact O-N 3.36Š| ||
| 355 | D | 25.4 | Very low | 31.6 | Very low | 161 Ų | 161 | 131.6 Ų | 131.6 | 86% | 0.861 | 77% | 0.767 | S | S | * | * | trans | -46.9 | 126.2 | 151.2 | -69.6 | -50.2 | 0 | 0 | 0 | 109.6 | ||||
| 356 | M | 32.4 | Very low | 30.9 | Very low | 176 Ų | 176 | 132.3 Ų | 132.3 | 87% | 0.867 | 77% | 0.773 | S | S | * | * | 171.1 | 114.3 | 128.1 | -139.8 | 84.8 | 169.4 | 0 | 0 | 106.5 | R354 | R354-M356 PolarHBondContact O-N 3.36Š| |||
| 357 | S | 26.2 | Very low | 30.8 | Very low | 117 Ų | 117 | 132.4 Ų | 132.4 | 82% | 0.818 | 77% | 0.772 | S | S | * | * | trans | -70.6 | 149.3 | 172 | 37.7 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 358 | P | 29.2 | Very low | 30.5 | Very low | 115 Ų | 115 | 135.2 Ų | 135.2 | 75% | 0.747 | 78% | 0.783 | S | S | * | * | trans | -128.7 | 160.8 | 141.8 | 36.1 | -24.3 | 0 | 0 | 0 | 112.1 | ||||
| 359 | P | 30.7 | Very low | 30.8 | Very low | 125 Ų | 125 | 135.4 Ų | 135.4 | 81% | 0.812 | 78% | 0.776 | S | S | * | * | trans | -86.4 | 134.9 | -173.2 | 33.7 | -31 | 0 | 0 | 0 | 112.9 | ||||
| 360 | V | 33.9 | Very low | 30.8 | Very low | 145 Ų | 145 | 135.6 Ų | 135.6 | 88% | 0.879 | 77% | 0.766 | S | S | * | * | trans | 24.3 | 110.1 | 158.1 | -169.7 | 0 | 0 | 0 | 0 | 119.4 | ||||
| 361 | S | 25 | Very low | 31.3 | Very low | 104 Ų | 104 | 135.3 Ų | 135.3 | 73% | 0.727 | 77% | 0.766 | S | S | * | * | -165.7 | 134 | 128.2 | 63.4 | 0 | 0 | 0 | 0 | 111.8 | |||||
| 362 | S | 28 | Very low | 31.9 | Very low | 102 Ų | 102 | 134.2 Ų | 134.2 | 71% | 0.713 | 75% | 0.754 | S | S | * | * | S | Bend | trans | 60.5 | 119.2 | 154.5 | 47 | 0 | 0 | 0 | 0 | 121 | ||
| 363 | E | 32.2 | Very low | 31.9 | Very low | 164 Ų | 164 | 135 Ų | 135 | 77% | 0.766 | 75% | 0.749 | S | S | * | * | trans | 53 | 78.5 | 142.7 | -64.6 | -174.7 | 123.7 | 0 | 0 | 118 | ||||
| 364 | D | 28.6 | Very low | 31.9 | Very low | 164 Ų | 164 | 135.9 Ų | 135.9 | 88% | 0.877 | 76% | 0.759 | S | S | * | * | trans | -154.2 | 77.7 | 147.6 | -101.6 | -27.9 | 0 | 0 | 0 | 110.4 | A366 | D364-A366 PolarHBondContact O-N 3.36Å; D364-A366 VanDerWaalsContact O-N 3.11Å | ||
| 365 | Y | 35.4 | Very low | 31.8 | Very low | 227 Ų | 227 | 128.2 Ų | 128.2 | 89% | 0.89 | 75% | 0.746 | S | S | * | * | trans | -75.4 | 93.5 | 162 | -96.8 | -87.5 | 0 | 0 | 0 | 108.2 | M367 | Y365-M367 VanDerWaalsContact C-N 3.32Å; Y365-M367 PolarHBondContact O-N 2.89Å | ||
| 366 | A | 30.2 | Very low | 32.3 | Very low | 93 Ų | 93 | 126.5 Ų | 126.5 | 77% | 0.769 | 74% | 0.741 | S | S | * | * | trans | -64.3 | 92.8 | 165.7 | 0 | 0 | 0 | 0 | 0 | 109.3 | D364 K368 | D364-A366 PolarHBondContact O-N 3.36Å; D364-A366 VanDerWaalsContact O-N 3.11Å; A366-K368 PolarHBondContact O-N 2.99Å | ||
| 367 | M | 38.1 | Very low | 32.1 | Very low | 111 Ų | 111 | 126 Ų | 126 | 55% | 0.547 | 74% | 0.741 | S | S | . | * | trans | -80.7 | 103.2 | -179.3 | -160.1 | -177.8 | -68 | 0 | 0 | 110 | Y365 I369 | Y365-M367 VanDerWaalsContact C-N 3.32Å; Y365-M367 PolarHBondContact O-N 2.89Å; M367-I369 HydrophobicContact CB-CG1 4.48Å; M367-I369 HydrophobicContact CG-CD1 4.3Å; M367-I369 HydrophobicContact CG-CG1 3.69Å; M367-I369 PolarHBondContact O-N 3.16Å; M367-I369 HydrophobicContact SD-CD1 3.75Å; M367-I369 HydrophobicContact SD-CG1 3.72Å | ||
| 368 | K | 30.1 | Very low | 32.4 | Very low | 196 Ų | 196 | 125.8 Ų | 125.8 | 85% | 0.852 | 74% | 0.735 | S | S | * | * | trans | -81.6 | 99.3 | 161.7 | -84.5 | -177.9 | 177.2 | 176.4 | 0 | 108.5 | A366 | A366-K368 PolarHBondContact O-N 2.99Š| ||
| 369 | I | 41.1 | Very low | 32.5 | Very low | 117 Ų | 117 | 128.1 Ų | 128.1 | 60% | 0.6 | 74% | 0.735 | S | S | * | * | trans | -83.4 | 120.7 | 174.5 | -58.5 | 175.4 | 0 | 0 | 0 | 108.5 | M367 | M367-I369 HydrophobicContact CB-CG1 4.48Å; M367-I369 HydrophobicContact CG-CD1 4.3Å; M367-I369 HydrophobicContact CG-CG1 3.69Å; M367-I369 PolarHBondContact O-N 3.16Å; M367-I369 HydrophobicContact SD-CD1 3.75Å; M367-I369 HydrophobicContact SD-CG1 3.72Å | ||
| 370 | C | 29 | Very low | 32.4 | Very low | 72 Ų | 72 | 130.5 Ų | 130.5 | 49% | 0.486 | 73% | 0.733 | S | S | . | * | trans | -75.1 | 120.5 | 163.6 | -178.6 | 0 | 0 | 0 | 0 | 108.3 | V372 | C370-V372 PolarHBondContact O-N 3.04Š| ||
| 371 | P | 39.8 | Very low | 32.3 | Very low | 103 Ų | 103 | 128.9 Ų | 128.9 | 67% | 0.669 | 73% | 0.725 | S | S | * | * | S | Bend | trans | -71.6 | -1.8 | -168.7 | 25.9 | -32.8 | 0 | 0 | 0 | 115 | ||
| 372 | V | 40.5 | Very low | 32.8 | Very low | 106 Ų | 106 | 129.9 Ų | 129.9 | 64% | 0.642 | 73% | 0.727 | S | S | * | * | S | Bend | trans | -112.4 | -32.3 | -174.8 | -174.2 | 0 | 0 | 0 | 0 | 112.8 | C370 | C370-V372 PolarHBondContact O-N 3.04Š|
| 373 | H | 31.9 | Very low | 33 | Very low | 129 Ų | 129 | 127.9 Ų | 127.9 | 60% | 0.597 | 72% | 0.722 | S | S | * | * | trans | -125.1 | 107.1 | -178.6 | -57 | 117.6 | 0 | 0 | 0 | 108.3 | A375 | H373-A375 PolarHBondContact O-N 2.99Š| ||
| 374 | G | 31.3 | Very low | 33 | Very low | 89 Ų | 89 | 125.6 Ų | 125.6 | 92% | 0.918 | 72% | 0.719 | S | S | * | * | trans | -66.3 | 34.3 | 174.7 | 0 | 0 | 0 | 0 | 0 | 114.4 | ||||
| 375 | A | 28.7 | Very low | 33.1 | Very low | 76 Ų | 76 | 128 Ų | 128 | 63% | 0.628 | 72% | 0.716 | S | S | * | * | trans | -88.7 | 119.7 | 172 | 0 | 0 | 0 | 0 | 0 | 108.8 | H373 L377 | H373-A375 PolarHBondContact O-N 2.99Å; A375-L377 PolarHBondContact O-N 3.3Å | ||
| 376 | V | 36.1 | Very low | 32.9 | Very low | 126 Ų | 126 | 125.4 Ų | 125.4 | 76% | 0.764 | 71% | 0.712 | S | S | * | * | trans | -60.8 | 105.8 | 165.8 | -176 | 0 | 0 | 0 | 0 | 107 | V378 | V376-V378 HydrophobicContact CB-CG2 4.43Å; V376-V378 HydrophobicContact CG1-CG2 3.5Å; V376-V378 PolarHBondContact O-N 3.35Å | ||
| 377 | L | 27.8 | Very low | 33.2 | Very low | 166 Ų | 166 | 127 Ų | 127 | 87% | 0.869 | 71% | 0.708 | S | S | * | * | trans | -73.1 | 84.4 | 159.2 | -80 | 169.9 | 0 | 0 | 0 | 106.7 | A375 H379 | A375-L377 PolarHBondContact O-N 3.3Å; L377-H379 VanDerWaalsContact C-N 3.28Å; L377-H379 PolarHBondContact O-N 3.07Å | ||
| 378 | V | 33.7 | Very low | 32.8 | Very low | 111 Ų | 111 | 129.9 Ų | 129.9 | 67% | 0.673 | 73% | 0.725 | S | S | * | * | trans | -64.4 | 101.7 | 155.9 | -179 | 0 | 0 | 0 | 0 | 104.4 | V376 K380 | V376-V378 HydrophobicContact CB-CG2 4.43Å; V376-V378 HydrophobicContact CG1-CG2 3.5Å; V376-V378 PolarHBondContact O-N 3.35Å; V378-K380 PolarHBondContact O-N 3.35Å | ||
| 379 | H | 30.1 | Very low | 33.1 | Very low | 165 Ų | 165 | 129.3 Ų | 129.3 | 76% | 0.764 | 73% | 0.727 | S | S | * | * | trans | -63.1 | 98 | 161 | -129.8 | -73.8 | 0 | 0 | 0 | 105.2 | L377 | L377-H379 VanDerWaalsContact C-N 3.28Å; L377-H379 PolarHBondContact O-N 3.07Å | ||
| 380 | K | 27.9 | Very low | 32.8 | Very low | 174 Ų | 174 | 132.3 Ų | 132.3 | 76% | 0.757 | 74% | 0.739 | S | S | * | * | trans | -54.1 | 128 | 159.1 | -134.6 | 177.7 | -175.9 | 179.8 | 0 | 104.3 | V378 V382 | V378-K380 PolarHBondContact O-N 3.35Å; K380-V382 PolarHBondContact O-N 3.3Å | ||
| 381 | P | 31.9 | Very low | 33.7 | Very low | 111 Ų | 111 | 134.7 Ų | 134.7 | 72% | 0.721 | 75% | 0.753 | S | S | * | * | trans | -53 | 124.1 | 164.6 | -13.9 | 25.8 | 0 | 0 | 0 | 105.1 | G383 | P381-G383 PolarHBondContact O-N 3.14Š| ||
| 382 | V | 35.6 | Very low | 33.8 | Very low | 125 Ų | 125 | 139.7 Ų | 139.7 | 76% | 0.758 | 78% | 0.783 | S | S | * | * | trans | -56.9 | 105.8 | 162 | 173.7 | 0 | 0 | 0 | 0 | 103.5 | K380 V384 | K380-V382 PolarHBondContact O-N 3.3Å; V382-V384 PolarHBondContact O-N 3.41Å | ||
| 383 | G | 33.3 | Very low | 33.4 | Very low | 60 Ų | 60 | 141.4 Ų | 141.4 | 62% | 0.619 | 79% | 0.79 | S | S | * | * | trans | -57 | 110.5 | 168.7 | 0 | 0 | 0 | 0 | 0 | 105.2 | P381 R385 | P381-G383 PolarHBondContact O-N 3.14Å; G383-R385 VanDerWaalsContact C-N 3.25Å; G383-R385 PolarHBondContact O-N 3.37Å | ||
| 384 | V | 32.3 | Very low | 33.5 | Very low | 117 Ų | 117 | 142.1 Ų | 142.1 | 71% | 0.709 | 80% | 0.8 | S | S | * | * | trans | -56 | 103.1 | 162.1 | 175.3 | 0 | 0 | 0 | 0 | 104.4 | V382 H386 | V382-V384 PolarHBondContact O-N 3.41Å; V384-H386 VanDerWaalsContact C-N 3.32Å; V384-H386 PolarHBondContact O-N 2.96Å | ||
| 385 | R | 30.3 | Very low | 33.6 | Very low | 213 Ų | 213 | 145 Ų | 145 | 80% | 0.804 | 79% | 0.793 | S | S | * | * | trans | -72.1 | 99 | 170.3 | -156 | -174.7 | -69.7 | -173.4 | -0.8 | 104.4 | G383 D387 | G383-R385 VanDerWaalsContact C-N 3.25Å; G383-R385 PolarHBondContact O-N 3.37Å; R385-D387 HydrophobicContact CG-CB 4.45Å; R385-D387 WeakPolarHBondContact CG-OD2 3.35Å; R385-D387 PolarHBondContact O-N 3.46Å | ||
| 386 | H | 32.1 | Very low | 33.9 | Very low | 174 Ų | 174 | 149.1 Ų | 149.1 | 81% | 0.806 | 80% | 0.803 | S | S | * | * | trans | -66.6 | 80.7 | 166.8 | -92.8 | -77.9 | 0 | 0 | 0 | 107.9 | V384 | V384-H386 VanDerWaalsContact C-N 3.32Å; V384-H386 PolarHBondContact O-N 2.96Å | ||
| 387 | D | 35.1 | Very low | 33.8 | Very low | 127 Ų | 127 | 150.5 Ų | 150.5 | 68% | 0.679 | 81% | 0.805 | S | S | * | * | trans | -139 | 18.3 | 171.2 | -78.5 | -40.7 | 0 | 0 | 0 | 112.4 | R385 | R385-D387 HydrophobicContact CG-CB 4.45Å; R385-D387 WeakPolarHBondContact CG-OD2 3.35Å; R385-D387 PolarHBondContact O-N 3.46Å | ||
| 388 | D | 30.9 | Very low | 34.2 | Very low | 170 Ų | 170 | 149.5 Ų | 149.5 | 91% | 0.909 | 80% | 0.801 | S | S | * | * | trans | -112.5 | 72.1 | 164.7 | -76.4 | -38 | 0 | 0 | 0 | 109.2 | ||||
| 389 | M | 35 | Very low | 34.2 | Very low | 184 Ų | 184 | 152.2 Ų | 152.2 | 91% | 0.906 | 81% | 0.81 | S | S | * | * | trans | -129.5 | 72.9 | 160 | -149.6 | 171.1 | -132.4 | 0 | 0 | 107.2 | P391 | M389-P391 WeakPolarHBondContact O-CD 3.09Š| ||
| 390 | Q | 35.7 | Very low | 34.5 | Very low | 181 Ų | 181 | 151.2 Ų | 151.2 | 85% | 0.846 | 81% | 0.814 | S | S | * | * | trans | -77.5 | 119.6 | 154.6 | -81.8 | -172.2 | -28.9 | 0 | 0 | 107.3 | T392 | Q390-T392 PolarHBondContact O-N 3.09Š| ||
| 391 | P | 46.7 | Very low | 35.1 | Very low | 121 Ų | 121 | 149.3 Ų | 149.3 | 79% | 0.786 | 82% | 0.819 | S | S | * | * | trans | -77.1 | 113.9 | 160.2 | 6.6 | 11 | 0 | 0 | 0 | 107.7 | M389 | M389-P391 WeakPolarHBondContact O-CD 3.09Š| ||
| 392 | T | 42.4 | Very low | 35.4 | Very low | 209 Ų | 209 | 152.8 Ų | 152.8 | 100% | 1.282 | 83% | 0.828 | S | S | * | * | trans | -60.4 | 0 | 154.6 | 46.9 | 0 | 0 | 0 | 0 | 111.4 | Q390 | Q390-T392 PolarHBondContact O-N 3.09Š|
Retrieved 392 of 392 residues in 935.6 ms
(Link to these results)