| 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 | 51.9 | Low | 56.9 | Low | 253 Ų | 253 | 145 Ų | 145 | 100% | 1.246 | 81% | 0.81 | S | S | * | * | 0 | 104.1 | 0 | -65.7 | 167 | 81.7 | 0 | 0 | 107.3 | |||||
| 2 | G | 48.6 | Very low | 57.1 | Low | 77 Ų | 77 | 138 Ų | 138 | 79% | 0.794 | 80% | 0.795 | S | S | * | * | trans | -135.3 | 107.2 | 178 | 0 | 0 | 0 | 0 | 0 | 108 | G4 | G2-G4 PolarHBondContact O-N 3.31Š| ||
| 3 | S | 54.9 | Low | 57.4 | Low | 87 Ų | 87 | 135.8 Ų | 135.8 | 61% | 0.608 | 79% | 0.792 | S | S | * | * | trans | -55.2 | 102.4 | -179.5 | 173.4 | 0 | 0 | 0 | 0 | 110.4 | H5 | S3-H5 PolarHBondContact O-CD2 3.47Å; S3-H5 PolarHBondContact O-N 3.41Å; S3-H5 PolarHBondContact OG-CD2 3.06Å; S3-H5 PolarHBondContact OG-CE1 2.64Å; S3-H5 PolarHBondContact OG-NE2 3.45Å; S3-H5 VanDerWaalsContact OG-NE2 3.08Å | ||
| 4 | G | 56.5 | Low | 58.1 | Low | 70 Ų | 70 | 140.1 Ų | 140.1 | 72% | 0.722 | 80% | 0.797 | S | S | * | * | trans | -69.1 | 84.7 | 164 | 0 | 0 | 0 | 0 | 0 | 107.6 | G2 C6 | G2-G4 PolarHBondContact O-N 3.31Å; G4-C6 PolarHBondContact O-N 3.21Å | ||
| 5 | H | 58.6 | Low | 58.6 | Low | 149 Ų | 149 | 142.4 Ų | 142.4 | 69% | 0.69 | 80% | 0.801 | S | S | * | * | trans | -55.2 | 112.5 | 174.3 | -71.5 | -87.9 | 0 | 0 | 0 | 107.9 | S3 L7 | S3-H5 PolarHBondContact O-CD2 3.47Å; S3-H5 PolarHBondContact O-N 3.41Å; S3-H5 PolarHBondContact OG-CD2 3.06Å; S3-H5 PolarHBondContact OG-CE1 2.64Å; S3-H5 PolarHBondContact OG-NE2 3.45Å; S3-H5 VanDerWaalsContact OG-NE2 3.08Å; H5-L7 PolarHBondContact O-N 2.94Å | ||
| 6 | C | 57.8 | Low | 59.2 | Low | 123 Ų | 123 | 138.6 Ų | 138.6 | 83% | 0.831 | 78% | 0.781 | S | S | * | * | trans | -56.8 | 91 | 164 | -62.5 | 0 | 0 | 0 | 0 | 107.3 | G4 R8 | G4-C6 PolarHBondContact O-N 3.21Å; C6-R8 PolarHBondContact O-N 2.85Å | ||
| 7 | L | 59.9 | Low | 60.1 | Low | 161 Ų | 161 | 133.9 Ų | 133.9 | 84% | 0.843 | 76% | 0.76 | S | S | * | * | trans | -67.5 | 74.4 | 158.9 | -68.5 | 171.7 | 0 | 0 | 0 | 105.8 | H5 S9 | H5-L7 PolarHBondContact O-N 2.94Å; L7-S9 PolarHBondContact O-N 3.18Å | ||
| 8 | R | 56.2 | Low | 61.2 | Low | 224 Ų | 224 | 137.9 Ų | 137.9 | 85% | 0.845 | 76% | 0.761 | S | S | * | * | trans | -56.4 | 97.1 | 161.3 | -170.9 | 167.5 | -175.4 | 131.2 | -2.4 | 103.3 | C6 T10 | C6-R8 PolarHBondContact O-N 2.85Å; R8-T10 PolarHBondContact O-N 2.81Å; R8-T10 PolarHBondContact O-OG1 3.32Å | ||
| 9 | S | 60.3 | Low | 62.1 | Low | 104 Ų | 104 | 134.5 Ų | 134.5 | 73% | 0.727 | 75% | 0.748 | S | S | * | * | trans | -63.1 | 82.3 | 173.3 | -178.5 | 0 | 0 | 0 | 0 | 105.8 | L7 R11 | L7-S9 PolarHBondContact O-N 3.18Å; S9-R11 PolarHBondContact O-N 3.39Å | ||
| 10 | T | 61.2 | Low | 62.9 | Low | 123 Ų | 123 | 130.8 Ų | 130.8 | 76% | 0.755 | 73% | 0.729 | S | S | * | * | trans | -68.4 | 75.3 | 154.2 | -39.9 | 0 | 0 | 0 | 0 | 103.3 | R8 G12 | R8-T10 PolarHBondContact O-N 2.81Å; R8-T10 PolarHBondContact O-OG1 3.32Å; T10-G12 PolarHBondContact O-N 3.08Å | ||
| 11 | R | 60.4 | Low | 63.8 | Low | 224 Ų | 224 | 127.3 Ų | 127.3 | 85% | 0.845 | 71% | 0.708 | S | S | * | * | trans | -53.8 | 95.3 | 166.8 | 178.9 | -177.9 | 179.7 | -176.5 | 0.2 | 103.5 | S9 S13 | S9-R11 PolarHBondContact O-N 3.39Å; R11-S13 VanDerWaalsContact C-N 3.28Å; R11-S13 PolarHBondContact O-N 3.36Å | ||
| 12 | G | 58.8 | Low | 65.2 | Low | 61 Ų | 61 | 117.3 Ų | 117.3 | 63% | 0.629 | 67% | 0.666 | S | S | * | * | trans | -57.7 | 97.8 | -172 | 0 | 0 | 0 | 0 | 0 | 107.2 | T10 K14 | T10-G12 PolarHBondContact O-N 3.08Å; G12-K14 VanDerWaalsContact C-N 3.29Å; G12-K14 PolarHBondContact O-N 3.49Å | ||
| 13 | S | 61.5 | Low | 66.8 | Low | 109 Ų | 109 | 120 Ų | 120 | 76% | 0.762 | 66% | 0.656 | S | S | * | * | trans | -58.8 | 106.5 | 163.3 | -175.7 | 0 | 0 | 0 | 0 | 103.4 | R11 M15 | R11-S13 VanDerWaalsContact C-N 3.28Å; R11-S13 PolarHBondContact O-N 3.36Å; S13-M15 VanDerWaalsContact C-N 3.27Å; S13-M15 PolarHBondContact O-N 3.15Å | ||
| 14 | K | 66.9 | Low | 68 | Low | 197 Ų | 197 | 120 Ų | 120 | 86% | 0.857 | 65% | 0.647 | S | S | * | * | trans | -57.6 | 101.2 | 176.7 | -80.5 | 174.7 | 176.1 | 167.5 | 0 | 105.3 | G12 V16 | G12-K14 VanDerWaalsContact C-N 3.29Å; G12-K14 PolarHBondContact O-N 3.49Å; K14-V16 PolarHBondContact O-N 2.75Å | ||
| 15 | M | 65.3 | Low | 69 | Low | 174 Ų | 174 | 122 Ų | 122 | 86% | 0.857 | 64% | 0.638 | S | S | * | * | P | Polyproline II helix | trans | -57.9 | 119.7 | 173.4 | -80.5 | -179.8 | 69.6 | 0 | 0 | 105.9 | S13 S17 | S13-M15 VanDerWaalsContact C-N 3.27Å; S13-M15 PolarHBondContact O-N 3.15Å; M15-S17 PolarHBondContact O-N 2.9Å |
| 16 | V | 67.8 | Low | 70.2 | Confident | 81 Ų | 81 | 119.4 Ų | 119.4 | 49% | 0.491 | 63% | 0.627 | S | S | . | * | P | Polyproline II helix | trans | -51.3 | 132.5 | 174.5 | 174.4 | 0 | 0 | 0 | 0 | 107 | K14 W18 V20 I21 | K14-V16 PolarHBondContact O-N 2.75Å; V16-W18 PolarHBondContact O-N 2.98Å; V16-V20 HydrophobicContact CG1-CB 3.48Å; V16-V20 VanDerWaalsContact CG1-CB 3.48Å; V16-V20 HydrophobicContact CG1-CG1 3.32Å; V16-V20 HydrophobicContact CG1-CG2 4.43Å; V16-I21 HydrophobicContact CB-CG1 4.36Å; V16-I21 HydrophobicContact CG1-CG1 4.15Å |
| 17 | S | 74.8 | Confident | 71.2 | Confident | 60 Ų | 60 | 118.1 Ų | 118.1 | 42% | 0.42 | 61% | 0.61 | S | S | . | * | P | Polyproline II helix | trans | -55.9 | 144.1 | -174.8 | 64.5 | 0 | 0 | 0 | 0 | 110.1 | M15 S19 V20 I21 | M15-S17 PolarHBondContact O-N 2.9Å; S17-S19 PolarHBondContact O-N 3.41Å; S17-S19 PolarHBondContact OG-OG 2.92Å; S17-V20 PolarHBondContact O-N 3.33Å; S17-V20 WeakPolarHBondContact OG-CG2 3.47Å; S17-I21 PolarHBondContact O-N 3.01Å |
| 18 | W | 80.9 | Confident | 71.7 | Confident | 205 Ų | 205 | 114.8 Ų | 114.8 | 78% | 0.777 | 59% | 0.593 | S | S | * | * | H | α-helix | trans | -50.9 | -36.3 | 178.8 | -174.9 | -107.3 | 0 | 0 | 0 | 112.6 | V16 V20 I21 A22 | V16-W18 PolarHBondContact O-N 2.98Å; W18-V20 VanDerWaalsContact C-N 3.34Å; W18-V20 PolarHBondContact O-N 3.36Å; W18-I21 PolarHBondContact O-N 3.46Å; W18-A22 WeakPolarHBondContact O-CB 3.37Å; W18-A22 PolarHBondContact O-N 2.95Å |
| 19 | S | 77.6 | Confident | 72.7 | Confident | 73 Ų | 73 | 110.3 Ų | 110.3 | 51% | 0.51 | 58% | 0.581 | S | S | . | * | H | α-helix | trans | -60.2 | -36.6 | 174.6 | 54.5 | 0 | 0 | 0 | 0 | 114.4 | S17 K23 | S17-S19 PolarHBondContact O-N 3.41Å; S17-S19 PolarHBondContact OG-OG 2.92Å; S19-K23 WeakPolarHBondContact O-CG 3.46Å; S19-K23 PolarHBondContact O-N 3.48Å |
| 20 | V | 78.9 | Confident | 73.6 | Confident | 61 Ų | 61 | 112.9 Ų | 112.9 | 37% | 0.37 | 58% | 0.575 | S | S | . | * | H | α-helix | trans | -77.6 | -37.5 | 178.5 | 171.4 | 0 | 0 | 0 | 0 | 110.1 | V16 S17 W18 K23 I24 | V16-V20 HydrophobicContact CG1-CB 3.48Å; V16-V20 VanDerWaalsContact CG1-CB 3.48Å; V16-V20 HydrophobicContact CG1-CG1 3.32Å; V16-V20 HydrophobicContact CG1-CG2 4.43Å; S17-V20 PolarHBondContact O-N 3.33Å; S17-V20 WeakPolarHBondContact OG-CG2 3.47Å; W18-V20 VanDerWaalsContact C-N 3.34Å; W18-V20 PolarHBondContact O-N 3.36Å; V20-K23 PolarHBondContact O-N 2.92Å; V20-I24 HydrophobicContact CG1-CD1 3.82Å; V20-I24 HydrophobicContact CG1-CG1 4.4Å; V20-I24 VanDerWaalsContact O-CG1 3.23Å; V20-I24 WeakPolarHBondContact O-CG1 3.45Å; V20-I24 PolarHBondContact O-N 3.21Å |
| 21 | I | 80.8 | Confident | 74.3 | Confident | 58 Ų | 58 | 112.9 Ų | 112.9 | 30% | 0.297 | 57% | 0.565 | S | S | . | * | H | α-helix | trans | -61.6 | -45.6 | 174.3 | -62.3 | 174.8 | 0 | 0 | 0 | 110.7 | V16 S17 W18 K23 I24 Q25 | V16-I21 HydrophobicContact CB-CG1 4.36Å; V16-I21 HydrophobicContact CG1-CG1 4.15Å; S17-I21 PolarHBondContact O-N 3.01Å; W18-I21 PolarHBondContact O-N 3.46Å; I21-K23 PolarHBondContact O-N 3.49Å; I21-I24 PolarHBondContact O-N 2.92Å; I21-Q25 WeakPolarHBondContact O-CG 3.44Å; I21-Q25 PolarHBondContact O-N 3.32Å |
| 22 | A | 81.2 | Confident | 75 | Confident | 42 Ų | 42 | 107.8 Ų | 107.8 | 35% | 0.347 | 55% | 0.552 | S | S | . | * | H | α-helix | trans | -60.2 | -43.6 | 176.8 | 0 | 0 | 0 | 0 | 0 | 112.1 | W18 I24 Q25 E26 | W18-A22 WeakPolarHBondContact O-CB 3.37Å; W18-A22 PolarHBondContact O-N 2.95Å; A22-I24 PolarHBondContact O-N 3.44Å; A22-Q25 PolarHBondContact O-N 3.05Å; A22-E26 WeakPolarHBondContact O-CB 3.22Å; A22-E26 PolarHBondContact O-N 2.77Å |
| 23 | K | 83.6 | Confident | 75.8 | Confident | 135 Ų | 135 | 109.1 Ų | 109.1 | 59% | 0.587 | 55% | 0.548 | S | S | * | . | H | α-helix | trans | -62.8 | -40.9 | 175.2 | -77.2 | 179.4 | 178 | -176.4 | 0 | 112.5 | S19 V20 I21 E26 I27 | S19-K23 WeakPolarHBondContact O-CG 3.46Å; S19-K23 PolarHBondContact O-N 3.48Å; V20-K23 PolarHBondContact O-N 2.92Å; I21-K23 PolarHBondContact O-N 3.49Å; K23-E26 PolarHBondContact O-N 2.91Å; K23-I27 WeakPolarHBondContact O-CD1 3.31Å; K23-I27 VanDerWaalsContact O-CG1 3.22Å; K23-I27 WeakPolarHBondContact O-CG1 3.33Å; K23-I27 PolarHBondContact O-N 2.98Å |
| 24 | I | 79.1 | Confident | 76.7 | Confident | 85 Ų | 85 | 113.3 Ų | 113.3 | 44% | 0.436 | 55% | 0.547 | S | S | . | . | H | α-helix | trans | -63.3 | -45.7 | 176.9 | -70 | 165.7 | 0 | 0 | 0 | 110 | V20 I21 A22 E26 I27 L28 | V20-I24 HydrophobicContact CG1-CD1 3.82Å; V20-I24 HydrophobicContact CG1-CG1 4.4Å; V20-I24 VanDerWaalsContact O-CG1 3.23Å; V20-I24 WeakPolarHBondContact O-CG1 3.45Å; V20-I24 PolarHBondContact O-N 3.21Å; I21-I24 PolarHBondContact O-N 2.92Å; A22-I24 PolarHBondContact O-N 3.44Å; I24-E26 PolarHBondContact O-N 2.73Å; I24-I27 PolarHBondContact O-N 3.47Å; I24-L28 HydrophobicContact CG2-CD1 3.76Å; I24-L28 HydrophobicContact CG2-CG 4.32Å; I24-L28 WeakPolarHBondContact O-CB 3.13Å; I24-L28 VanDerWaalsContact O-CG 3.24Å; I24-L28 WeakPolarHBondContact O-CG 3.48Å; I24-L28 PolarHBondContact O-N 3.13Å |
| 25 | Q | 78.4 | Confident | 77.5 | Confident | 113 Ų | 113 | 110.2 Ų | 110.2 | 53% | 0.528 | 54% | 0.536 | S | S | . | . | H | α-helix | trans | -61.5 | -43.1 | 176.7 | -75.4 | 178.9 | -31.6 | 0 | 0 | 112.1 | I21 A22 L28 Q29 | I21-Q25 WeakPolarHBondContact O-CG 3.44Å; I21-Q25 PolarHBondContact O-N 3.32Å; A22-Q25 PolarHBondContact O-N 3.05Å; Q25-L28 PolarHBondContact O-N 3.22Å; Q25-Q29 WeakPolarHBondContact O-CB 3.31Å; Q25-Q29 WeakPolarHBondContact O-CG 3.33Å; Q25-Q29 PolarHBondContact O-N 3.3Å |
| 26 | E | 82.3 | Confident | 78.1 | Confident | 95 Ų | 95 | 108.6 Ų | 108.6 | 44% | 0.444 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -62.7 | -43.9 | 177.5 | -172.5 | -177.2 | -178.9 | 0 | 0 | 112.1 | A22 K23 I24 Q29 R30 | A22-E26 WeakPolarHBondContact O-CB 3.22Å; A22-E26 PolarHBondContact O-N 2.77Å; K23-E26 PolarHBondContact O-N 2.91Å; I24-E26 PolarHBondContact O-N 2.73Å; E26-Q29 PolarHBondContact O-N 2.71Å; E26-R30 WeakPolarHBondContact O-CB 3.24Å; E26-R30 VanDerWaalsContact O-CG 3.31Å; E26-R30 WeakPolarHBondContact O-CG 3.41Å; E26-R30 PolarHBondContact O-N 2.7Å; E26-R30 IonicContact OE1-CZ 3.26Å; E26-R30 VanDerWaalsContact OE1-CZ 3.26Å; E26-R30 IonicContact OE1-NE 3.45Å; E26-R30 PolarHBondContact OE1-NE 2.75Å; E26-R30 IonicContact OE1-NH2 2.64Å; E26-R30 PolarHBondContact OE1-NH2 3.44Å |
| 27 | I | 78.8 | Confident | 78.7 | Confident | 95 Ų | 95 | 109.1 Ų | 109.1 | 49% | 0.487 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -64.2 | -44.3 | 176.8 | -68 | 164.6 | 0 | 0 | 0 | 110.6 | K23 I24 R30 K31 | K23-I27 WeakPolarHBondContact O-CD1 3.31Å; K23-I27 VanDerWaalsContact O-CG1 3.22Å; K23-I27 WeakPolarHBondContact O-CG1 3.33Å; K23-I27 PolarHBondContact O-N 2.98Å; I24-I27 PolarHBondContact O-N 3.47Å; I27-R30 PolarHBondContact O-N 3.41Å; I27-K31 HydrophobicContact CG2-CD 4.36Å; I27-K31 WeakPolarHBondContact O-CG 3.23Å; I27-K31 PolarHBondContact O-N 2.83Å |
| 28 | L | 71.9 | Confident | 79.2 | Confident | 91 Ų | 91 | 108.8 Ų | 108.8 | 48% | 0.476 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -63.5 | -45 | 177.9 | -72.8 | 171.8 | 0 | 0 | 0 | 111.2 | I24 Q25 R30 K31 M32 | I24-L28 HydrophobicContact CG2-CD1 3.76Å; I24-L28 HydrophobicContact CG2-CG 4.32Å; I24-L28 WeakPolarHBondContact O-CB 3.13Å; I24-L28 VanDerWaalsContact O-CG 3.24Å; I24-L28 WeakPolarHBondContact O-CG 3.48Å; I24-L28 PolarHBondContact O-N 3.13Å; Q25-L28 PolarHBondContact O-N 3.22Å; L28-R30 PolarHBondContact O-N 2.86Å; L28-K31 PolarHBondContact O-N 2.87Å; L28-M32 WeakPolarHBondContact O-CB 3.41Å; L28-M32 VanDerWaalsContact O-CG 3.3Å; L28-M32 WeakPolarHBondContact O-CG 3.36Å; L28-M32 PolarHBondContact O-N 3.42Å |
| 29 | Q | 76.3 | Confident | 79.2 | Confident | 130 Ų | 130 | 105.5 Ų | 105.5 | 61% | 0.607 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -62.3 | -43.7 | 176.4 | -75.4 | -156.3 | -17.6 | 0 | 0 | 112 | Q25 E26 K31 M32 V33 | Q25-Q29 WeakPolarHBondContact O-CB 3.31Å; Q25-Q29 WeakPolarHBondContact O-CG 3.33Å; Q25-Q29 PolarHBondContact O-N 3.3Å; E26-Q29 PolarHBondContact O-N 2.71Å; Q29-K31 VanDerWaalsContact C-N 3.34Å; Q29-K31 PolarHBondContact O-N 3.35Å; Q29-M32 PolarHBondContact O-N 2.98Å; Q29-V33 VanDerWaalsContact O-CB 3.31Å; Q29-V33 WeakPolarHBondContact O-CB 3.39Å; Q29-V33 WeakPolarHBondContact O-CG2 3.44Å; Q29-V33 PolarHBondContact O-N 3.48Å |
| 30 | R | 78.9 | Confident | 79.2 | Confident | 158 Ų | 158 | 107.6 Ų | 107.6 | 60% | 0.596 | 52% | 0.518 | S | S | * | . | H | α-helix | trans | -63.2 | -37.8 | 176.8 | -73.5 | 177.5 | -175.2 | -161.6 | 2.5 | 112.9 | E26 I27 L28 R34 | E26-R30 WeakPolarHBondContact O-CB 3.24Å; E26-R30 VanDerWaalsContact O-CG 3.31Å; E26-R30 WeakPolarHBondContact O-CG 3.41Å; E26-R30 PolarHBondContact O-N 2.7Å; E26-R30 IonicContact OE1-CZ 3.26Å; E26-R30 VanDerWaalsContact OE1-CZ 3.26Å; E26-R30 IonicContact OE1-NE 3.45Å; E26-R30 PolarHBondContact OE1-NE 2.75Å; E26-R30 IonicContact OE1-NH2 2.64Å; E26-R30 PolarHBondContact OE1-NH2 3.44Å; I27-R30 PolarHBondContact O-N 3.41Å; L28-R30 PolarHBondContact O-N 2.86Å; R30-R34 WeakPolarHBondContact O-CG 3.3Å; R30-R34 PolarHBondContact O-N 2.81Å |
| 31 | K | 76.6 | Confident | 79.2 | Confident | 124 Ų | 124 | 110 Ų | 110 | 54% | 0.539 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -69.2 | -49 | 176.1 | -76.2 | -175.3 | 174.9 | -173.2 | 0 | 111.6 | I27 L28 Q29 V33 R34 E35 | I27-K31 HydrophobicContact CG2-CD 4.36Å; I27-K31 WeakPolarHBondContact O-CG 3.23Å; I27-K31 PolarHBondContact O-N 2.83Å; L28-K31 PolarHBondContact O-N 2.87Å; Q29-K31 VanDerWaalsContact C-N 3.34Å; Q29-K31 PolarHBondContact O-N 3.35Å; K31-V33 VanDerWaalsContact C-N 3.32Å; K31-V33 PolarHBondContact O-N 2.91Å; K31-R34 PolarHBondContact O-N 2.77Å; K31-R34 VanDerWaalsContact O-N 3.13Å; K31-E35 PolarHBondContact O-N 3.23Å |
| 32 | M | 74.8 | Confident | 78.9 | Confident | 116 Ų | 116 | 110.9 Ų | 110.9 | 57% | 0.571 | 54% | 0.538 | S | S | * | . | H | α-helix | trans | -61 | -40 | 178 | -70.4 | -167.5 | -54.9 | 0 | 0 | 112 | L28 Q29 R34 F36 | L28-M32 WeakPolarHBondContact O-CB 3.41Å; L28-M32 VanDerWaalsContact O-CG 3.3Å; L28-M32 WeakPolarHBondContact O-CG 3.36Å; L28-M32 PolarHBondContact O-N 3.42Å; Q29-M32 PolarHBondContact O-N 2.98Å; M32-R34 VanDerWaalsContact C-N 3.34Å; M32-R34 PolarHBondContact O-N 3.49Å; M32-F36 WeakPolarHBondContact O-CB 3.09Å; M32-F36 PolarHBondContact O-N 2.92Å |
| 33 | V | 76.6 | Confident | 78.5 | Confident | 90 Ų | 90 | 113 Ų | 113 | 55% | 0.545 | 55% | 0.546 | S | S | . | . | H | α-helix | trans | -64.5 | -38.5 | 176.5 | 169.4 | 0 | 0 | 0 | 0 | 111.5 | Q29 K31 L37 | Q29-V33 VanDerWaalsContact O-CB 3.31Å; Q29-V33 WeakPolarHBondContact O-CB 3.39Å; Q29-V33 WeakPolarHBondContact O-CG2 3.44Å; Q29-V33 PolarHBondContact O-N 3.48Å; K31-V33 VanDerWaalsContact C-N 3.32Å; K31-V33 PolarHBondContact O-N 2.91Å; V33-L37 WeakPolarHBondContact O-CB 3.26Å; V33-L37 PolarHBondContact O-N 2.82Å |
| 34 | R | 79.6 | Confident | 77.8 | Confident | 197 Ų | 197 | 112.2 Ų | 112.2 | 74% | 0.743 | 54% | 0.541 | S | S | * | . | H | α-helix | trans | -70.1 | -45.3 | 178.2 | -77 | 179.1 | 175.8 | -155.6 | -1.7 | 112.4 | R30 K31 M32 L37 A38 | R30-R34 WeakPolarHBondContact O-CG 3.3Å; R30-R34 PolarHBondContact O-N 2.81Å; K31-R34 PolarHBondContact O-N 2.77Å; K31-R34 VanDerWaalsContact O-N 3.13Å; M32-R34 VanDerWaalsContact C-N 3.34Å; M32-R34 PolarHBondContact O-N 3.49Å; R34-L37 PolarHBondContact O-N 2.89Å; R34-A38 WeakPolarHBondContact O-CB 3.09Å; R34-A38 PolarHBondContact O-N 2.85Å |
| 35 | E | 83.9 | Confident | 77.4 | Confident | 132 Ų | 132 | 111 Ų | 111 | 62% | 0.617 | 54% | 0.537 | S | S | * | . | H | α-helix | trans | -65.6 | -46.1 | 177.7 | -72.5 | 170.5 | -170.4 | 0 | 0 | 110.8 | K31 L37 A38 E39 | K31-E35 PolarHBondContact O-N 3.23Å; E35-L37 PolarHBondContact O-N 3.45Å; E35-A38 PolarHBondContact O-N 3.38Å; E35-E39 WeakPolarHBondContact O-CB 3.04Å; E35-E39 PolarHBondContact O-N 2.81Å |
| 36 | F | 76.8 | Confident | 76.8 | Confident | 140 Ų | 140 | 112.8 Ų | 112.8 | 61% | 0.614 | 55% | 0.547 | S | S | * | . | H | α-helix | trans | -59.4 | -45.5 | 174.5 | 177 | -98.8 | 0 | 0 | 0 | 112.1 | M32 A38 E39 F40 | M32-F36 WeakPolarHBondContact O-CB 3.09Å; M32-F36 PolarHBondContact O-N 2.92Å; F36-A38 VanDerWaalsContact C-N 3.34Å; F36-A38 PolarHBondContact O-N 2.96Å; F36-E39 PolarHBondContact O-N 3.42Å; F36-F40 WeakPolarHBondContact O-CB 3.33Å; F36-F40 PolarHBondContact O-N 3.21Å |
| 37 | L | 81.4 | Confident | 76 | Confident | 91 Ų | 91 | 115.1 Ų | 115.1 | 48% | 0.476 | 56% | 0.56 | S | S | . | * | H | α-helix | trans | -65.2 | -39.2 | 178.3 | -177.1 | 63 | 0 | 0 | 0 | 111.3 | V33 R34 E35 M41 | V33-L37 WeakPolarHBondContact O-CB 3.26Å; V33-L37 PolarHBondContact O-N 2.82Å; R34-L37 PolarHBondContact O-N 2.89Å; E35-L37 PolarHBondContact O-N 3.45Å; L37-M41 HydrophobicContact CD1-CG 4.09Å; L37-M41 HydrophobicContact CG-CG 4.28Å; L37-M41 VanDerWaalsContact O-CB 3.26Å; L37-M41 WeakPolarHBondContact O-CB 3.15Å; L37-M41 WeakPolarHBondContact O-CG 3.23Å; L37-M41 PolarHBondContact O-N 3.46Å |
| 38 | A | 84.4 | Confident | 75 | Confident | 53 Ų | 53 | 118.4 Ų | 118.4 | 44% | 0.438 | 57% | 0.566 | S | S | . | * | H | α-helix | trans | -66 | -43.4 | 176.9 | 0 | 0 | 0 | 0 | 0 | 112 | R34 E35 F36 S42 | R34-A38 WeakPolarHBondContact O-CB 3.09Å; R34-A38 PolarHBondContact O-N 2.85Å; E35-A38 PolarHBondContact O-N 3.38Å; F36-A38 VanDerWaalsContact C-N 3.34Å; F36-A38 PolarHBondContact O-N 2.96Å; A38-S42 WeakPolarHBondContact O-CB 3.19Å; A38-S42 PolarHBondContact O-N 3.41Å; A38-S42 PolarHBondContact O-OG 2.95Å |
| 39 | E | 81.4 | Confident | 74.2 | Confident | 136 Ų | 136 | 120.7 Ų | 120.7 | 64% | 0.636 | 57% | 0.574 | S | S | * | * | H | α-helix | trans | -65.8 | -46.3 | 176.8 | -170.2 | 169.3 | -174 | 0 | 0 | 110.9 | E35 F36 M41 S42 T43 | E35-E39 WeakPolarHBondContact O-CB 3.04Å; E35-E39 PolarHBondContact O-N 2.81Å; F36-E39 PolarHBondContact O-N 3.42Å; E39-M41 PolarHBondContact O-N 3.48Å; E39-S42 PolarHBondContact O-N 2.82Å; E39-T43 PolarHBondContact O-N 2.84Å; E39-T43 PolarHBondContact O-OG1 3.47Å; E39-T43 VanDerWaalsContact O-OG1 3.14Å |
| 40 | F | 76.7 | Confident | 73.1 | Confident | 118 Ų | 118 | 116.5 Ų | 116.5 | 52% | 0.518 | 57% | 0.566 | S | S | . | * | H | α-helix | trans | -60.2 | -46.4 | 174.9 | -177.3 | -96.1 | 0 | 0 | 0 | 112.2 | F36 S42 T43 Y44 | F36-F40 WeakPolarHBondContact O-CB 3.33Å; F36-F40 PolarHBondContact O-N 3.21Å; F40-S42 VanDerWaalsContact C-N 3.32Å; F40-S42 PolarHBondContact O-N 3.14Å; F40-T43 PolarHBondContact O-N 2.91Å; F40-Y44 VanDerWaalsContact O-CB 3.23Å; F40-Y44 WeakPolarHBondContact O-CB 3.12Å; F40-Y44 PolarHBondContact O-N 3.43Å |
| 41 | M | 79.8 | Confident | 71.8 | Confident | 110 Ų | 110 | 115.3 Ų | 115.3 | 54% | 0.542 | 57% | 0.571 | S | S | . | * | H | α-helix | trans | -63.8 | -38.3 | 176.4 | -71.2 | -126.9 | -56.2 | 0 | 0 | 111.4 | L37 E39 Y44 V45 | L37-M41 HydrophobicContact CD1-CG 4.09Å; L37-M41 HydrophobicContact CG-CG 4.28Å; L37-M41 VanDerWaalsContact O-CB 3.26Å; L37-M41 WeakPolarHBondContact O-CB 3.15Å; L37-M41 WeakPolarHBondContact O-CG 3.23Å; L37-M41 PolarHBondContact O-N 3.46Å; E39-M41 PolarHBondContact O-N 3.48Å; M41-Y44 PolarHBondContact O-N 2.89Å; M41-V45 WeakPolarHBondContact O-CB 3.14Å; M41-V45 WeakPolarHBondContact O-CG2 3.1Å; M41-V45 PolarHBondContact O-N 2.72Å |
| 42 | S | 74.8 | Confident | 70.7 | Confident | 78 Ų | 78 | 116.5 Ų | 116.5 | 55% | 0.545 | 58% | 0.584 | S | S | . | * | H | α-helix | trans | -65.9 | -42.1 | 178.3 | -58.6 | 0 | 0 | 0 | 0 | 111.6 | A38 E39 F40 M46 | A38-S42 WeakPolarHBondContact O-CB 3.19Å; A38-S42 PolarHBondContact O-N 3.41Å; A38-S42 PolarHBondContact O-OG 2.95Å; E39-S42 PolarHBondContact O-N 2.82Å; F40-S42 VanDerWaalsContact C-N 3.32Å; F40-S42 PolarHBondContact O-N 3.14Å; S42-M46 WeakPolarHBondContact O-CB 3.34Å; S42-M46 PolarHBondContact O-N 3.34Å |
| 43 | T | 72.6 | Confident | 69.4 | Low | 85 Ų | 85 | 121.4 Ų | 121.4 | 52% | 0.521 | 60% | 0.596 | S | S | . | * | H | α-helix | trans | -68.3 | -42.7 | 174.1 | -52.4 | 0 | 0 | 0 | 0 | 111.9 | E39 F40 M46 M47 | E39-T43 PolarHBondContact O-N 2.84Å; E39-T43 PolarHBondContact O-OG1 3.47Å; E39-T43 VanDerWaalsContact O-OG1 3.14Å; F40-T43 PolarHBondContact O-N 2.91Å; T43-M46 PolarHBondContact O-N 3.24Å; T43-M47 WeakPolarHBondContact O-CB 3.23Å; T43-M47 PolarHBondContact O-N 2.73Å |
| 44 | Y | 70 | Confident | 67.9 | Low | 120 Ų | 120 | 127.6 Ų | 127.6 | 47% | 0.471 | 62% | 0.616 | S | S | . | * | H | α-helix | trans | -64.5 | -42.6 | 178.6 | -178.7 | -99.4 | 0 | 0 | 0 | 111.9 | F40 M41 M47 R48 | F40-Y44 VanDerWaalsContact O-CB 3.23Å; F40-Y44 WeakPolarHBondContact O-CB 3.12Å; F40-Y44 PolarHBondContact O-N 3.43Å; M41-Y44 PolarHBondContact O-N 2.89Å; Y44-M47 PolarHBondContact O-N 3.2Å; Y44-R48 WeakPolarHBondContact O-CB 3.19Å; Y44-R48 PolarHBondContact O-N 2.85Å |
| 45 | V | 69.9 | Low | 66.3 | Low | 58 Ų | 58 | 121.5 Ų | 121.5 | 35% | 0.352 | 61% | 0.614 | S | S | . | * | H | α-helix | trans | -66.1 | -46 | 175.1 | 169.7 | 0 | 0 | 0 | 0 | 110.3 | M41 M47 R48 E49 | M41-V45 WeakPolarHBondContact O-CB 3.14Å; M41-V45 WeakPolarHBondContact O-CG2 3.1Å; M41-V45 PolarHBondContact O-N 2.72Å; V45-M47 VanDerWaalsContact C-N 3.28Å; V45-M47 PolarHBondContact O-N 3.49Å; V45-R48 PolarHBondContact O-N 3.32Å; V45-E49 HydrophobicContact CG1-CG 3.99Å; V45-E49 WeakPolarHBondContact CG1-OE1 3.21Å; V45-E49 WeakPolarHBondContact CG1-OE2 3.49Å; V45-E49 VanDerWaalsContact O-CB 3.23Å; V45-E49 WeakPolarHBondContact O-CB 3.4Å; V45-E49 PolarHBondContact O-N 2.84Å |
| 46 | M | 66.4 | Low | 64.6 | Low | 151 Ų | 151 | 120.7 Ų | 120.7 | 74% | 0.744 | 62% | 0.618 | S | S | * | * | H | α-helix | trans | -59.2 | -38.7 | 174.1 | -176.5 | -179.6 | -69.7 | 0 | 0 | 112.6 | S42 T43 G50 | S42-M46 WeakPolarHBondContact O-CB 3.34Å; S42-M46 PolarHBondContact O-N 3.34Å; T43-M46 PolarHBondContact O-N 3.24Å; M46-G50 PolarHBondContact O-N 3.42Å |
| 47 | M | 65.6 | Low | 63.4 | Low | 145 Ų | 145 | 116.8 Ų | 116.8 | 71% | 0.714 | 62% | 0.617 | S | S | * | * | H | α-helix | trans | -73.6 | -33.6 | 178.7 | -165.5 | 171.7 | -170.9 | 0 | 0 | 112.1 | T43 Y44 V45 | T43-M47 WeakPolarHBondContact O-CB 3.23Å; T43-M47 PolarHBondContact O-N 2.73Å; Y44-M47 PolarHBondContact O-N 3.2Å; V45-M47 VanDerWaalsContact C-N 3.28Å; V45-M47 PolarHBondContact O-N 3.49Å |
| 48 | R | 57.6 | Low | 61.9 | Low | 164 Ų | 164 | 120.5 Ų | 120.5 | 62% | 0.619 | 63% | 0.632 | S | S | * | * | H | α-helix | trans | -91.6 | -33 | -176.6 | -160.5 | -171.9 | -178.7 | -156.9 | -1.2 | 113.8 | Y44 V45 D51 | Y44-R48 WeakPolarHBondContact O-CB 3.19Å; Y44-R48 PolarHBondContact O-N 2.85Å; V45-R48 PolarHBondContact O-N 3.32Å; R48-D51 PolarHBondContact O-N 3.39Å |
| 49 | E | 55 | Low | 60.3 | Low | 139 Ų | 139 | 125.7 Ų | 125.7 | 65% | 0.65 | 65% | 0.647 | S | S | * | * | H | α-helix | trans | -73.8 | -15.7 | 168.3 | -73 | 174.4 | 167 | 0 | 0 | 111.6 | V45 D51 | V45-E49 HydrophobicContact CG1-CG 3.99Å; V45-E49 WeakPolarHBondContact CG1-OE1 3.21Å; V45-E49 WeakPolarHBondContact CG1-OE2 3.49Å; V45-E49 VanDerWaalsContact O-CB 3.23Å; V45-E49 WeakPolarHBondContact O-CB 3.4Å; V45-E49 PolarHBondContact O-N 2.84Å; E49-D51 VanDerWaalsContact C-N 3.31Å |
| 50 | G | 52.4 | Low | 58.9 | Low | 42 Ų | 42 | 120.9 Ų | 120.9 | 43% | 0.433 | 63% | 0.628 | S | S | . | * | G | 310 helix | trans | -74.8 | -14.7 | 168.9 | 0 | 0 | 0 | 0 | 0 | 114.6 | M46 D52 | M46-G50 PolarHBondContact O-N 3.42Å; G50-D52 VanDerWaalsContact C-N 3.31Å; G50-D52 PolarHBondContact O-N 2.94Å |
| 51 | D | 52 | Low | 57.8 | Low | 132 Ų | 132 | 119.6 Ų | 119.6 | 71% | 0.706 | 63% | 0.63 | S | S | * | * | G | 310 helix | trans | -84.4 | -3 | -179 | -71.7 | -42.8 | 0 | 0 | 0 | 113.5 | R48 E49 | R48-D51 PolarHBondContact O-N 3.39Å; E49-D51 VanDerWaalsContact C-N 3.31Å |
| 52 | D | 53.4 | Low | 56.6 | Low | 150 Ų | 150 | 119 Ų | 119 | 80% | 0.802 | 64% | 0.636 | S | S | * | * | G | 310 helix | trans | -115 | 11.3 | 176.5 | -84.5 | -34.5 | 0 | 0 | 0 | 114.6 | G50 | G50-D52 VanDerWaalsContact C-N 3.31Å; G50-D52 PolarHBondContact O-N 2.94Å |
| 53 | W | 47 | Very low | 55.6 | Low | 219 Ų | 219 | 120.7 Ų | 120.7 | 83% | 0.83 | 64% | 0.638 | S | S | * | * | trans | -114.5 | 101.8 | 172.7 | -87.7 | 96.1 | 0 | 0 | 0 | 112.8 | G55 | W53-G55 PolarHBondContact O-N 2.88Š| ||
| 54 | F | 45.8 | Very low | 54.9 | Low | 220 Ų | 220 | 124.3 Ų | 124.3 | 97% | 0.965 | 64% | 0.642 | S | S | * | * | trans | -43.3 | 93.1 | 162.8 | -150.4 | -97.2 | 0 | 0 | 0 | 111.6 | ||||
| 55 | G | 45.5 | Very low | 54.4 | Low | 68 Ų | 68 | 120.1 Ų | 120.1 | 70% | 0.701 | 64% | 0.636 | S | S | * | * | trans | -170.2 | 9.3 | 179 | 0 | 0 | 0 | 0 | 0 | 115.7 | W53 G57 | W53-G55 PolarHBondContact O-N 2.88Å; G55-G57 VanDerWaalsContact C-N 3.27Å; G55-G57 PolarHBondContact O-N 3.22Å | ||
| 56 | V | 47.8 | Very low | 53.9 | Low | 116 Ų | 116 | 121.9 Ų | 121.9 | 70% | 0.703 | 64% | 0.643 | S | S | * | * | trans | -81.8 | 74.3 | 177.4 | -177.4 | 0 | 0 | 0 | 0 | 109.6 | S60 | V56-S60 VanDerWaalsContact CG1-OG 3.24Å; V56-S60 WeakPolarHBondContact CG1-OG 3.24Å | ||
| 57 | G | 51.1 | Low | 53.4 | Low | 57 Ų | 57 | 123.6 Ų | 123.6 | 59% | 0.588 | 64% | 0.641 | S | S | * | * | S | Bend | trans | -103.2 | -39.9 | 173.2 | 0 | 0 | 0 | 0 | 0 | 114.1 | G55 | G55-G57 VanDerWaalsContact C-N 3.27Å; G55-G57 PolarHBondContact O-N 3.22Å |
| 58 | E | 51.7 | Low | 53.1 | Low | 170 Ų | 170 | 124.2 Ų | 124.2 | 79% | 0.794 | 64% | 0.64 | S | S | * | * | S | Bend | trans | -123.2 | -37.7 | -168.4 | -78.5 | 177.5 | 103.3 | 0 | 0 | 114.3 | S60 T61 | E58-S60 VanDerWaalsContact C-N 3.33Å; E58-S60 PolarHBondContact O-N 3.36Å; E58-T61 PolarHBondContact O-N 3.03Å; E58-T61 PolarHBondContact O-OG1 3.47Å |
| 59 | E | 49.4 | Very low | 53.5 | Low | 161 Ų | 161 | 119.8 Ų | 119.8 | 75% | 0.752 | 63% | 0.631 | S | S | * | * | H | α-helix | trans | -71.9 | -25.6 | -172 | -145.8 | 173.5 | 143.8 | 0 | 0 | 114 | T61 | E59-T61 VanDerWaalsContact C-N 3.25Å; E59-T61 PolarHBondContact O-N 2.98Å |
| 60 | S | 52.4 | Low | 53.9 | Low | 35 Ų | 35 | 118.6 Ų | 118.6 | 25% | 0.245 | 63% | 0.625 | C | S | . | * | H | α-helix | trans | -77.6 | -5.9 | 178.4 | 69 | 0 | 0 | 0 | 0 | 114.1 | V56 E58 R64 | V56-S60 VanDerWaalsContact CG1-OG 3.24Å; V56-S60 WeakPolarHBondContact CG1-OG 3.24Å; E58-S60 VanDerWaalsContact C-N 3.33Å; E58-S60 PolarHBondContact O-N 3.36Å; S60-R64 WeakPolarHBondContact O-CB 3.44Å; S60-R64 PolarHBondContact O-NE 3.11Å |
| 61 | T | 53.3 | Low | 54.3 | Low | 91 Ų | 91 | 119.6 Ų | 119.6 | 56% | 0.558 | 63% | 0.626 | S | S | * | * | H | α-helix | trans | -85.8 | -40.6 | 172.2 | 61.1 | 0 | 0 | 0 | 0 | 111.8 | E58 E59 R64 G65 | E58-T61 PolarHBondContact O-N 3.03Å; E58-T61 PolarHBondContact O-OG1 3.47Å; E59-T61 VanDerWaalsContact C-N 3.25Å; E59-T61 PolarHBondContact O-N 2.98Å; T61-R64 PolarHBondContact O-N 2.98Å; T61-G65 PolarHBondContact O-N 3.42Å |
| 62 | C | 54.5 | Low | 54.9 | Low | 97 Ų | 97 | 115 Ų | 115 | 66% | 0.655 | 61% | 0.61 | S | S | * | * | H | α-helix | trans | -63.9 | -49.4 | 177.9 | -98.4 | 0 | 0 | 0 | 0 | 112.3 | R64 G65 L66 | C62-R64 VanDerWaalsContact C-N 3.33Å; C62-R64 PolarHBondContact O-N 3.43Å; C62-G65 PolarHBondContact O-N 2.88Å; C62-L66 WeakPolarHBondContact O-CB 3.42Å; C62-L66 PolarHBondContact O-N 3.46Å |
| 63 | L | 54.9 | Low | 55.3 | Low | 114 Ų | 114 | 115.4 Ų | 115.4 | 60% | 0.597 | 60% | 0.6 | S | S | * | * | H | α-helix | trans | -66.5 | -35.5 | 178.6 | -69.1 | 174.5 | 0 | 0 | 0 | 112.2 | L66 W67 | L63-L66 PolarHBondContact O-N 3.38Å; L63-W67 WeakPolarHBondContact O-CB 3.36Å; L63-W67 PolarHBondContact O-N 3.42Å |
| 64 | R | 57.8 | Low | 55.9 | Low | 161 Ų | 161 | 109.4 Ų | 109.4 | 61% | 0.608 | 58% | 0.584 | S | S | * | * | H | α-helix | trans | -69.9 | -33.6 | 175.6 | -161 | -173.6 | -51 | -104.7 | 6.4 | 112 | S60 T61 C62 K68 | S60-R64 WeakPolarHBondContact O-CB 3.44Å; S60-R64 PolarHBondContact O-NE 3.11Å; T61-R64 PolarHBondContact O-N 2.98Å; C62-R64 VanDerWaalsContact C-N 3.33Å; C62-R64 PolarHBondContact O-N 3.43Å; R64-K68 WeakPolarHBondContact O-CB 3.21Å; R64-K68 PolarHBondContact O-N 3.26Å; R64-K68 VanDerWaalsContact O-N 3.11Å |
| 65 | G | 58.8 | Low | 56.5 | Low | 33 Ų | 33 | 102.4 Ų | 102.4 | 34% | 0.34 | 56% | 0.562 | S | S | . | * | H | α-helix | trans | -70.1 | -40.6 | 172.4 | 0 | 0 | 0 | 0 | 0 | 112.8 | T61 C62 K68 T69 | T61-G65 PolarHBondContact O-N 3.42Å; C62-G65 PolarHBondContact O-N 2.88Å; G65-K68 PolarHBondContact O-N 3.44Å; G65-T69 WeakPolarHBondContact O-CB 3.42Å; G65-T69 PolarHBondContact O-N 3.41Å; G65-T69 PolarHBondContact O-OG1 3.45Å |
| 66 | L | 60 | Low | 57.2 | Low | 95 Ų | 95 | 104 Ų | 104 | 50% | 0.497 | 55% | 0.551 | S | S | . | * | H | α-helix | trans | -65.1 | -47.1 | 176.1 | -171.9 | 64.6 | 0 | 0 | 0 | 111 | C62 L63 K68 T69 E70 | C62-L66 WeakPolarHBondContact O-CB 3.42Å; C62-L66 PolarHBondContact O-N 3.46Å; L63-L66 PolarHBondContact O-N 3.38Å; L66-K68 PolarHBondContact O-N 3.45Å; L66-T69 PolarHBondContact O-N 2.94Å; L66-T69 VanDerWaalsContact O-N 3.12Å; L66-E70 WeakPolarHBondContact O-CB 3.1Å; L66-E70 PolarHBondContact O-N 3.33Å |
| 67 | W | 55.3 | Low | 57.9 | Low | 187 Ų | 187 | 105.1 Ų | 105.1 | 71% | 0.708 | 55% | 0.548 | S | S | * | . | H | α-helix | trans | -59.4 | -42.7 | 175.2 | -175.3 | -99.5 | 0 | 0 | 0 | 112.6 | L63 T69 E70 S71 | L63-W67 WeakPolarHBondContact O-CB 3.36Å; L63-W67 PolarHBondContact O-N 3.42Å; W67-T69 VanDerWaalsContact C-N 3.34Å; W67-T69 PolarHBondContact O-N 3.26Å; W67-E70 PolarHBondContact O-N 3.43Å; W67-S71 WeakPolarHBondContact O-CB 3.42Å; W67-S71 PolarHBondContact O-N 3.43Å |
| 68 | K | 60.2 | Low | 58.3 | Low | 157 Ų | 157 | 109.1 Ų | 109.1 | 68% | 0.683 | 55% | 0.55 | S | S | * | . | H | α-helix | trans | -61.3 | -41.4 | 174 | -89 | -173.2 | 175.7 | -178.3 | 0 | 112.2 | R64 G65 L66 G72 | R64-K68 WeakPolarHBondContact O-CB 3.21Å; R64-K68 PolarHBondContact O-N 3.26Å; R64-K68 VanDerWaalsContact O-N 3.11Å; G65-K68 PolarHBondContact O-N 3.44Å; L66-K68 PolarHBondContact O-N 3.45Å; K68-G72 PolarHBondContact O-N 3.18Å |
| 69 | T | 65.6 | Low | 58.4 | Low | 71 Ų | 71 | 105.9 Ų | 105.9 | 44% | 0.436 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -69.4 | -41.4 | -179.8 | -54.4 | 0 | 0 | 0 | 0 | 111.5 | G65 L66 W67 G72 R73 | G65-T69 WeakPolarHBondContact O-CB 3.42Å; G65-T69 PolarHBondContact O-N 3.41Å; G65-T69 PolarHBondContact O-OG1 3.45Å; L66-T69 PolarHBondContact O-N 2.94Å; L66-T69 VanDerWaalsContact O-N 3.12Å; W67-T69 VanDerWaalsContact C-N 3.34Å; W67-T69 PolarHBondContact O-N 3.26Å; T69-G72 PolarHBondContact O-N 2.95Å; T69-R73 PolarHBondContact O-N 3.25Å |
| 70 | E | 63.7 | Low | 58.6 | Low | 114 Ų | 114 | 107.3 Ų | 107.3 | 53% | 0.533 | 53% | 0.534 | S | S | . | . | H | α-helix | trans | -70.4 | -42.3 | 179.4 | -150.5 | 175 | 125.1 | 0 | 0 | 111.7 | L66 W67 G72 R73 L74 | L66-E70 WeakPolarHBondContact O-CB 3.1Å; L66-E70 PolarHBondContact O-N 3.33Å; W67-E70 PolarHBondContact O-N 3.43Å; E70-G72 VanDerWaalsContact C-N 3.33Å; E70-G72 PolarHBondContact O-N 3.3Å; E70-R73 PolarHBondContact O-N 2.98Å; E70-L74 PolarHBondContact O-N 3.03Å |
| 71 | S | 59.9 | Low | 58.8 | Low | 63 Ų | 63 | 109.2 Ų | 109.2 | 44% | 0.441 | 55% | 0.552 | S | S | . | * | H | α-helix | trans | -64.1 | -36.5 | 173 | -170.5 | 0 | 0 | 0 | 0 | 112.4 | W67 L74 C75 | W67-S71 WeakPolarHBondContact O-CB 3.42Å; W67-S71 PolarHBondContact O-N 3.43Å; S71-L74 PolarHBondContact O-N 3.4Å; S71-C75 WeakPolarHBondContact O-CB 3.42Å; S71-C75 PolarHBondContact O-N 3.47Å |
| 72 | G | 65.1 | Low | 58.9 | Low | 36 Ų | 36 | 113.7 Ų | 113.7 | 37% | 0.371 | 56% | 0.564 | S | S | . | * | H | α-helix | trans | -64.7 | -41.6 | 174.2 | 0 | 0 | 0 | 0 | 0 | 112.7 | K68 T69 E70 C75 Q76 | K68-G72 PolarHBondContact O-N 3.18Å; T69-G72 PolarHBondContact O-N 2.95Å; E70-G72 VanDerWaalsContact C-N 3.33Å; E70-G72 PolarHBondContact O-N 3.3Å; G72-C75 PolarHBondContact O-N 3Å; G72-Q76 WeakPolarHBondContact O-CG 3.49Å; G72-Q76 PolarHBondContact O-N 3.44Å |
| 73 | R | 61.7 | Low | 58.9 | Low | 158 Ų | 158 | 119 Ų | 119 | 60% | 0.596 | 57% | 0.57 | S | S | * | * | H | α-helix | trans | -64.2 | -42.1 | 174.7 | -80.6 | -171.2 | -89.2 | -130.6 | 3.3 | 112.3 | T69 E70 Q76 Q77 | T69-R73 PolarHBondContact O-N 3.25Å; E70-R73 PolarHBondContact O-N 2.98Å; R73-Q76 PolarHBondContact O-N 2.95Å; R73-Q77 WeakPolarHBondContact O-CB 3.47Å; R73-Q77 PolarHBondContact O-N 3Å |
| 74 | L | 59.5 | Low | 58.6 | Low | 93 Ų | 93 | 127.5 Ų | 127.5 | 49% | 0.487 | 59% | 0.594 | S | S | . | * | H | α-helix | trans | -65 | -39.5 | 176.4 | -162.6 | 78.7 | 0 | 0 | 0 | 111.9 | E70 S71 Q77 K78 | E70-L74 PolarHBondContact O-N 3.03Å; S71-L74 PolarHBondContact O-N 3.4Å; L74-Q77 PolarHBondContact O-N 2.94Å; L74-K78 WeakPolarHBondContact O-CG 3.47Å; L74-K78 PolarHBondContact O-N 3.43Å |
| 75 | C | 58.8 | Low | 58.6 | Low | 74 Ų | 74 | 125.8 Ų | 125.8 | 50% | 0.5 | 59% | 0.593 | S | S | . | * | H | α-helix | trans | -65.2 | -44.8 | 177.1 | -167.7 | 0 | 0 | 0 | 0 | 111.9 | S71 G72 K78 M79 | S71-C75 WeakPolarHBondContact O-CB 3.42Å; S71-C75 PolarHBondContact O-N 3.47Å; G72-C75 PolarHBondContact O-N 3Å; C75-K78 PolarHBondContact O-N 2.96Å; C75-M79 PolarHBondContact O-N 3.03Å |
| 76 | Q | 60.4 | Low | 58.6 | Low | 102 Ų | 102 | 130.7 Ų | 130.7 | 48% | 0.477 | 61% | 0.607 | S | S | . | * | H | α-helix | trans | -58.8 | -50.7 | 173 | -73.6 | -76 | 19 | 0 | 0 | 110.7 | G72 R73 K78 M79 W80 | G72-Q76 WeakPolarHBondContact O-CG 3.49Å; G72-Q76 PolarHBondContact O-N 3.44Å; R73-Q76 PolarHBondContact O-N 2.95Å; Q76-K78 VanDerWaalsContact C-N 3.25Å; Q76-K78 PolarHBondContact O-N 2.85Å; Q76-M79 WeakPolarHBondContact O-CA 3.4Å; Q76-M79 WeakPolarHBondContact O-CB 3.41Å; Q76-M79 PolarHBondContact O-N 3.12Å; Q76-W80 PolarHBondContact O-N 3.45Å |
| 77 | Q | 62 | Low | 58.5 | Low | 138 Ų | 138 | 132.7 Ų | 132.7 | 65% | 0.645 | 61% | 0.613 | S | S | * | * | H | α-helix | trans | -57.1 | -38.8 | -178.8 | -159.6 | -179.5 | 93.1 | 0 | 0 | 112.4 | R73 L74 W80 A81 | R73-Q77 WeakPolarHBondContact O-CB 3.47Å; R73-Q77 PolarHBondContact O-N 3Å; L74-Q77 PolarHBondContact O-N 2.94Å; Q77-W80 PolarHBondContact O-N 2.97Å; Q77-A81 WeakPolarHBondContact O-CB 3.48Å; Q77-A81 PolarHBondContact O-N 2.87Å |
| 78 | K | 60 | Low | 58.7 | Low | 142 Ų | 142 | 129.5 Ų | 129.5 | 62% | 0.617 | 61% | 0.607 | S | S | * | * | H | α-helix | trans | -68.2 | -35.8 | 173.8 | -73.6 | -177.4 | 179 | -175.8 | 0 | 113.3 | L74 C75 Q76 K82 | L74-K78 WeakPolarHBondContact O-CG 3.47Å; L74-K78 PolarHBondContact O-N 3.43Å; C75-K78 PolarHBondContact O-N 2.96Å; Q76-K78 VanDerWaalsContact C-N 3.25Å; Q76-K78 PolarHBondContact O-N 2.85Å; K78-K82 WeakPolarHBondContact O-CB 3.47Å; K78-K82 PolarHBondContact O-N 2.79Å |
| 79 | M | 53 | Low | 58.6 | Low | 101 Ų | 101 | 127.8 Ų | 127.8 | 50% | 0.498 | 60% | 0.602 | S | S | . | * | H | α-helix | trans | -67.3 | -39.3 | 173.4 | -74.7 | -148.9 | -63.2 | 0 | 0 | 112.6 | C75 Q76 K82 R83 | C75-M79 PolarHBondContact O-N 3.03Å; Q76-M79 WeakPolarHBondContact O-CA 3.4Å; Q76-M79 WeakPolarHBondContact O-CB 3.41Å; Q76-M79 PolarHBondContact O-N 3.12Å; M79-K82 PolarHBondContact O-N 3.24Å; M79-R83 PolarHBondContact O-N 2.74Å |
| 80 | W | 53.4 | Low | 58.1 | Low | 191 Ų | 191 | 131.5 Ų | 131.5 | 72% | 0.723 | 61% | 0.614 | S | S | * | * | H | α-helix | trans | -67.9 | -37.2 | 176 | -74 | 98.3 | 0 | 0 | 0 | 112.3 | Q76 Q77 K82 | Q76-W80 PolarHBondContact O-N 3.45Å; Q77-W80 PolarHBondContact O-N 2.97Å; W80-K82 VanDerWaalsContact C-N 3.32Å; W80-K82 PolarHBondContact O-N 2.85Å |
| 81 | A | 56.3 | Low | 57.7 | Low | 75 Ų | 75 | 132.8 Ų | 132.8 | 62% | 0.62 | 62% | 0.619 | S | S | * | * | H | α-helix | trans | -69.9 | -25.4 | 176 | 0 | 0 | 0 | 0 | 0 | 113.7 | Q77 | Q77-A81 WeakPolarHBondContact O-CB 3.48Å; Q77-A81 PolarHBondContact O-N 2.87Å |
| 82 | K | 56.8 | Low | 57.6 | Low | 186 Ų | 186 | 138.2 Ų | 138.2 | 81% | 0.809 | 63% | 0.633 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -91.1 | -4.3 | -179.2 | -165.6 | 150.1 | -174.7 | 173 | 0 | 114.2 | K78 M79 W80 | K78-K82 WeakPolarHBondContact O-CB 3.47Å; K78-K82 PolarHBondContact O-N 2.79Å; M79-K82 PolarHBondContact O-N 3.24Å; W80-K82 VanDerWaalsContact C-N 3.32Å; W80-K82 PolarHBondContact O-N 2.85Å |
| 83 | R | 54.2 | Low | 57 | Low | 208 Ų | 208 | 146.7 Ų | 146.7 | 79% | 0.785 | 66% | 0.655 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -104.3 | 13.8 | 179 | -155.3 | -174.9 | -75.1 | -175.8 | -4.3 | 112.9 | M79 | M79-R83 PolarHBondContact O-N 2.74Š|
| 84 | R | 47.3 | Very low | 56.5 | Low | 292 Ų | 292 | 145.6 Ų | 145.6 | 100% | 1.102 | 66% | 0.66 | S | S | * | * | trans | -122.4 | 0 | 174.1 | -163 | -174.4 | -116.9 | 156.5 | -2.6 | 108.5 |
Retrieved 84 of 84 residues in 14.1 ms
(Link to these results)