| 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 | 51.2 | Low | 58.2 | Low | 219 Ų | 219 | 105.9 Ų | 105.9 | 100% | 1.079 | 55% | 0.549 | S | S | * | . | 0 | -26.1 | 0 | -127 | 169.1 | -167.2 | 0 | 0 | 113.3 | |||||
| 2 | V | 50.5 | Low | 59.9 | Low | 110 Ų | 110 | 112 Ų | 112 | 67% | 0.667 | 56% | 0.56 | S | S | * | * | H | α-helix | trans | -66.1 | -39.2 | -177 | -169.8 | 0 | 0 | 0 | 0 | 113.5 | K4 L5 F6 | V2-K4 PolarHBondContact O-N 3.3Å; V2-L5 PolarHBondContact O-N 3.16Å; V2-F6 HydrophobicContact CG1-CD2 4.39Å; V2-F6 PolarHBondContact O-N 3.28Å; V2-F6 VanDerWaalsContact O-N 3.11Å |
| 3 | S | 53.8 | Low | 61.3 | Low | 75 Ų | 75 | 110.2 Ų | 110.2 | 52% | 0.524 | 56% | 0.563 | S | S | . | * | H | α-helix | trans | -60.6 | -44.4 | -176.8 | -26.9 | 0 | 0 | 0 | 0 | 113.1 | L5 F6 F7 | S3-L5 VanDerWaalsContact C-N 3.3Å; S3-L5 PolarHBondContact O-N 3.17Å; S3-F6 PolarHBondContact O-N 3.12Å; S3-F7 WeakPolarHBondContact O-CB 3.48Å; S3-F7 PolarHBondContact O-N 3.09Å |
| 4 | K | 51.1 | Low | 62.7 | Low | 173 Ų | 173 | 107.3 Ų | 107.3 | 75% | 0.752 | 54% | 0.544 | S | S | * | . | H | α-helix | trans | -67 | -31.1 | -178.4 | -136.5 | 161.8 | -168.8 | 164.5 | 0 | 112.8 | V2 S8 | V2-K4 PolarHBondContact O-N 3.3Å; K4-S8 WeakPolarHBondContact O-CB 3.38Å; K4-S8 PolarHBondContact O-N 3.12Å |
| 5 | L | 49.2 | Very low | 64 | Low | 124 Ų | 124 | 103.9 Ų | 103.9 | 65% | 0.649 | 53% | 0.528 | S | S | * | . | H | α-helix | trans | -76.6 | -41.1 | 178.1 | -146.7 | 85.9 | 0 | 0 | 0 | 111.4 | V2 S3 S8 N9 | V2-L5 PolarHBondContact O-N 3.16Å; S3-L5 VanDerWaalsContact C-N 3.3Å; S3-L5 PolarHBondContact O-N 3.17Å; L5-S8 PolarHBondContact O-N 3.18Å; L5-N9 PolarHBondContact O-N 2.77Å; L5-N9 VanDerWaalsContact O-N 3.17Å |
| 6 | F | 52.8 | Low | 65.2 | Low | 133 Ų | 133 | 106.4 Ų | 106.4 | 58% | 0.583 | 53% | 0.534 | S | S | * | . | H | α-helix | trans | -61.6 | -46.7 | 174 | -117.3 | -89.8 | 0 | 0 | 0 | 111.1 | V2 S3 S8 N9 E10 | V2-F6 HydrophobicContact CG1-CD2 4.39Å; V2-F6 PolarHBondContact O-N 3.28Å; V2-F6 VanDerWaalsContact O-N 3.11Å; S3-F6 PolarHBondContact O-N 3.12Å; F6-S8 VanDerWaalsContact C-N 3.28Å; F6-S8 PolarHBondContact O-N 3.25Å; F6-N9 PolarHBondContact O-N 3.38Å; F6-N9 VanDerWaalsContact O-N 3.17Å; F6-E10 PolarHBondContact O-N 3.33Å |
| 7 | F | 58 | Low | 66.1 | Low | 53 Ų | 53 | 102 Ų | 102 | 23% | 0.232 | 52% | 0.518 | C | S | . | . | H | α-helix | trans | -56.7 | -41.8 | 175 | -124 | -110 | 0 | 0 | 0 | 112.3 | S3 N9 S11 L36 E41 I42 | S3-F7 WeakPolarHBondContact O-CB 3.48Å; S3-F7 PolarHBondContact O-N 3.09Å; F7-N9 VanDerWaalsContact C-N 3.35Å; F7-N9 PolarHBondContact O-N 3.1Å; F7-S11 WeakPolarHBondContact O-CB 3.37Å; F7-S11 PolarHBondContact O-N 3.17Å; F7-S11 PolarHBondContact O-OG 3.34Å; F7-L36 HydrophobicContact CD1-CD1 3.76Å; F7-L36 HydrophobicContact CD1-CD2 4.1Å; F7-L36 HydrophobicContact CD1-CG 4Å; F7-L36 HydrophobicContact CD2-CD1 4.44Å; F7-L36 HydrophobicContact CE1-CD1 3.16Å; F7-L36 HydrophobicContact CE1-CD2 3.92Å; F7-L36 HydrophobicContact CE1-CG 3.33Å; F7-L36 HydrophobicContact CE2-CD1 3.9Å; F7-L36 HydrophobicContact CG-CD1 4.38Å; F7-L36 HydrophobicContact CZ-CD1 3.23Å; F7-L36 HydrophobicContact CZ-CG 3.84Å; F7-E41 WeakPolarHBondContact CD2-OE2 3.45Å; F7-E41 HydrophobicContact CE1-CB 4.29Å; F7-E41 WeakPolarHBondContact CE2-OE2 3.43Å; F7-E41 HydrophobicContact CZ-CB 4.27Å; F7-I42 HydrophobicContact CD1-CD1 3.99Å; F7-I42 HydrophobicContact CD1-CG1 4.38Å; F7-I42 HydrophobicContact CE1-CD1 3.71Å; F7-I42 HydrophobicContact CE1-CG1 3.96Å |
| 8 | S | 63.7 | Low | 67 | Low | 62 Ų | 62 | 96.5 Ų | 96.5 | 43% | 0.434 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -67.2 | -34.6 | -179 | -155.6 | 0 | 0 | 0 | 0 | 112.7 | K4 L5 F6 S11 R12 | K4-S8 WeakPolarHBondContact O-CB 3.38Å; K4-S8 PolarHBondContact O-N 3.12Å; L5-S8 PolarHBondContact O-N 3.18Å; F6-S8 VanDerWaalsContact C-N 3.28Å; F6-S8 PolarHBondContact O-N 3.25Å; S8-S11 WeakPolarHBondContact CA-OG 3.16Å; S8-S11 PolarHBondContact O-OG 3.34Å; S8-S11 VanDerWaalsContact O-OG 3.13Å; S8-R12 WeakPolarHBondContact O-CB 3.45Å; S8-R12 WeakPolarHBondContact O-CG 3.49Å; S8-R12 PolarHBondContact O-N 3.02Å |
| 9 | N | 65.3 | Low | 67.5 | Low | 97 Ų | 97 | 97.7 Ų | 97.7 | 52% | 0.519 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -77.2 | -46.6 | 177.5 | -73.9 | -25.9 | 0 | 0 | 0 | 112 | L5 F6 F7 R12 C13 | L5-N9 PolarHBondContact O-N 2.77Å; L5-N9 VanDerWaalsContact O-N 3.17Å; F6-N9 PolarHBondContact O-N 3.38Å; F6-N9 VanDerWaalsContact O-N 3.17Å; F7-N9 VanDerWaalsContact C-N 3.35Å; F7-N9 PolarHBondContact O-N 3.1Å; N9-R12 WeakPolarHBondContact O-CB 3.37Å; N9-R12 PolarHBondContact O-N 2.96Å; N9-C13 PolarHBondContact O-N 2.85Å |
| 10 | E | 69.3 | Low | 67.6 | Low | 99 Ų | 99 | 97 Ų | 97 | 46% | 0.463 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -62.8 | -44.4 | 176.8 | -86.4 | 176.4 | 131.1 | 0 | 0 | 111.6 | F6 R12 C13 F14 | F6-E10 PolarHBondContact O-N 3.33Å; E10-R12 VanDerWaalsContact C-N 3.27Å; E10-R12 PolarHBondContact O-N 3.32Å; E10-C13 PolarHBondContact O-N 3.31Å; E10-C13 VanDerWaalsContact O-N 3.14Å; E10-F14 HydrophobicContact CB-CD2 4.38Å; E10-F14 HydrophobicContact CB-CE2 4.07Å; E10-F14 WeakPolarHBondContact O-CD2 3.29Å; E10-F14 WeakPolarHBondContact O-CG 3.39Å; E10-F14 PolarHBondContact O-N 3.43Å |
| 11 | S | 74.9 | Confident | 67.6 | Low | 20 Ų | 20 | 96.2 Ų | 96.2 | 14% | 0.14 | 51% | 0.512 | C | S | . | . | H | α-helix | trans | -60.8 | -35.1 | 175.8 | 58.1 | 0 | 0 | 0 | 0 | 112.7 | F7 S8 L15 | F7-S11 WeakPolarHBondContact O-CB 3.37Å; F7-S11 PolarHBondContact O-N 3.17Å; F7-S11 PolarHBondContact O-OG 3.34Å; S8-S11 WeakPolarHBondContact CA-OG 3.16Å; S8-S11 PolarHBondContact O-OG 3.34Å; S8-S11 VanDerWaalsContact O-OG 3.13Å; S11-L15 VanDerWaalsContact O-CB 3.3Å; S11-L15 WeakPolarHBondContact O-CB 3.48Å; S11-L15 WeakPolarHBondContact O-CD1 3.25Å; S11-L15 VanDerWaalsContact O-CG 3.28Å; S11-L15 WeakPolarHBondContact O-CG 3.32Å; S11-L15 PolarHBondContact O-N 3.41Å |
| 12 | R | 79 | Confident | 68.5 | Low | 179 Ų | 179 | 90.9 Ų | 90.9 | 68% | 0.675 | 49% | 0.488 | S | S | * | . | H | α-helix | trans | -65.5 | -44.3 | 172.6 | -91.1 | -177.3 | 175.3 | -169.6 | -1 | 112.8 | S8 N9 E10 F14 L15 F16 | S8-R12 WeakPolarHBondContact O-CB 3.45Å; S8-R12 WeakPolarHBondContact O-CG 3.49Å; S8-R12 PolarHBondContact O-N 3.02Å; N9-R12 WeakPolarHBondContact O-CB 3.37Å; N9-R12 PolarHBondContact O-N 2.96Å; E10-R12 VanDerWaalsContact C-N 3.27Å; E10-R12 PolarHBondContact O-N 3.32Å; R12-F14 VanDerWaalsContact C-N 3.34Å; R12-L15 PolarHBondContact O-N 2.85Å; R12-F16 PolarHBondContact O-N 3.41Å |
| 13 | C | 77.7 | Confident | 69.5 | Low | 89 Ų | 89 | 89.1 Ų | 89.1 | 60% | 0.601 | 48% | 0.48 | S | S | * | . | H | α-helix | trans | -61.8 | -44.4 | 176.1 | -70.9 | 0 | 0 | 0 | 0 | 111.1 | N9 E10 F16 A17 | N9-C13 PolarHBondContact O-N 2.85Å; E10-C13 PolarHBondContact O-N 3.31Å; E10-C13 VanDerWaalsContact O-N 3.14Å; C13-F16 PolarHBondContact O-N 2.71Å; C13-A17 WeakPolarHBondContact O-CB 3.35Å; C13-A17 PolarHBondContact O-N 2.91Å |
| 14 | F | 81.1 | Confident | 70.2 | Confident | 69 Ų | 69 | 93.3 Ų | 93.3 | 30% | 0.303 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -65.4 | -40.1 | 175.6 | -66.7 | -53.6 | 0 | 0 | 0 | 112.4 | E10 R12 F16 A17 A18 A29 A32 L33 | E10-F14 HydrophobicContact CB-CD2 4.38Å; E10-F14 HydrophobicContact CB-CE2 4.07Å; E10-F14 WeakPolarHBondContact O-CD2 3.29Å; E10-F14 WeakPolarHBondContact O-CG 3.39Å; E10-F14 PolarHBondContact O-N 3.43Å; R12-F14 VanDerWaalsContact C-N 3.34Å; F14-F16 VanDerWaalsContact C-N 3.29Å; F14-F16 PolarHBondContact O-N 3.48Å; F14-A17 PolarHBondContact O-N 3.45Å; F14-A18 WeakPolarHBondContact O-CB 3.41Å; F14-A18 PolarHBondContact O-N 2.77Å; F14-A29 HydrophobicContact CB-CB 4.41Å; F14-A29 HydrophobicContact CD1-CB 4.16Å; F14-A32 HydrophobicContact CD1-CB 4.23Å; F14-A32 HydrophobicContact CE1-CB 4.12Å; F14-A32 HydrophobicContact CE2-CB 4.45Å; F14-A32 HydrophobicContact CG-CB 4.46Å; F14-A32 HydrophobicContact CZ-CB 4.24Å; F14-L33 HydrophobicContact CB-CD1 4.19Å; F14-L33 HydrophobicContact CB-CD2 3.89Å; F14-L33 HydrophobicContact CB-CG 3.82Å |
| 15 | L | 82.1 | Confident | 71.1 | Confident | 57 Ų | 57 | 87.5 Ų | 87.5 | 30% | 0.298 | 47% | 0.473 | S | S | . | . | H | α-helix | trans | -59.9 | -40.7 | 174.2 | -84.6 | 162.5 | 0 | 0 | 0 | 111.8 | S11 R12 N19 L33 W51 | S11-L15 VanDerWaalsContact O-CB 3.3Å; S11-L15 WeakPolarHBondContact O-CB 3.48Å; S11-L15 WeakPolarHBondContact O-CD1 3.25Å; S11-L15 VanDerWaalsContact O-CG 3.28Å; S11-L15 WeakPolarHBondContact O-CG 3.32Å; S11-L15 PolarHBondContact O-N 3.41Å; R12-L15 PolarHBondContact O-N 2.85Å; L15-N19 WeakPolarHBondContact O-CB 3.37Å; L15-N19 PolarHBondContact O-N 3Å; L15-N19 PolarHBondContact O-ND2 3.35Å; L15-L33 HydrophobicContact CD2-CD1 4.29Å; L15-L33 HydrophobicContact CG-CD1 4.34Å; L15-L33 HydrophobicContact CG-CD2 4.41Å; L15-W51 HydrophobicContact CD2-CH2 3.99Å; L15-W51 HydrophobicContact CD2-CZ2 3.62Å |
| 16 | F | 83 | Confident | 72.7 | Confident | 144 Ų | 144 | 82.1 Ų | 82.1 | 63% | 0.632 | 45% | 0.445 | S | S | * | . | H | α-helix | trans | -68 | -45.1 | 177.2 | -165.7 | -95.4 | 0 | 0 | 0 | 111.4 | R12 C13 F14 N19 N20 | R12-F16 PolarHBondContact O-N 3.41Å; C13-F16 PolarHBondContact O-N 2.71Å; F14-F16 VanDerWaalsContact C-N 3.29Å; F14-F16 PolarHBondContact O-N 3.48Å; F16-N19 PolarHBondContact O-N 3.11Å; F16-N20 VanDerWaalsContact CE1-ND2 3.27Å; F16-N20 WeakPolarHBondContact CE1-ND2 3.17Å; F16-N20 PolarHBondContact O-N 3.26Å |
| 17 | A | 81.9 | Confident | 74.3 | Confident | 31 Ų | 31 | 77.2 Ų | 77.2 | 26% | 0.256 | 43% | 0.425 | S | S | . | . | H | α-helix | trans | -65.4 | -39.4 | 177.8 | 0 | 0 | 0 | 0 | 0 | 112.9 | C13 F14 N19 N20 A29 | C13-A17 WeakPolarHBondContact O-CB 3.35Å; C13-A17 PolarHBondContact O-N 2.91Å; F14-A17 PolarHBondContact O-N 3.45Å; A17-N19 PolarHBondContact O-N 3.23Å; A17-N20 PolarHBondContact O-N 3.4Å; A17-A29 HydrophobicContact CB-CB 3.7Å |
| 18 | A | 80.8 | Confident | 75.6 | Confident | 3 Ų | 3 | 78.5 Ų | 78.5 | 3% | 0.025 | 44% | 0.441 | C | S | . | . | H | α-helix | trans | -70.3 | -15 | 177.8 | 0 | 0 | 0 | 0 | 0 | 113.6 | F14 C26 A29 Q30 L33 W51 | F14-A18 WeakPolarHBondContact O-CB 3.41Å; F14-A18 PolarHBondContact O-N 2.77Å; A18-C26 PolarHBondContact O-SG 3.16Å; A18-A29 HydrophobicContact CB-CB 3.87Å; A18-Q30 HydrophobicContact CB-CG 3.72Å; A18-Q30 PolarHBondContact O-NE2 3.3Å; A18-L33 HydrophobicContact CB-CD1 3.81Å; A18-W51 HydrophobicContact CB-CH2 4.25Å; A18-W51 HydrophobicContact CB-CZ3 3.83Å |
| 19 | N | 76.8 | Confident | 76.8 | Confident | 119 Ų | 119 | 75.7 Ų | 75.7 | 64% | 0.636 | 42% | 0.421 | S | S | * | . | H | α-helix | trans | -104.7 | -12.2 | 174.2 | -74.2 | -55.4 | 0 | 0 | 0 | 112.8 | L15 F16 A17 | L15-N19 WeakPolarHBondContact O-CB 3.37Å; L15-N19 PolarHBondContact O-N 3Å; L15-N19 PolarHBondContact O-ND2 3.35Å; F16-N19 PolarHBondContact O-N 3.11Å; A17-N19 PolarHBondContact O-N 3.23Å |
| 20 | N | 70.8 | Confident | 78 | Confident | 84 Ų | 84 | 71.7 Ų | 71.7 | 45% | 0.449 | 40% | 0.399 | S | S | . | . | S | Bend | trans | -81.3 | 130.7 | 174.4 | -97 | -1.5 | 0 | 0 | 0 | 110 | F16 A17 D22 C26 | F16-N20 VanDerWaalsContact CE1-ND2 3.27Å; F16-N20 WeakPolarHBondContact CE1-ND2 3.17Å; F16-N20 PolarHBondContact O-N 3.26Å; A17-N20 PolarHBondContact O-N 3.4Å; N20-D22 PolarHBondContact O-N 3.36Å; N20-C26 PolarHBondContact O-SG 3.34Å; N20-C26 VanDerWaalsContact O-SG 3.35Å |
| 21 | G | 66.7 | Low | 78.9 | Confident | 80 Ų | 80 | 67.2 Ų | 67.2 | 83% | 0.825 | 38% | 0.379 | S | S | * | . | S | Bend | trans | -67.9 | 11.2 | -171 | 0 | 0 | 0 | 0 | 0 | 116.9 | S23 | G21-S23 PolarHBondContact O-N 2.96Å; G21-S23 VanDerWaalsContact O-N 3.13Å |
| 22 | D | 69.9 | Low | 79.6 | Confident | 108 Ų | 108 | 67.6 Ų | 67.6 | 58% | 0.578 | 38% | 0.383 | S | S | * | . | trans | -77.9 | 96.3 | 170.9 | -168.4 | -32 | 0 | 0 | 0 | 108.9 | N20 K24 A25 C26 | N20-D22 PolarHBondContact O-N 3.36Å; D22-K24 VanDerWaalsContact C-N 3.25Å; D22-K24 PolarHBondContact O-N 3.34Å; D22-A25 HydrophobicContact CB-CB 4.3Å; D22-A25 PolarHBondContact O-N 3.23Å; D22-A25 VanDerWaalsContact O-N 3.08Å; D22-C26 VanDerWaalsContact O-CB 3.22Å; D22-C26 WeakPolarHBondContact O-CB 3.38Å; D22-C26 PolarHBondContact O-N 3.11Å | ||
| 23 | S | 70.9 | Confident | 80.1 | Confident | 72 Ų | 72 | 59.1 Ų | 59.1 | 50% | 0.503 | 35% | 0.351 | S | S | . | . | H | α-helix | trans | -49.2 | -39.5 | -167 | 55.8 | 0 | 0 | 0 | 0 | 114.3 | G21 C26 I27 | G21-S23 PolarHBondContact O-N 2.96Å; G21-S23 VanDerWaalsContact O-N 3.13Å; S23-C26 WeakPolarHBondContact O-CB 3.46Å; S23-I27 VanDerWaalsContact O-CD1 3.24Å; S23-I27 WeakPolarHBondContact O-CD1 3.38Å; S23-I27 WeakPolarHBondContact O-CG1 3.24Å; S23-I27 PolarHBondContact O-N 2.95Å |
| 24 | K | 69.2 | Low | 80.7 | Confident | 164 Ų | 164 | 54.9 Ų | 54.9 | 71% | 0.713 | 32% | 0.323 | S | S | * | . | H | α-helix | trans | -73.3 | -44.1 | -179.8 | -76 | -173.5 | 178.2 | 180 | 0 | 113.2 | D22 C26 S28 | D22-K24 VanDerWaalsContact C-N 3.25Å; D22-K24 PolarHBondContact O-N 3.34Å; K24-C26 VanDerWaalsContact C-N 3.26Å; K24-S28 PolarHBondContact O-N 3.4Å; K24-S28 PolarHBondContact O-OG 3.45Å |
| 25 | A | 71 | Confident | 81 | Confident | 50 Ų | 50 | 56.3 Ų | 56.3 | 41% | 0.413 | 33% | 0.327 | S | S | . | . | H | α-helix | trans | -65.5 | -37.3 | 175.8 | 0 | 0 | 0 | 0 | 0 | 110.5 | D22 S28 A29 | D22-A25 HydrophobicContact CB-CB 4.3Å; D22-A25 PolarHBondContact O-N 3.23Å; D22-A25 VanDerWaalsContact O-N 3.08Å; A25-S28 PolarHBondContact O-N 3.31Å; A25-A29 WeakPolarHBondContact O-CB 3.4Å; A25-A29 PolarHBondContact O-N 3.26Å; A25-A29 VanDerWaalsContact O-N 3.09Å |
| 26 | C | 82.6 | Confident | 81.3 | Confident | 11 Ų | 11 | 54.8 Ų | 54.8 | 7% | 0.074 | 32% | 0.319 | C | S | . | . | H | α-helix | trans | -60.3 | -50.2 | 177 | -147.2 | 0 | 0 | 0 | 0 | 111.5 | A18 N20 D22 S23 K24 S28 A29 Q30 | A18-C26 PolarHBondContact O-SG 3.16Å; N20-C26 PolarHBondContact O-SG 3.34Å; N20-C26 VanDerWaalsContact O-SG 3.35Å; D22-C26 VanDerWaalsContact O-CB 3.22Å; D22-C26 WeakPolarHBondContact O-CB 3.38Å; D22-C26 PolarHBondContact O-N 3.11Å; S23-C26 WeakPolarHBondContact O-CB 3.46Å; K24-C26 VanDerWaalsContact C-N 3.26Å; C26-S28 VanDerWaalsContact C-N 3.34Å; C26-S28 PolarHBondContact O-N 2.93Å; C26-A29 PolarHBondContact O-N 3.25Å; C26-Q30 WeakPolarHBondContact O-CB 3.36Å; C26-Q30 WeakPolarHBondContact O-CG 3.41Å; C26-Q30 PolarHBondContact O-N 3.23Å; C26-Q30 PolarHBondContact SG-NE2 2.88Å; C26-Q30 VanDerWaalsContact SG-NE2 3.41Å |
| 27 | I | 86 | Confident | 81.6 | Confident | 31 Ų | 31 | 49.3 Ų | 49.3 | 16% | 0.159 | 29% | 0.294 | C | S | . | . | H | α-helix | trans | -56.6 | -46.5 | 178.4 | -71.9 | 157.8 | 0 | 0 | 0 | 112 | S23 Q30 T31 N58 | S23-I27 VanDerWaalsContact O-CD1 3.24Å; S23-I27 WeakPolarHBondContact O-CD1 3.38Å; S23-I27 WeakPolarHBondContact O-CG1 3.24Å; S23-I27 PolarHBondContact O-N 2.95Å; I27-Q30 PolarHBondContact O-N 3.08Å; I27-T31 WeakPolarHBondContact O-CB 3.15Å; I27-T31 PolarHBondContact O-N 3.44Å; I27-T31 PolarHBondContact O-OG1 2.9Å; I27-N58 HydrophobicContact CD1-CB 4.06Å; I27-N58 WeakPolarHBondContact CD1-O 3.48Å; I27-N58 HydrophobicContact CG1-CB 3.46Å; I27-N58 VanDerWaalsContact CG1-CB 3.46Å |
| 28 | S | 86 | Confident | 81.9 | Confident | 80 Ų | 80 | 49.6 Ų | 49.6 | 56% | 0.559 | 29% | 0.294 | S | S | * | . | H | α-helix | trans | -65.8 | -42.5 | -177.1 | -54.2 | 0 | 0 | 0 | 0 | 110.6 | K24 A25 C26 T31 A32 | K24-S28 PolarHBondContact O-N 3.4Å; K24-S28 PolarHBondContact O-OG 3.45Å; A25-S28 PolarHBondContact O-N 3.31Å; C26-S28 VanDerWaalsContact C-N 3.34Å; C26-S28 PolarHBondContact O-N 2.93Å; S28-T31 PolarHBondContact O-N 3.4Å; S28-A32 WeakPolarHBondContact O-CB 3.37Å; S28-A32 PolarHBondContact O-N 2.91Å |
| 29 | A | 88.5 | Confident | 82.1 | Confident | 3 Ų | 3 | 50.2 Ų | 50.2 | 3% | 0.025 | 30% | 0.301 | C | S | . | . | H | α-helix | trans | -67.1 | -42.6 | 177.3 | 0 | 0 | 0 | 0 | 0 | 112.6 | F14 A17 A18 A25 C26 A32 L33 | F14-A29 HydrophobicContact CB-CB 4.41Å; F14-A29 HydrophobicContact CD1-CB 4.16Å; A17-A29 HydrophobicContact CB-CB 3.7Å; A18-A29 HydrophobicContact CB-CB 3.87Å; A25-A29 WeakPolarHBondContact O-CB 3.4Å; A25-A29 PolarHBondContact O-N 3.26Å; A25-A29 VanDerWaalsContact O-N 3.09Å; C26-A29 PolarHBondContact O-N 3.25Å; A29-A32 PolarHBondContact O-N 3.49Å; A29-L33 WeakPolarHBondContact O-CG 3.47Å; A29-L33 PolarHBondContact O-N 2.95Å |
| 30 | Q | 88.9 | Confident | 82.5 | Confident | 12 Ų | 12 | 50.8 Ų | 50.8 | 6% | 0.056 | 31% | 0.311 | C | S | . | . | H | α-helix | trans | -62.9 | -42.9 | 175.7 | -69.5 | 168.8 | -9.5 | 0 | 0 | 111.2 | A18 C26 I27 L33 G34 W51 D54 A55 N58 | A18-Q30 HydrophobicContact CB-CG 3.72Å; A18-Q30 PolarHBondContact O-NE2 3.3Å; C26-Q30 WeakPolarHBondContact O-CB 3.36Å; C26-Q30 WeakPolarHBondContact O-CG 3.41Å; C26-Q30 PolarHBondContact O-N 3.23Å; C26-Q30 PolarHBondContact SG-NE2 2.88Å; C26-Q30 VanDerWaalsContact SG-NE2 3.41Å; I27-Q30 PolarHBondContact O-N 3.08Å; Q30-L33 PolarHBondContact O-N 3.2Å; Q30-G34 PolarHBondContact O-N 3.28Å; Q30-W51 HydrophobicContact CB-CE3 4.2Å; Q30-W51 HydrophobicContact CG-CE3 3.88Å; Q30-W51 HydrophobicContact CG-CZ3 4Å; Q30-D54 PolarHBondContact OE1-O 3.17Å; Q30-A55 HydrophobicContact CB-CB 3.72Å; Q30-N58 PolarHBondContact NE2-ND2 3.19Å; Q30-N58 PolarHBondContact OE1-ND2 2.99Å |
| 31 | T | 89.7 | Confident | 83.1 | Confident | 5 Ų | 5 | 52.1 Ų | 52.1 | 3% | 0.031 | 32% | 0.315 | C | S | . | . | H | α-helix | trans | -63.4 | -43.7 | 176.4 | -54.5 | 0 | 0 | 0 | 0 | 111 | I27 S28 G34 Y35 S60 E62 S63 | I27-T31 WeakPolarHBondContact O-CB 3.15Å; I27-T31 PolarHBondContact O-N 3.44Å; I27-T31 PolarHBondContact O-OG1 2.9Å; S28-T31 PolarHBondContact O-N 3.4Å; T31-G34 PolarHBondContact O-N 3.46Å; T31-Y35 HydrophobicContact CG2-CD2 4.15Å; T31-Y35 HydrophobicContact CG2-CE2 3.76Å; T31-Y35 VanDerWaalsContact O-CD2 3.29Å; T31-Y35 WeakPolarHBondContact O-CD2 3.36Å; T31-Y35 PolarHBondContact O-N 2.91Å; T31-Y35 VanDerWaalsContact O-N 3.11Å; T31-S60 PolarHBondContact OG1-OG 3.23Å; T31-S60 VanDerWaalsContact OG1-OG 3.08Å; T31-E62 HydrophobicContact CG2-CB 4.4Å; T31-E62 HydrophobicContact CG2-CG 4.24Å; T31-S63 PolarHBondContact OG1-OG 2.76Å |
| 32 | A | 89.7 | Confident | 83.9 | Confident | 29 Ų | 29 | 51.5 Ų | 51.5 | 24% | 0.24 | 29% | 0.292 | C | S | . | . | H | α-helix | trans | -62.7 | -41.9 | 176.1 | 0 | 0 | 0 | 0 | 0 | 112.5 | F14 S28 A29 G34 Y35 L36 | F14-A32 HydrophobicContact CD1-CB 4.23Å; F14-A32 HydrophobicContact CE1-CB 4.12Å; F14-A32 HydrophobicContact CE2-CB 4.45Å; F14-A32 HydrophobicContact CG-CB 4.46Å; F14-A32 HydrophobicContact CZ-CB 4.24Å; S28-A32 WeakPolarHBondContact O-CB 3.37Å; S28-A32 PolarHBondContact O-N 2.91Å; A29-A32 PolarHBondContact O-N 3.49Å; A32-G34 VanDerWaalsContact C-N 3.34Å; A32-Y35 PolarHBondContact O-N 3.28Å; A32-L36 WeakPolarHBondContact O-CB 3.49Å; A32-L36 PolarHBondContact O-N 2.84Å |
| 33 | L | 89.6 | Confident | 84.7 | Confident | 0 Ų | 0 | 50.2 Ų | 50.2 | 0% | 0 | 29% | 0.291 | C | S | . | . | H | α-helix | trans | -62.5 | -41.4 | 173.8 | -74.1 | 168.7 | 0 | 0 | 0 | 111.4 | F14 L15 A18 A29 Q30 Y35 L36 Y37 W51 | F14-L33 HydrophobicContact CB-CD1 4.19Å; F14-L33 HydrophobicContact CB-CD2 3.89Å; F14-L33 HydrophobicContact CB-CG 3.82Å; L15-L33 HydrophobicContact CD2-CD1 4.29Å; L15-L33 HydrophobicContact CG-CD1 4.34Å; L15-L33 HydrophobicContact CG-CD2 4.41Å; A18-L33 HydrophobicContact CB-CD1 3.81Å; A29-L33 WeakPolarHBondContact O-CG 3.47Å; A29-L33 PolarHBondContact O-N 2.95Å; Q30-L33 PolarHBondContact O-N 3.2Å; L33-Y35 VanDerWaalsContact C-N 3.32Å; L33-Y35 PolarHBondContact O-N 3.12Å; L33-L36 HydrophobicContact CD2-CD2 4.28Å; L33-L36 WeakPolarHBondContact O-CB 3.36Å; L33-L36 PolarHBondContact O-N 2.89Å; L33-L36 VanDerWaalsContact O-N 3.16Å; L33-Y37 HydrophobicContact CB-CD2 4.43Å; L33-Y37 HydrophobicContact CD2-CE2 4.24Å; L33-Y37 WeakPolarHBondContact O-CD2 3.13Å; L33-Y37 PolarHBondContact O-N 3.42Å; L33-W51 HydrophobicContact CB-CB 4.29Å; L33-W51 HydrophobicContact CB-CD2 3.91Å; L33-W51 HydrophobicContact CB-CE3 4.5Å; L33-W51 HydrophobicContact CB-CG 3.79Å; L33-W51 HydrophobicContact CD1-CD2 3.92Å; L33-W51 HydrophobicContact CD1-CE3 4.01Å; L33-W51 HydrophobicContact CD1-CH2 3.86Å; L33-W51 HydrophobicContact CD1-CZ2 3.77Å; L33-W51 HydrophobicContact CD1-CZ3 3.98Å |
| 34 | G | 89.1 | Confident | 85.5 | Confident | 0 Ų | 0 | 49.3 Ų | 49.3 | 0% | 0 | 28% | 0.28 | C | S | . | . | H | α-helix | trans | -52.8 | -49.6 | 173.4 | 0 | 0 | 0 | 0 | 0 | 112.1 | Q30 T31 A32 Y37 S38 A48 H52 | Q30-G34 PolarHBondContact O-N 3.28Å; T31-G34 PolarHBondContact O-N 3.46Å; A32-G34 VanDerWaalsContact C-N 3.34Å; G34-Y37 PolarHBondContact O-N 3.39Å; G34-S38 WeakPolarHBondContact O-CB 3.42Å; G34-S38 PolarHBondContact O-N 3Å; G34-A48 WeakPolarHBondContact O-CB 3.32Å; G34-H52 VanDerWaalsContact C-NE2 3.29Å; G34-H52 WeakPolarHBondContact CA-NE2 3.48Å |
| 35 | Y | 88.8 | Confident | 86.4 | Confident | 99 Ų | 99 | 46.3 Ų | 46.3 | 39% | 0.388 | 27% | 0.271 | S | S | . | . | H | α-helix | trans | -63.4 | -43.6 | 175.2 | -75.5 | -60.1 | 0 | 0 | 0 | 113.1 | T31 A32 L33 Y37 S38 G39 E62 F66 | T31-Y35 HydrophobicContact CG2-CD2 4.15Å; T31-Y35 HydrophobicContact CG2-CE2 3.76Å; T31-Y35 VanDerWaalsContact O-CD2 3.29Å; T31-Y35 WeakPolarHBondContact O-CD2 3.36Å; T31-Y35 PolarHBondContact O-N 2.91Å; T31-Y35 VanDerWaalsContact O-N 3.11Å; A32-Y35 PolarHBondContact O-N 3.28Å; L33-Y35 VanDerWaalsContact C-N 3.32Å; L33-Y35 PolarHBondContact O-N 3.12Å; Y35-Y37 VanDerWaalsContact C-N 3.31Å; Y35-Y37 PolarHBondContact O-N 2.83Å; Y35-S38 WeakPolarHBondContact CA-OG 3.07Å; Y35-S38 CarbonylContact O-C 3.58Å; Y35-S38 PolarHBondContact O-N 3.35Å; Y35-S38 VanDerWaalsContact O-N 3.1Å; Y35-S38 PolarHBondContact O-OG 3.33Å; Y35-G39 PolarHBondContact O-N 3.04Å; Y35-E62 HydrophobicContact CE2-CG 4.39Å; Y35-E62 WeakPolarHBondContact OH-CG 3.44Å; Y35-E62 PolarHBondContact OH-OE1 3.06Å; Y35-F66 HydrophobicContact CE1-CD2 4.46Å |
| 36 | L | 88.5 | Confident | 87.3 | Confident | 25 Ų | 25 | 51.9 Ų | 51.9 | 13% | 0.131 | 29% | 0.289 | C | S | . | . | H | α-helix | trans | -56 | -46.8 | 179.1 | -162.2 | 87.3 | 0 | 0 | 0 | 111.6 | F7 A32 L33 G39 I42 | F7-L36 HydrophobicContact CD1-CD1 3.76Å; F7-L36 HydrophobicContact CD1-CD2 4.1Å; F7-L36 HydrophobicContact CD1-CG 4Å; F7-L36 HydrophobicContact CD2-CD1 4.44Å; F7-L36 HydrophobicContact CE1-CD1 3.16Å; F7-L36 HydrophobicContact CE1-CD2 3.92Å; F7-L36 HydrophobicContact CE1-CG 3.33Å; F7-L36 HydrophobicContact CE2-CD1 3.9Å; F7-L36 HydrophobicContact CG-CD1 4.38Å; F7-L36 HydrophobicContact CZ-CD1 3.23Å; F7-L36 HydrophobicContact CZ-CG 3.84Å; A32-L36 WeakPolarHBondContact O-CB 3.49Å; A32-L36 PolarHBondContact O-N 2.84Å; L33-L36 HydrophobicContact CD2-CD2 4.28Å; L33-L36 WeakPolarHBondContact O-CB 3.36Å; L33-L36 PolarHBondContact O-N 2.89Å; L33-L36 VanDerWaalsContact O-N 3.16Å; L36-G39 PolarHBondContact O-N 2.98Å; L36-I42 HydrophobicContact CD2-CD1 3.78Å; L36-I42 HydrophobicContact CG-CD1 3.95Å |
| 37 | Y | 88.1 | Confident | 87.5 | Confident | 30 Ų | 30 | 56 Ų | 56 | 12% | 0.118 | 31% | 0.305 | C | S | . | . | H | α-helix | trans | -73.1 | -27.1 | 178.7 | -77.8 | -69.5 | 0 | 0 | 0 | 112.7 | L33 G34 Y35 G39 I42 C43 D44 K47 W51 | L33-Y37 HydrophobicContact CB-CD2 4.43Å; L33-Y37 HydrophobicContact CD2-CE2 4.24Å; L33-Y37 WeakPolarHBondContact O-CD2 3.13Å; L33-Y37 PolarHBondContact O-N 3.42Å; G34-Y37 PolarHBondContact O-N 3.39Å; Y35-Y37 VanDerWaalsContact C-N 3.31Å; Y35-Y37 PolarHBondContact O-N 2.83Å; Y37-G39 VanDerWaalsContact C-N 3.3Å; Y37-I42 HydrophobicContact CD1-CB 4.34Å; Y37-I42 HydrophobicContact CD1-CD1 4.26Å; Y37-I42 HydrophobicContact CD1-CG2 3.52Å; Y37-I42 HydrophobicContact CE1-CD1 4.25Å; Y37-I42 HydrophobicContact CE1-CG2 3.83Å; Y37-C43 CarbonylContact O-C 3.5Å; Y37-C43 WeakPolarHBondContact O-CA 3.4Å; Y37-C43 PolarHBondContact O-N 3.3Å; Y37-D44 HydrophobicContact CD1-CB 3.99Å; Y37-D44 PolarHBondContact O-N 2.94Å; Y37-K47 HydrophobicContact CD1-CB 3.86Å; Y37-K47 HydrophobicContact CD1-CD 3.91Å; Y37-K47 HydrophobicContact CD2-CB 4.2Å; Y37-K47 HydrophobicContact CE1-CB 4.28Å; Y37-K47 HydrophobicContact CE1-CD 3.47Å; Y37-K47 VanDerWaalsContact CE1-CD 3.47Å; Y37-K47 HydrophobicContact CE2-CD 4.28Å; Y37-K47 HydrophobicContact CG-CB 3.84Å; Y37-K47 HydrophobicContact CG-CD 4.49Å; Y37-W51 AromaticContact CD2-CD1 3.39Å; Y37-W51 AromaticContact CD2-NE1 3.59Å; Y37-W51 AromaticContact CE2-CD1 3.61Å; Y37-W51 AromaticContact CE2-NE1 3.25Å; Y37-W51 VanDerWaalsContact CE2-NE1 3.25Å |
| 38 | S | 87.9 | Confident | 87.7 | Confident | 36 Ų | 36 | 54.6 Ų | 54.6 | 25% | 0.252 | 30% | 0.298 | S | S | . | . | H | α-helix | trans | -77.2 | -16.3 | 172.7 | 79.6 | 0 | 0 | 0 | 0 | 113.8 | G34 Y35 | G34-S38 WeakPolarHBondContact O-CB 3.42Å; G34-S38 PolarHBondContact O-N 3Å; Y35-S38 WeakPolarHBondContact CA-OG 3.07Å; Y35-S38 CarbonylContact O-C 3.58Å; Y35-S38 PolarHBondContact O-N 3.35Å; Y35-S38 VanDerWaalsContact O-N 3.1Å; Y35-S38 PolarHBondContact O-OG 3.33Å |
| 39 | G | 85.9 | Confident | 87.8 | Confident | 16 Ų | 16 | 54.2 Ų | 54.2 | 17% | 0.165 | 29% | 0.287 | C | S | . | . | S | Bend | trans | -73.5 | 161 | -175.3 | 0 | 0 | 0 | 0 | 0 | 113.5 | Y35 L36 Y37 E41 I42 C43 | Y35-G39 PolarHBondContact O-N 3.04Å; L36-G39 PolarHBondContact O-N 2.98Å; Y37-G39 VanDerWaalsContact C-N 3.3Å; G39-E41 PolarHBondContact O-N 3.17Å; G39-E41 VanDerWaalsContact O-N 3.12Å; G39-I42 PolarHBondContact O-N 3.17Å; G39-C43 WeakPolarHBondContact O-CA 3.48Å; G39-C43 PolarHBondContact O-N 3.48Å |
| 40 | P | 85.1 | Confident | 87.9 | Confident | 132 Ų | 132 | 59.1 Ų | 59.1 | 86% | 0.857 | 31% | 0.309 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -65.4 | -17 | -175.1 | 26.8 | -35.3 | 0 | 0 | 0 | 114.3 | ||
| 41 | E | 82.8 | Confident | 88 | Confident | 111 Ų | 111 | 60.1 Ų | 60.1 | 52% | 0.519 | 31% | 0.312 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -78.4 | -34.4 | 179.3 | -71.9 | -161 | 178 | 0 | 0 | 113.9 | F7 G39 | F7-E41 WeakPolarHBondContact CD2-OE2 3.45Å; F7-E41 HydrophobicContact CE1-CB 4.29Å; F7-E41 WeakPolarHBondContact CE2-OE2 3.43Å; F7-E41 HydrophobicContact CZ-CB 4.27Å; G39-E41 PolarHBondContact O-N 3.17Å; G39-E41 VanDerWaalsContact O-N 3.12Å |
| 42 | I | 83.6 | Confident | 88.1 | Confident | 67 Ų | 67 | 59.9 Ų | 59.9 | 34% | 0.344 | 31% | 0.311 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -110.9 | -45 | -178.5 | -54.2 | 178.6 | 0 | 0 | 0 | 111 | F7 L36 Y37 G39 D44 | F7-I42 HydrophobicContact CD1-CD1 3.99Å; F7-I42 HydrophobicContact CD1-CG1 4.38Å; F7-I42 HydrophobicContact CE1-CD1 3.71Å; F7-I42 HydrophobicContact CE1-CG1 3.96Å; L36-I42 HydrophobicContact CD2-CD1 3.78Å; L36-I42 HydrophobicContact CG-CD1 3.95Å; Y37-I42 HydrophobicContact CD1-CB 4.34Å; Y37-I42 HydrophobicContact CD1-CD1 4.26Å; Y37-I42 HydrophobicContact CD1-CG2 3.52Å; Y37-I42 HydrophobicContact CE1-CD1 4.25Å; Y37-I42 HydrophobicContact CE1-CG2 3.83Å; G39-I42 PolarHBondContact O-N 3.17Å; I42-D44 VanDerWaalsContact C-N 3.32Å; I42-D44 HydrophobicContact CG2-CB 4.17Å; I42-D44 PolarHBondContact O-N 3.31Å |
| 43 | C | 86 | Confident | 88 | Confident | 82 Ų | 82 | 60.1 Ų | 60.1 | 55% | 0.554 | 31% | 0.311 | S | S | * | . | trans | 44.6 | 51 | 178 | -151.3 | 0 | 0 | 0 | 0 | 113.9 | Y37 G39 | Y37-C43 CarbonylContact O-C 3.5Å; Y37-C43 WeakPolarHBondContact O-CA 3.4Å; Y37-C43 PolarHBondContact O-N 3.3Å; G39-C43 WeakPolarHBondContact O-CA 3.48Å; G39-C43 PolarHBondContact O-N 3.48Å | ||
| 44 | D | 89 | Confident | 87.9 | Confident | 53 Ų | 53 | 63 Ų | 63 | 28% | 0.283 | 33% | 0.326 | S | S | . | . | trans | -107.1 | 86 | 172.7 | -176 | -17.5 | 0 | 0 | 0 | 108.3 | Y37 I42 Q46 K47 A48 | Y37-D44 HydrophobicContact CD1-CB 3.99Å; Y37-D44 PolarHBondContact O-N 2.94Å; I42-D44 VanDerWaalsContact C-N 3.32Å; I42-D44 HydrophobicContact CG2-CB 4.17Å; I42-D44 PolarHBondContact O-N 3.31Å; D44-Q46 PolarHBondContact O-N 3.18Å; D44-Q46 PolarHBondContact OD1-N 3.14Å; D44-K47 HydrophobicContact CB-CB 4.25Å; D44-K47 PolarHBondContact O-N 2.89Å; D44-K47 PolarHBondContact OD1-N 3.32Å; D44-K47 WeakPolarHBondContact OD2-CD 3.14Å; D44-K47 WeakPolarHBondContact OD2-CG 3.41Å; D44-A48 WeakPolarHBondContact O-CB 3.38Å; D44-A48 PolarHBondContact O-N 3.15Å | ||
| 45 | L | 87.7 | Confident | 87.9 | Confident | 101 Ų | 101 | 63 Ų | 63 | 53% | 0.529 | 33% | 0.326 | S | S | . | . | H | α-helix | trans | -63.9 | -27.9 | -175.7 | -62.8 | 179.1 | 0 | 0 | 0 | 112.6 | A48 F49 | L45-A48 PolarHBondContact O-N 3.47Å; L45-F49 WeakPolarHBondContact O-CB 3.36Å; L45-F49 PolarHBondContact O-N 2.86Å |
| 46 | Q | 89.2 | Confident | 87.9 | Confident | 167 Ų | 167 | 59.8 Ų | 59.8 | 78% | 0.78 | 32% | 0.317 | S | S | * | . | H | α-helix | trans | -69.5 | -46.5 | 177.8 | -169.2 | 177.1 | 12.6 | 0 | 0 | 110.5 | D44 F49 Q50 | D44-Q46 PolarHBondContact O-N 3.18Å; D44-Q46 PolarHBondContact OD1-N 3.14Å; Q46-F49 PolarHBondContact O-N 3.26Å; Q46-Q50 PolarHBondContact O-N 3.44Å |
| 47 | K | 87.6 | Confident | 87.7 | Confident | 98 Ų | 98 | 62 Ų | 62 | 43% | 0.426 | 35% | 0.346 | S | S | . | . | H | α-helix | trans | -64.8 | -40 | 172.1 | -84.9 | -170.5 | -175.5 | 176.5 | 0 | 112.7 | Y37 D44 F49 Q50 W51 | Y37-K47 HydrophobicContact CD1-CB 3.86Å; Y37-K47 HydrophobicContact CD1-CD 3.91Å; Y37-K47 HydrophobicContact CD2-CB 4.2Å; Y37-K47 HydrophobicContact CE1-CB 4.28Å; Y37-K47 HydrophobicContact CE1-CD 3.47Å; Y37-K47 VanDerWaalsContact CE1-CD 3.47Å; Y37-K47 HydrophobicContact CE2-CD 4.28Å; Y37-K47 HydrophobicContact CG-CB 3.84Å; Y37-K47 HydrophobicContact CG-CD 4.49Å; D44-K47 HydrophobicContact CB-CB 4.25Å; D44-K47 PolarHBondContact O-N 2.89Å; D44-K47 PolarHBondContact OD1-N 3.32Å; D44-K47 WeakPolarHBondContact OD2-CD 3.14Å; D44-K47 WeakPolarHBondContact OD2-CG 3.41Å; K47-F49 VanDerWaalsContact C-N 3.29Å; K47-F49 PolarHBondContact O-N 2.63Å; K47-Q50 PolarHBondContact O-N 3.13Å; K47-W51 PolarHBondContact O-N 2.91Å |
| 48 | A | 89.3 | Confident | 87.5 | Confident | 0 Ų | 0 | 64.3 Ų | 64.3 | 0% | 0 | 36% | 0.361 | C | S | . | . | H | α-helix | trans | -57.2 | -46.5 | 176.5 | 0 | 0 | 0 | 0 | 0 | 110.8 | G34 D44 L45 Q50 W51 H52 | G34-A48 WeakPolarHBondContact O-CB 3.32Å; D44-A48 WeakPolarHBondContact O-CB 3.38Å; D44-A48 PolarHBondContact O-N 3.15Å; L45-A48 PolarHBondContact O-N 3.47Å; A48-Q50 VanDerWaalsContact C-N 3.35Å; A48-Q50 PolarHBondContact O-N 2.91Å; A48-W51 PolarHBondContact O-N 3.45Å; A48-H52 PolarHBondContact O-CD2 2.98Å; A48-H52 PolarHBondContact O-N 2.88Å |
| 49 | F | 89.6 | Confident | 87.3 | Confident | 73 Ų | 73 | 65.1 Ų | 65.1 | 32% | 0.32 | 38% | 0.375 | S | S | . | . | H | α-helix | trans | -62.1 | -40.8 | 176.8 | -172.8 | -90.9 | 0 | 0 | 0 | 112.6 | L45 Q46 K47 S53 I67 H70 | L45-F49 WeakPolarHBondContact O-CB 3.36Å; L45-F49 PolarHBondContact O-N 2.86Å; Q46-F49 PolarHBondContact O-N 3.26Å; K47-F49 VanDerWaalsContact C-N 3.29Å; K47-F49 PolarHBondContact O-N 2.63Å; F49-S53 WeakPolarHBondContact CE1-OG 3.45Å; F49-S53 VanDerWaalsContact O-CB 3.32Å; F49-S53 WeakPolarHBondContact O-CB 3.09Å; F49-S53 PolarHBondContact O-N 3.09Å; F49-S53 PolarHBondContact O-OG 3.36Å; F49-I67 HydrophobicContact CE2-CB 4.42Å; F49-I67 HydrophobicContact CE2-CG1 4.44Å; F49-I67 HydrophobicContact CE2-CG2 3.83Å; F49-I67 HydrophobicContact CZ-CG2 3.98Å; F49-H70 HydrophobicContact CD2-CB 4.47Å |
| 50 | Q | 90.3 | Very high | 87.2 | Confident | 105 Ų | 105 | 64.8 Ų | 64.8 | 49% | 0.491 | 37% | 0.37 | S | S | . | . | H | α-helix | trans | -62.1 | -50 | 176.8 | -171.3 | 63.5 | 51.1 | 0 | 0 | 111.4 | Q46 K47 A48 H52 S53 D54 | Q46-Q50 PolarHBondContact O-N 3.44Å; K47-Q50 PolarHBondContact O-N 3.13Å; A48-Q50 VanDerWaalsContact C-N 3.35Å; A48-Q50 PolarHBondContact O-N 2.91Å; Q50-H52 PolarHBondContact O-N 2.99Å; Q50-S53 WeakPolarHBondContact O-CA 3.37Å; Q50-S53 WeakPolarHBondContact O-CB 3.48Å; Q50-S53 PolarHBondContact O-N 3.2Å; Q50-D54 PolarHBondContact NE2-OD1 3.35Å; Q50-D54 VanDerWaalsContact NE2-OD1 3.13Å; Q50-D54 PolarHBondContact O-N 3.28Å |
| 51 | W | 90.5 | Very high | 87.2 | Confident | 34 Ų | 34 | 63.9 Ų | 63.9 | 13% | 0.129 | 36% | 0.361 | C | S | . | . | H | α-helix | trans | -63.1 | -41.6 | -180 | -77.5 | 117.1 | 0 | 0 | 0 | 112.9 | L15 A18 Q30 L33 Y37 K47 A48 S53 D54 A55 | L15-W51 HydrophobicContact CD2-CH2 3.99Å; L15-W51 HydrophobicContact CD2-CZ2 3.62Å; A18-W51 HydrophobicContact CB-CH2 4.25Å; A18-W51 HydrophobicContact CB-CZ3 3.83Å; Q30-W51 HydrophobicContact CB-CE3 4.2Å; Q30-W51 HydrophobicContact CG-CE3 3.88Å; Q30-W51 HydrophobicContact CG-CZ3 4Å; L33-W51 HydrophobicContact CB-CB 4.29Å; L33-W51 HydrophobicContact CB-CD2 3.91Å; L33-W51 HydrophobicContact CB-CE3 4.5Å; L33-W51 HydrophobicContact CB-CG 3.79Å; L33-W51 HydrophobicContact CD1-CD2 3.92Å; L33-W51 HydrophobicContact CD1-CE3 4.01Å; L33-W51 HydrophobicContact CD1-CH2 3.86Å; L33-W51 HydrophobicContact CD1-CZ2 3.77Å; L33-W51 HydrophobicContact CD1-CZ3 3.98Å; Y37-W51 AromaticContact CD2-CD1 3.39Å; Y37-W51 AromaticContact CD2-NE1 3.59Å; Y37-W51 AromaticContact CE2-CD1 3.61Å; Y37-W51 AromaticContact CE2-NE1 3.25Å; Y37-W51 VanDerWaalsContact CE2-NE1 3.25Å; K47-W51 PolarHBondContact O-N 2.91Å; A48-W51 PolarHBondContact O-N 3.45Å; W51-S53 VanDerWaalsContact C-N 3.31Å; W51-S53 PolarHBondContact O-N 2.79Å; W51-D54 PolarHBondContact O-N 2.89Å; W51-A55 WeakPolarHBondContact O-CB 3.48Å; W51-A55 PolarHBondContact O-N 3.34Å |
| 52 | H | 90.8 | Very high | 87.3 | Confident | 0 Ų | 0 | 64.2 Ų | 64.2 | 0% | 0 | 36% | 0.363 | C | S | . | . | H | α-helix | trans | -63.6 | -38.6 | 172.9 | -77.1 | -58.9 | 0 | 0 | 0 | 111.4 | G34 A48 Q50 A55 C56 S63 F66 I67 | G34-H52 VanDerWaalsContact C-NE2 3.29Å; G34-H52 WeakPolarHBondContact CA-NE2 3.48Å; A48-H52 PolarHBondContact O-CD2 2.98Å; A48-H52 PolarHBondContact O-N 2.88Å; Q50-H52 PolarHBondContact O-N 2.99Å; H52-A55 PolarHBondContact O-N 3.42Å; H52-C56 WeakPolarHBondContact O-CB 3.47Å; H52-C56 PolarHBondContact O-N 3.49Å; H52-S63 WeakPolarHBondContact ND1-CB 3.41Å; H52-S63 PolarHBondContact ND1-OG 3.25Å; H52-S63 WeakPolarHBondContact O-CB 3.19Å; H52-F66 HydrophobicContact CB-CD1 4.39Å; H52-F66 AromaticContact CD2-CD1 3.24Å; H52-F66 WeakPolarHBondContact CD2-CD1 3.43Å; H52-F66 AromaticContact CD2-CE1 3.62Å; H52-F66 AromaticContact CD2-CG 3.51Å; H52-F66 AromaticContact CG-CD1 3.89Å; H52-F66 AromaticContact NE2-CD1 3.76Å; H52-F66 AromaticContact NE2-CD2 3.69Å; H52-F66 AromaticContact NE2-CE2 3.99Å; H52-F66 AromaticContact NE2-CG 3.57Å; H52-I67 HydrophobicContact CB-CD1 4.33Å; H52-I67 HydrophobicContact CB-CG1 3.93Å; H52-I67 WeakPolarHBondContact O-CD1 3.45Å |
| 53 | S | 88.2 | Confident | 87.4 | Confident | 34 Ų | 34 | 61 Ų | 61 | 24% | 0.238 | 35% | 0.347 | C | S | . | . | H | α-helix | trans | -61.5 | -44.2 | 176.7 | -66.1 | 0 | 0 | 0 | 0 | 112.3 | F49 Q50 W51 C56 G57 I67 | F49-S53 WeakPolarHBondContact CE1-OG 3.45Å; F49-S53 VanDerWaalsContact O-CB 3.32Å; F49-S53 WeakPolarHBondContact O-CB 3.09Å; F49-S53 PolarHBondContact O-N 3.09Å; F49-S53 PolarHBondContact O-OG 3.36Å; Q50-S53 WeakPolarHBondContact O-CA 3.37Å; Q50-S53 WeakPolarHBondContact O-CB 3.48Å; Q50-S53 PolarHBondContact O-N 3.2Å; W51-S53 VanDerWaalsContact C-N 3.31Å; W51-S53 PolarHBondContact O-N 2.79Å; S53-C56 WeakPolarHBondContact O-CB 3.47Å; S53-C56 PolarHBondContact O-N 3.11Å; S53-G57 PolarHBondContact O-N 2.93Å; S53-I67 VanDerWaalsContact CA-CD1 3.46Å |
| 54 | D | 88.9 | Confident | 87.3 | Confident | 61 Ų | 61 | 61.5 Ų | 61.5 | 33% | 0.326 | 34% | 0.341 | S | S | . | . | H | α-helix | trans | -65.2 | -43.9 | 176.9 | -62.4 | -14.2 | 0 | 0 | 0 | 110.7 | Q30 Q50 W51 C56 G57 N58 | Q30-D54 PolarHBondContact OE1-O 3.17Å; Q50-D54 PolarHBondContact NE2-OD1 3.35Å; Q50-D54 VanDerWaalsContact NE2-OD1 3.13Å; Q50-D54 PolarHBondContact O-N 3.28Å; W51-D54 PolarHBondContact O-N 2.89Å; D54-C56 VanDerWaalsContact C-N 3.32Å; D54-C56 PolarHBondContact O-N 3.3Å; D54-G57 PolarHBondContact O-N 3.39Å; D54-N58 PolarHBondContact O-N 3.33Å; D54-N58 VanDerWaalsContact O-N 3.11Å; D54-N58 PolarHBondContact O-ND2 3.2Å; D54-N58 VanDerWaalsContact O-ND2 3.15Å |
| 55 | A | 88.7 | Confident | 87 | Confident | 0 Ų | 0 | 61.1 Ų | 61.1 | 0% | 0 | 35% | 0.349 | C | S | . | . | H | α-helix | trans | -60.6 | -41.6 | 175.5 | 0 | 0 | 0 | 0 | 0 | 112.3 | Q30 W51 H52 N58 G59 S60 S63 | Q30-A55 HydrophobicContact CB-CB 3.72Å; W51-A55 WeakPolarHBondContact O-CB 3.48Å; W51-A55 PolarHBondContact O-N 3.34Å; H52-A55 PolarHBondContact O-N 3.42Å; A55-N58 CarbonylContact O-C 3.51Å; A55-N58 PolarHBondContact O-N 3.15Å; A55-G59 PolarHBondContact O-N 3.06Å; A55-S60 VanDerWaalsContact C-CB 3.46Å; A55-S60 WeakPolarHBondContact O-CB 3.28Å; A55-S60 PolarHBondContact O-N 3.06Å; A55-S63 WeakPolarHBondContact CB-OG 3.08Å |
| 56 | C | 87.7 | Confident | 86.7 | Confident | 30 Ų | 30 | 58.1 Ų | 58.1 | 20% | 0.203 | 33% | 0.332 | C | S | . | . | H | α-helix | trans | -65.5 | -42.9 | 178.7 | -173.6 | 0 | 0 | 0 | 0 | 111.4 | H52 S53 D54 N58 G59 Q64 I67 | H52-C56 WeakPolarHBondContact O-CB 3.47Å; H52-C56 PolarHBondContact O-N 3.49Å; S53-C56 WeakPolarHBondContact O-CB 3.47Å; S53-C56 PolarHBondContact O-N 3.11Å; D54-C56 VanDerWaalsContact C-N 3.32Å; D54-C56 PolarHBondContact O-N 3.3Å; C56-N58 PolarHBondContact O-N 2.94Å; C56-G59 PolarHBondContact O-N 3.13Å; C56-Q64 WeakPolarHBondContact SG-CG 3.24Å; C56-I67 HydrophobicContact CB-CD1 3.46Å; C56-I67 VanDerWaalsContact CB-CD1 3.46Å |
| 57 | G | 84.4 | Confident | 86.2 | Confident | 71 Ų | 71 | 51 Ų | 51 | 73% | 0.732 | 30% | 0.299 | S | S | * | . | H | α-helix | trans | -59.5 | -30 | 172.3 | 0 | 0 | 0 | 0 | 0 | 113 | S53 D54 | S53-G57 PolarHBondContact O-N 2.93Å; D54-G57 PolarHBondContact O-N 3.39Å |
| 58 | N | 84.1 | Confident | 85.8 | Confident | 80 Ų | 80 | 50.5 Ų | 50.5 | 43% | 0.428 | 30% | 0.304 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -87.1 | 1.1 | 174.9 | -67.6 | -39.3 | 0 | 0 | 0 | 114.2 | I27 Q30 D54 A55 C56 | I27-N58 HydrophobicContact CD1-CB 4.06Å; I27-N58 WeakPolarHBondContact CD1-O 3.48Å; I27-N58 HydrophobicContact CG1-CB 3.46Å; I27-N58 VanDerWaalsContact CG1-CB 3.46Å; Q30-N58 PolarHBondContact NE2-ND2 3.19Å; Q30-N58 PolarHBondContact OE1-ND2 2.99Å; D54-N58 PolarHBondContact O-N 3.33Å; D54-N58 VanDerWaalsContact O-N 3.11Å; D54-N58 PolarHBondContact O-ND2 3.2Å; D54-N58 VanDerWaalsContact O-ND2 3.15Å; A55-N58 CarbonylContact O-C 3.51Å; A55-N58 PolarHBondContact O-N 3.15Å; C56-N58 PolarHBondContact O-N 2.94Å |
| 59 | G | 83.1 | Confident | 85.1 | Confident | 53 Ų | 53 | 58.5 Ų | 58.5 | 55% | 0.546 | 34% | 0.339 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 101.1 | 16.1 | 175.4 | 0 | 0 | 0 | 0 | 0 | 115.9 | A55 C56 V61 | A55-G59 PolarHBondContact O-N 3.06Å; C56-G59 PolarHBondContact O-N 3.13Å; G59-V61 PolarHBondContact O-N 3.29Å |
| 60 | S | 84.1 | Confident | 84.2 | Confident | 8 Ų | 8 | 58.1 Ų | 58.1 | 6% | 0.056 | 34% | 0.338 | C | S | . | . | trans | -71.4 | 107.6 | 174.4 | -172.4 | 0 | 0 | 0 | 0 | 112.2 | T31 A55 E62 S63 Q64 | T31-S60 PolarHBondContact OG1-OG 3.23Å; T31-S60 VanDerWaalsContact OG1-OG 3.08Å; A55-S60 VanDerWaalsContact C-CB 3.46Å; A55-S60 WeakPolarHBondContact O-CB 3.28Å; A55-S60 PolarHBondContact O-N 3.06Å; S60-E62 VanDerWaalsContact C-N 3.31Å; S60-S63 PolarHBondContact OG-N 2.86Å; S60-S63 PolarHBondContact OG-OG 2.94Å; S60-Q64 PolarHBondContact O-N 2.78Å; S60-Q64 VanDerWaalsContact O-N 3.12Å | ||
| 61 | V | 85.2 | Confident | 82.9 | Confident | 113 Ų | 113 | 62.2 Ų | 62.2 | 69% | 0.685 | 35% | 0.349 | S | S | * | . | H | α-helix | trans | -66.8 | -33.6 | 173.4 | -178.6 | 0 | 0 | 0 | 0 | 111.6 | G59 Q64 G65 | G59-V61 PolarHBondContact O-N 3.29Å; V61-Q64 WeakPolarHBondContact O-CB 3.3Å; V61-Q64 PolarHBondContact O-N 2.98Å; V61-G65 PolarHBondContact O-N 3.35Å |
| 62 | E | 86.1 | Confident | 81.2 | Confident | 118 Ų | 118 | 67.3 Ų | 67.3 | 55% | 0.551 | 38% | 0.378 | S | S | * | . | H | α-helix | trans | -65.6 | -45.2 | 178.3 | -172.2 | 172.8 | -161.2 | 0 | 0 | 111.1 | T31 Y35 S60 Q64 G65 F66 | T31-E62 HydrophobicContact CG2-CB 4.4Å; T31-E62 HydrophobicContact CG2-CG 4.24Å; Y35-E62 HydrophobicContact CE2-CG 4.39Å; Y35-E62 WeakPolarHBondContact OH-CG 3.44Å; Y35-E62 PolarHBondContact OH-OE1 3.06Å; S60-E62 VanDerWaalsContact C-N 3.31Å; E62-Q64 VanDerWaalsContact C-N 3.31Å; E62-Q64 PolarHBondContact O-N 3.25Å; E62-G65 PolarHBondContact O-N 2.83Å; E62-G65 VanDerWaalsContact O-N 3.17Å; E62-F66 PolarHBondContact O-N 3.08Å |
| 63 | S | 85.2 | Confident | 79.5 | Confident | 0 Ų | 0 | 71.6 Ų | 71.6 | 0% | 0 | 41% | 0.407 | C | S | . | . | H | α-helix | trans | -69.7 | -27.6 | 176.8 | -65.5 | 0 | 0 | 0 | 0 | 112.8 | T31 H52 A55 S60 G65 F66 I67 | T31-S63 PolarHBondContact OG1-OG 2.76Å; H52-S63 WeakPolarHBondContact ND1-CB 3.41Å; H52-S63 PolarHBondContact ND1-OG 3.25Å; H52-S63 WeakPolarHBondContact O-CB 3.19Å; A55-S63 WeakPolarHBondContact CB-OG 3.08Å; S60-S63 PolarHBondContact OG-N 2.86Å; S60-S63 PolarHBondContact OG-OG 2.94Å; S63-G65 VanDerWaalsContact C-N 3.28Å; S63-G65 PolarHBondContact O-N 2.94Å; S63-F66 PolarHBondContact O-N 3.46Å; S63-I67 WeakPolarHBondContact O-CG1 3.13Å; S63-I67 PolarHBondContact O-N 3.42Å |
| 64 | Q | 83.8 | Confident | 77.5 | Confident | 93 Ų | 93 | 81.4 Ų | 81.4 | 44% | 0.435 | 45% | 0.446 | S | S | . | . | H | α-helix | trans | -56.7 | -43.1 | 169.5 | -85.8 | -178.1 | -14.1 | 0 | 0 | 111.8 | C56 S60 V61 E62 F66 T68 | C56-Q64 WeakPolarHBondContact SG-CG 3.24Å; S60-Q64 PolarHBondContact O-N 2.78Å; S60-Q64 VanDerWaalsContact O-N 3.12Å; V61-Q64 WeakPolarHBondContact O-CB 3.3Å; V61-Q64 PolarHBondContact O-N 2.98Å; E62-Q64 VanDerWaalsContact C-N 3.31Å; E62-Q64 PolarHBondContact O-N 3.25Å; Q64-F66 VanDerWaalsContact C-N 3.34Å; Q64-F66 PolarHBondContact O-N 3.3Å; Q64-T68 VanDerWaalsContact O-CB 3.25Å; Q64-T68 WeakPolarHBondContact O-CB 3.46Å; Q64-T68 PolarHBondContact O-N 3.4Å; Q64-T68 PolarHBondContact O-OG1 3.02Å |
| 65 | G | 82.6 | Confident | 76.9 | Confident | 45 Ų | 45 | 82.5 Ų | 82.5 | 46% | 0.464 | 45% | 0.452 | S | S | . | . | H | α-helix | trans | -59.1 | -45.3 | 176.6 | 0 | 0 | 0 | 0 | 0 | 112.1 | V61 E62 S63 K69 | V61-G65 PolarHBondContact O-N 3.35Å; E62-G65 PolarHBondContact O-N 2.83Å; E62-G65 VanDerWaalsContact O-N 3.17Å; S63-G65 VanDerWaalsContact C-N 3.28Å; S63-G65 PolarHBondContact O-N 2.94Å; G65-K69 WeakPolarHBondContact O-CB 3.22Å; G65-K69 PolarHBondContact O-N 2.89Å; G65-K69 VanDerWaalsContact O-N 3.16Å |
| 66 | F | 80.6 | Confident | 76.3 | Confident | 37 Ų | 37 | 86.8 Ų | 86.8 | 16% | 0.162 | 48% | 0.476 | C | S | . | . | H | α-helix | trans | -63.2 | -51 | 179 | -162 | -84.5 | 0 | 0 | 0 | 112 | Y35 H52 E62 S63 Q64 T68 K69 H70 | Y35-F66 HydrophobicContact CE1-CD2 4.46Å; H52-F66 HydrophobicContact CB-CD1 4.39Å; H52-F66 AromaticContact CD2-CD1 3.24Å; H52-F66 WeakPolarHBondContact CD2-CD1 3.43Å; H52-F66 AromaticContact CD2-CE1 3.62Å; H52-F66 AromaticContact CD2-CG 3.51Å; H52-F66 AromaticContact CG-CD1 3.89Å; H52-F66 AromaticContact NE2-CD1 3.76Å; H52-F66 AromaticContact NE2-CD2 3.69Å; H52-F66 AromaticContact NE2-CE2 3.99Å; H52-F66 AromaticContact NE2-CG 3.57Å; E62-F66 PolarHBondContact O-N 3.08Å; S63-F66 PolarHBondContact O-N 3.46Å; Q64-F66 VanDerWaalsContact C-N 3.34Å; Q64-F66 PolarHBondContact O-N 3.3Å; F66-T68 PolarHBondContact O-N 2.97Å; F66-K69 PolarHBondContact O-N 3.35Å; F66-H70 AromaticContact CD1-CD2 3.66Å; F66-H70 AromaticContact CE1-CD2 3.37Å; F66-H70 WeakPolarHBondContact CE1-CD2 3.06Å; F66-H70 AromaticContact CE1-NE2 3.74Å; F66-H70 AromaticContact CZ-CD2 3.75Å; F66-H70 AromaticContact CZ-NE2 3.6Å; F66-H70 PolarHBondContact O-CD2 3.41Å; F66-H70 PolarHBondContact O-N 3.03Å; F66-H70 VanDerWaalsContact O-N 3.17Å |
| 67 | I | 80 | Confident | 75.7 | Confident | 17 Ų | 17 | 89.9 Ų | 89.9 | 9% | 0.087 | 49% | 0.491 | C | S | . | . | H | α-helix | trans | -62.3 | -45.2 | 179.9 | -63.3 | 170.6 | 0 | 0 | 0 | 110.8 | F49 H52 S53 C56 S63 K69 H70 R71 | F49-I67 HydrophobicContact CE2-CB 4.42Å; F49-I67 HydrophobicContact CE2-CG1 4.44Å; F49-I67 HydrophobicContact CE2-CG2 3.83Å; F49-I67 HydrophobicContact CZ-CG2 3.98Å; H52-I67 HydrophobicContact CB-CD1 4.33Å; H52-I67 HydrophobicContact CB-CG1 3.93Å; H52-I67 WeakPolarHBondContact O-CD1 3.45Å; S53-I67 VanDerWaalsContact CA-CD1 3.46Å; C56-I67 HydrophobicContact CB-CD1 3.46Å; C56-I67 VanDerWaalsContact CB-CD1 3.46Å; S63-I67 WeakPolarHBondContact O-CG1 3.13Å; S63-I67 PolarHBondContact O-N 3.42Å; I67-K69 PolarHBondContact O-N 3.26Å; I67-H70 PolarHBondContact O-N 3.32Å; I67-H70 VanDerWaalsContact O-N 3.12Å; I67-R71 HydrophobicContact CG2-CB 4.44Å; I67-R71 WeakPolarHBondContact O-CB 3.27Å; I67-R71 PolarHBondContact O-N 3.32Å |
| 68 | T | 79.5 | Confident | 75.1 | Confident | 88 Ų | 88 | 91.1 Ų | 91.1 | 54% | 0.54 | 48% | 0.477 | S | S | . | . | H | α-helix | trans | -60.4 | -38.2 | -177.5 | -58.8 | 0 | 0 | 0 | 0 | 110.8 | Q64 F66 | Q64-T68 VanDerWaalsContact O-CB 3.25Å; Q64-T68 WeakPolarHBondContact O-CB 3.46Å; Q64-T68 PolarHBondContact O-N 3.4Å; Q64-T68 PolarHBondContact O-OG1 3.02Å; F66-T68 PolarHBondContact O-N 2.97Å |
| 69 | K | 73.5 | Confident | 74.6 | Confident | 169 Ų | 169 | 91.8 Ų | 91.8 | 74% | 0.735 | 48% | 0.48 | S | S | * | . | H | α-helix | trans | -67.1 | -38 | 177.3 | -138.9 | -179.3 | -173.5 | -177 | 0 | 112.8 | G65 F66 I67 | G65-K69 WeakPolarHBondContact O-CB 3.22Å; G65-K69 PolarHBondContact O-N 2.89Å; G65-K69 VanDerWaalsContact O-N 3.16Å; F66-K69 PolarHBondContact O-N 3.35Å; I67-K69 PolarHBondContact O-N 3.26Å |
| 70 | H | 70.2 | Confident | 74 | Confident | 65 Ų | 65 | 94.3 Ų | 94.3 | 30% | 0.301 | 48% | 0.476 | S | S | . | . | H | α-helix | trans | -90.4 | -22.4 | -176.5 | -78.7 | -74.7 | 0 | 0 | 0 | 114.7 | F49 F66 I67 I72 S73 | F49-H70 HydrophobicContact CD2-CB 4.47Å; F66-H70 AromaticContact CD1-CD2 3.66Å; F66-H70 AromaticContact CE1-CD2 3.37Å; F66-H70 WeakPolarHBondContact CE1-CD2 3.06Å; F66-H70 AromaticContact CE1-NE2 3.74Å; F66-H70 AromaticContact CZ-CD2 3.75Å; F66-H70 AromaticContact CZ-NE2 3.6Å; F66-H70 PolarHBondContact O-CD2 3.41Å; F66-H70 PolarHBondContact O-N 3.03Å; F66-H70 VanDerWaalsContact O-N 3.17Å; I67-H70 PolarHBondContact O-N 3.32Å; I67-H70 VanDerWaalsContact O-N 3.12Å; H70-I72 PolarHBondContact O-N 3.28Å; H70-S73 PolarHBondContact O-N 3.13Å; H70-S73 VanDerWaalsContact O-N 3.09Å |
| 71 | R | 63.1 | Low | 73.3 | Confident | 190 Ų | 190 | 100.5 Ų | 100.5 | 72% | 0.717 | 51% | 0.506 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -69.2 | -15.3 | 178.7 | -171.3 | 173.9 | 169.6 | 171.1 | -1.8 | 113.1 | I67 S73 | I67-R71 HydrophobicContact CG2-CB 4.44Å; I67-R71 WeakPolarHBondContact O-CB 3.27Å; I67-R71 PolarHBondContact O-N 3.32Å; R71-S73 VanDerWaalsContact C-N 3.3Å |
| 72 | I | 54.9 | Low | 72.4 | Confident | 142 Ų | 142 | 99.5 Ų | 99.5 | 73% | 0.728 | 49% | 0.492 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -85.3 | -7 | 175.5 | -53.8 | 166.7 | 0 | 0 | 0 | 111 | H70 | H70-I72 PolarHBondContact O-N 3.28Š|
| 73 | S | 54.9 | Low | 71.2 | Confident | 89 Ų | 89 | 98 Ų | 98 | 62% | 0.622 | 49% | 0.487 | S | S | * | . | trans | -104.8 | 7.2 | -175 | -59 | 0 | 0 | 0 | 0 | 115.5 | H70 R71 | H70-S73 PolarHBondContact O-N 3.13Å; H70-S73 VanDerWaalsContact O-N 3.09Å; R71-S73 VanDerWaalsContact C-N 3.3Å | ||
| 74 | F | 46.7 | Very low | 70 | Confident | 241 Ų | 241 | 106.9 Ų | 106.9 | 100% | 1.057 | 53% | 0.532 | S | S | * | . | trans | -129.6 | 0 | 173 | -70.1 | -83.1 | 0 | 0 | 0 | 110.1 |
Retrieved 74 of 74 residues in 19.9 ms
(Link to these results)