| 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 | 35.4 | Very low | 50.7 | Low | 243 Ų | 243 | 150.7 Ų | 150.7 | 100% | 1.197 | 76% | 0.758 | S | S | * | * | 0 | 115.8 | 0 | -77.7 | 175.8 | -175.8 | 0 | 0 | 107.3 | Q3 | M1-Q3 PolarHBondContact O-N 2.93Š| |||
| 2 | M | 42.7 | Very low | 52.3 | Low | 188 Ų | 188 | 148.9 Ų | 148.9 | 93% | 0.926 | 75% | 0.752 | S | S | * | * | trans | -80.9 | 109.1 | 167.5 | -87.5 | 175 | 168.5 | 0 | 0 | 106.9 | I4 | M2-I4 PolarHBondContact O-N 3.23Š| ||
| 3 | Q | 49.5 | Very low | 54.6 | Low | 191 Ų | 191 | 141.2 Ų | 141.2 | 89% | 0.893 | 72% | 0.72 | S | S | * | * | trans | -64.1 | 112.9 | 166.4 | -98.8 | -177.3 | -61.1 | 0 | 0 | 107.4 | M1 S5 | M1-Q3 PolarHBondContact O-N 2.93Å; Q3-S5 PolarHBondContact O-N 3.14Å | ||
| 4 | I | 54.2 | Low | 56.8 | Low | 129 Ų | 129 | 138.4 Ų | 138.4 | 66% | 0.662 | 71% | 0.707 | S | S | * | * | trans | -79.8 | 116.9 | 172.2 | -45 | 163.2 | 0 | 0 | 0 | 105 | M2 D6 | M2-I4 PolarHBondContact O-N 3.23Å; I4-D6 VanDerWaalsContact CB-OD2 3.32Å; I4-D6 WeakPolarHBondContact CB-OD2 3.39Å; I4-D6 VanDerWaalsContact CG2-CG 3.44Å; I4-D6 WeakPolarHBondContact CG2-OD1 3.36Å; I4-D6 WeakPolarHBondContact CG2-OD2 3.34Å; I4-D6 PolarHBondContact O-N 3.4Å | ||
| 5 | S | 48.8 | Very low | 58.6 | Low | 96 Ų | 96 | 139.3 Ų | 139.3 | 67% | 0.671 | 70% | 0.704 | S | S | * | * | trans | -72.2 | 58.5 | 176.9 | -58.5 | 0 | 0 | 0 | 0 | 110.6 | Q3 S7 | Q3-S5 PolarHBondContact O-N 3.14Å; S5-S7 PolarHBondContact O-N 3.23Å | ||
| 6 | D | 51.9 | Low | 60.5 | Low | 107 Ų | 107 | 132.4 Ų | 132.4 | 57% | 0.572 | 67% | 0.672 | S | S | * | * | H | α-helix | trans | -67.7 | -22 | -170.4 | -76.4 | -45.9 | 0 | 0 | 0 | 113.4 | I4 | I4-D6 VanDerWaalsContact CB-OD2 3.32Å; I4-D6 WeakPolarHBondContact CB-OD2 3.39Å; I4-D6 VanDerWaalsContact CG2-CG 3.44Å; I4-D6 WeakPolarHBondContact CG2-OD1 3.36Å; I4-D6 WeakPolarHBondContact CG2-OD2 3.34Å; I4-D6 PolarHBondContact O-N 3.4Å |
| 7 | S | 54.3 | Low | 62.1 | Low | 108 Ų | 108 | 127.8 Ų | 127.8 | 76% | 0.755 | 66% | 0.658 | S | S | * | * | H | α-helix | trans | -83.3 | -20.3 | -166.1 | -153 | 0 | 0 | 0 | 0 | 115.4 | S5 | S5-S7 PolarHBondContact O-N 3.23Å |
| 8 | Y | 48.4 | Very low | 63.6 | Low | 202 Ų | 202 | 122.9 Ų | 122.9 | 79% | 0.792 | 63% | 0.632 | S | S | * | * | H | α-helix | trans | -97.1 | -22.3 | -174.4 | -155.3 | -99.7 | 0 | 0 | 0 | 113.8 | ||
| 9 | N | 53.3 | Low | 64.9 | Low | 108 Ų | 108 | 119.2 Ų | 119.2 | 58% | 0.578 | 62% | 0.619 | S | S | * | * | H | α-helix | trans | -92.3 | -13.6 | -178.6 | -76.1 | -75.7 | 0 | 0 | 0 | 113.8 | K11 N12 S13 | N9-K11 VanDerWaalsContact C-N 3.26Å; N9-K11 PolarHBondContact O-N 3.49Å; N9-N12 PolarHBondContact O-N 3.39Å; N9-N12 VanDerWaalsContact O-N 3.1Å; N9-S13 PolarHBondContact O-N 3.04Å |
| 10 | Q | 57.6 | Low | 66.2 | Low | 136 Ų | 136 | 120.4 Ų | 120.4 | 64% | 0.636 | 62% | 0.615 | S | S | * | * | G | 310 helix | trans | -64.9 | -28.8 | -174.6 | -158.6 | 174.2 | 10.9 | 0 | 0 | 113.2 | N12 S13 T16 | Q10-N12 PolarHBondContact O-N 3.16Å; Q10-S13 WeakPolarHBondContact O-CB 3.46Å; Q10-S13 PolarHBondContact O-N 3.01Å; Q10-T16 WeakPolarHBondContact O-CB 3.29Å; Q10-T16 PolarHBondContact O-OG1 3.03Å |
| 11 | K | 61.5 | Low | 67.5 | Low | 150 Ų | 150 | 117.2 Ų | 117.2 | 65% | 0.652 | 60% | 0.596 | S | S | * | * | G | 310 helix | trans | -69.9 | -21.4 | 177.4 | -67.4 | -177.9 | -179.3 | 175.1 | 0 | 113.7 | N9 R20 | N9-K11 VanDerWaalsContact C-N 3.26Å; N9-K11 PolarHBondContact O-N 3.49Å; K11-R20 PolarHBondContact O-NH1 2.95Å |
| 12 | N | 70.1 | Confident | 70.2 | Confident | 129 Ų | 129 | 107.4 Ų | 107.4 | 69% | 0.69 | 55% | 0.549 | S | S | * | . | G | 310 helix | trans | -107.5 | 5.6 | -179.3 | -56.4 | -21.3 | 0 | 0 | 0 | 112.1 | N9 Q10 | N9-N12 PolarHBondContact O-N 3.39Å; N9-N12 VanDerWaalsContact O-N 3.1Å; Q10-N12 PolarHBondContact O-N 3.16Å |
| 13 | S | 82.8 | Confident | 72.6 | Confident | 49 Ų | 49 | 100.4 Ų | 100.4 | 34% | 0.343 | 53% | 0.525 | S | S | . | . | trans | -65.6 | 141.2 | 176.9 | 178.8 | 0 | 0 | 0 | 0 | 110.3 | N9 Q10 F15 T16 A17 | N9-S13 PolarHBondContact O-N 3.04Å; Q10-S13 WeakPolarHBondContact O-CB 3.46Å; Q10-S13 PolarHBondContact O-N 3.01Å; S13-F15 PolarHBondContact O-N 3.21Å; S13-F15 PolarHBondContact OG-N 3.38Å; S13-T16 WeakPolarHBondContact O-CA 3.48Å; S13-T16 WeakPolarHBondContact O-CB 3.4Å; S13-T16 PolarHBondContact O-N 3.41Å; S13-A17 PolarHBondContact O-N 3.3Å | ||
| 14 | L | 84.7 | Confident | 74.8 | Confident | 102 Ų | 102 | 94.2 Ų | 94.2 | 53% | 0.534 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -50.6 | -41.8 | 172.2 | 178.2 | 63.7 | 0 | 0 | 0 | 111.1 | T16 A17 M18 L120 | L14-T16 VanDerWaalsContact C-N 3.29Å; L14-T16 PolarHBondContact O-N 2.94Å; L14-A17 PolarHBondContact O-N 3.43Å; L14-M18 HydrophobicContact CD1-CG 4.2Å; L14-M18 HydrophobicContact CD1-SD 4.25Å; L14-M18 HydrophobicContact CD2-SD 4.41Å; L14-M18 HydrophobicContact CG-CG 4.32Å; L14-M18 HydrophobicContact CG-SD 3.9Å; L14-M18 VanDerWaalsContact O-CG 3.27Å; L14-M18 WeakPolarHBondContact O-CG 3.46Å; L14-M18 PolarHBondContact O-N 3.47Å; L14-L120 HydrophobicContact CD2-CD2 3.64Å |
| 15 | F | 84.4 | Confident | 76.6 | Confident | 151 Ų | 151 | 88.3 Ų | 88.3 | 66% | 0.662 | 48% | 0.476 | S | S | * | . | H | α-helix | trans | -58.9 | -40.7 | 177.6 | -178.8 | -96.8 | 0 | 0 | 0 | 112.5 | S13 S19 | S13-F15 PolarHBondContact O-N 3.21Å; S13-F15 PolarHBondContact OG-N 3.38Å; F15-S19 WeakPolarHBondContact O-CB 3.23Å; F15-S19 PolarHBondContact O-N 2.91Å; F15-S19 PolarHBondContact O-OG 3.27Å |
| 16 | T | 87.9 | Confident | 78.7 | Confident | 30 Ų | 30 | 86.2 Ų | 86.2 | 18% | 0.184 | 46% | 0.457 | C | S | . | . | H | α-helix | trans | -70.7 | -39.4 | 178.4 | -52.1 | 0 | 0 | 0 | 0 | 111.1 | Q10 S13 L14 S19 R20 | Q10-T16 WeakPolarHBondContact O-CB 3.29Å; Q10-T16 PolarHBondContact O-OG1 3.03Å; S13-T16 WeakPolarHBondContact O-CA 3.48Å; S13-T16 WeakPolarHBondContact O-CB 3.4Å; S13-T16 PolarHBondContact O-N 3.41Å; L14-T16 VanDerWaalsContact C-N 3.29Å; L14-T16 PolarHBondContact O-N 2.94Å; T16-S19 PolarHBondContact O-N 2.89Å; T16-R20 VanDerWaalsContact CG2-CZ 3.43Å; T16-R20 WeakPolarHBondContact O-CG 3.45Å; T16-R20 PolarHBondContact O-N 2.87Å |
| 17 | A | 88.1 | Confident | 80.8 | Confident | 53 Ų | 53 | 85.9 Ų | 85.9 | 44% | 0.438 | 46% | 0.455 | S | S | . | . | H | α-helix | trans | -62.6 | -46.6 | 174.4 | 0 | 0 | 0 | 0 | 0 | 111.5 | S13 L14 S19 R20 F21 | S13-A17 PolarHBondContact O-N 3.3Å; L14-A17 PolarHBondContact O-N 3.43Å; A17-S19 PolarHBondContact O-N 3.46Å; A17-R20 PolarHBondContact O-N 3.42Å; A17-F21 PolarHBondContact O-N 3.48Å |
| 18 | M | 89.1 | Confident | 82.7 | Confident | 40 Ų | 40 | 82.8 Ų | 82.8 | 20% | 0.197 | 43% | 0.429 | C | S | . | . | H | α-helix | trans | -60.6 | -45.4 | 175.7 | -67.9 | 175.8 | 95.3 | 0 | 0 | 111.6 | L14 R20 F21 I22 M82 F113 L117 | L14-M18 HydrophobicContact CD1-CG 4.2Å; L14-M18 HydrophobicContact CD1-SD 4.25Å; L14-M18 HydrophobicContact CD2-SD 4.41Å; L14-M18 HydrophobicContact CG-CG 4.32Å; L14-M18 HydrophobicContact CG-SD 3.9Å; L14-M18 VanDerWaalsContact O-CG 3.27Å; L14-M18 WeakPolarHBondContact O-CG 3.46Å; L14-M18 PolarHBondContact O-N 3.47Å; M18-R20 VanDerWaalsContact C-N 3.3Å; M18-R20 PolarHBondContact O-N 3.24Å; M18-F21 WeakPolarHBondContact O-CB 3.47Å; M18-F21 PolarHBondContact O-N 2.85Å; M18-I22 WeakPolarHBondContact O-CG1 3.49Å; M18-I22 PolarHBondContact O-N 3.45Å; M18-M82 HydrophobicContact CB-SD 4.38Å; M18-M82 HydrophobicContact CE-CB 4.38Å; M18-M82 HydrophobicContact CE-CG 3.79Å; M18-M82 HydrophobicContact CE-SD 3.97Å; M18-M82 HydrophobicContact CG-SD 4.3Å; M18-F113 HydrophobicContact CE-CZ 4.39Å; M18-L117 HydrophobicContact CE-CD1 4.41Å |
| 19 | S | 89.2 | Confident | 84.7 | Confident | 53 Ų | 53 | 75.5 Ų | 75.5 | 37% | 0.371 | 41% | 0.405 | S | S | . | . | H | α-helix | trans | -61.1 | -39 | 178.2 | -60.2 | 0 | 0 | 0 | 0 | 112.4 | F15 T16 A17 G23 | F15-S19 WeakPolarHBondContact O-CB 3.23Å; F15-S19 PolarHBondContact O-N 2.91Å; F15-S19 PolarHBondContact O-OG 3.27Å; T16-S19 PolarHBondContact O-N 2.89Å; A17-S19 PolarHBondContact O-N 3.46Å; S19-G23 PolarHBondContact O-N 2.8Å |
| 20 | R | 91.1 | Very high | 86.5 | Confident | 143 Ų | 143 | 77.7 Ų | 77.7 | 54% | 0.54 | 41% | 0.411 | S | S | . | . | H | α-helix | trans | -67 | -43.7 | 175.3 | -73.8 | 175.9 | -178.1 | 129.7 | 0.6 | 111.8 | K11 T16 A17 M18 G23 A24 | K11-R20 PolarHBondContact O-NH1 2.95Å; T16-R20 VanDerWaalsContact CG2-CZ 3.43Å; T16-R20 WeakPolarHBondContact O-CG 3.45Å; T16-R20 PolarHBondContact O-N 2.87Å; A17-R20 PolarHBondContact O-N 3.42Å; M18-R20 VanDerWaalsContact C-N 3.3Å; M18-R20 PolarHBondContact O-N 3.24Å; R20-G23 PolarHBondContact O-N 3.2Å; R20-A24 PolarHBondContact O-N 3.32Å |
| 21 | F | 92.4 | Very high | 88.2 | Confident | 53 Ų | 53 | 75.9 Ų | 75.9 | 23% | 0.232 | 41% | 0.409 | C | S | . | . | H | α-helix | trans | -59.1 | -51.7 | 175.9 | 170.4 | -98.7 | 0 | 0 | 0 | 111.5 | A17 M18 G23 A24 V25 L75 I78 R79 M82 | A17-F21 PolarHBondContact O-N 3.48Å; M18-F21 WeakPolarHBondContact O-CB 3.47Å; M18-F21 PolarHBondContact O-N 2.85Å; F21-G23 VanDerWaalsContact C-N 3.28Å; F21-G23 PolarHBondContact O-N 3.44Å; F21-A24 PolarHBondContact O-N 3.3Å; F21-V25 HydrophobicContact CD1-CG2 4.41Å; F21-V25 HydrophobicContact CD2-CG2 4.1Å; F21-V25 HydrophobicContact CE1-CG2 3.99Å; F21-V25 HydrophobicContact CE2-CG2 3.64Å; F21-V25 HydrophobicContact CG-CG2 4.47Å; F21-V25 HydrophobicContact CZ-CG2 3.58Å; F21-V25 WeakPolarHBondContact O-CG2 3.49Å; F21-V25 PolarHBondContact O-N 2.95Å; F21-L75 HydrophobicContact CE2-CD2 3.81Å; F21-L75 HydrophobicContact CZ-CD2 4.33Å; F21-I78 HydrophobicContact CE1-CB 4.47Å; F21-I78 HydrophobicContact CE1-CG2 3.79Å; F21-I78 HydrophobicContact CZ-CB 4.09Å; F21-I78 HydrophobicContact CZ-CG2 3.64Å; F21-R79 HydrophobicContact CE1-CB 4.08Å; F21-M82 HydrophobicContact CD1-CE 3.59Å; F21-M82 HydrophobicContact CD1-SD 3.4Å; F21-M82 WeakPolarHBondContact CD1-SD 3.4Å; F21-M82 HydrophobicContact CE1-CE 3.71Å; F21-M82 HydrophobicContact CE1-SD 3.72Å; F21-M82 HydrophobicContact CG-CE 4.3Å; F21-M82 HydrophobicContact CG-SD 4.44Å |
| 22 | I | 91.9 | Very high | 89.6 | Confident | 38 Ų | 38 | 70.1 Ų | 70.1 | 20% | 0.195 | 39% | 0.387 | C | S | . | . | H | α-helix | trans | -57 | -44.1 | 177.7 | -66.7 | 165.8 | 0 | 0 | 0 | 110.5 | M18 A24 V25 N26 R79 M82 E83 | M18-I22 WeakPolarHBondContact O-CG1 3.49Å; M18-I22 PolarHBondContact O-N 3.45Å; I22-A24 PolarHBondContact O-N 2.88Å; I22-V25 PolarHBondContact O-N 3.4Å; I22-N26 WeakPolarHBondContact CG2-ND2 3.49Å; I22-N26 VanDerWaalsContact O-CB 3.26Å; I22-N26 WeakPolarHBondContact O-CB 3.39Å; I22-N26 PolarHBondContact O-N 3.45Å; I22-N26 PolarHBondContact O-ND2 2.91Å; I22-R79 HydrophobicContact CG1-CG 4.47Å; I22-M82 HydrophobicContact CD1-CB 4.39Å; I22-M82 HydrophobicContact CG1-SD 4.34Å; I22-E83 HydrophobicContact CD1-CG 4.42Å; I22-E83 WeakPolarHBondContact CG2-OE1 3.42Å |
| 23 | G | 93.5 | Very high | 90.6 | Very high | 41 Ų | 41 | 72 Ų | 72 | 42% | 0.423 | 39% | 0.394 | S | S | . | . | H | α-helix | trans | -59.6 | -42.7 | 175.9 | 0 | 0 | 0 | 0 | 0 | 113.3 | S19 R20 F21 N27 | S19-G23 PolarHBondContact O-N 2.8Å; R20-G23 PolarHBondContact O-N 3.2Å; F21-G23 VanDerWaalsContact C-N 3.28Å; F21-G23 PolarHBondContact O-N 3.44Å; G23-N27 WeakPolarHBondContact O-CB 3.45Å; G23-N27 PolarHBondContact O-N 3.47Å |
| 24 | A | 95 | Very high | 90.9 | Very high | 61 Ų | 61 | 73.1 Ų | 73.1 | 50% | 0.504 | 40% | 0.398 | S | S | . | . | H | α-helix | trans | -67.4 | -46.5 | 178.1 | 0 | 0 | 0 | 0 | 0 | 112.2 | R20 F21 I22 N26 N27 M28 | R20-A24 PolarHBondContact O-N 3.32Å; F21-A24 PolarHBondContact O-N 3.3Å; I22-A24 PolarHBondContact O-N 2.88Å; A24-N26 VanDerWaalsContact C-N 3.32Å; A24-N26 PolarHBondContact O-N 3.08Å; A24-N27 PolarHBondContact O-N 3.3Å; A24-M28 PolarHBondContact O-N 2.96Å |
| 25 | V | 93.5 | Very high | 91 | Very high | 5 Ų | 5 | 70.2 Ų | 70.2 | 3% | 0.03 | 39% | 0.385 | C | S | . | . | H | α-helix | trans | -65 | -37.5 | 177.4 | 178.7 | 0 | 0 | 0 | 0 | 111.1 | F21 I22 M28 D29 L75 K76 R79 | F21-V25 HydrophobicContact CD1-CG2 4.41Å; F21-V25 HydrophobicContact CD2-CG2 4.1Å; F21-V25 HydrophobicContact CE1-CG2 3.99Å; F21-V25 HydrophobicContact CE2-CG2 3.64Å; F21-V25 HydrophobicContact CG-CG2 4.47Å; F21-V25 HydrophobicContact CZ-CG2 3.58Å; F21-V25 WeakPolarHBondContact O-CG2 3.49Å; F21-V25 PolarHBondContact O-N 2.95Å; I22-V25 PolarHBondContact O-N 3.4Å; V25-M28 HydrophobicContact CG1-CE 3.94Å; V25-M28 WeakPolarHBondContact O-CB 3.32Å; V25-M28 PolarHBondContact O-N 3.36Å; V25-D29 WeakPolarHBondContact O-CB 3.31Å; V25-D29 PolarHBondContact O-N 2.9Å; V25-L75 HydrophobicContact CG2-CB 4.21Å; V25-K76 HydrophobicContact CG1-CG 4.32Å; V25-R79 HydrophobicContact CB-CB 4.29Å; V25-R79 HydrophobicContact CB-CG 4.41Å; V25-R79 HydrophobicContact CG1-CB 3.84Å; V25-R79 HydrophobicContact CG1-CG 4.18Å |
| 26 | N | 92.6 | Very high | 91.1 | Very high | 52 Ų | 52 | 66.2 Ų | 66.2 | 28% | 0.278 | 38% | 0.376 | S | S | . | . | H | α-helix | trans | -66.1 | -39.6 | 174.7 | -75.6 | -18 | 0 | 0 | 0 | 112.3 | I22 A24 M28 D29 Q30 R79 | I22-N26 WeakPolarHBondContact CG2-ND2 3.49Å; I22-N26 VanDerWaalsContact O-CB 3.26Å; I22-N26 WeakPolarHBondContact O-CB 3.39Å; I22-N26 PolarHBondContact O-N 3.45Å; I22-N26 PolarHBondContact O-ND2 2.91Å; A24-N26 VanDerWaalsContact C-N 3.32Å; A24-N26 PolarHBondContact O-N 3.08Å; N26-M28 VanDerWaalsContact C-N 3.34Å; N26-D29 PolarHBondContact O-N 3.27Å; N26-Q30 WeakPolarHBondContact O-CB 3.46Å; N26-Q30 VanDerWaalsContact O-CG 3.31Å; N26-Q30 WeakPolarHBondContact O-CG 3.39Å; N26-Q30 PolarHBondContact O-N 3.5Å; N26-R79 WeakPolarHBondContact OD1-CD 3.07Å; N26-R79 PolarHBondContact OD1-NH1 2.86Å |
| 27 | N | 94.8 | Very high | 91.1 | Very high | 99 Ų | 99 | 70.8 Ų | 70.8 | 53% | 0.529 | 40% | 0.399 | S | S | . | . | H | α-helix | trans | -63.9 | -40.6 | 172.9 | 178.5 | -107.2 | 0 | 0 | 0 | 111.9 | G23 A24 Q30 T31 | G23-N27 WeakPolarHBondContact O-CB 3.45Å; G23-N27 PolarHBondContact O-N 3.47Å; A24-N27 PolarHBondContact O-N 3.3Å; N27-Q30 PolarHBondContact O-N 2.84Å; N27-T31 WeakPolarHBondContact O-CB 3.42Å; N27-T31 PolarHBondContact O-N 3.05Å; N27-T31 VanDerWaalsContact O-N 3.07Å; N27-T31 PolarHBondContact O-OG1 3.46Å |
| 28 | M | 93.9 | Very high | 91 | Very high | 43 Ų | 43 | 69.4 Ų | 69.4 | 21% | 0.212 | 38% | 0.384 | C | S | . | . | H | α-helix | trans | -58.8 | -51.7 | 173 | -179.5 | -173.2 | 70 | 0 | 0 | 111.2 | A24 V25 N26 Q30 T31 V32 Y72 L75 K76 | A24-M28 PolarHBondContact O-N 2.96Å; V25-M28 HydrophobicContact CG1-CE 3.94Å; V25-M28 WeakPolarHBondContact O-CB 3.32Å; V25-M28 PolarHBondContact O-N 3.36Å; N26-M28 VanDerWaalsContact C-N 3.34Å; M28-Q30 VanDerWaalsContact C-N 3.3Å; M28-Q30 PolarHBondContact O-N 3.35Å; M28-T31 PolarHBondContact O-N 3.23Å; M28-V32 HydrophobicContact CG-CG2 4.15Å; M28-V32 WeakPolarHBondContact O-CG2 3.47Å; M28-V32 PolarHBondContact O-N 3.01Å; M28-Y72 HydrophobicContact CE-CD2 3.48Å; M28-Y72 VanDerWaalsContact CE-CD2 3.48Å; M28-Y72 HydrophobicContact CE-CE2 3.87Å; M28-Y72 HydrophobicContact CE-CG 4.37Å; M28-Y72 HydrophobicContact CG-CD2 4.07Å; M28-Y72 HydrophobicContact CG-CE2 4.28Å; M28-Y72 HydrophobicContact SD-CD2 3.76Å; M28-Y72 HydrophobicContact SD-CE2 4.44Å; M28-L75 HydrophobicContact CE-CB 3.91Å; M28-L75 HydrophobicContact CE-CD1 4.14Å; M28-L75 HydrophobicContact SD-CD1 3.94Å; M28-K76 HydrophobicContact CE-CG 4.32Å |
| 29 | D | 90.4 | Very high | 90.8 | Very high | 50 Ų | 50 | 73.8 Ų | 73.8 | 27% | 0.267 | 40% | 0.398 | S | S | . | . | H | α-helix | trans | -61.7 | -34.8 | -179.2 | -162.9 | 33.7 | 0 | 0 | 0 | 112.4 | V25 N26 Y72 K76 R79 | V25-D29 WeakPolarHBondContact O-CB 3.31Å; V25-D29 PolarHBondContact O-N 2.9Å; N26-D29 PolarHBondContact O-N 3.27Å; D29-Y72 PolarHBondContact OD1-OH 2.82Å; D29-K76 IonicContact OD1-NZ 3.37Å; D29-K76 PolarHBondContact OD1-NZ 3.48Å; D29-K76 IonicContact OD2-NZ 2.88Å; D29-K76 PolarHBondContact OD2-NZ 2.74Å; D29-R79 IonicContact OD2-CZ 2.88Å; D29-R79 IonicContact OD2-NH1 3.63Å; D29-R79 PolarHBondContact OD2-NH1 3.04Å; D29-R79 IonicContact OD2-NH2 3.84Å; D29-R79 PolarHBondContact OD2-NH2 3.19Å |
| 30 | Q | 91.4 | Very high | 90.4 | Very high | 154 Ų | 154 | 78.3 Ų | 78.3 | 72% | 0.72 | 42% | 0.418 | S | S | * | . | H | α-helix | trans | -71.3 | -31.2 | 173.6 | -75.1 | 179.1 | -15 | 0 | 0 | 113.2 | N26 N27 M28 | N26-Q30 WeakPolarHBondContact O-CB 3.46Å; N26-Q30 VanDerWaalsContact O-CG 3.31Å; N26-Q30 WeakPolarHBondContact O-CG 3.39Å; N26-Q30 PolarHBondContact O-N 3.5Å; N27-Q30 PolarHBondContact O-N 2.84Å; M28-Q30 VanDerWaalsContact C-N 3.3Å; M28-Q30 PolarHBondContact O-N 3.35Å |
| 31 | T | 93.5 | Very high | 89.9 | Confident | 97 Ų | 97 | 74.1 Ų | 74.1 | 60% | 0.595 | 41% | 0.408 | S | S | * | . | H | α-helix | trans | -84.9 | -38.9 | -176.6 | -55.4 | 0 | 0 | 0 | 0 | 111.3 | N27 M28 M33 | N27-T31 WeakPolarHBondContact O-CB 3.42Å; N27-T31 PolarHBondContact O-N 3.05Å; N27-T31 VanDerWaalsContact O-N 3.07Å; N27-T31 PolarHBondContact O-OG1 3.46Å; M28-T31 PolarHBondContact O-N 3.23Å; T31-M33 PolarHBondContact O-N 3.49Å |
| 32 | V | 91.8 | Very high | 89.1 | Confident | 30 Ų | 30 | 76.6 Ų | 76.6 | 18% | 0.182 | 43% | 0.43 | C | S | . | . | trans | -79.2 | 84.2 | 179.1 | -178.2 | 0 | 0 | 0 | 0 | 109.6 | M28 V34 P35 L38 Y72 | M28-V32 HydrophobicContact CG-CG2 4.15Å; M28-V32 WeakPolarHBondContact O-CG2 3.47Å; M28-V32 PolarHBondContact O-N 3.01Å; V32-V34 VanDerWaalsContact C-N 3.34Å; V32-V34 PolarHBondContact O-N 3.41Å; V32-P35 HydrophobicContact CG1-CB 4.2Å; V32-P35 HydrophobicContact CG1-CG 4.03Å; V32-L38 HydrophobicContact CG1-CD1 3.71Å; V32-L38 HydrophobicContact CG1-CG 4.32Å; V32-L38 HydrophobicContact CG2-CD1 4.2Å; V32-Y72 HydrophobicContact CB-CD2 4.47Å; V32-Y72 HydrophobicContact CB-CE2 3.89Å; V32-Y72 HydrophobicContact CG1-CD2 4.4Å; V32-Y72 HydrophobicContact CG1-CE2 3.99Å; V32-Y72 HydrophobicContact CG2-CD2 4.29Å; V32-Y72 HydrophobicContact CG2-CE2 4.13Å | ||
| 33 | M | 89.9 | Confident | 87.9 | Confident | 168 Ų | 168 | 77.4 Ų | 77.4 | 83% | 0.828 | 43% | 0.434 | S | S | * | . | S | Bend | trans | -74.8 | -23.1 | -178.9 | -58.5 | -154.1 | 77.6 | 0 | 0 | 113.8 | T31 | T31-M33 PolarHBondContact O-N 3.49Š|
| 34 | V | 89.9 | Confident | 86.1 | Confident | 73 Ų | 73 | 84.3 Ų | 84.3 | 44% | 0.442 | 46% | 0.456 | S | S | . | . | trans | -135.9 | 84.8 | -179.4 | -171.9 | 0 | 0 | 0 | 0 | 109.1 | V32 S36 L37 | V32-V34 VanDerWaalsContact C-N 3.34Å; V32-V34 PolarHBondContact O-N 3.41Å; V34-S36 WeakPolarHBondContact CG1-OG 3.31Å; V34-S36 PolarHBondContact O-N 3.38Å; V34-S36 VanDerWaalsContact O-N 3.13Å; V34-L37 HydrophobicContact CB-CD1 3.95Å; V34-L37 HydrophobicContact CB-CG 4.08Å; V34-L37 HydrophobicContact CG1-CD1 4.19Å; V34-L37 HydrophobicContact CG1-CG 3.86Å; V34-L37 WeakPolarHBondContact O-CB 3.48Å; V34-L37 PolarHBondContact O-N 2.93Å; V34-L37 VanDerWaalsContact O-N 3.12Å | ||
| 35 | P | 86.5 | Confident | 84.2 | Confident | 40 Ų | 40 | 87 Ų | 87 | 26% | 0.26 | 46% | 0.461 | S | S | . | . | G | 310 helix | trans | -58.4 | -28.2 | -175.3 | -27.4 | 35.4 | 0 | 0 | 0 | 114.4 | V32 L37 L38 Y69 Y72 | V32-P35 HydrophobicContact CG1-CB 4.2Å; V32-P35 HydrophobicContact CG1-CG 4.03Å; P35-L37 PolarHBondContact O-N 2.79Å; P35-L37 VanDerWaalsContact O-N 3.13Å; P35-L38 WeakPolarHBondContact O-CB 3.41Å; P35-L38 PolarHBondContact O-N 2.68Å; P35-Y69 HydrophobicContact CB-CD2 4.16Å; P35-Y69 HydrophobicContact CB-CE2 3.85Å; P35-Y69 VanDerWaalsContact O-CD2 3.25Å; P35-Y69 WeakPolarHBondContact O-CD2 3.44Å; P35-Y72 HydrophobicContact CB-CD1 4.24Å; P35-Y72 HydrophobicContact CB-CE1 3.72Å; P35-Y72 HydrophobicContact CG-CE1 3.86Å |
| 36 | S | 86.3 | Confident | 81.9 | Confident | 68 Ų | 68 | 89.2 Ų | 89.2 | 48% | 0.476 | 49% | 0.485 | S | S | . | . | G | 310 helix | trans | -62.9 | -19.6 | 179.2 | 58.8 | 0 | 0 | 0 | 0 | 113.9 | V34 L38 R39 | V34-S36 WeakPolarHBondContact CG1-OG 3.31Å; V34-S36 PolarHBondContact O-N 3.38Å; V34-S36 VanDerWaalsContact O-N 3.13Å; S36-L38 PolarHBondContact O-N 3.24Å; S36-R39 PolarHBondContact O-N 3.37Å |
| 37 | L | 87.5 | Confident | 79.7 | Confident | 126 Ų | 126 | 96.2 Ų | 96.2 | 66% | 0.66 | 52% | 0.516 | S | S | * | . | G | 310 helix | trans | -72.2 | -14 | 174.8 | -64.3 | 179.4 | 0 | 0 | 0 | 113.1 | V34 P35 R39 V41 | V34-L37 HydrophobicContact CB-CD1 3.95Å; V34-L37 HydrophobicContact CB-CG 4.08Å; V34-L37 HydrophobicContact CG1-CD1 4.19Å; V34-L37 HydrophobicContact CG1-CG 3.86Å; V34-L37 WeakPolarHBondContact O-CB 3.48Å; V34-L37 PolarHBondContact O-N 2.93Å; V34-L37 VanDerWaalsContact O-N 3.12Å; P35-L37 PolarHBondContact O-N 2.79Å; P35-L37 VanDerWaalsContact O-N 3.13Å; L37-R39 VanDerWaalsContact C-N 3.32Å; L37-V41 VanDerWaalsContact O-CG2 3.26Å; L37-V41 WeakPolarHBondContact O-CG2 3.26Å |
| 38 | L | 86.6 | Confident | 77.2 | Confident | 24 Ų | 24 | 98.3 Ų | 98.3 | 13% | 0.126 | 53% | 0.528 | C | S | . | . | G | 310 helix | trans | -86.3 | -7.6 | 177 | -55.2 | -177.3 | 0 | 0 | 0 | 112.3 | V32 P35 S36 M68 Y69 Y72 | V32-L38 HydrophobicContact CG1-CD1 3.71Å; V32-L38 HydrophobicContact CG1-CG 4.32Å; V32-L38 HydrophobicContact CG2-CD1 4.2Å; P35-L38 WeakPolarHBondContact O-CB 3.41Å; P35-L38 PolarHBondContact O-N 2.68Å; S36-L38 PolarHBondContact O-N 3.24Å; L38-M68 HydrophobicContact CB-CB 4.12Å; L38-M68 HydrophobicContact CB-CG 4.29Å; L38-M68 HydrophobicContact CD1-CG 4.35Å; L38-M68 HydrophobicContact CD2-CE 4.1Å; L38-M68 HydrophobicContact CD2-CG 4.07Å; L38-M68 HydrophobicContact CD2-SD 3.74Å; L38-M68 HydrophobicContact CG-CG 4.47Å; L38-Y69 PolarHBondContact O-N 3.2Å; L38-Y69 VanDerWaalsContact O-N 3.08Å; L38-Y72 HydrophobicContact CD1-CD2 4.28Å; L38-Y72 HydrophobicContact CD1-CG 4.13Å |
| 39 | R | 85.4 | Confident | 75.1 | Confident | 132 Ų | 132 | 103.6 Ų | 103.6 | 50% | 0.498 | 56% | 0.556 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -71.2 | 141.1 | 177.4 | -69.8 | -172.9 | -173.7 | 175.5 | 1.9 | 110.1 | S36 L37 V41 D67 Y69 | S36-R39 PolarHBondContact O-N 3.37Å; L37-R39 VanDerWaalsContact C-N 3.32Å; R39-V41 PolarHBondContact O-N 3.37Å; R39-D67 WeakPolarHBondContact CA-OD2 3.33Å; R39-Y69 HydrophobicContact CG-CD1 3.9Å; R39-Y69 HydrophobicContact CG-CD2 4.19Å; R39-Y69 HydrophobicContact CG-CG 3.69Å |
| 40 | D | 80.6 | Confident | 72.6 | Confident | 148 Ų | 148 | 110.9 Ų | 110.9 | 79% | 0.791 | 59% | 0.585 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 58.7 | 16.5 | -179.7 | -48 | -62.1 | 0 | 0 | 0 | 113.7 | P42 D67 | D40-P42 WeakPolarHBondContact O-CD 3.34Å; D40-D67 PolarHBondContact N-OD2 3.26Å |
| 41 | V | 79.8 | Confident | 70.5 | Confident | 54 Ų | 54 | 108.7 Ų | 108.7 | 33% | 0.327 | 58% | 0.582 | S | S | . | * | trans | -90.6 | 113.8 | 172.2 | 179.2 | 0 | 0 | 0 | 0 | 107.8 | L37 R39 L43 M68 | L37-V41 VanDerWaalsContact O-CG2 3.26Å; L37-V41 WeakPolarHBondContact O-CG2 3.26Å; R39-V41 PolarHBondContact O-N 3.37Å; V41-L43 PolarHBondContact O-N 3.1Å; V41-M68 HydrophobicContact CB-CB 4.21Å; V41-M68 HydrophobicContact CG1-CB 4.4Å; V41-M68 HydrophobicContact CG1-SD 4.45Å; V41-M68 PolarHBondContact O-N 2.89Å; V41-M68 VanDerWaalsContact O-N 3.08Å | ||
| 42 | P | 75.5 | Confident | 68 | Low | 106 Ų | 106 | 109 Ų | 109 | 69% | 0.688 | 59% | 0.586 | S | S | * | * | trans | -62.2 | 137.6 | 173.4 | -15.7 | 28.9 | 0 | 0 | 0 | 109.2 | D40 E44 | D40-P42 WeakPolarHBondContact O-CD 3.34Å; P42-E44 VanDerWaalsContact C-N 3.25Å; P42-E44 PolarHBondContact O-N 2.93Å | ||
| 43 | L | 67.2 | Low | 65.6 | Low | 55 Ų | 55 | 117.1 Ų | 117.1 | 29% | 0.288 | 62% | 0.622 | S | S | . | * | trans | -71.3 | 92.7 | 164.2 | -73.3 | 161.3 | 0 | 0 | 0 | 106.1 | V41 D45 P64 M68 | V41-L43 PolarHBondContact O-N 3.1Å; L43-D45 PolarHBondContact O-N 3.36Å; L43-P64 HydrophobicContact CB-CG 3.72Å; L43-P64 HydrophobicContact CD1-CB 3.42Å; L43-P64 VanDerWaalsContact CD1-CB 3.42Å; L43-P64 HydrophobicContact CD1-CG 3.42Å; L43-P64 VanDerWaalsContact CD1-CG 3.42Å; L43-P64 HydrophobicContact CG-CG 4.18Å; L43-M68 HydrophobicContact CD2-CB 4.13Å; L43-M68 HydrophobicContact CD2-CG 4.06Å; L43-M68 HydrophobicContact CG-CB 4.42Å | ||
| 44 | E | 56.3 | Low | 63.3 | Low | 186 Ų | 186 | 114.6 Ų | 114.6 | 87% | 0.869 | 62% | 0.621 | S | S | * | * | trans | -53.7 | 128.6 | 177.8 | -150.4 | -173.9 | 172.5 | 0 | 0 | 108 | P42 G46 | P42-E44 VanDerWaalsContact C-N 3.25Å; P42-E44 PolarHBondContact O-N 2.93Å; E44-G46 PolarHBondContact O-N 2.77Å | ||
| 45 | D | 54.2 | Low | 61 | Low | 116 Ų | 116 | 114.1 Ų | 114.1 | 62% | 0.62 | 62% | 0.624 | S | S | * | * | trans | -62.5 | 79.7 | -179.2 | -74.1 | -41.5 | 0 | 0 | 0 | 109.7 | L43 E47 | L43-D45 PolarHBondContact O-N 3.36Å; D45-E47 WeakPolarHBondContact O-CG 3.43Å; D45-E47 PolarHBondContact O-N 2.93Å; D45-E47 VanDerWaalsContact O-N 3.13Å | ||
| 46 | G | 45.4 | Very low | 58.7 | Low | 52 Ų | 52 | 117.6 Ų | 117.6 | 54% | 0.536 | 65% | 0.647 | S | S | . | * | trans | -80.2 | 96.9 | -176.3 | 0 | 0 | 0 | 0 | 0 | 109.5 | E44 D48 | E44-G46 PolarHBondContact O-N 2.77Å; G46-D48 PolarHBondContact O-N 3.37Å | ||
| 47 | E | 46 | Very low | 56.5 | Low | 199 Ų | 199 | 119.4 Ų | 119.4 | 93% | 0.93 | 66% | 0.66 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -55.8 | 13.8 | 172.9 | -37 | -170.9 | -157.5 | 0 | 0 | 114.6 | D45 | D45-E47 WeakPolarHBondContact O-CG 3.43Å; D45-E47 PolarHBondContact O-N 2.93Å; D45-E47 VanDerWaalsContact O-N 3.13Å |
| 48 | D | 42.7 | Very low | 54.5 | Low | 144 Ų | 144 | 118.2 Ų | 118.2 | 77% | 0.77 | 66% | 0.658 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -124.3 | 10 | -167.6 | -147 | 18.3 | 0 | 0 | 0 | 114.1 | G46 K50 | G46-D48 PolarHBondContact O-N 3.37Å; D48-K50 VanDerWaalsContact C-N 3.25Å; D48-K50 PolarHBondContact O-N 3.05Å |
| 49 | L | 49.3 | Very low | 52.3 | Low | 154 Ų | 154 | 124.5 Ų | 124.5 | 81% | 0.806 | 69% | 0.692 | S | S | * | * | trans | -77.7 | 79 | 164.2 | -75.6 | 167.6 | 0 | 0 | 0 | 109.5 | V51 | L49-V51 VanDerWaalsContact C-N 3.26Å; L49-V51 PolarHBondContact O-N 3.24Å | ||
| 50 | K | 38.7 | Very low | 50 | Low | 202 Ų | 202 | 121.3 Ų | 121.3 | 88% | 0.878 | 70% | 0.7 | S | S | * | * | trans | -61.3 | 89.3 | 164.7 | -90.1 | -167.4 | 176.5 | -176.7 | 0 | 110.1 | D48 | D48-K50 VanDerWaalsContact C-N 3.25Å; D48-K50 PolarHBondContact O-N 3.05Å | ||
| 51 | V | 47 | Very low | 48.4 | Very low | 109 Ų | 109 | 122.9 Ų | 122.9 | 66% | 0.661 | 70% | 0.696 | S | S | * | * | trans | -62.9 | 133.9 | 162.1 | -178 | 0 | 0 | 0 | 0 | 107.8 | L49 E53 | L49-V51 VanDerWaalsContact C-N 3.26Å; L49-V51 PolarHBondContact O-N 3.24Å; V51-E53 PolarHBondContact O-N 3.48Å | ||
| 52 | P | 40.7 | Very low | 46.6 | Very low | 102 Ų | 102 | 128.6 Ų | 128.6 | 66% | 0.662 | 72% | 0.717 | S | S | * | * | trans | -60.6 | 134.3 | 174.3 | 22.9 | -30.3 | 0 | 0 | 0 | 110.3 | S54 | P52-S54 PolarHBondContact O-N 3.19Š| ||
| 53 | E | 41.6 | Very low | 45.3 | Very low | 201 Ų | 201 | 130.8 Ų | 130.8 | 94% | 0.939 | 72% | 0.718 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -62.9 | 42.2 | -172.7 | -160.6 | -174.6 | 136.4 | 0 | 0 | 114.7 | V51 | V51-E53 PolarHBondContact O-N 3.48Š|
| 54 | S | 41.9 | Very low | 44.7 | Very low | 115 Ų | 115 | 129.7 Ų | 129.7 | 80% | 0.804 | 71% | 0.714 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -132.4 | -1.2 | -174.7 | -47.6 | 0 | 0 | 0 | 0 | 114 | P52 | P52-S54 PolarHBondContact O-N 3.19Š|
| 55 | A | 41.2 | Very low | 44.4 | Very low | 63 Ų | 63 | 125.8 Ų | 125.8 | 52% | 0.521 | 70% | 0.699 | S | S | . | * | S | Bend | trans | -104.8 | 137.5 | 172 | 0 | 0 | 0 | 0 | 0 | 109.4 | S57 | A55-S57 PolarHBondContact O-N 3.18Š|
| 56 | P | 37.7 | Very low | 44.8 | Very low | 114 Ų | 114 | 121.3 Ų | 121.3 | 74% | 0.74 | 68% | 0.68 | S | S | * | * | trans | -58.4 | 125.1 | 171.6 | 25.6 | -31.1 | 0 | 0 | 0 | 108.1 | T58 | P56-T58 PolarHBondContact O-N 3.31Å; P56-T58 PolarHBondContact O-OG1 3.35Å | ||
| 57 | S | 42 | Very low | 46.4 | Very low | 106 Ų | 106 | 120.4 Ų | 120.4 | 74% | 0.741 | 66% | 0.663 | S | S | * | * | trans | -34.9 | 97.3 | 179.1 | -74.1 | 0 | 0 | 0 | 0 | 112.9 | A55 N59 | A55-S57 PolarHBondContact O-N 3.18Å; S57-N59 PolarHBondContact O-N 3.04Å; S57-N59 VanDerWaalsContact O-N 3.16Å | ||
| 58 | T | 43.5 | Very low | 48.3 | Very low | 100 Ų | 100 | 114.8 Ų | 114.8 | 61% | 0.613 | 64% | 0.638 | S | S | * | * | trans | -86.5 | 57.7 | 161.7 | -51.2 | 0 | 0 | 0 | 0 | 107.1 | P56 G60 Y61 | P56-T58 PolarHBondContact O-N 3.31Å; P56-T58 PolarHBondContact O-OG1 3.35Å; T58-G60 PolarHBondContact O-N 3.35Å; T58-Y61 HydrophobicContact CG2-CD2 3.62Å; T58-Y61 HydrophobicContact CG2-CG 4.22Å | ||
| 59 | N | 41.6 | Very low | 50.4 | Low | 157 Ų | 157 | 111 Ų | 111 | 84% | 0.84 | 61% | 0.613 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -84.9 | 50.1 | -172.8 | -122 | 68.1 | 0 | 0 | 0 | 111.4 | S57 | S57-N59 PolarHBondContact O-N 3.04Å; S57-N59 VanDerWaalsContact O-N 3.16Å |
| 60 | G | 37.4 | Very low | 52.1 | Low | 65 Ų | 65 | 106.3 Ų | 106.3 | 67% | 0.67 | 59% | 0.593 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -178.8 | 11.4 | -179.1 | 0 | 0 | 0 | 0 | 0 | 118.1 | T58 | T58-G60 PolarHBondContact O-N 3.35Š|
| 61 | Y | 45.8 | Very low | 54.4 | Low | 181 Ų | 181 | 97.8 Ų | 97.8 | 71% | 0.71 | 56% | 0.559 | S | S | * | * | S | Bend | trans | -111 | 0.3 | 179.1 | -78.7 | -87.5 | 0 | 0 | 0 | 114.1 | T58 | T58-Y61 HydrophobicContact CG2-CD2 3.62Å; T58-Y61 HydrophobicContact CG2-CG 4.22Å |
| 62 | F | 43.8 | Very low | 56.4 | Low | 174 Ų | 174 | 93.4 Ų | 93.4 | 76% | 0.763 | 53% | 0.531 | S | S | * | . | trans | -108.2 | 74.1 | 172.3 | -92.1 | -92.7 | 0 | 0 | 0 | 108 | P64 | F62-P64 VanDerWaalsContact C-CD 3.43Š| ||
| 63 | Q | 47.1 | Very low | 58.8 | Low | 152 Ų | 152 | 91.7 Ų | 91.7 | 71% | 0.71 | 52% | 0.518 | S | S | * | . | trans | -113 | 82.1 | 153.4 | -167.1 | 160.2 | 23.5 | 0 | 0 | 105 | D65 | Q63-D65 VanDerWaalsContact C-N 3.26Å; Q63-D65 PolarHBondContact O-N 3.27Å | ||
| 64 | P | 53.8 | Low | 61 | Low | 31 Ų | 31 | 83.2 Ų | 83.2 | 20% | 0.201 | 48% | 0.479 | C | S | . | . | trans | -76.4 | 91.9 | -176.9 | 33.8 | -32 | 0 | 0 | 0 | 106.7 | L43 F62 G66 | L43-P64 HydrophobicContact CB-CG 3.72Å; L43-P64 HydrophobicContact CD1-CB 3.42Å; L43-P64 VanDerWaalsContact CD1-CB 3.42Å; L43-P64 HydrophobicContact CD1-CG 3.42Å; L43-P64 VanDerWaalsContact CD1-CG 3.42Å; L43-P64 HydrophobicContact CG-CG 4.18Å; F62-P64 VanDerWaalsContact C-CD 3.43Å; P64-G66 PolarHBondContact O-N 3.05Å; P64-G66 VanDerWaalsContact O-N 3.13Å | ||
| 65 | D | 51.1 | Low | 63.4 | Low | 105 Ų | 105 | 80.7 Ų | 80.7 | 56% | 0.561 | 46% | 0.456 | S | S | * | . | trans | -71.6 | 7.3 | 170.8 | -142.3 | 6.3 | 0 | 0 | 0 | 111.4 | Q63 E102 | Q63-D65 VanDerWaalsContact C-N 3.26Å; Q63-D65 PolarHBondContact O-N 3.27Å; D65-E102 HydrophobicContact CB-CB 4.08Å; D65-E102 WeakPolarHBondContact OD2-CB 3.4Å; D65-E102 WeakPolarHBondContact OD2-CG 3.32Å | ||
| 66 | G | 61.4 | Low | 65.8 | Low | 21 Ų | 21 | 80.5 Ų | 80.5 | 22% | 0.216 | 44% | 0.444 | C | S | . | . | S | Bend | trans | -91.9 | 149.7 | 170.5 | 0 | 0 | 0 | 0 | 0 | 112.4 | P64 | P64-G66 PolarHBondContact O-N 3.05Å; P64-G66 VanDerWaalsContact O-N 3.13Å |
| 67 | D | 80.4 | Confident | 68.2 | Low | 34 Ų | 34 | 77 Ų | 77 | 18% | 0.182 | 42% | 0.421 | C | S | . | . | trans | -67.1 | 158.7 | 171.2 | 67.1 | 6.3 | 0 | 0 | 0 | 111.5 | R39 D40 Y69 S70 S71 | R39-D67 WeakPolarHBondContact CA-OD2 3.33Å; D40-D67 PolarHBondContact N-OD2 3.26Å; D67-Y69 PolarHBondContact O-N 2.92Å; D67-Y69 PolarHBondContact OD1-N 3.49Å; D67-S70 WeakPolarHBondContact O-CB 3.45Å; D67-S70 PolarHBondContact O-N 2.86Å; D67-S70 WeakPolarHBondContact OD1-CB 3.37Å; D67-S70 PolarHBondContact OD1-N 2.88Å; D67-S70 PolarHBondContact OD1-OG 3.19Å; D67-S71 PolarHBondContact O-N 3.02Å | ||
| 68 | M | 84.9 | Confident | 70.4 | Confident | 81 Ų | 81 | 72.7 Ų | 72.7 | 40% | 0.399 | 39% | 0.39 | S | S | . | . | H | α-helix | trans | -57.1 | -23.7 | 179.3 | -170.2 | 172.1 | 178.5 | 0 | 0 | 112.9 | L38 V41 L43 Y72 | L38-M68 HydrophobicContact CB-CB 4.12Å; L38-M68 HydrophobicContact CB-CG 4.29Å; L38-M68 HydrophobicContact CD1-CG 4.35Å; L38-M68 HydrophobicContact CD2-CE 4.1Å; L38-M68 HydrophobicContact CD2-CG 4.07Å; L38-M68 HydrophobicContact CD2-SD 3.74Å; L38-M68 HydrophobicContact CG-CG 4.47Å; V41-M68 HydrophobicContact CB-CB 4.21Å; V41-M68 HydrophobicContact CG1-CB 4.4Å; V41-M68 HydrophobicContact CG1-SD 4.45Å; V41-M68 PolarHBondContact O-N 2.89Å; V41-M68 VanDerWaalsContact O-N 3.08Å; L43-M68 HydrophobicContact CD2-CB 4.13Å; L43-M68 HydrophobicContact CD2-CG 4.06Å; L43-M68 HydrophobicContact CG-CB 4.42Å; M68-Y72 WeakPolarHBondContact O-CB 3.49Å; M68-Y72 PolarHBondContact O-N 3.22Å; M68-Y72 VanDerWaalsContact O-N 3.14Å |
| 69 | Y | 87.3 | Confident | 72.7 | Confident | 64 Ų | 64 | 69.2 Ų | 69.2 | 25% | 0.251 | 37% | 0.366 | S | S | . | . | H | α-helix | trans | -68.9 | -40.2 | 173.6 | -178.6 | -103.8 | 0 | 0 | 0 | 112.9 | P35 L38 R39 D67 Y72 V73 | P35-Y69 HydrophobicContact CB-CD2 4.16Å; P35-Y69 HydrophobicContact CB-CE2 3.85Å; P35-Y69 VanDerWaalsContact O-CD2 3.25Å; P35-Y69 WeakPolarHBondContact O-CD2 3.44Å; L38-Y69 PolarHBondContact O-N 3.2Å; L38-Y69 VanDerWaalsContact O-N 3.08Å; R39-Y69 HydrophobicContact CG-CD1 3.9Å; R39-Y69 HydrophobicContact CG-CD2 4.19Å; R39-Y69 HydrophobicContact CG-CG 3.69Å; D67-Y69 PolarHBondContact O-N 2.92Å; D67-Y69 PolarHBondContact OD1-N 3.49Å; Y69-Y72 HydrophobicContact CD2-CD1 4.47Å; Y69-Y72 WeakPolarHBondContact O-CB 3.42Å; Y69-Y72 PolarHBondContact O-N 3.47Å; Y69-V73 HydrophobicContact CD1-CG2 4.23Å; Y69-V73 HydrophobicContact CE1-CG2 3.79Å; Y69-V73 HydrophobicContact CE2-CG2 4.14Å; Y69-V73 WeakPolarHBondContact O-CG2 3.32Å; Y69-V73 PolarHBondContact O-N 3.09Å |
| 70 | S | 85.8 | Confident | 74.8 | Confident | 55 Ų | 55 | 64.9 Ų | 64.9 | 39% | 0.385 | 34% | 0.343 | S | S | . | . | H | α-helix | trans | -61.8 | -48.8 | 178.8 | -61.3 | 0 | 0 | 0 | 0 | 111 | D67 Y72 V73 L74 | D67-S70 WeakPolarHBondContact O-CB 3.45Å; D67-S70 PolarHBondContact O-N 2.86Å; D67-S70 WeakPolarHBondContact OD1-CB 3.37Å; D67-S70 PolarHBondContact OD1-N 2.88Å; D67-S70 PolarHBondContact OD1-OG 3.19Å; S70-Y72 VanDerWaalsContact C-N 3.32Å; S70-Y72 PolarHBondContact O-N 2.92Å; S70-V73 PolarHBondContact O-N 3.35Å; S70-L74 PolarHBondContact O-N 3.37Å |
| 71 | S | 86.2 | Confident | 77.1 | Confident | 24 Ų | 24 | 62.3 Ų | 62.3 | 17% | 0.168 | 31% | 0.313 | C | S | . | . | H | α-helix | trans | -64.5 | -35.4 | 175.2 | -49.6 | 0 | 0 | 0 | 0 | 112.5 | D67 L74 L75 | D67-S71 PolarHBondContact O-N 3.02Å; S71-L74 PolarHBondContact O-N 3.33Å; S71-L75 WeakPolarHBondContact O-CB 3.32Å; S71-L75 VanDerWaalsContact O-CG 3.25Å; S71-L75 WeakPolarHBondContact O-CG 3.5Å; S71-L75 PolarHBondContact O-N 2.95Å |
| 72 | Y | 89.6 | Confident | 78.9 | Confident | 17 Ų | 17 | 55.4 Ų | 55.4 | 7% | 0.067 | 29% | 0.288 | C | S | . | . | H | α-helix | trans | -60.9 | -44 | 173.6 | 169.8 | -95.4 | 0 | 0 | 0 | 112.1 | M28 D29 V32 P35 L38 M68 Y69 S70 K76 | M28-Y72 HydrophobicContact CE-CD2 3.48Å; M28-Y72 VanDerWaalsContact CE-CD2 3.48Å; M28-Y72 HydrophobicContact CE-CE2 3.87Å; M28-Y72 HydrophobicContact CE-CG 4.37Å; M28-Y72 HydrophobicContact CG-CD2 4.07Å; M28-Y72 HydrophobicContact CG-CE2 4.28Å; M28-Y72 HydrophobicContact SD-CD2 3.76Å; M28-Y72 HydrophobicContact SD-CE2 4.44Å; D29-Y72 PolarHBondContact OD1-OH 2.82Å; V32-Y72 HydrophobicContact CB-CD2 4.47Å; V32-Y72 HydrophobicContact CB-CE2 3.89Å; V32-Y72 HydrophobicContact CG1-CD2 4.4Å; V32-Y72 HydrophobicContact CG1-CE2 3.99Å; V32-Y72 HydrophobicContact CG2-CD2 4.29Å; V32-Y72 HydrophobicContact CG2-CE2 4.13Å; P35-Y72 HydrophobicContact CB-CD1 4.24Å; P35-Y72 HydrophobicContact CB-CE1 3.72Å; P35-Y72 HydrophobicContact CG-CE1 3.86Å; L38-Y72 HydrophobicContact CD1-CD2 4.28Å; L38-Y72 HydrophobicContact CD1-CG 4.13Å; M68-Y72 WeakPolarHBondContact O-CB 3.49Å; M68-Y72 PolarHBondContact O-N 3.22Å; M68-Y72 VanDerWaalsContact O-N 3.14Å; Y69-Y72 HydrophobicContact CD2-CD1 4.47Å; Y69-Y72 WeakPolarHBondContact O-CB 3.42Å; Y69-Y72 PolarHBondContact O-N 3.47Å; S70-Y72 VanDerWaalsContact C-N 3.32Å; S70-Y72 PolarHBondContact O-N 2.92Å; Y72-K76 HydrophobicContact CD1-CD 4.37Å; Y72-K76 HydrophobicContact CE1-CD 3.65Å; Y72-K76 HydrophobicContact CE2-CD 3.96Å; Y72-K76 HydrophobicContact CE2-CG 4.47Å; Y72-K76 VanDerWaalsContact CZ-CD 3.42Å; Y72-K76 WeakPolarHBondContact O-CG 3.47Å; Y72-K76 PolarHBondContact O-N 2.92Å; Y72-K76 WeakPolarHBondContact OH-CD 3.27Å |
| 73 | V | 89.9 | Confident | 80.6 | Confident | 66 Ų | 66 | 51.2 Ų | 51.2 | 40% | 0.4 | 27% | 0.271 | S | S | . | . | H | α-helix | trans | -66.1 | -45.6 | 177.4 | 172.5 | 0 | 0 | 0 | 0 | 110.9 | Y69 S70 L75 K76 S77 | Y69-V73 HydrophobicContact CD1-CG2 4.23Å; Y69-V73 HydrophobicContact CE1-CG2 3.79Å; Y69-V73 HydrophobicContact CE2-CG2 4.14Å; Y69-V73 WeakPolarHBondContact O-CG2 3.32Å; Y69-V73 PolarHBondContact O-N 3.09Å; S70-V73 PolarHBondContact O-N 3.35Å; V73-L75 PolarHBondContact O-N 3.46Å; V73-K76 PolarHBondContact O-N 3Å; V73-S77 PolarHBondContact O-N 3.24Å |
| 74 | L | 89.4 | Confident | 82 | Confident | 23 Ų | 23 | 52.8 Ų | 52.8 | 12% | 0.12 | 27% | 0.271 | C | S | . | . | H | α-helix | trans | -55.2 | -52.4 | 177 | 175.8 | 66.6 | 0 | 0 | 0 | 111.9 | S70 S71 K76 S77 I78 D106 E110 | S70-L74 PolarHBondContact O-N 3.37Å; S71-L74 PolarHBondContact O-N 3.33Å; L74-K76 VanDerWaalsContact C-N 3.25Å; L74-K76 PolarHBondContact O-N 2.81Å; L74-S77 WeakPolarHBondContact O-CB 3.38Å; L74-S77 PolarHBondContact O-N 3.01Å; L74-S77 VanDerWaalsContact O-N 3.11Å; L74-I78 HydrophobicContact CD1-CD1 3.92Å; L74-I78 HydrophobicContact CD1-CG1 4.37Å; L74-I78 HydrophobicContact CG-CD1 4.01Å; L74-I78 WeakPolarHBondContact O-CG1 3.18Å; L74-I78 PolarHBondContact O-N 3.01Å; L74-D106 HydrophobicContact CD2-CB 3.85Å; L74-E110 HydrophobicContact CD1-CB 3.76Å; L74-E110 HydrophobicContact CD1-CG 4.44Å |
| 75 | L | 92.1 | Very high | 82.8 | Confident | 61 Ų | 61 | 52.1 Ų | 52.1 | 32% | 0.319 | 27% | 0.269 | S | S | . | . | H | α-helix | trans | -60.5 | -36.6 | 179.7 | -70.6 | 171 | 0 | 0 | 0 | 112.1 | F21 V25 M28 S71 V73 R79 | F21-L75 HydrophobicContact CE2-CD2 3.81Å; F21-L75 HydrophobicContact CZ-CD2 4.33Å; V25-L75 HydrophobicContact CG2-CB 4.21Å; M28-L75 HydrophobicContact CE-CB 3.91Å; M28-L75 HydrophobicContact CE-CD1 4.14Å; M28-L75 HydrophobicContact SD-CD1 3.94Å; S71-L75 WeakPolarHBondContact O-CB 3.32Å; S71-L75 VanDerWaalsContact O-CG 3.25Å; S71-L75 WeakPolarHBondContact O-CG 3.5Å; S71-L75 PolarHBondContact O-N 2.95Å; V73-L75 PolarHBondContact O-N 3.46Å; L75-R79 WeakPolarHBondContact O-CB 3.26Å; L75-R79 PolarHBondContact O-N 3.42Å |
| 76 | K | 91.1 | Very high | 83.5 | Confident | 60 Ų | 60 | 49 Ų | 49 | 26% | 0.261 | 25% | 0.254 | S | S | . | . | H | α-helix | trans | -69.6 | -38.3 | 175.1 | -79.6 | -166.3 | 64.1 | 157.6 | 0 | 112.9 | V25 M28 D29 Y72 V73 L74 N80 | V25-K76 HydrophobicContact CG1-CG 4.32Å; M28-K76 HydrophobicContact CE-CG 4.32Å; D29-K76 IonicContact OD1-NZ 3.37Å; D29-K76 PolarHBondContact OD1-NZ 3.48Å; D29-K76 IonicContact OD2-NZ 2.88Å; D29-K76 PolarHBondContact OD2-NZ 2.74Å; Y72-K76 HydrophobicContact CD1-CD 4.37Å; Y72-K76 HydrophobicContact CE1-CD 3.65Å; Y72-K76 HydrophobicContact CE2-CD 3.96Å; Y72-K76 HydrophobicContact CE2-CG 4.47Å; Y72-K76 VanDerWaalsContact CZ-CD 3.42Å; Y72-K76 WeakPolarHBondContact O-CG 3.47Å; Y72-K76 PolarHBondContact O-N 2.92Å; Y72-K76 WeakPolarHBondContact OH-CD 3.27Å; V73-K76 PolarHBondContact O-N 3Å; L74-K76 VanDerWaalsContact C-N 3.25Å; L74-K76 PolarHBondContact O-N 2.81Å; K76-N80 WeakPolarHBondContact O-CB 3.43Å; K76-N80 PolarHBondContact O-N 3Å |
| 77 | S | 88.2 | Confident | 83.2 | Confident | 39 Ų | 39 | 53.9 Ų | 53.9 | 27% | 0.273 | 28% | 0.275 | S | S | . | . | H | α-helix | trans | -59.8 | -56.8 | 175.2 | -162.4 | 0 | 0 | 0 | 0 | 109.9 | V73 L74 R79 N80 D81 E110 | V73-S77 PolarHBondContact O-N 3.24Å; L74-S77 WeakPolarHBondContact O-CB 3.38Å; L74-S77 PolarHBondContact O-N 3.01Å; L74-S77 VanDerWaalsContact O-N 3.11Å; S77-R79 VanDerWaalsContact C-N 3.3Å; S77-R79 PolarHBondContact O-N 3.47Å; S77-N80 WeakPolarHBondContact O-CA 3.39Å; S77-N80 VanDerWaalsContact O-CB 3.26Å; S77-N80 WeakPolarHBondContact O-CB 3.01Å; S77-N80 PolarHBondContact O-N 2.74Å; S77-D81 PolarHBondContact O-N 3.03Å; S77-E110 VanDerWaalsContact CB-OE1 3.25Å; S77-E110 WeakPolarHBondContact CB-OE1 3.39Å; S77-E110 PolarHBondContact OG-OE1 3.49Å |
| 78 | I | 89 | Confident | 81.7 | Confident | 16 Ų | 16 | 55.7 Ų | 55.7 | 8% | 0.082 | 30% | 0.301 | C | S | . | . | H | α-helix | trans | -56.1 | -41.4 | 178.9 | -65.9 | 171.4 | 0 | 0 | 0 | 112 | F21 L74 D81 M82 E110 F113 | F21-I78 HydrophobicContact CE1-CB 4.47Å; F21-I78 HydrophobicContact CE1-CG2 3.79Å; F21-I78 HydrophobicContact CZ-CB 4.09Å; F21-I78 HydrophobicContact CZ-CG2 3.64Å; L74-I78 HydrophobicContact CD1-CD1 3.92Å; L74-I78 HydrophobicContact CD1-CG1 4.37Å; L74-I78 HydrophobicContact CG-CD1 4.01Å; L74-I78 WeakPolarHBondContact O-CG1 3.18Å; L74-I78 PolarHBondContact O-N 3.01Å; I78-D81 PolarHBondContact O-N 3.42Å; I78-M82 HydrophobicContact CG2-CE 3.78Å; I78-M82 WeakPolarHBondContact O-CG 3.4Å; I78-M82 PolarHBondContact O-N 3.24Å; I78-M82 VanDerWaalsContact O-N 3.07Å; I78-E110 HydrophobicContact CG1-CG 4.46Å; I78-F113 HydrophobicContact CG2-CD1 3.79Å; I78-F113 HydrophobicContact CG2-CE1 4Å; I78-F113 HydrophobicContact CG2-CG 4.15Å |
| 79 | R | 90.6 | Very high | 79.8 | Confident | 27 Ų | 27 | 58.6 Ų | 58.6 | 10% | 0.102 | 32% | 0.318 | C | S | . | . | H | α-helix | trans | -60.5 | -45.1 | 174 | 179.5 | -160.8 | 60.6 | -173.7 | 1.4 | 111.5 | F21 I22 V25 N26 D29 L75 S77 D81 M82 E83 | F21-R79 HydrophobicContact CE1-CB 4.08Å; I22-R79 HydrophobicContact CG1-CG 4.47Å; V25-R79 HydrophobicContact CB-CB 4.29Å; V25-R79 HydrophobicContact CB-CG 4.41Å; V25-R79 HydrophobicContact CG1-CB 3.84Å; V25-R79 HydrophobicContact CG1-CG 4.18Å; N26-R79 WeakPolarHBondContact OD1-CD 3.07Å; N26-R79 PolarHBondContact OD1-NH1 2.86Å; D29-R79 IonicContact OD2-CZ 2.88Å; D29-R79 IonicContact OD2-NH1 3.63Å; D29-R79 PolarHBondContact OD2-NH1 3.04Å; D29-R79 IonicContact OD2-NH2 3.84Å; D29-R79 PolarHBondContact OD2-NH2 3.19Å; L75-R79 WeakPolarHBondContact O-CB 3.26Å; L75-R79 PolarHBondContact O-N 3.42Å; S77-R79 VanDerWaalsContact C-N 3.3Å; S77-R79 PolarHBondContact O-N 3.47Å; R79-D81 VanDerWaalsContact C-N 3.32Å; R79-D81 PolarHBondContact O-N 2.87Å; R79-M82 WeakPolarHBondContact O-CB 3.47Å; R79-M82 PolarHBondContact O-N 3.37Å; R79-E83 PolarHBondContact O-N 2.99Å |
| 80 | N | 87.1 | Confident | 77.3 | Confident | 66 Ų | 66 | 63.5 Ų | 63.5 | 35% | 0.353 | 34% | 0.343 | S | S | . | . | H | α-helix | trans | -61 | -42.9 | 179.9 | -174.1 | 68.7 | 0 | 0 | 0 | 111.3 | K76 S77 M82 E83 W84 | K76-N80 WeakPolarHBondContact O-CB 3.43Å; K76-N80 PolarHBondContact O-N 3Å; S77-N80 WeakPolarHBondContact O-CA 3.39Å; S77-N80 VanDerWaalsContact O-CB 3.26Å; S77-N80 WeakPolarHBondContact O-CB 3.01Å; S77-N80 PolarHBondContact O-N 2.74Å; N80-M82 VanDerWaalsContact C-N 3.27Å; N80-M82 PolarHBondContact O-N 3.07Å; N80-E83 PolarHBondContact O-N 2.88Å; N80-W84 PolarHBondContact O-N 3.45Å |
| 81 | D | 85.6 | Confident | 75.2 | Confident | 11 Ų | 11 | 65.5 Ų | 65.5 | 6% | 0.059 | 36% | 0.355 | C | S | . | . | H | α-helix | trans | -66.1 | -29.1 | 176.7 | -62 | -51.1 | 0 | 0 | 0 | 113 | S77 I78 R79 G85 V86 H114 | S77-D81 PolarHBondContact O-N 3.03Å; I78-D81 PolarHBondContact O-N 3.42Å; R79-D81 VanDerWaalsContact C-N 3.32Å; R79-D81 PolarHBondContact O-N 2.87Å; D81-G85 CarbonylContact O-C 3.24Å; D81-G85 VanDerWaalsContact O-C 3.24Å; D81-G85 WeakPolarHBondContact O-CA 3.4Å; D81-G85 PolarHBondContact O-N 3.45Å; D81-V86 HydrophobicContact CB-CG2 4.28Å; D81-H114 IonicContact OD2-CE1 2.83Å; D81-H114 PolarHBondContact OD2-CE1 2.9Å; D81-H114 IonicContact OD2-NE2 3.41Å; D81-H114 PolarHBondContact OD2-NE2 3.3Å |
| 82 | M | 83.6 | Confident | 73.1 | Confident | 37 Ų | 37 | 69.8 Ų | 69.8 | 18% | 0.182 | 38% | 0.382 | C | S | . | . | H | α-helix | trans | -71.1 | -43.5 | 171.8 | -74.9 | -173.8 | -167.3 | 0 | 0 | 113.2 | M18 F21 I22 I78 R79 N80 F113 | M18-M82 HydrophobicContact CB-SD 4.38Å; M18-M82 HydrophobicContact CE-CB 4.38Å; M18-M82 HydrophobicContact CE-CG 3.79Å; M18-M82 HydrophobicContact CE-SD 3.97Å; M18-M82 HydrophobicContact CG-SD 4.3Å; F21-M82 HydrophobicContact CD1-CE 3.59Å; F21-M82 HydrophobicContact CD1-SD 3.4Å; F21-M82 WeakPolarHBondContact CD1-SD 3.4Å; F21-M82 HydrophobicContact CE1-CE 3.71Å; F21-M82 HydrophobicContact CE1-SD 3.72Å; F21-M82 HydrophobicContact CG-CE 4.3Å; F21-M82 HydrophobicContact CG-SD 4.44Å; I22-M82 HydrophobicContact CD1-CB 4.39Å; I22-M82 HydrophobicContact CG1-SD 4.34Å; I78-M82 HydrophobicContact CG2-CE 3.78Å; I78-M82 WeakPolarHBondContact O-CG 3.4Å; I78-M82 PolarHBondContact O-N 3.24Å; I78-M82 VanDerWaalsContact O-N 3.07Å; R79-M82 WeakPolarHBondContact O-CB 3.47Å; R79-M82 PolarHBondContact O-N 3.37Å; N80-M82 VanDerWaalsContact C-N 3.27Å; N80-M82 PolarHBondContact O-N 3.07Å; M82-F113 HydrophobicContact CE-CD2 4.15Å; M82-F113 HydrophobicContact CE-CE1 3.92Å; M82-F113 HydrophobicContact CE-CE2 3.31Å; M82-F113 HydrophobicContact CE-CZ 3.19Å; M82-F113 HydrophobicContact CG-CE1 3.71Å; M82-F113 HydrophobicContact CG-CE2 4.42Å; M82-F113 HydrophobicContact CG-CZ 3.38Å; M82-F113 HydrophobicContact SD-CZ 4.07Å |
| 83 | E | 79.3 | Confident | 70.6 | Confident | 86 Ų | 86 | 78.6 Ų | 78.6 | 40% | 0.402 | 42% | 0.421 | S | S | . | . | H | α-helix | trans | -75.8 | -39.1 | -175.7 | -75.3 | -174.7 | 169.6 | 0 | 0 | 112.4 | I22 R79 N80 | I22-E83 HydrophobicContact CD1-CG 4.42Å; I22-E83 WeakPolarHBondContact CG2-OE1 3.42Å; R79-E83 PolarHBondContact O-N 2.99Å; N80-E83 PolarHBondContact O-N 2.88Å |
| 84 | W | 75.9 | Confident | 68.6 | Low | 185 Ų | 185 | 80 Ų | 80 | 70% | 0.701 | 44% | 0.439 | S | S | * | . | H | α-helix | trans | -114.3 | -2.8 | -171.8 | -60.5 | 105.3 | 0 | 0 | 0 | 113.9 | N80 L87 | N80-W84 PolarHBondContact O-N 3.45Å; W84-L87 HydrophobicContact CB-CD1 4.11Å |
| 85 | G | 70.4 | Confident | 66.3 | Low | 17 Ų | 17 | 88.1 Ų | 88.1 | 18% | 0.175 | 48% | 0.477 | C | S | . | . | trans | 78.3 | 163.1 | -168.5 | 0 | 0 | 0 | 0 | 0 | 111.2 | D81 L87 | D81-G85 CarbonylContact O-C 3.24Å; D81-G85 VanDerWaalsContact O-C 3.24Å; D81-G85 WeakPolarHBondContact O-CA 3.4Å; D81-G85 PolarHBondContact O-N 3.45Å; G85-L87 VanDerWaalsContact C-N 3.31Å; G85-L87 PolarHBondContact O-N 3.45Å | ||
| 86 | V | 66.3 | Low | 63.7 | Low | 39 Ų | 39 | 90.1 Ų | 90.1 | 24% | 0.236 | 50% | 0.502 | C | S | . | . | trans | -64.3 | 93.3 | 173.4 | -175.2 | 0 | 0 | 0 | 0 | 108 | D81 G88 H114 L117 | D81-V86 HydrophobicContact CB-CG2 4.28Å; V86-G88 PolarHBondContact O-N 2.91Å; V86-G88 VanDerWaalsContact O-N 3.09Å; V86-H114 HydrophobicContact CG2-CB 4.44Å; V86-L117 HydrophobicContact CG2-CD2 4.11Å | ||
| 87 | L | 55.4 | Low | 61.4 | Low | 124 Ų | 124 | 96.8 Ų | 96.8 | 65% | 0.649 | 53% | 0.534 | S | S | * | . | trans | -68.2 | 105.7 | 169.7 | -88.8 | 146.7 | 0 | 0 | 0 | 105.8 | W84 G85 D89 | W84-L87 HydrophobicContact CB-CD1 4.11Å; G85-L87 VanDerWaalsContact C-N 3.31Å; G85-L87 PolarHBondContact O-N 3.45Å; L87-D89 PolarHBondContact O-N 3.07Å | ||
| 88 | G | 48.2 | Very low | 59.3 | Low | 72 Ų | 72 | 99.4 Ų | 99.4 | 74% | 0.742 | 56% | 0.558 | S | S | * | * | trans | -39 | 120.2 | -172.2 | 0 | 0 | 0 | 0 | 0 | 113.2 | V86 E90 | V86-G88 PolarHBondContact O-N 2.91Å; V86-G88 VanDerWaalsContact O-N 3.09Å; G88-E90 PolarHBondContact O-N 2.92Å | ||
| 89 | D | 44.1 | Very low | 56.9 | Low | 141 Ų | 141 | 109 Ų | 109 | 75% | 0.754 | 60% | 0.599 | S | S | * | * | P | Polyproline II helix | trans | -52.9 | 116.4 | 176.4 | -155.3 | 39.7 | 0 | 0 | 0 | 109.9 | L87 | L87-D89 PolarHBondContact O-N 3.07Š|
| 90 | E | 35.5 | Very low | 54.9 | Low | 167 Ų | 167 | 119.1 Ų | 119.1 | 78% | 0.78 | 64% | 0.637 | S | S | * | * | P | Polyproline II helix | trans | -76.8 | 120 | 156.8 | -177.4 | 174 | 110.5 | 0 | 0 | 105.7 | G88 | G88-E90 PolarHBondContact O-N 2.92Š|
| 91 | P | 42.7 | Very low | 52.6 | Low | 97 Ų | 97 | 120.3 Ų | 120.3 | 63% | 0.63 | 65% | 0.651 | S | S | * | * | P | Polyproline II helix | trans | -61.6 | 129.9 | -176.6 | 24.1 | -32.6 | 0 | 0 | 0 | 109.5 | K93 | P91-K93 PolarHBondContact O-N 3.41Å; P91-K93 VanDerWaalsContact O-N 3.1Å |
| 92 | P | 41.3 | Very low | 50.5 | Low | 114 Ų | 114 | 126 Ų | 126 | 74% | 0.74 | 68% | 0.678 | S | S | * | * | P | Polyproline II helix | trans | -62.2 | 119.7 | 174 | 24.2 | -30.7 | 0 | 0 | 0 | 108.3 | A94 | P92-A94 PolarHBondContact O-N 3.3Å; P92-A94 VanDerWaalsContact O-N 3.15Å |
| 93 | K | 37.9 | Very low | 48.8 | Very low | 203 Ų | 203 | 127.7 Ų | 127.7 | 88% | 0.883 | 70% | 0.697 | S | S | * | * | P | Polyproline II helix | trans | -52.4 | 121.3 | 173.9 | -77.1 | -179.8 | 175.9 | 172.9 | 0 | 109.3 | P91 E95 | P91-K93 PolarHBondContact O-N 3.41Å; P91-K93 VanDerWaalsContact O-N 3.1Å; K93-E95 PolarHBondContact O-N 2.98Å |
| 94 | A | 45.9 | Very low | 47.4 | Very low | 95 Ų | 95 | 130.7 Ų | 130.7 | 79% | 0.785 | 71% | 0.711 | S | S | * | * | trans | -57.3 | 113.8 | 176.6 | 0 | 0 | 0 | 0 | 0 | 111.7 | P92 | P92-A94 PolarHBondContact O-N 3.3Å; P92-A94 VanDerWaalsContact O-N 3.15Å | ||
| 95 | E | 41.2 | Very low | 46.1 | Very low | 194 Ų | 194 | 126.8 Ų | 126.8 | 91% | 0.907 | 70% | 0.704 | S | S | * | * | trans | -160 | 81.3 | 147.3 | -63 | -163.5 | 180 | 0 | 0 | 110.1 | K93 | K93-E95 PolarHBondContact O-N 2.98Š| ||
| 96 | A | 38.2 | Very low | 45.3 | Very low | 103 Ų | 103 | 128 Ų | 128 | 85% | 0.851 | 71% | 0.707 | S | S | * | * | trans | -169.5 | 84.3 | 155 | 0 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 97 | E | 43.3 | Very low | 45 | Very low | 199 Ų | 199 | 129.6 Ų | 129.6 | 93% | 0.93 | 71% | 0.713 | S | S | * | * | trans | -67.6 | 148.9 | 160.4 | -71 | -174.1 | 135.8 | 0 | 0 | 110.2 | ||||
| 98 | A | 44.6 | Very low | 46.1 | Very low | 94 Ų | 94 | 127.9 Ų | 127.9 | 78% | 0.777 | 71% | 0.705 | S | S | * | * | trans | 97.1 | 72.1 | 169.4 | 0 | 0 | 0 | 0 | 0 | 118 | ||||
| 99 | K | 37 | Very low | 47.5 | Very low | 217 Ų | 217 | 128.4 Ų | 128.4 | 94% | 0.943 | 69% | 0.691 | S | S | * | * | -179.6 | 99 | 121.5 | -93.9 | 166.2 | -175 | -170.1 | 0 | 108.4 | |||||
| 100 | R | 48.5 | Very low | 49.2 | Very low | 240 Ų | 240 | 123.8 Ų | 123.8 | 91% | 0.906 | 66% | 0.664 | S | S | * | * | trans | -107.7 | 104.3 | -179.4 | -107.1 | -176 | 178.8 | -128 | 1.4 | 108.9 | ||||
| 101 | S | 39.8 | Very low | 51.4 | Low | 92 Ų | 92 | 121.5 Ų | 121.5 | 64% | 0.643 | 65% | 0.652 | S | S | * | * | S | Bend | trans | 173.1 | 139.7 | 149.7 | 47 | 0 | 0 | 0 | 0 | 105.8 | ||
| 102 | E | 41.7 | Very low | 53.5 | Low | 131 Ų | 131 | 121.4 Ų | 121.4 | 61% | 0.612 | 64% | 0.643 | S | S | * | * | S | Bend | trans | 100.1 | 6 | 164.6 | -55 | 158.5 | -168.9 | 0 | 0 | 118.9 | D65 | D65-E102 HydrophobicContact CB-CB 4.08Å; D65-E102 WeakPolarHBondContact OD2-CB 3.4Å; D65-E102 WeakPolarHBondContact OD2-CG 3.32Å |
| 103 | A | 47.6 | Very low | 55.5 | Low | 71 Ų | 71 | 118.1 Ų | 118.1 | 59% | 0.587 | 62% | 0.617 | S | S | * | * | trans | -115.2 | 20.8 | 171.5 | 0 | 0 | 0 | 0 | 0 | 114.1 | D107 | A103-D107 WeakPolarHBondContact O-CB 3.48Š| ||
| 104 | E | 49.5 | Very low | 57.8 | Low | 149 Ų | 149 | 110.3 Ų | 110.3 | 70% | 0.696 | 58% | 0.584 | S | S | * | * | H | α-helix | trans | -81.8 | -26.3 | -174.7 | -70.6 | -172.1 | 167.5 | 0 | 0 | 113.7 | D108 | E104-D108 PolarHBondContact O-N 3.38Å |
| 105 | D | 49.8 | Very low | 59.8 | Low | 104 Ų | 104 | 113.1 Ų | 113.1 | 56% | 0.556 | 58% | 0.578 | S | S | * | * | H | α-helix | trans | -82.4 | -40.3 | -172.1 | -67.9 | -32 | 0 | 0 | 0 | 113.5 | D107 D108 | D105-D107 VanDerWaalsContact C-N 3.32Å; D105-D108 WeakPolarHBondContact O-CB 3.3Å; D105-D108 PolarHBondContact O-N 3.4Å |
| 106 | D | 53 | Low | 62.1 | Low | 43 Ų | 43 | 109 Ų | 109 | 23% | 0.23 | 56% | 0.559 | C | S | . | * | H | α-helix | trans | -65.9 | -38.2 | 175.4 | -91 | 8.8 | 0 | 0 | 0 | 111.5 | L74 D108 L109 | L74-D106 HydrophobicContact CD2-CB 3.85Å; D106-D108 PolarHBondContact O-N 3.46Å; D106-L109 PolarHBondContact O-N 2.94Å |
| 107 | D | 60.5 | Low | 64.5 | Low | 71 Ų | 71 | 105 Ų | 105 | 38% | 0.38 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -61.1 | -29.7 | 173.1 | -109.4 | 31 | 0 | 0 | 0 | 112.7 | A103 D105 K111 | A103-D107 WeakPolarHBondContact O-CB 3.48Å; D105-D107 VanDerWaalsContact C-N 3.32Å; D107-K111 WeakPolarHBondContact O-CB 3.38Å; D107-K111 VanDerWaalsContact O-CD 3.24Å; D107-K111 WeakPolarHBondContact O-CD 3.46Å; D107-K111 WeakPolarHBondContact O-CG 3.36Å; D107-K111 PolarHBondContact O-N 3.07Å; D107-K111 IonicContact OD2-NZ 2.92Å; D107-K111 PolarHBondContact OD2-NZ 2.97Å |
| 108 | D | 77.8 | Confident | 66.5 | Low | 89 Ų | 89 | 98.9 Ų | 98.9 | 48% | 0.476 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -73.7 | -38.4 | -179.5 | -170.2 | 50 | 0 | 0 | 0 | 111.5 | E104 D105 D106 K111 Q112 | E104-D108 PolarHBondContact O-N 3.38Å; D105-D108 WeakPolarHBondContact O-CB 3.3Å; D105-D108 PolarHBondContact O-N 3.4Å; D106-D108 PolarHBondContact O-N 3.46Å; D108-K111 PolarHBondContact O-N 2.95Å; D108-Q112 WeakPolarHBondContact O-CB 3.43Å; D108-Q112 PolarHBondContact O-N 2.88Å |
| 109 | L | 78.1 | Confident | 68.6 | Low | 83 Ų | 83 | 96.2 Ų | 96.2 | 44% | 0.435 | 48% | 0.478 | S | S | . | . | H | α-helix | trans | -65.2 | -42.3 | 179.4 | -70.9 | 176.9 | 0 | 0 | 0 | 112.3 | D106 F113 | D106-L109 PolarHBondContact O-N 2.94Å; L109-F113 VanDerWaalsContact O-CB 3.24Å; L109-F113 WeakPolarHBondContact O-CB 3.25Å; L109-F113 PolarHBondContact O-N 2.99Å |
| 110 | E | 78.9 | Confident | 71.2 | Confident | 43 Ų | 43 | 89.3 Ų | 89.3 | 20% | 0.201 | 45% | 0.451 | C | S | . | . | H | α-helix | trans | -62.9 | -49.8 | 175.4 | -172 | 171.5 | -148.3 | 0 | 0 | 111 | L74 S77 I78 Q112 F113 H114 | L74-E110 HydrophobicContact CD1-CB 3.76Å; L74-E110 HydrophobicContact CD1-CG 4.44Å; S77-E110 VanDerWaalsContact CB-OE1 3.25Å; S77-E110 WeakPolarHBondContact CB-OE1 3.39Å; S77-E110 PolarHBondContact OG-OE1 3.49Å; I78-E110 HydrophobicContact CG1-CG 4.46Å; E110-Q112 VanDerWaalsContact C-N 3.34Å; E110-Q112 PolarHBondContact O-N 2.96Å; E110-F113 PolarHBondContact O-N 3.34Å; E110-H114 WeakPolarHBondContact O-CB 3.46Å; E110-H114 PolarHBondContact O-CD2 3.18Å; E110-H114 VanDerWaalsContact O-CG 3.3Å; E110-H114 PolarHBondContact O-N 2.88Å |
| 111 | K | 82.6 | Confident | 73 | Confident | 119 Ų | 119 | 81.8 Ų | 81.8 | 52% | 0.517 | 43% | 0.427 | S | S | . | . | H | α-helix | trans | -60 | -43.7 | 178.6 | -72.1 | 167.1 | -164.8 | 150.7 | 0 | 111.6 | D107 D108 H114 F115 | D107-K111 WeakPolarHBondContact O-CB 3.38Å; D107-K111 VanDerWaalsContact O-CD 3.24Å; D107-K111 WeakPolarHBondContact O-CD 3.46Å; D107-K111 WeakPolarHBondContact O-CG 3.36Å; D107-K111 PolarHBondContact O-N 3.07Å; D107-K111 IonicContact OD2-NZ 2.92Å; D107-K111 PolarHBondContact OD2-NZ 2.97Å; D108-K111 PolarHBondContact O-N 2.95Å; K111-H114 PolarHBondContact O-N 3.11Å; K111-F115 WeakPolarHBondContact O-CB 3.47Å; K111-F115 PolarHBondContact O-N 2.92Å |
| 112 | Q | 85.3 | Confident | 75.4 | Confident | 96 Ų | 96 | 79.7 Ų | 79.7 | 45% | 0.449 | 42% | 0.415 | S | S | . | . | H | α-helix | trans | -64.5 | -44 | 177.2 | -175.7 | 178.7 | 99.5 | 0 | 0 | 111.1 | D108 E110 H114 F115 H116 | D108-Q112 WeakPolarHBondContact O-CB 3.43Å; D108-Q112 PolarHBondContact O-N 2.88Å; E110-Q112 VanDerWaalsContact C-N 3.34Å; E110-Q112 PolarHBondContact O-N 2.96Å; Q112-H114 PolarHBondContact O-N 2.88Å; Q112-F115 PolarHBondContact O-N 3.06Å; Q112-H116 WeakPolarHBondContact CG-NE2 3.36Å; Q112-H116 PolarHBondContact O-CD2 3.5Å; Q112-H116 PolarHBondContact O-N 3.17Å |
| 113 | F | 84.9 | Confident | 78 | Confident | 45 Ų | 45 | 77.3 Ų | 77.3 | 20% | 0.197 | 41% | 0.409 | C | S | . | . | H | α-helix | trans | -60.1 | -46.2 | 176.1 | -176.3 | -105.4 | 0 | 0 | 0 | 111.4 | M18 I78 M82 L109 E110 F115 H116 L117 | M18-F113 HydrophobicContact CE-CZ 4.39Å; I78-F113 HydrophobicContact CG2-CD1 3.79Å; I78-F113 HydrophobicContact CG2-CE1 4Å; I78-F113 HydrophobicContact CG2-CG 4.15Å; M82-F113 HydrophobicContact CE-CD2 4.15Å; M82-F113 HydrophobicContact CE-CE1 3.92Å; M82-F113 HydrophobicContact CE-CE2 3.31Å; M82-F113 HydrophobicContact CE-CZ 3.19Å; M82-F113 HydrophobicContact CG-CE1 3.71Å; M82-F113 HydrophobicContact CG-CE2 4.42Å; M82-F113 HydrophobicContact CG-CZ 3.38Å; M82-F113 HydrophobicContact SD-CZ 4.07Å; L109-F113 VanDerWaalsContact O-CB 3.24Å; L109-F113 WeakPolarHBondContact O-CB 3.25Å; L109-F113 PolarHBondContact O-N 2.99Å; E110-F113 PolarHBondContact O-N 3.34Å; F113-F115 VanDerWaalsContact C-N 3.34Å; F113-F115 PolarHBondContact O-N 2.85Å; F113-H116 PolarHBondContact O-N 2.98Å; F113-L117 HydrophobicContact CE1-CB 4.41Å; F113-L117 HydrophobicContact CE1-CD2 3.8Å; F113-L117 HydrophobicContact CZ-CB 4.37Å; F113-L117 HydrophobicContact CZ-CD2 4.04Å; F113-L117 VanDerWaalsContact O-CB 3.32Å; F113-L117 WeakPolarHBondContact O-CB 3.46Å; F113-L117 PolarHBondContact O-N 2.72Å |
| 114 | H | 85.5 | Confident | 80.1 | Confident | 39 Ų | 39 | 78.2 Ų | 78.2 | 18% | 0.181 | 40% | 0.403 | C | S | . | . | H | α-helix | trans | -61.9 | -43.9 | 178.6 | -72 | -165.6 | 0 | 0 | 0 | 111.3 | D81 V86 E110 K111 Q112 H116 L117 N118 | D81-H114 IonicContact OD2-CE1 2.83Å; D81-H114 PolarHBondContact OD2-CE1 2.9Å; D81-H114 IonicContact OD2-NE2 3.41Å; D81-H114 PolarHBondContact OD2-NE2 3.3Å; V86-H114 HydrophobicContact CG2-CB 4.44Å; E110-H114 WeakPolarHBondContact O-CB 3.46Å; E110-H114 PolarHBondContact O-CD2 3.18Å; E110-H114 VanDerWaalsContact O-CG 3.3Å; E110-H114 PolarHBondContact O-N 2.88Å; K111-H114 PolarHBondContact O-N 3.11Å; Q112-H114 PolarHBondContact O-N 2.88Å; H114-H116 PolarHBondContact O-N 3.41Å; H114-L117 PolarHBondContact O-N 3.29Å; H114-N118 VanDerWaalsContact O-CB 3.26Å; H114-N118 WeakPolarHBondContact O-CB 3.5Å; H114-N118 VanDerWaalsContact O-CG 3.29Å; H114-N118 PolarHBondContact O-N 3.16Å; H114-N118 PolarHBondContact O-ND2 3.48Å |
| 115 | F | 88.1 | Confident | 82.1 | Confident | 153 Ų | 153 | 74.8 Ų | 74.8 | 67% | 0.671 | 40% | 0.396 | S | S | * | . | H | α-helix | trans | -59.1 | -48.6 | 177 | 178.9 | -97.3 | 0 | 0 | 0 | 111.6 | K111 Q112 F113 G119 | K111-F115 WeakPolarHBondContact O-CB 3.47Å; K111-F115 PolarHBondContact O-N 2.92Å; Q112-F115 PolarHBondContact O-N 3.06Å; F113-F115 VanDerWaalsContact C-N 3.34Å; F113-F115 PolarHBondContact O-N 2.85Å; F115-G119 PolarHBondContact O-N 3.41Å |
| 116 | H | 89.8 | Confident | 84.3 | Confident | 107 Ų | 107 | 76.8 Ų | 76.8 | 50% | 0.495 | 40% | 0.4 | S | S | . | . | H | α-helix | trans | -68.5 | -41.3 | -179.6 | -69.9 | -49.2 | 0 | 0 | 0 | 113 | Q112 F113 H114 G119 L120 | Q112-H116 WeakPolarHBondContact CG-NE2 3.36Å; Q112-H116 PolarHBondContact O-CD2 3.5Å; Q112-H116 PolarHBondContact O-N 3.17Å; F113-H116 PolarHBondContact O-N 2.98Å; H114-H116 PolarHBondContact O-N 3.41Å; H116-G119 PolarHBondContact O-N 3.28Å; H116-L120 WeakPolarHBondContact O-CB 3.26Å; H116-L120 PolarHBondContact O-N 2.86Å |
| 117 | L | 87.3 | Confident | 86.4 | Confident | 21 Ų | 21 | 79.4 Ų | 79.4 | 11% | 0.11 | 41% | 0.413 | C | S | . | . | H | α-helix | trans | -63 | -47.6 | 178.7 | -175.6 | 61.1 | 0 | 0 | 0 | 110.9 | M18 V86 F113 H114 G119 L120 Q121 | M18-L117 HydrophobicContact CE-CD1 4.41Å; V86-L117 HydrophobicContact CG2-CD2 4.11Å; F113-L117 HydrophobicContact CE1-CB 4.41Å; F113-L117 HydrophobicContact CE1-CD2 3.8Å; F113-L117 HydrophobicContact CZ-CB 4.37Å; F113-L117 HydrophobicContact CZ-CD2 4.04Å; F113-L117 VanDerWaalsContact O-CB 3.32Å; F113-L117 WeakPolarHBondContact O-CB 3.46Å; F113-L117 PolarHBondContact O-N 2.72Å; H114-L117 PolarHBondContact O-N 3.29Å; L117-G119 VanDerWaalsContact C-N 3.35Å; L117-G119 PolarHBondContact O-N 3.18Å; L117-L120 PolarHBondContact O-N 2.99Å; L117-Q121 WeakPolarHBondContact O-CB 3.24Å; L117-Q121 VanDerWaalsContact O-CG 3.3Å; L117-Q121 WeakPolarHBondContact O-CG 3.41Å; L117-Q121 PolarHBondContact O-N 3.44Å |
| 118 | N | 87 | Confident | 88 | Confident | 70 Ų | 70 | 79.7 Ų | 79.7 | 37% | 0.374 | 42% | 0.418 | S | S | . | . | H | α-helix | trans | -61.9 | -42.5 | 175.9 | -75.6 | -44.5 | 0 | 0 | 0 | 111.9 | H114 L120 Q121 A122 | H114-N118 VanDerWaalsContact O-CB 3.26Å; H114-N118 WeakPolarHBondContact O-CB 3.5Å; H114-N118 VanDerWaalsContact O-CG 3.29Å; H114-N118 PolarHBondContact O-N 3.16Å; H114-N118 PolarHBondContact O-ND2 3.48Å; N118-L120 PolarHBondContact O-N 2.86Å; N118-Q121 PolarHBondContact O-N 3.5Å; N118-A122 WeakPolarHBondContact O-CB 3.48Å; N118-A122 PolarHBondContact O-N 3.35Å |
| 119 | G | 88.9 | Confident | 88.8 | Confident | 37 Ų | 37 | 81 Ų | 81 | 38% | 0.381 | 42% | 0.424 | S | S | . | . | H | α-helix | trans | -59.8 | -46 | 175.9 | 0 | 0 | 0 | 0 | 0 | 112.3 | F115 H116 L117 A122 V123 | F115-G119 PolarHBondContact O-N 3.41Å; H116-G119 PolarHBondContact O-N 3.28Å; L117-G119 VanDerWaalsContact C-N 3.35Å; L117-G119 PolarHBondContact O-N 3.18Å; G119-A122 PolarHBondContact O-N 3.49Å; G119-V123 WeakPolarHBondContact O-CG2 3.25Å; G119-V123 PolarHBondContact O-N 3.01Å |
| 120 | L | 90.4 | Very high | 89.7 | Confident | 73 Ų | 73 | 84 Ų | 84 | 38% | 0.382 | 43% | 0.433 | S | S | . | . | H | α-helix | trans | -63.4 | -46.9 | 177.6 | -177.5 | 62.8 | 0 | 0 | 0 | 111.5 | L14 H116 L117 N118 A122 V123 L124 | L14-L120 HydrophobicContact CD2-CD2 3.64Å; H116-L120 WeakPolarHBondContact O-CB 3.26Å; H116-L120 PolarHBondContact O-N 2.86Å; L117-L120 PolarHBondContact O-N 2.99Å; N118-L120 PolarHBondContact O-N 2.86Å; L120-A122 VanDerWaalsContact C-N 3.32Å; L120-A122 PolarHBondContact O-N 3.09Å; L120-V123 PolarHBondContact O-N 3.4Å; L120-L124 HydrophobicContact CD1-CD1 4.15Å; L120-L124 HydrophobicContact CD1-CG 4.17Å; L120-L124 HydrophobicContact CG-CD1 3.91Å; L120-L124 HydrophobicContact CG-CG 4.34Å; L120-L124 WeakPolarHBondContact O-CB 3.34Å; L120-L124 VanDerWaalsContact O-CG 3.32Å; L120-L124 WeakPolarHBondContact O-CG 3.38Å; L120-L124 PolarHBondContact O-N 2.72Å |
| 121 | Q | 87.4 | Confident | 90.5 | Very high | 82 Ų | 82 | 84.3 Ų | 84.3 | 38% | 0.383 | 44% | 0.443 | S | S | . | . | H | α-helix | trans | -58.3 | -42.9 | 176.6 | -73.7 | 178.3 | 1.7 | 0 | 0 | 111.9 | L117 N118 L124 S125 | L117-Q121 WeakPolarHBondContact O-CB 3.24Å; L117-Q121 VanDerWaalsContact O-CG 3.3Å; L117-Q121 WeakPolarHBondContact O-CG 3.41Å; L117-Q121 PolarHBondContact O-N 3.44Å; N118-Q121 PolarHBondContact O-N 3.5Å; Q121-L124 PolarHBondContact O-N 2.94Å; Q121-S125 WeakPolarHBondContact O-CB 3.25Å; Q121-S125 PolarHBondContact O-N 3Å; Q121-S125 PolarHBondContact O-OG 2.94Å |
| 122 | A | 90 | Very high | 91.1 | Very high | 48 Ų | 48 | 82.7 Ų | 82.7 | 40% | 0.397 | 44% | 0.441 | S | S | . | . | H | α-helix | trans | -63.7 | -42.7 | 177.7 | 0 | 0 | 0 | 0 | 0 | 112.3 | N118 G119 L120 K126 | N118-A122 WeakPolarHBondContact O-CB 3.48Å; N118-A122 PolarHBondContact O-N 3.35Å; G119-A122 PolarHBondContact O-N 3.49Å; L120-A122 VanDerWaalsContact C-N 3.32Å; L120-A122 PolarHBondContact O-N 3.09Å; A122-K126 WeakPolarHBondContact O-CG 3.36Å; A122-K126 PolarHBondContact O-N 3.19Å |
| 123 | V | 94.8 | Very high | 91.6 | Very high | 80 Ų | 80 | 81.7 Ų | 81.7 | 49% | 0.485 | 44% | 0.441 | S | S | . | . | H | α-helix | trans | -66.4 | -48 | 177.5 | 172.4 | 0 | 0 | 0 | 0 | 110.9 | G119 L120 S125 K126 L127 | G119-V123 WeakPolarHBondContact O-CG2 3.25Å; G119-V123 PolarHBondContact O-N 3.01Å; L120-V123 PolarHBondContact O-N 3.4Å; V123-S125 VanDerWaalsContact C-N 3.29Å; V123-S125 PolarHBondContact O-N 3.13Å; V123-K126 PolarHBondContact O-N 3.47Å; V123-L127 HydrophobicContact CG1-CD1 3.86Å; V123-L127 HydrophobicContact CG1-CG 4.3Å; V123-L127 WeakPolarHBondContact O-CG 3.39Å; V123-L127 PolarHBondContact O-N 3.19Å |
| 124 | L | 91.8 | Very high | 92.1 | Very high | 90 Ų | 90 | 85.4 Ų | 85.4 | 47% | 0.471 | 46% | 0.462 | S | S | . | . | H | α-helix | trans | -60.2 | -39.3 | 178.5 | -71.6 | 175.7 | 0 | 0 | 0 | 111.8 | L120 Q121 K126 L127 T128 | L120-L124 HydrophobicContact CD1-CD1 4.15Å; L120-L124 HydrophobicContact CD1-CG 4.17Å; L120-L124 HydrophobicContact CG-CD1 3.91Å; L120-L124 HydrophobicContact CG-CG 4.34Å; L120-L124 WeakPolarHBondContact O-CB 3.34Å; L120-L124 VanDerWaalsContact O-CG 3.32Å; L120-L124 WeakPolarHBondContact O-CG 3.38Å; L120-L124 PolarHBondContact O-N 2.72Å; Q121-L124 PolarHBondContact O-N 2.94Å; L124-K126 PolarHBondContact O-N 3.23Å; L124-L127 PolarHBondContact O-N 3.13Å; L124-T128 VanDerWaalsContact O-CB 3.31Å; L124-T128 WeakPolarHBondContact O-CB 3.48Å; L124-T128 PolarHBondContact O-N 3.12Å; L124-T128 PolarHBondContact O-OG1 3.01Å |
| 125 | S | 93.1 | Very high | 92.4 | Very high | 78 Ų | 78 | 86.8 Ų | 86.8 | 55% | 0.545 | 47% | 0.473 | S | S | . | . | H | α-helix | trans | -60.5 | -46.3 | 175.3 | -62.4 | 0 | 0 | 0 | 0 | 111.9 | Q121 V123 T128 L129 | Q121-S125 WeakPolarHBondContact O-CB 3.25Å; Q121-S125 PolarHBondContact O-N 3Å; Q121-S125 PolarHBondContact O-OG 2.94Å; V123-S125 VanDerWaalsContact C-N 3.29Å; V123-S125 PolarHBondContact O-N 3.13Å; S125-T128 PolarHBondContact O-N 2.61Å; S125-L129 PolarHBondContact O-N 3.45Å |
| 126 | K | 95.3 | Very high | 92.7 | Very high | 146 Ų | 146 | 83.5 Ų | 83.5 | 64% | 0.635 | 46% | 0.463 | S | S | * | . | H | α-helix | trans | -64.3 | -42.1 | 177 | -71.6 | 173.9 | -177.9 | 174.9 | 0 | 112.2 | A122 V123 L124 L129 K130 | A122-K126 WeakPolarHBondContact O-CG 3.36Å; A122-K126 PolarHBondContact O-N 3.19Å; V123-K126 PolarHBondContact O-N 3.47Å; L124-K126 PolarHBondContact O-N 3.23Å; K126-L129 PolarHBondContact O-N 2.96Å; K126-K130 WeakPolarHBondContact O-CG 3.38Å; K126-K130 PolarHBondContact O-N 2.87Å |
| 127 | L | 96 | Very high | 92.7 | Very high | 97 Ų | 97 | 84.9 Ų | 84.9 | 51% | 0.508 | 46% | 0.464 | S | S | . | . | H | α-helix | trans | -65.7 | -41.5 | 177.8 | -70.7 | 174.6 | 0 | 0 | 0 | 111.5 | V123 L124 L129 K130 A131 | V123-L127 HydrophobicContact CG1-CD1 3.86Å; V123-L127 HydrophobicContact CG1-CG 4.3Å; V123-L127 WeakPolarHBondContact O-CG 3.39Å; V123-L127 PolarHBondContact O-N 3.19Å; L124-L127 PolarHBondContact O-N 3.13Å; L127-L129 PolarHBondContact O-N 3.31Å; L127-K130 PolarHBondContact O-N 2.82Å; L127-A131 WeakPolarHBondContact O-CB 3.26Å; L127-A131 PolarHBondContact O-N 2.99Å |
| 128 | T | 94.4 | Very high | 93 | Very high | 78 Ų | 78 | 91.2 Ų | 91.2 | 48% | 0.479 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -60.7 | -45.1 | 175.9 | -58.6 | 0 | 0 | 0 | 0 | 111 | L124 S125 K130 A131 N132 | L124-T128 VanDerWaalsContact O-CB 3.31Å; L124-T128 WeakPolarHBondContact O-CB 3.48Å; L124-T128 PolarHBondContact O-N 3.12Å; L124-T128 PolarHBondContact O-OG1 3.01Å; S125-T128 PolarHBondContact O-N 2.61Å; T128-K130 PolarHBondContact O-N 3.14Å; T128-A131 PolarHBondContact O-N 3.39Å; T128-N132 WeakPolarHBondContact O-CB 3.32Å; T128-N132 VanDerWaalsContact O-CG 3.3Å; T128-N132 PolarHBondContact O-N 2.8Å; T128-N132 PolarHBondContact O-ND2 3.17Å |
| 129 | L | 95.3 | Very high | 93.2 | Very high | 116 Ų | 116 | 92.9 Ų | 92.9 | 61% | 0.607 | 49% | 0.491 | S | S | * | . | H | α-helix | trans | -59.9 | -46.4 | 175 | -177.6 | 64.2 | 0 | 0 | 0 | 111.6 | S125 K126 L127 A131 N132 T133 | S125-L129 PolarHBondContact O-N 3.45Å; K126-L129 PolarHBondContact O-N 2.96Å; L127-L129 PolarHBondContact O-N 3.31Å; L129-A131 VanDerWaalsContact C-N 3.35Å; L129-A131 PolarHBondContact O-N 3.41Å; L129-N132 PolarHBondContact O-N 3.35Å; L129-T133 PolarHBondContact O-N 3.2Å; L129-T133 PolarHBondContact O-OG1 3.39Å; L129-T133 VanDerWaalsContact O-OG1 3.08Å |
| 130 | K | 96.6 | Very high | 93.2 | Very high | 145 Ų | 145 | 96.6 Ų | 96.6 | 63% | 0.63 | 50% | 0.499 | S | S | * | . | H | α-helix | trans | -59.5 | -44 | 176.8 | -75.7 | -177.5 | 178.3 | -175.8 | 0 | 112.2 | K126 L127 T128 T133 L134 | K126-K130 WeakPolarHBondContact O-CG 3.38Å; K126-K130 PolarHBondContact O-N 2.87Å; L127-K130 PolarHBondContact O-N 2.82Å; T128-K130 PolarHBondContact O-N 3.14Å; K130-T133 PolarHBondContact O-N 3.1Å; K130-L134 WeakPolarHBondContact O-CG 3.17Å; K130-L134 PolarHBondContact O-N 3.36Å |
| 131 | A | 96.6 | Very high | 93 | Very high | 50 Ų | 50 | 99.9 Ų | 99.9 | 41% | 0.413 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -62.9 | -41.8 | 177.9 | 0 | 0 | 0 | 0 | 0 | 112.1 | L127 T128 L129 L134 T135 | L127-A131 WeakPolarHBondContact O-CB 3.26Å; L127-A131 PolarHBondContact O-N 2.99Å; T128-A131 PolarHBondContact O-N 3.39Å; L129-A131 VanDerWaalsContact C-N 3.35Å; L129-A131 PolarHBondContact O-N 3.41Å; A131-L134 PolarHBondContact O-N 2.74Å; A131-T135 WeakPolarHBondContact O-CB 3.43Å; A131-T135 PolarHBondContact O-N 3.41Å; A131-T135 PolarHBondContact O-OG1 3.08Å |
| 132 | N | 94.5 | Very high | 93 | Very high | 86 Ų | 86 | 99.7 Ų | 99.7 | 46% | 0.46 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -64.7 | -43.6 | 175.5 | -71.8 | -25.2 | 0 | 0 | 0 | 111.8 | T128 L129 L134 T135 N136 | T128-N132 WeakPolarHBondContact O-CB 3.32Å; T128-N132 VanDerWaalsContact O-CG 3.3Å; T128-N132 PolarHBondContact O-N 2.8Å; T128-N132 PolarHBondContact O-ND2 3.17Å; L129-N132 PolarHBondContact O-N 3.35Å; N132-L134 PolarHBondContact O-N 2.83Å; N132-T135 PolarHBondContact O-N 2.63Å; N132-N136 WeakPolarHBondContact O-CB 3.47Å; N132-N136 VanDerWaalsContact O-CG 3.26Å; N132-N136 PolarHBondContact O-N 3.49Å; N132-N136 PolarHBondContact O-ND2 2.83Å |
| 133 | T | 95.3 | Very high | 92 | Very high | 74 Ų | 74 | 100.2 Ų | 100.2 | 45% | 0.454 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -59.7 | -46.6 | 175 | -61.1 | 0 | 0 | 0 | 0 | 111.4 | L129 K130 T135 N136 R137 | L129-T133 PolarHBondContact O-N 3.2Å; L129-T133 PolarHBondContact O-OG1 3.39Å; L129-T133 VanDerWaalsContact O-OG1 3.08Å; K130-T133 PolarHBondContact O-N 3.1Å; T133-T135 VanDerWaalsContact C-N 3.31Å; T133-T135 PolarHBondContact O-N 3.25Å; T133-N136 PolarHBondContact O-N 3.01Å; T133-R137 HydrophobicContact CG2-CG 4.27Å; T133-R137 WeakPolarHBondContact O-CB 3.41Å; T133-R137 VanDerWaalsContact O-CG 3.23Å; T133-R137 WeakPolarHBondContact O-CG 3.34Å; T133-R137 PolarHBondContact O-N 2.94Å |
| 134 | L | 95.2 | Very high | 90.4 | Very high | 124 Ų | 124 | 100.4 Ų | 100.4 | 65% | 0.649 | 53% | 0.527 | S | S | * | . | H | α-helix | trans | -59 | -43.6 | 176.1 | -74.8 | 170 | 0 | 0 | 0 | 111.9 | K130 A131 N132 R137 Y138 | K130-L134 WeakPolarHBondContact O-CG 3.17Å; K130-L134 PolarHBondContact O-N 3.36Å; A131-L134 PolarHBondContact O-N 2.74Å; N132-L134 PolarHBondContact O-N 2.83Å; L134-R137 PolarHBondContact O-N 3.37Å; L134-Y138 WeakPolarHBondContact O-CB 3.19Å; L134-Y138 PolarHBondContact O-N 3.36Å |
| 135 | T | 93.6 | Very high | 88.8 | Confident | 67 Ų | 67 | 107 Ų | 107 | 41% | 0.411 | 55% | 0.546 | S | S | . | . | H | α-helix | trans | -62.9 | -43.1 | 177.9 | -58.5 | 0 | 0 | 0 | 0 | 111.6 | A131 N132 T133 Y138 K139 | A131-T135 WeakPolarHBondContact O-CB 3.43Å; A131-T135 PolarHBondContact O-N 3.41Å; A131-T135 PolarHBondContact O-OG1 3.08Å; N132-T135 PolarHBondContact O-N 2.63Å; T133-T135 VanDerWaalsContact C-N 3.31Å; T133-T135 PolarHBondContact O-N 3.25Å; T135-Y138 PolarHBondContact O-N 2.83Å; T135-K139 HydrophobicContact CG2-CD 4.47Å; T135-K139 WeakPolarHBondContact O-CG 3.42Å; T135-K139 PolarHBondContact O-N 2.67Å |
| 136 | N | 92.7 | Very high | 86.8 | Confident | 85 Ų | 85 | 114.4 Ų | 114.4 | 46% | 0.455 | 58% | 0.579 | S | S | . | * | H | α-helix | trans | -67.4 | -44.9 | 178.5 | -70.2 | -16.3 | 0 | 0 | 0 | 111.6 | N132 T133 Y138 K139 E140 | N132-N136 WeakPolarHBondContact O-CB 3.47Å; N132-N136 VanDerWaalsContact O-CG 3.26Å; N132-N136 PolarHBondContact O-N 3.49Å; N132-N136 PolarHBondContact O-ND2 2.83Å; T133-N136 PolarHBondContact O-N 3.01Å; N136-Y138 VanDerWaalsContact C-N 3.3Å; N136-Y138 PolarHBondContact O-N 3.08Å; N136-K139 WeakPolarHBondContact O-CB 3.47Å; N136-K139 PolarHBondContact O-N 3.13Å; N136-K139 VanDerWaalsContact O-N 3.16Å; N136-E140 WeakPolarHBondContact O-CG 3.49Å; N136-E140 PolarHBondContact O-N 3.48Å |
| 137 | R | 91.6 | Very high | 86.4 | Confident | 135 Ų | 135 | 112.9 Ų | 112.9 | 51% | 0.509 | 58% | 0.577 | S | S | . | * | H | α-helix | trans | -59.7 | -42.5 | 175.2 | -68.4 | -67.6 | -68.2 | 157.5 | -0.6 | 111.3 | T133 L134 K139 E140 E141 | T133-R137 HydrophobicContact CG2-CG 4.27Å; T133-R137 WeakPolarHBondContact O-CB 3.41Å; T133-R137 VanDerWaalsContact O-CG 3.23Å; T133-R137 WeakPolarHBondContact O-CG 3.34Å; T133-R137 PolarHBondContact O-N 2.94Å; L134-R137 PolarHBondContact O-N 3.37Å; R137-K139 PolarHBondContact O-N 3.07Å; R137-E140 WeakPolarHBondContact CD-OE2 3.45Å; R137-E140 IonicContact CZ-OE2 3.48Å; R137-E140 IonicContact NH1-OE2 2.72Å; R137-E140 PolarHBondContact NH1-OE2 3.15Å; R137-E140 WeakPolarHBondContact O-CB 3.43Å; R137-E140 PolarHBondContact O-N 3.16Å; R137-E141 IonicContact NH2-OE1 3.8Å; R137-E141 VanDerWaalsContact O-CG 3.29Å; R137-E141 WeakPolarHBondContact O-CG 3.24Å; R137-E141 PolarHBondContact O-N 3.25Å |
| 138 | Y | 93.1 | Very high | 85.9 | Confident | 154 Ų | 154 | 113.7 Ų | 113.7 | 60% | 0.604 | 58% | 0.58 | S | S | * | * | H | α-helix | trans | -60.6 | -46.1 | 174.8 | -179.2 | -105.9 | 0 | 0 | 0 | 111.9 | L134 T135 N136 E140 E141 I142 | L134-Y138 WeakPolarHBondContact O-CB 3.19Å; L134-Y138 PolarHBondContact O-N 3.36Å; T135-Y138 PolarHBondContact O-N 2.83Å; N136-Y138 VanDerWaalsContact C-N 3.3Å; N136-Y138 PolarHBondContact O-N 3.08Å; Y138-E140 VanDerWaalsContact C-N 3.3Å; Y138-E140 PolarHBondContact O-N 3.34Å; Y138-E141 PolarHBondContact O-N 3.18Å; Y138-I142 HydrophobicContact CD1-CD1 4.03Å; Y138-I142 HydrophobicContact CD2-CG2 4.24Å; Y138-I142 HydrophobicContact CE1-CD1 3.63Å; Y138-I142 HydrophobicContact CE1-CG2 4.09Å; Y138-I142 HydrophobicContact CE2-CG2 3.73Å; Y138-I142 WeakPolarHBondContact O-CG1 3.18Å; Y138-I142 PolarHBondContact O-N 3.06Å |
| 139 | K | 90.3 | Very high | 85.4 | Confident | 105 Ų | 105 | 115.7 Ų | 115.7 | 46% | 0.457 | 59% | 0.586 | S | S | . | * | H | α-helix | trans | -58.8 | -38.9 | 176.3 | -74 | 174 | 178.2 | 179.1 | 0 | 113 | T135 N136 R137 G143 C144 | T135-K139 HydrophobicContact CG2-CD 4.47Å; T135-K139 WeakPolarHBondContact O-CG 3.42Å; T135-K139 PolarHBondContact O-N 2.67Å; N136-K139 WeakPolarHBondContact O-CB 3.47Å; N136-K139 PolarHBondContact O-N 3.13Å; N136-K139 VanDerWaalsContact O-N 3.16Å; R137-K139 PolarHBondContact O-N 3.07Å; K139-G143 PolarHBondContact O-N 3.07Å; K139-C144 PolarHBondContact O-N 3.13Å; K139-C144 VanDerWaalsContact O-N 3.14Å |
| 140 | E | 88.4 | Confident | 84.8 | Confident | 116 Ų | 116 | 115.6 Ų | 115.6 | 54% | 0.542 | 59% | 0.585 | S | S | . | * | H | α-helix | trans | -63.3 | -46.8 | 174.8 | -71.5 | 169.8 | -175.7 | 0 | 0 | 111.7 | N136 R137 Y138 G143 | N136-E140 WeakPolarHBondContact O-CG 3.49Å; N136-E140 PolarHBondContact O-N 3.48Å; R137-E140 WeakPolarHBondContact CD-OE2 3.45Å; R137-E140 IonicContact CZ-OE2 3.48Å; R137-E140 IonicContact NH1-OE2 2.72Å; R137-E140 PolarHBondContact NH1-OE2 3.15Å; R137-E140 WeakPolarHBondContact O-CB 3.43Å; R137-E140 PolarHBondContact O-N 3.16Å; Y138-E140 VanDerWaalsContact C-N 3.3Å; Y138-E140 PolarHBondContact O-N 3.34Å; E140-G143 PolarHBondContact O-N 3.48Å |
| 141 | E | 86.9 | Confident | 84.1 | Confident | 141 Ų | 141 | 113.8 Ų | 113.8 | 66% | 0.659 | 58% | 0.582 | S | S | * | * | H | α-helix | trans | -67.4 | -36 | -178 | -67.5 | -68.6 | 163 | 0 | 0 | 112.8 | R137 Y138 G143 | R137-E141 IonicContact NH2-OE1 3.8Å; R137-E141 VanDerWaalsContact O-CG 3.29Å; R137-E141 WeakPolarHBondContact O-CG 3.24Å; R137-E141 PolarHBondContact O-N 3.25Å; Y138-E141 PolarHBondContact O-N 3.18Å; E141-G143 PolarHBondContact O-N 2.94Å |
| 142 | I | 88.3 | Confident | 83.2 | Confident | 78 Ų | 78 | 118.1 Ų | 118.1 | 40% | 0.4 | 59% | 0.593 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -82.8 | 1.7 | 177.4 | 68.1 | 176.4 | 0 | 0 | 0 | 113.4 | Y138 C144 | Y138-I142 HydrophobicContact CD1-CD1 4.03Å; Y138-I142 HydrophobicContact CD2-CG2 4.24Å; Y138-I142 HydrophobicContact CE1-CD1 3.63Å; Y138-I142 HydrophobicContact CE1-CG2 4.09Å; Y138-I142 HydrophobicContact CE2-CG2 3.73Å; Y138-I142 WeakPolarHBondContact O-CG1 3.18Å; Y138-I142 PolarHBondContact O-N 3.06Å; I142-C144 HydrophobicContact CD1-CB 3.97Å; I142-C144 VanDerWaalsContact CD1-SG 3.51Å; I142-C144 HydrophobicContact CG1-CB 3.87Å; I142-C144 PolarHBondContact O-N 2.89Å |
| 143 | G | 68.9 | Low | 82.4 | Confident | 60 Ų | 60 | 120.4 Ų | 120.4 | 62% | 0.619 | 60% | 0.603 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 68.7 | 13.1 | 178.9 | 0 | 0 | 0 | 0 | 0 | 114.6 | K139 E140 E141 R145 | K139-G143 PolarHBondContact O-N 3.07Å; E140-G143 PolarHBondContact O-N 3.48Å; E141-G143 PolarHBondContact O-N 2.94Å; G143-R145 PolarHBondContact O-N 3.23Å |
| 144 | C | 61.1 | Low | 81.5 | Confident | 83 Ų | 83 | 123.9 Ų | 123.9 | 56% | 0.561 | 61% | 0.614 | S | S | * | * | trans | -80.5 | 62.4 | 175.2 | -67 | 0 | 0 | 0 | 0 | 110.4 | K139 I142 | K139-C144 PolarHBondContact O-N 3.13Å; K139-C144 VanDerWaalsContact O-N 3.14Å; I142-C144 HydrophobicContact CD1-CB 3.97Å; I142-C144 VanDerWaalsContact CD1-SG 3.51Å; I142-C144 HydrophobicContact CG1-CB 3.87Å; I142-C144 PolarHBondContact O-N 2.89Å | ||
| 145 | R | 57.1 | Low | 80.3 | Confident | 228 Ų | 228 | 123.9 Ų | 123.9 | 86% | 0.86 | 61% | 0.611 | S | S | * | * | trans | -93.5 | 107.3 | 167.8 | -168.8 | 156.7 | 70.9 | 166.5 | 3.5 | 107.8 | G143 | G143-R145 PolarHBondContact O-N 3.23Š| ||
| 146 | N | 51.7 | Low | 79.1 | Confident | 235 Ų | 235 | 129.1 Ų | 129.1 | 100% | 1.257 | 63% | 0.629 | S | S | * | * | trans | -73.3 | 0 | 157.9 | -84.2 | 0.3 | 0 | 0 | 0 | 108.9 |
Retrieved 146 of 146 residues in 193.5 ms
(Link to these results)