| Site | Residue | pLDDT | pLDDT confidence | pLDDT10 | pLDDT10 confidence | SASA | SASA [Ų] | SASA10 | SASA10 [Ų] | RSA | RSA unformatted | RSA10 | RSA10 unformatted | Surface | Surface10 (not used) | Disorder (not used) | Disorder | Sec. str. | Secondary structure | Isomer | Phi (φ) | Psi (ψ) | Omega (ω) | Chi 1 (χ1) | Chi 2 (χ2) | Chi 3 (χ3) | Chi 4 (χ4) | Chi 5 (χ5) | Tau (τ) | Contacts (colored by PAE) | Contact details |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 1 | M | 39.1 | Very low | 39.1 | Very low | 248 Ų | 248 | 146.6 Ų | 146.6 | 100% | 1.222 | 87% | 0.87 | S | S | * | * | 0 | 116.6 | 0 | -65.1 | 178 | 75.6 | 0 | 0 | 107.3 | |||||
| 2 | S | 41.4 | Very low | 39 | Very low | 121 Ų | 121 | 144 Ų | 144 | 85% | 0.846 | 87% | 0.865 | S | S | * | * | trans | -100 | 142.9 | -176 | -53.9 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 3 | R | 37.5 | Very low | 38.7 | Very low | 251 Ų | 251 | 137.6 Ų | 137.6 | 95% | 0.947 | 85% | 0.846 | S | S | * | * | trans | 151.5 | 147.6 | 152.3 | -91.4 | 174.7 | 160.7 | 147.3 | -2.6 | 109.3 | ||||
| 4 | A | 37.6 | Very low | 38.3 | Very low | 90 Ų | 90 | 133.5 Ų | 133.5 | 74% | 0.744 | 85% | 0.845 | S | S | * | * | cis | -171.8 | 144.9 | -17.9 | 0 | 0 | 0 | 0 | 0 | 105.4 | ||||
| 5 | A | 46.1 | Very low | 38.3 | Very low | 104 Ų | 104 | 137.4 Ų | 137.4 | 86% | 0.86 | 85% | 0.848 | S | S | * | * | trans | -63.2 | 138.2 | 176.3 | 0 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 6 | G | 34.3 | Very low | 38.3 | Very low | 78 Ų | 78 | 137.4 Ų | 137.4 | 80% | 0.804 | 85% | 0.848 | S | S | * | * | trans | -114.2 | 90.5 | 169.9 | 0 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 7 | S | 38.9 | Very low | 38.7 | Very low | 117 Ų | 117 | 134.5 Ų | 134.5 | 82% | 0.818 | 84% | 0.841 | S | S | * | * | trans | -73.1 | 128.5 | 164 | -66.6 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 8 | R | 40.4 | Very low | 39.3 | Very low | 246 Ų | 246 | 132.6 Ų | 132.6 | 93% | 0.928 | 84% | 0.84 | S | S | * | * | trans | -104.3 | 116.6 | 164 | -71.6 | -173.9 | 178.3 | -162.6 | 0.1 | 108.7 | ||||
| 9 | P | 41.3 | Very low | 40.1 | Very low | 109 Ų | 109 | 129.4 Ų | 129.4 | 71% | 0.708 | 83% | 0.826 | S | S | * | * | trans | -78.9 | 131.3 | 163.7 | 4.2 | 11.9 | 0 | 0 | 0 | 109.3 | ||||
| 10 | G | 38.3 | Very low | 41.6 | Very low | 77 Ų | 77 | 125.5 Ų | 125.5 | 79% | 0.794 | 80% | 0.803 | S | S | * | * | trans | -65.8 | 129.2 | 163.1 | 0 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 11 | L | 35.3 | Very low | 42.5 | Very low | 172 Ų | 172 | 124.3 Ų | 124.3 | 90% | 0.901 | 80% | 0.796 | S | S | * | * | trans | -90.2 | 111.5 | 170.7 | -116.5 | 78.9 | 0 | 0 | 0 | 108.9 | ||||
| 12 | S | 38 | Very low | 43.4 | Very low | 115 Ų | 115 | 118 Ų | 118 | 80% | 0.804 | 77% | 0.767 | S | S | * | * | trans | -75.4 | 163.3 | 168.3 | 62.9 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 13 | G | 34.5 | Very low | 44.5 | Very low | 61 Ų | 61 | 117.8 Ų | 117.8 | 63% | 0.629 | 76% | 0.755 | S | S | * | * | trans | 90.4 | 86.3 | 147.5 | 0 | 0 | 0 | 0 | 0 | 115.1 | Q15 | G13-Q15 PolarHBondContact O-N 3.16Š| ||
| 14 | G | 34.1 | Very low | 45.8 | Very low | 80 Ų | 80 | 108.1 Ų | 108.1 | 83% | 0.825 | 73% | 0.727 | S | S | * | * | trans | -58 | 102.7 | 154.1 | 0 | 0 | 0 | 0 | 0 | 108.8 | V16 | G14-V16 PolarHBondContact O-N 2.95Š| ||
| 15 | Q | 37.6 | Very low | 47.2 | Very low | 192 Ų | 192 | 106.9 Ų | 106.9 | 90% | 0.897 | 71% | 0.707 | S | S | * | * | trans | -64.5 | 100.6 | 172.7 | -75.6 | 177 | 73.5 | 0 | 0 | 108.1 | G13 A17 | G13-Q15 PolarHBondContact O-N 3.16Å; Q15-A17 PolarHBondContact O-N 3.04Å; Q15-A17 VanDerWaalsContact O-N 3.16Å | ||
| 16 | V | 38.6 | Very low | 48.4 | Very low | 138 Ų | 138 | 107.8 Ų | 107.8 | 84% | 0.836 | 70% | 0.697 | S | S | * | * | trans | -66.9 | 109.6 | 158.9 | -178.9 | 0 | 0 | 0 | 0 | 105 | G14 A18 | G14-V16 PolarHBondContact O-N 2.95Å; V16-A18 PolarHBondContact O-N 3.47Å | ||
| 17 | A | 44.6 | Very low | 50.2 | Low | 88 Ų | 88 | 109.6 Ų | 109.6 | 73% | 0.727 | 69% | 0.687 | S | S | * | * | trans | -50.3 | 109.2 | 178.8 | 0 | 0 | 0 | 0 | 0 | 109.1 | Q15 A19 | Q15-A17 PolarHBondContact O-N 3.04Å; Q15-A17 VanDerWaalsContact O-N 3.16Å; A17-A19 VanDerWaalsContact C-N 3.26Å; A17-A19 PolarHBondContact O-N 3.43Å | ||
| 18 | A | 49.9 | Very low | 51.6 | Low | 100 Ų | 100 | 105.5 Ų | 105.5 | 83% | 0.826 | 66% | 0.656 | S | S | * | * | trans | -65.7 | 92.4 | 172.3 | 0 | 0 | 0 | 0 | 0 | 107.1 | V16 S20 | V16-A18 PolarHBondContact O-N 3.47Å; A18-S20 PolarHBondContact O-N 2.89Å | ||
| 19 | A | 55.3 | Low | 53 | Low | 71 Ų | 71 | 99.6 Ų | 99.6 | 59% | 0.587 | 64% | 0.642 | S | S | * | * | trans | -57.3 | 117 | 171.3 | 0 | 0 | 0 | 0 | 0 | 107.1 | A17 | A17-A19 VanDerWaalsContact C-N 3.26Å; A17-A19 PolarHBondContact O-N 3.43Å | ||
| 20 | S | 68.8 | Low | 54.2 | Low | 51 Ų | 51 | 97.3 Ų | 97.3 | 36% | 0.357 | 63% | 0.633 | S | S | . | * | trans | -51.1 | 133.2 | -177 | -179.7 | 0 | 0 | 0 | 0 | 109.8 | A18 L22 L23 S24 | A18-S20 PolarHBondContact O-N 2.89Å; S20-L22 PolarHBondContact O-N 3.43Å; S20-L23 WeakPolarHBondContact O-CB 3.41Å; S20-L23 PolarHBondContact O-N 3.39Å; S20-S24 PolarHBondContact O-N 2.84Å | ||
| 21 | P | 61.9 | Low | 55.3 | Low | 102 Ų | 102 | 95.9 Ų | 95.9 | 66% | 0.662 | 61% | 0.61 | S | S | * | * | H | α-helix | trans | -56.4 | -23.4 | -179.3 | 21.8 | -33 | 0 | 0 | 0 | 112.6 | L25 | P21-L25 WeakPolarHBondContact O-CB 3.37Å; P21-L25 PolarHBondContact O-N 3.33Å |
| 22 | L | 57.7 | Low | 56.4 | Low | 114 Ų | 114 | 91.6 Ų | 91.6 | 60% | 0.597 | 58% | 0.584 | S | S | * | * | H | α-helix | trans | -66.9 | -39.6 | 172.9 | -64.4 | 174.4 | 0 | 0 | 0 | 112.9 | S20 L25 L26 | S20-L22 PolarHBondContact O-N 3.43Å; L22-L25 PolarHBondContact O-N 2.96Å; L22-L26 WeakPolarHBondContact O-CB 3.39Å; L22-L26 WeakPolarHBondContact O-CD1 3.4Å; L22-L26 PolarHBondContact O-N 2.84Å |
| 23 | L | 64.7 | Low | 57.3 | Low | 117 Ų | 117 | 89.3 Ų | 89.3 | 61% | 0.613 | 57% | 0.573 | S | S | * | * | H | α-helix | trans | -65.9 | -41.5 | 176.2 | -85.6 | 160.1 | 0 | 0 | 0 | 111 | S20 L25 L26 L27 | S20-L23 WeakPolarHBondContact O-CB 3.41Å; S20-L23 PolarHBondContact O-N 3.39Å; L23-L25 VanDerWaalsContact C-N 3.33Å; L23-L25 PolarHBondContact O-N 3.49Å; L23-L26 PolarHBondContact O-N 2.92Å; L23-L27 WeakPolarHBondContact O-CB 3.04Å; L23-L27 PolarHBondContact O-N 3.42Å |
| 24 | S | 64.9 | Low | 58.2 | Low | 49 Ų | 49 | 92.8 Ų | 92.8 | 34% | 0.343 | 58% | 0.576 | S | S | . | * | H | α-helix | trans | -63.6 | -39 | 175 | -56.9 | 0 | 0 | 0 | 0 | 111.8 | S20 L27 L28 | S20-S24 PolarHBondContact O-N 2.84Å; S24-L27 PolarHBondContact O-N 3.12Å; S24-L28 PolarHBondContact O-N 3.42Å |
| 25 | L | 66.6 | Low | 59.2 | Low | 64 Ų | 64 | 92.6 Ų | 92.6 | 34% | 0.335 | 57% | 0.567 | S | S | . | * | H | α-helix | trans | -67.7 | -43.9 | 176 | -179.1 | 59 | 0 | 0 | 0 | 112.8 | P21 L22 L23 L27 L28 L29 L78 | P21-L25 WeakPolarHBondContact O-CB 3.37Å; P21-L25 PolarHBondContact O-N 3.33Å; L22-L25 PolarHBondContact O-N 2.96Å; L23-L25 VanDerWaalsContact C-N 3.33Å; L23-L25 PolarHBondContact O-N 3.49Å; L25-L27 VanDerWaalsContact C-N 3.27Å; L25-L27 PolarHBondContact O-N 2.98Å; L25-L28 VanDerWaalsContact O-CB 3.32Å; L25-L28 WeakPolarHBondContact O-CB 3.41Å; L25-L28 PolarHBondContact O-N 3.07Å; L25-L29 HydrophobicContact CD1-CD1 4.18Å; L25-L29 PolarHBondContact O-N 3.47Å; L25-L78 HydrophobicContact CD1-CD1 3.55Å; L25-L78 HydrophobicContact CD2-CD1 4.05Å; L25-L78 HydrophobicContact CG-CD1 4.43Å |
| 26 | L | 72 | Confident | 59.9 | Low | 122 Ų | 122 | 88.7 Ų | 88.7 | 64% | 0.639 | 56% | 0.56 | S | S | * | * | H | α-helix | trans | -59.4 | -40.8 | 173.9 | -95.3 | 137.8 | 0 | 0 | 0 | 111.2 | L22 L23 L29 A30 | L22-L26 WeakPolarHBondContact O-CB 3.39Å; L22-L26 WeakPolarHBondContact O-CD1 3.4Å; L22-L26 PolarHBondContact O-N 2.84Å; L23-L26 PolarHBondContact O-N 2.92Å; L26-L29 PolarHBondContact O-N 3.02Å; L26-A30 WeakPolarHBondContact O-CB 3.4Å; L26-A30 PolarHBondContact O-N 3.3Å |
| 27 | L | 70.5 | Confident | 60.5 | Low | 116 Ų | 116 | 92.7 Ų | 92.7 | 61% | 0.607 | 56% | 0.56 | S | S | * | * | H | α-helix | trans | -66.8 | -38.6 | 175.8 | -168 | 64.9 | 0 | 0 | 0 | 111.8 | L23 S24 L25 A30 C31 | L23-L27 WeakPolarHBondContact O-CB 3.04Å; L23-L27 PolarHBondContact O-N 3.42Å; S24-L27 PolarHBondContact O-N 3.12Å; L25-L27 VanDerWaalsContact C-N 3.27Å; L25-L27 PolarHBondContact O-N 2.98Å; L27-A30 PolarHBondContact O-N 3.36Å; L27-C31 PolarHBondContact O-N 3.04Å; L27-C31 PolarHBondContact O-SG 3.35Å |
| 28 | L | 69 | Low | 60.8 | Low | 31 Ų | 31 | 92.5 Ų | 92.5 | 16% | 0.162 | 57% | 0.566 | C | S | . | * | H | α-helix | trans | -58.9 | -53.1 | 173.4 | -127.5 | 86.3 | 0 | 0 | 0 | 111 | S24 L25 A30 C31 F32 V58 F81 | S24-L28 PolarHBondContact O-N 3.42Å; L25-L28 VanDerWaalsContact O-CB 3.32Å; L25-L28 WeakPolarHBondContact O-CB 3.41Å; L25-L28 PolarHBondContact O-N 3.07Å; L28-A30 VanDerWaalsContact C-N 3.3Å; L28-A30 PolarHBondContact O-N 3.19Å; L28-C31 WeakPolarHBondContact O-CB 3.48Å; L28-C31 PolarHBondContact O-N 3.14Å; L28-C31 VanDerWaalsContact O-N 3.14Å; L28-F32 HydrophobicContact CD2-CE2 4.08Å; L28-F32 HydrophobicContact CG-CE2 3.99Å; L28-F32 WeakPolarHBondContact O-CD2 3.32Å; L28-F32 PolarHBondContact O-N 3.46Å; L28-V58 HydrophobicContact CD1-CB 4.43Å; L28-V58 HydrophobicContact CD1-CG1 4.24Å; L28-V58 HydrophobicContact CD1-CG2 3.84Å; L28-V58 HydrophobicContact CD2-CG1 4.49Å; L28-F81 HydrophobicContact CD2-CE1 3.75Å; L28-F81 HydrophobicContact CD2-CZ 4.3Å |
| 29 | L | 70.1 | Confident | 60.3 | Low | 122 Ų | 122 | 91.7 Ų | 91.7 | 64% | 0.639 | 56% | 0.56 | S | S | * | * | H | α-helix | trans | -59.1 | -41.1 | -179.8 | -111.5 | 78.1 | 0 | 0 | 0 | 112.1 | L25 L26 F32 A33 | L25-L29 HydrophobicContact CD1-CD1 4.18Å; L25-L29 PolarHBondContact O-N 3.47Å; L26-L29 PolarHBondContact O-N 3.02Å; L29-F32 PolarHBondContact O-N 2.96Å; L29-A33 PolarHBondContact O-N 2.95Å; L29-A33 VanDerWaalsContact O-N 3.12Å |
| 30 | A | 66.8 | Low | 60 | Low | 61 Ų | 61 | 94.6 Ų | 94.6 | 50% | 0.504 | 57% | 0.572 | S | S | . | * | H | α-helix | trans | -64.5 | -38.5 | 177.1 | 0 | 0 | 0 | 0 | 0 | 112.3 | L26 L27 L28 F32 A33 D34 | L26-A30 WeakPolarHBondContact O-CB 3.4Å; L26-A30 PolarHBondContact O-N 3.3Å; L27-A30 PolarHBondContact O-N 3.36Å; L28-A30 VanDerWaalsContact C-N 3.3Å; L28-A30 PolarHBondContact O-N 3.19Å; A30-F32 VanDerWaalsContact C-N 3.34Å; A30-F32 PolarHBondContact O-N 3.19Å; A30-A33 PolarHBondContact O-N 3Å; A30-D34 PolarHBondContact O-N 3.37Å |
| 31 | C | 60.9 | Low | 58.7 | Low | 48 Ų | 48 | 98.1 Ų | 98.1 | 32% | 0.324 | 59% | 0.592 | S | S | . | * | H | α-helix | trans | -64.8 | -36.5 | 176.8 | -69.3 | 0 | 0 | 0 | 0 | 112.4 | L27 L28 L54 | L27-C31 PolarHBondContact O-N 3.04Å; L27-C31 PolarHBondContact O-SG 3.35Å; L28-C31 WeakPolarHBondContact O-CB 3.48Å; L28-C31 PolarHBondContact O-N 3.14Å; L28-C31 VanDerWaalsContact O-N 3.14Å; C31-L54 HydrophobicContact CB-CD2 4.46Å |
| 32 | F | 59.1 | Low | 58.1 | Low | 82 Ų | 82 | 97.7 Ų | 97.7 | 36% | 0.36 | 59% | 0.591 | S | S | . | * | H | α-helix | trans | -76.2 | -31.5 | 178.4 | -70.8 | -70.5 | 0 | 0 | 0 | 113.1 | L28 L29 A30 D34 A35 C36 F81 | L28-F32 HydrophobicContact CD2-CE2 4.08Å; L28-F32 HydrophobicContact CG-CE2 3.99Å; L28-F32 WeakPolarHBondContact O-CD2 3.32Å; L28-F32 PolarHBondContact O-N 3.46Å; L29-F32 PolarHBondContact O-N 2.96Å; A30-F32 VanDerWaalsContact C-N 3.34Å; A30-F32 PolarHBondContact O-N 3.19Å; F32-D34 VanDerWaalsContact C-N 3.29Å; F32-D34 PolarHBondContact O-N 3.44Å; F32-A35 PolarHBondContact O-N 3.14Å; F32-C36 PolarHBondContact O-SG 3.43Å; F32-F81 HydrophobicContact CE2-CZ 4.03Å; F32-F81 HydrophobicContact CZ-CE2 4.47Å; F32-F81 AromaticContact CZ-CZ 3.9Å; F32-F81 HydrophobicContact CZ-CZ 3.9Å |
| 33 | A | 56.8 | Low | 57.4 | Low | 67 Ų | 67 | 95.7 Ų | 95.7 | 55% | 0.554 | 59% | 0.585 | S | S | * | * | H | α-helix | trans | -63.6 | -34.5 | 175.7 | 0 | 0 | 0 | 0 | 0 | 112.6 | L29 A30 A35 C36 | L29-A33 PolarHBondContact O-N 2.95Å; L29-A33 VanDerWaalsContact O-N 3.12Å; A30-A33 PolarHBondContact O-N 3Å; A33-A35 VanDerWaalsContact C-N 3.32Å; A33-C36 PolarHBondContact O-N 3.24Å |
| 34 | D | 53.5 | Low | 56.7 | Low | 133 Ų | 133 | 97.8 Ų | 97.8 | 71% | 0.711 | 59% | 0.592 | S | S | * | * | H | α-helix | trans | -70.2 | -28.7 | 177.2 | -161.1 | 50.5 | 0 | 0 | 0 | 112.5 | A30 F32 C36 | A30-D34 PolarHBondContact O-N 3.37Å; F32-D34 VanDerWaalsContact C-N 3.29Å; F32-D34 PolarHBondContact O-N 3.44Å; D34-C36 VanDerWaalsContact C-N 3.27Å; D34-C36 PolarHBondContact O-N 3.3Å |
| 35 | A | 53.6 | Low | 55.6 | Low | 77 Ų | 77 | 105 Ų | 105 | 64% | 0.636 | 61% | 0.611 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -74.3 | -13.1 | 175.1 | 0 | 0 | 0 | 0 | 0 | 114 | F32 A33 | F32-A35 PolarHBondContact O-N 3.14Å; A33-A35 VanDerWaalsContact C-N 3.32Å |
| 36 | C | 52.3 | Low | 54.5 | Low | 109 Ų | 109 | 109.3 Ų | 109.3 | 74% | 0.736 | 63% | 0.633 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -94.7 | -1.4 | -178.4 | -65.2 | 0 | 0 | 0 | 0 | 114.4 | F32 A33 D34 G38 | F32-C36 PolarHBondContact O-SG 3.43Å; A33-C36 PolarHBondContact O-N 3.24Å; D34-C36 VanDerWaalsContact C-N 3.27Å; D34-C36 PolarHBondContact O-N 3.3Å; C36-G38 PolarHBondContact O-N 3.39Å |
| 37 | R | 51.7 | Low | 53.3 | Low | 223 Ų | 223 | 110 Ų | 110 | 84% | 0.842 | 63% | 0.627 | S | S | * | * | S | Bend | trans | -81.1 | 99.9 | 171.7 | -105.4 | -173.4 | -175.7 | -105.6 | 2.6 | 110 | A39 | R37-A39 PolarHBondContact O-N 3.23Š|
| 38 | G | 50.3 | Low | 52.7 | Low | 83 Ų | 83 | 107.2 Ų | 107.2 | 86% | 0.856 | 62% | 0.618 | S | S | * | * | trans | -61.5 | 120 | -180 | 0 | 0 | 0 | 0 | 0 | 114.1 | C36 | C36-G38 PolarHBondContact O-N 3.39Š| ||
| 39 | A | 40.2 | Very low | 52.2 | Low | 84 Ų | 84 | 112.6 Ų | 112.6 | 69% | 0.694 | 64% | 0.642 | S | S | * | * | trans | -169 | 138.3 | 140.9 | 0 | 0 | 0 | 0 | 0 | 109.2 | R37 V41 | R37-A39 PolarHBondContact O-N 3.23Å; A39-V41 PolarHBondContact O-N 3.41Å | ||
| 40 | P | 49.7 | Very low | 52.1 | Low | 131 Ų | 131 | 113.9 Ų | 113.9 | 85% | 0.851 | 65% | 0.645 | S | S | * | * | trans | -88.6 | 106 | -175.2 | 33.8 | -28 | 0 | 0 | 0 | 109.8 | ||||
| 41 | V | 39.6 | Very low | 52.3 | Low | 126 Ų | 126 | 114.2 Ų | 114.2 | 76% | 0.764 | 64% | 0.636 | S | S | * | * | trans | -126.1 | 111.3 | 158.7 | -175.8 | 0 | 0 | 0 | 0 | 107.5 | A39 | A39-V41 PolarHBondContact O-N 3.41Š| ||
| 42 | S | 50.2 | Low | 53 | Low | 92 Ų | 92 | 117 Ų | 117 | 64% | 0.643 | 65% | 0.647 | S | S | * | * | trans | -33.5 | 121.3 | 175.7 | 169 | 0 | 0 | 0 | 0 | 113.1 | ||||
| 43 | P | 43.4 | Very low | 53.8 | Low | 73 Ų | 73 | 118.6 Ų | 118.6 | 47% | 0.474 | 66% | 0.655 | S | S | . | * | trans | -101.5 | 80.2 | 172.3 | 35.7 | -25.5 | 0 | 0 | 0 | 109.6 | R45 R47 | P43-R45 PolarHBondContact O-N 3.41Å; P43-R47 HydrophobicContact CB-CB 3.94Å; P43-R47 HydrophobicContact CB-CG 4.25Å | ||
| 44 | Q | 48.8 | Very low | 54.9 | Low | 161 Ų | 161 | 118.9 Ų | 118.9 | 75% | 0.752 | 65% | 0.647 | S | S | * | * | trans | -89.1 | 103.7 | 177.5 | -134 | 168.1 | 9.7 | 0 | 0 | 110.3 | ||||
| 45 | R | 41.8 | Very low | 56.2 | Low | 200 Ų | 200 | 117.5 Ų | 117.5 | 76% | 0.755 | 63% | 0.632 | S | S | * | * | S | Bend | trans | 99.9 | -28.9 | 149.4 | -159.6 | 177.5 | -71.6 | 153.3 | -2.6 | 119.9 | P43 S48 | P43-R45 PolarHBondContact O-N 3.41Å; R45-S48 PolarHBondContact O-OG 2.89Å |
| 46 | I | 44 | Very low | 57.6 | Low | 155 Ų | 155 | 117.2 Ų | 117.2 | 80% | 0.795 | 62% | 0.62 | S | S | * | * | S | Bend | trans | -94.2 | -31 | 177.5 | -58.1 | 175.3 | 0 | 0 | 0 | 111.7 | S48 | I46-S48 VanDerWaalsContact C-N 3.28Å; I46-S48 PolarHBondContact O-N 2.95Å |
| 47 | R | 46.5 | Very low | 59.2 | Low | 136 Ų | 136 | 118.8 Ų | 118.8 | 51% | 0.513 | 61% | 0.614 | S | S | . | * | H | α-helix | trans | -67.3 | -27.9 | 176.6 | -160.7 | -176.3 | 165.2 | 158.5 | -12.3 | 112.7 | P43 E49 Q50 E51 | P43-R47 HydrophobicContact CB-CB 3.94Å; P43-R47 HydrophobicContact CB-CG 4.25Å; R47-E49 PolarHBondContact O-N 2.71Å; R47-Q50 PolarHBondContact O-N 3.42Å; R47-E51 WeakPolarHBondContact CD-OE1 2.88Å; R47-E51 HydrophobicContact CG-CG 4.03Å; R47-E51 IonicContact CZ-OE1 3.47Å; R47-E51 IonicContact NE-OE1 2.69Å; R47-E51 PolarHBondContact NE-OE1 2.69Å; R47-E51 IonicContact NH2-OE1 3.46Å; R47-E51 PolarHBondContact NH2-OE1 3.02Å; R47-E51 VanDerWaalsContact O-CB 3.27Å; R47-E51 WeakPolarHBondContact O-CB 3.21Å; R47-E51 VanDerWaalsContact O-CG 3.23Å; R47-E51 WeakPolarHBondContact O-CG 3.43Å; R47-E51 PolarHBondContact O-N 3.46Å |
| 48 | S | 59.4 | Low | 60.7 | Low | 58 Ų | 58 | 108.6 Ų | 108.6 | 41% | 0.406 | 58% | 0.577 | S | S | . | * | H | α-helix | trans | -66.7 | -32.7 | -174.1 | 49.1 | 0 | 0 | 0 | 0 | 114.4 | R45 I46 L52 | R45-S48 PolarHBondContact O-OG 2.89Å; I46-S48 VanDerWaalsContact C-N 3.28Å; I46-S48 PolarHBondContact O-N 2.95Å; S48-L52 WeakPolarHBondContact O-CB 3.37Å; S48-L52 PolarHBondContact O-N 3.46Å |
| 49 | E | 57.8 | Low | 62.4 | Low | 144 Ų | 144 | 106.7 Ų | 106.7 | 67% | 0.673 | 55% | 0.546 | S | S | * | . | H | α-helix | trans | -75.1 | -42.4 | 178.7 | -72.6 | -170.2 | 170.7 | 0 | 0 | 112 | R47 L52 Q53 | R47-E49 PolarHBondContact O-N 2.71Å; E49-L52 PolarHBondContact O-N 2.95Å; E49-Q53 WeakPolarHBondContact O-CB 3.23Å; E49-Q53 WeakPolarHBondContact O-CG 3.27Å; E49-Q53 PolarHBondContact O-N 3.41Å |
| 50 | Q | 68.1 | Low | 64.6 | Low | 149 Ų | 149 | 107.6 Ų | 107.6 | 70% | 0.696 | 54% | 0.539 | S | S | * | . | H | α-helix | trans | -68.1 | -37.7 | 175.8 | -169.2 | 175.5 | 6 | 0 | 0 | 111.4 | R47 Q53 L54 | R47-Q50 PolarHBondContact O-N 3.42Å; Q50-Q53 PolarHBondContact O-N 3.48Å; Q50-L54 WeakPolarHBondContact O-CB 3.35Å; Q50-L54 PolarHBondContact O-N 2.91Å |
| 51 | E | 70.8 | Confident | 66.3 | Low | 68 Ų | 68 | 103 Ų | 103 | 32% | 0.318 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -63.7 | -44.4 | 171.3 | -77.8 | 176.4 | 156.7 | 0 | 0 | 111.4 | R47 Q53 L54 W55 | R47-E51 WeakPolarHBondContact CD-OE1 2.88Å; R47-E51 HydrophobicContact CG-CG 4.03Å; R47-E51 IonicContact CZ-OE1 3.47Å; R47-E51 IonicContact NE-OE1 2.69Å; R47-E51 PolarHBondContact NE-OE1 2.69Å; R47-E51 IonicContact NH2-OE1 3.46Å; R47-E51 PolarHBondContact NH2-OE1 3.02Å; R47-E51 VanDerWaalsContact O-CB 3.27Å; R47-E51 WeakPolarHBondContact O-CB 3.21Å; R47-E51 VanDerWaalsContact O-CG 3.23Å; R47-E51 WeakPolarHBondContact O-CG 3.43Å; R47-E51 PolarHBondContact O-N 3.46Å; E51-Q53 VanDerWaalsContact C-N 3.34Å; E51-Q53 PolarHBondContact O-N 3.4Å; E51-L54 WeakPolarHBondContact O-CB 3.46Å; E51-L54 PolarHBondContact O-N 3.3Å; E51-L54 VanDerWaalsContact O-N 3.17Å; E51-W55 PolarHBondContact O-N 3.45Å |
| 52 | L | 74.8 | Confident | 68.5 | Low | 105 Ų | 105 | 97.2 Ų | 97.2 | 55% | 0.55 | 48% | 0.477 | S | S | . | . | H | α-helix | trans | -61.6 | -42.8 | 176.5 | -172.4 | 71.3 | 0 | 0 | 0 | 111.5 | S48 E49 L54 W55 N56 | S48-L52 WeakPolarHBondContact O-CB 3.37Å; S48-L52 PolarHBondContact O-N 3.46Å; E49-L52 PolarHBondContact O-N 2.95Å; L52-L54 VanDerWaalsContact C-N 3.31Å; L52-L54 PolarHBondContact O-N 3.38Å; L52-W55 PolarHBondContact O-N 3.46Å; L52-N56 PolarHBondContact O-N 3.43Å; L52-N56 PolarHBondContact O-ND2 2.85Å |
| 53 | Q | 76.8 | Confident | 70.1 | Confident | 117 Ų | 117 | 95 Ų | 95 | 55% | 0.547 | 46% | 0.461 | S | S | . | . | H | α-helix | trans | -62 | -38.5 | 174.3 | -75.7 | -179.6 | -1.4 | 0 | 0 | 112.4 | E49 Q50 E51 K57 | E49-Q53 WeakPolarHBondContact O-CB 3.23Å; E49-Q53 WeakPolarHBondContact O-CG 3.27Å; E49-Q53 PolarHBondContact O-N 3.41Å; Q50-Q53 PolarHBondContact O-N 3.48Å; E51-Q53 VanDerWaalsContact C-N 3.34Å; E51-Q53 PolarHBondContact O-N 3.4Å; Q53-K57 WeakPolarHBondContact O-CG 3.33Å; Q53-K57 PolarHBondContact O-N 3.15Å; Q53-K57 VanDerWaalsContact O-N 3.15Å |
| 54 | L | 80.4 | Confident | 72 | Confident | 73 Ų | 73 | 94.9 Ų | 94.9 | 38% | 0.382 | 46% | 0.462 | S | S | . | . | H | α-helix | trans | -65.6 | -46.7 | 174.8 | -176.3 | 65.5 | 0 | 0 | 0 | 110.8 | C31 Q50 E51 L52 N56 K57 V58 | C31-L54 HydrophobicContact CB-CD2 4.46Å; Q50-L54 WeakPolarHBondContact O-CB 3.35Å; Q50-L54 PolarHBondContact O-N 2.91Å; E51-L54 WeakPolarHBondContact O-CB 3.46Å; E51-L54 PolarHBondContact O-N 3.3Å; E51-L54 VanDerWaalsContact O-N 3.17Å; L52-L54 VanDerWaalsContact C-N 3.31Å; L52-L54 PolarHBondContact O-N 3.38Å; L54-N56 VanDerWaalsContact C-N 3.31Å; L54-N56 PolarHBondContact O-N 2.94Å; L54-K57 WeakPolarHBondContact O-CB 3.44Å; L54-K57 PolarHBondContact O-N 3.11Å; L54-K57 VanDerWaalsContact O-N 3.11Å; L54-V58 WeakPolarHBondContact O-CG2 3.48Å; L54-V58 PolarHBondContact O-N 3.17Å |
| 55 | W | 81.1 | Confident | 73.5 | Confident | 104 Ų | 104 | 90.1 Ų | 90.1 | 39% | 0.394 | 44% | 0.439 | S | S | . | . | H | α-helix | trans | -59.4 | -39.8 | 177 | -79.1 | 114.3 | 0 | 0 | 0 | 112.7 | E51 L52 V58 H59 L89 | E51-W55 PolarHBondContact O-N 3.45Å; L52-W55 PolarHBondContact O-N 3.46Å; W55-V58 PolarHBondContact O-N 2.88Å; W55-H59 WeakPolarHBondContact O-CB 3.33Å; W55-H59 PolarHBondContact O-N 3.34Å; W55-L89 HydrophobicContact CB-CD1 4.35Å |
| 56 | N | 82.1 | Confident | 75.3 | Confident | 70 Ų | 70 | 84 Ų | 84 | 37% | 0.374 | 42% | 0.421 | S | S | . | . | H | α-helix | trans | -62.5 | -43.8 | 174.3 | -68.2 | -22.4 | 0 | 0 | 0 | 111.3 | L52 L54 V58 H59 D60 | L52-N56 PolarHBondContact O-N 3.43Å; L52-N56 PolarHBondContact O-ND2 2.85Å; L54-N56 VanDerWaalsContact C-N 3.31Å; L54-N56 PolarHBondContact O-N 2.94Å; N56-V58 VanDerWaalsContact C-N 3.34Å; N56-V58 PolarHBondContact O-N 2.94Å; N56-H59 WeakPolarHBondContact O-CB 3.45Å; N56-H59 PolarHBondContact O-N 3.3Å; N56-D60 PolarHBondContact O-N 3.03Å |
| 57 | K | 85.3 | Confident | 77 | Confident | 142 Ų | 142 | 81.1 Ų | 81.1 | 62% | 0.617 | 42% | 0.415 | S | S | * | . | H | α-helix | trans | -62 | -40.6 | 175.5 | -70.6 | 173 | -173.8 | 176.9 | 0 | 112.5 | Q53 L54 A61 | Q53-K57 WeakPolarHBondContact O-CG 3.33Å; Q53-K57 PolarHBondContact O-N 3.15Å; Q53-K57 VanDerWaalsContact O-N 3.15Å; L54-K57 WeakPolarHBondContact O-CB 3.44Å; L54-K57 PolarHBondContact O-N 3.11Å; L54-K57 VanDerWaalsContact O-N 3.11Å; K57-A61 WeakPolarHBondContact O-CB 3.39Å; K57-A61 PolarHBondContact O-N 3.23Å |
| 58 | V | 84.3 | Confident | 78.4 | Confident | 10 Ų | 10 | 77.7 Ų | 77.7 | 6% | 0.061 | 41% | 0.411 | C | S | . | . | H | α-helix | trans | -64.4 | -44 | 176 | 175.7 | 0 | 0 | 0 | 0 | 110.3 | L28 L54 W55 N56 A61 C62 V85 | L28-V58 HydrophobicContact CD1-CB 4.43Å; L28-V58 HydrophobicContact CD1-CG1 4.24Å; L28-V58 HydrophobicContact CD1-CG2 3.84Å; L28-V58 HydrophobicContact CD2-CG1 4.49Å; L54-V58 WeakPolarHBondContact O-CG2 3.48Å; L54-V58 PolarHBondContact O-N 3.17Å; W55-V58 PolarHBondContact O-N 2.88Å; N56-V58 VanDerWaalsContact C-N 3.34Å; N56-V58 PolarHBondContact O-N 2.94Å; V58-A61 PolarHBondContact O-N 2.92Å; V58-C62 WeakPolarHBondContact O-CB 3.49Å; V58-C62 PolarHBondContact O-N 3.46Å; V58-V85 HydrophobicContact CG1-CG1 4.15Å |
| 59 | H | 86.4 | Confident | 78.3 | Confident | 43 Ų | 43 | 82.7 Ų | 82.7 | 20% | 0.199 | 43% | 0.434 | C | S | . | . | H | α-helix | trans | -62.1 | -44.5 | 177.6 | 178.2 | -85 | 0 | 0 | 0 | 112.3 | W55 N56 C62 S63 L89 | W55-H59 WeakPolarHBondContact O-CB 3.33Å; W55-H59 PolarHBondContact O-N 3.34Å; N56-H59 WeakPolarHBondContact O-CB 3.45Å; N56-H59 PolarHBondContact O-N 3.3Å; H59-C62 PolarHBondContact O-N 3.31Å; H59-S63 PolarHBondContact CE1-OG 3.33Å; H59-S63 WeakPolarHBondContact O-CB 3.37Å; H59-S63 PolarHBondContact O-N 2.72Å; H59-S63 PolarHBondContact O-OG 2.82Å; H59-L89 HydrophobicContact CB-CD2 4.11Å |
| 60 | D | 85.1 | Confident | 78.3 | Confident | 102 Ų | 102 | 80 Ų | 80 | 55% | 0.545 | 43% | 0.431 | S | S | . | . | H | α-helix | trans | -64.7 | -42 | 177.9 | -66.5 | -18.3 | 0 | 0 | 0 | 111.4 | N56 S63 S64 | N56-D60 PolarHBondContact O-N 3.03Å; D60-S63 PolarHBondContact O-N 3.4Å; D60-S64 PolarHBondContact O-N 3.31Å |
| 61 | A | 85.9 | Confident | 77.8 | Confident | 35 Ų | 35 | 81 Ų | 81 | 29% | 0.289 | 44% | 0.436 | S | S | . | . | H | α-helix | trans | -60.8 | -46.7 | 174.6 | 0 | 0 | 0 | 0 | 0 | 111.5 | K57 V58 S63 S64 F65 | K57-A61 WeakPolarHBondContact O-CB 3.39Å; K57-A61 PolarHBondContact O-N 3.23Å; V58-A61 PolarHBondContact O-N 2.92Å; A61-S63 PolarHBondContact O-N 2.97Å; A61-S64 PolarHBondContact O-N 3.49Å; A61-S64 PolarHBondContact O-OG 3.15Å; A61-F65 WeakPolarHBondContact O-CB 3.38Å; A61-F65 PolarHBondContact O-N 2.98Å |
| 62 | C | 85.5 | Confident | 76.9 | Confident | 4 Ų | 4 | 80.3 Ų | 80.3 | 3% | 0.027 | 44% | 0.437 | C | S | . | . | H | α-helix | trans | -64.8 | -37.4 | 176.1 | -85.3 | 0 | 0 | 0 | 0 | 113.1 | V58 H59 F65 L66 C82 | V58-C62 WeakPolarHBondContact O-CB 3.49Å; V58-C62 PolarHBondContact O-N 3.46Å; H59-C62 PolarHBondContact O-N 3.31Å; C62-F65 PolarHBondContact O-N 3.21Å; C62-L66 WeakPolarHBondContact O-CB 3.39Å; C62-L66 VanDerWaalsContact O-CG 3.26Å; C62-L66 WeakPolarHBondContact O-CG 3.48Å; C62-L66 PolarHBondContact O-N 3.39Å; C62-C82 WeakPolarHBondContact CA-SG 3.42Å; C62-C82 HydrophobicContact CB-CB 3.51Å; C62-C82 WeakPolarHBondContact CB-SG 3.26Å; C62-C82 WeakPolarHBondContact SG-CA 3.34Å; C62-C82 WeakPolarHBondContact SG-CB 3.41Å; C62-C82 CovalentContact SG-SG 2.06Å; C62-C82 PolarHBondContact SG-SG 3.27Å |
| 63 | S | 84 | Confident | 75.9 | Confident | 46 Ų | 46 | 85 Ų | 85 | 32% | 0.322 | 46% | 0.456 | S | S | . | . | H | α-helix | trans | -63.6 | -43.4 | 175 | -59.9 | 0 | 0 | 0 | 0 | 111.4 | H59 D60 A61 F65 L66 S67 | H59-S63 PolarHBondContact CE1-OG 3.33Å; H59-S63 WeakPolarHBondContact O-CB 3.37Å; H59-S63 PolarHBondContact O-N 2.72Å; H59-S63 PolarHBondContact O-OG 2.82Å; D60-S63 PolarHBondContact O-N 3.4Å; A61-S63 PolarHBondContact O-N 2.97Å; S63-F65 VanDerWaalsContact C-N 3.33Å; S63-F65 PolarHBondContact O-N 3.26Å; S63-L66 PolarHBondContact O-N 2.92Å; S63-S67 VanDerWaalsContact O-CB 3.26Å; S63-S67 WeakPolarHBondContact O-CB 3.36Å; S63-S67 PolarHBondContact O-N 3.21Å |
| 64 | S | 82.5 | Confident | 75.1 | Confident | 71 Ų | 71 | 81 Ų | 81 | 50% | 0.497 | 45% | 0.446 | S | S | . | . | H | α-helix | trans | -64.5 | -36.9 | 175.7 | 75.1 | 0 | 0 | 0 | 0 | 112.8 | D60 A61 S68 | D60-S64 PolarHBondContact O-N 3.31Å; A61-S64 PolarHBondContact O-N 3.49Å; A61-S64 PolarHBondContact O-OG 3.15Å; S64-S68 PolarHBondContact O-N 2.9Å; S64-S68 PolarHBondContact O-OG 2.95Å |
| 65 | F | 80.6 | Confident | 74.3 | Confident | 61 Ų | 61 | 80.8 Ų | 80.8 | 27% | 0.268 | 45% | 0.451 | S | S | . | . | H | α-helix | trans | -70 | -40.4 | 178.1 | -178.3 | -92.8 | 0 | 0 | 0 | 112.2 | A61 C62 S63 P72 L78 R79 | A61-F65 WeakPolarHBondContact O-CB 3.38Å; A61-F65 PolarHBondContact O-N 2.98Å; C62-F65 PolarHBondContact O-N 3.21Å; S63-F65 VanDerWaalsContact C-N 3.33Å; S63-F65 PolarHBondContact O-N 3.26Å; F65-P72 HydrophobicContact CE2-CG 4.46Å; F65-P72 HydrophobicContact CZ-CG 4.23Å; F65-L78 HydrophobicContact CD1-CD2 3.6Å; F65-L78 HydrophobicContact CD2-CD2 3.89Å; F65-L78 HydrophobicContact CE1-CD2 3.31Å; F65-L78 HydrophobicContact CE2-CD2 3.62Å; F65-L78 HydrophobicContact CG-CD2 3.89Å; F65-L78 HydrophobicContact CZ-CD2 3.33Å; F65-R79 HydrophobicContact CE1-CB 4.37Å |
| 66 | L | 79 | Confident | 74 | Confident | 72 Ų | 72 | 81.6 Ų | 81.6 | 38% | 0.377 | 47% | 0.468 | S | S | . | . | H | α-helix | trans | -74.7 | -31.9 | 177.9 | -68.6 | 173.8 | 0 | 0 | 0 | 112.7 | C62 S63 S68 R79 C82 | C62-L66 WeakPolarHBondContact O-CB 3.39Å; C62-L66 VanDerWaalsContact O-CG 3.26Å; C62-L66 WeakPolarHBondContact O-CG 3.48Å; C62-L66 PolarHBondContact O-N 3.39Å; S63-L66 PolarHBondContact O-N 2.92Å; L66-S68 VanDerWaalsContact C-N 3.3Å; L66-R79 HydrophobicContact CD2-CG 4.07Å; L66-C82 HydrophobicContact CD1-CB 4.1Å; L66-C82 HydrophobicContact CD2-CB 4.3Å; L66-C82 HydrophobicContact CG-CB 4.11Å |
| 67 | S | 80.1 | Confident | 73.8 | Confident | 94 Ų | 94 | 81.7 Ų | 81.7 | 66% | 0.657 | 48% | 0.478 | S | S | * | . | H | α-helix | trans | -77 | -15.4 | 176.4 | -174.6 | 0 | 0 | 0 | 0 | 113.5 | S63 D69 | S63-S67 VanDerWaalsContact O-CB 3.26Å; S63-S67 WeakPolarHBondContact O-CB 3.36Å; S63-S67 PolarHBondContact O-N 3.21Å; S67-D69 PolarHBondContact O-N 3.15Å; S67-D69 VanDerWaalsContact O-N 3.15Å |
| 68 | S | 75.4 | Confident | 73.6 | Confident | 63 Ų | 63 | 76.5 Ų | 76.5 | 44% | 0.441 | 46% | 0.457 | S | S | . | . | trans | -78 | 98.9 | 176.5 | -65.5 | 0 | 0 | 0 | 0 | 109.1 | S64 L66 S70 | S64-S68 PolarHBondContact O-N 2.9Å; S64-S68 PolarHBondContact O-OG 2.95Å; L66-S68 VanDerWaalsContact C-N 3.3Å; S68-S70 PolarHBondContact O-N 2.92Å | ||
| 69 | D | 57.6 | Low | 73.5 | Confident | 163 Ų | 163 | 81.6 Ų | 81.6 | 87% | 0.872 | 48% | 0.475 | S | S | * | . | trans | -63.8 | -2.9 | 177.8 | -77.2 | -35.1 | 0 | 0 | 0 | 114.2 | S67 Q71 | S67-D69 PolarHBondContact O-N 3.15Å; S67-D69 VanDerWaalsContact O-N 3.15Å; D69-Q71 VanDerWaalsContact C-N 3.33Å; D69-Q71 PolarHBondContact O-N 3.35Å | ||
| 70 | S | 58.9 | Low | 73.4 | Confident | 88 Ų | 88 | 83.5 Ų | 83.5 | 62% | 0.615 | 48% | 0.484 | S | S | * | . | S | Bend | trans | -70.8 | 92.7 | 172.4 | 50.6 | 0 | 0 | 0 | 0 | 108.8 | S68 P72 | S68-S70 PolarHBondContact O-N 2.92Å; S70-P72 WeakPolarHBondContact O-CD 3.5Å; S70-P72 WeakPolarHBondContact O-CG 3.41Å |
| 71 | Q | 58 | Low | 73.3 | Confident | 170 Ų | 170 | 82 Ų | 82 | 79% | 0.794 | 47% | 0.473 | S | S | * | . | trans | -40.8 | 98.4 | 169.7 | 179.7 | 166.1 | -35.9 | 0 | 0 | 110.1 | D69 Q73 | D69-Q71 VanDerWaalsContact C-N 3.33Å; D69-Q71 PolarHBondContact O-N 3.35Å; Q71-Q73 PolarHBondContact O-N 3.38Å | ||
| 72 | P | 51.8 | Low | 73.3 | Confident | 54 Ų | 54 | 80.6 Ų | 80.6 | 35% | 0.351 | 46% | 0.461 | S | S | . | . | trans | -82.8 | 125.9 | 176.2 | 9.7 | 9.4 | 0 | 0 | 0 | 104 | F65 S70 G74 | F65-P72 HydrophobicContact CE2-CG 4.46Å; F65-P72 HydrophobicContact CZ-CG 4.23Å; S70-P72 WeakPolarHBondContact O-CD 3.5Å; S70-P72 WeakPolarHBondContact O-CG 3.41Å; P72-G74 PolarHBondContact O-N 3.02Å | ||
| 73 | Q | 53.2 | Low | 73.3 | Confident | 202 Ų | 202 | 85.9 Ų | 85.9 | 94% | 0.944 | 48% | 0.48 | S | S | * | . | S | Bend | trans | -61.8 | 45.1 | 157.4 | -78.5 | -99.8 | 21 | 0 | 0 | 110.4 | Q71 | Q71-Q73 PolarHBondContact O-N 3.38Š|
| 74 | G | 59.1 | Low | 73.4 | Confident | 34 Ų | 34 | 88.6 Ų | 88.6 | 35% | 0.351 | 49% | 0.49 | S | S | . | . | S | Bend | trans | -144.9 | 98.4 | -160.3 | 0 | 0 | 0 | 0 | 0 | 110.1 | P72 | P72-G74 PolarHBondContact O-N 3.02Š|
| 75 | S | 65.3 | Low | 73.5 | Confident | 68 Ų | 68 | 85.6 Ų | 85.6 | 48% | 0.476 | 47% | 0.469 | S | S | . | . | trans | 50.4 | 88.1 | 166.1 | 62.3 | 0 | 0 | 0 | 0 | 116.4 | A77 L78 R79 | S75-A77 PolarHBondContact O-N 2.93Å; S75-A77 VanDerWaalsContact O-N 3.15Å; S75-L78 PolarHBondContact O-N 3.34Å; S75-L78 WeakPolarHBondContact OG-CB 3.05Å; S75-R79 PolarHBondContact O-N 2.06Å | ||
| 76 | T | 73.7 | Confident | 73.5 | Confident | 122 Ų | 122 | 84 Ų | 84 | 75% | 0.748 | 47% | 0.465 | S | S | * | . | H | α-helix | trans | -44.5 | -40.4 | 161.1 | 48.4 | 0 | 0 | 0 | 0 | 112 | L78 R79 E80 | T76-L78 VanDerWaalsContact C-N 3.29Å; T76-L78 PolarHBondContact O-N 3.01Å; T76-R79 PolarHBondContact O-N 2.9Å; T76-E80 WeakPolarHBondContact O-CG 3.05Å; T76-E80 PolarHBondContact O-N 3.34Å |
| 77 | A | 78.3 | Confident | 73.5 | Confident | 71 Ų | 71 | 85.1 Ų | 85.1 | 59% | 0.587 | 47% | 0.468 | S | S | * | . | H | α-helix | trans | -55.4 | -37.7 | 176.2 | 0 | 0 | 0 | 0 | 0 | 114.2 | S75 F81 | S75-A77 PolarHBondContact O-N 2.93Å; S75-A77 VanDerWaalsContact O-N 3.15Å; A77-F81 WeakPolarHBondContact O-CB 3.42Å; A77-F81 PolarHBondContact O-N 3.3Å |
| 78 | L | 80.1 | Confident | 73.1 | Confident | 34 Ų | 34 | 84 Ų | 84 | 18% | 0.178 | 46% | 0.46 | C | S | . | . | H | α-helix | trans | -76.8 | -35.2 | -179 | -169.3 | 144.5 | 0 | 0 | 0 | 111.7 | L25 F65 S75 T76 F81 C82 | L25-L78 HydrophobicContact CD1-CD1 3.55Å; L25-L78 HydrophobicContact CD2-CD1 4.05Å; L25-L78 HydrophobicContact CG-CD1 4.43Å; F65-L78 HydrophobicContact CD1-CD2 3.6Å; F65-L78 HydrophobicContact CD2-CD2 3.89Å; F65-L78 HydrophobicContact CE1-CD2 3.31Å; F65-L78 HydrophobicContact CE2-CD2 3.62Å; F65-L78 HydrophobicContact CG-CD2 3.89Å; F65-L78 HydrophobicContact CZ-CD2 3.33Å; S75-L78 PolarHBondContact O-N 3.34Å; S75-L78 WeakPolarHBondContact OG-CB 3.05Å; T76-L78 VanDerWaalsContact C-N 3.29Å; T76-L78 PolarHBondContact O-N 3.01Å; L78-F81 PolarHBondContact O-N 2.84Å; L78-C82 PolarHBondContact O-N 3.15Å |
| 79 | R | 82.6 | Confident | 72.5 | Confident | 116 Ų | 116 | 83.5 Ų | 83.5 | 44% | 0.438 | 45% | 0.452 | S | S | . | . | H | α-helix | trans | -63.1 | -45.3 | 172.2 | -175.7 | 176.3 | -66.9 | -152 | -6.3 | 111.1 | F65 L66 S75 T76 C82 R83 | F65-R79 HydrophobicContact CE1-CB 4.37Å; L66-R79 HydrophobicContact CD2-CG 4.07Å; S75-R79 PolarHBondContact O-N 2.06Å; T76-R79 PolarHBondContact O-N 2.9Å; R79-C82 PolarHBondContact O-N 3.29Å; R79-R83 WeakPolarHBondContact O-CB 3.35Å; R79-R83 PolarHBondContact O-N 2.86Å |
| 80 | E | 84.1 | Confident | 72.6 | Confident | 84 Ų | 84 | 82.9 Ų | 82.9 | 39% | 0.393 | 44% | 0.444 | S | S | . | . | H | α-helix | trans | -62.9 | -42.1 | 174.9 | -66 | -53.4 | 148.1 | 0 | 0 | 111.8 | T76 R83 L84 | T76-E80 WeakPolarHBondContact O-CG 3.05Å; T76-E80 PolarHBondContact O-N 3.34Å; E80-R83 WeakPolarHBondContact O-CB 3.49Å; E80-R83 PolarHBondContact O-N 2.85Å; E80-R83 IonicContact OE2-CZ 2.66Å; E80-R83 VanDerWaalsContact OE2-CZ 3.22Å; E80-R83 IonicContact OE2-NE 2.96Å; E80-R83 PolarHBondContact OE2-NE 2.75Å; E80-R83 IonicContact OE2-NH2 3.23Å; E80-R83 PolarHBondContact OE2-NH2 3.48Å; E80-L84 WeakPolarHBondContact O-CG 3.28Å; E80-L84 PolarHBondContact O-N 3.33Å |
| 81 | F | 84.1 | Confident | 72.2 | Confident | 70 Ų | 70 | 86.7 Ų | 86.7 | 31% | 0.307 | 45% | 0.449 | S | S | . | . | H | α-helix | trans | -59 | -49.6 | 174.6 | 173.5 | -98.5 | 0 | 0 | 0 | 112.1 | L28 F32 A77 L78 R83 L84 V85 | L28-F81 HydrophobicContact CD2-CE1 3.75Å; L28-F81 HydrophobicContact CD2-CZ 4.3Å; F32-F81 HydrophobicContact CE2-CZ 4.03Å; F32-F81 HydrophobicContact CZ-CE2 4.47Å; F32-F81 AromaticContact CZ-CZ 3.9Å; F32-F81 HydrophobicContact CZ-CZ 3.9Å; A77-F81 WeakPolarHBondContact O-CB 3.42Å; A77-F81 PolarHBondContact O-N 3.3Å; L78-F81 PolarHBondContact O-N 2.84Å; F81-R83 VanDerWaalsContact C-N 3.28Å; F81-R83 PolarHBondContact O-N 3.43Å; F81-L84 WeakPolarHBondContact O-CB 3.26Å; F81-L84 PolarHBondContact O-N 2.91Å; F81-L84 VanDerWaalsContact O-N 3.15Å; F81-V85 HydrophobicContact CD1-CG2 4.18Å; F81-V85 HydrophobicContact CD2-CG2 4.32Å; F81-V85 HydrophobicContact CE1-CG2 3.68Å; F81-V85 HydrophobicContact CE2-CG2 3.85Å; F81-V85 HydrophobicContact CG-CG2 4.48Å; F81-V85 HydrophobicContact CZ-CG2 3.5Å; F81-V85 VanDerWaalsContact CZ-CG2 3.5Å; F81-V85 WeakPolarHBondContact O-CG2 3.16Å; F81-V85 PolarHBondContact O-N 2.93Å |
| 82 | C | 86.2 | Confident | 71.9 | Confident | 5 Ų | 5 | 82 Ų | 82 | 3% | 0.034 | 43% | 0.434 | C | S | . | . | H | α-helix | trans | -63.7 | -34.7 | 179.5 | -80.7 | 0 | 0 | 0 | 0 | 112.7 | C62 L66 L78 R79 V85 T86 | C62-C82 WeakPolarHBondContact CA-SG 3.42Å; C62-C82 HydrophobicContact CB-CB 3.51Å; C62-C82 WeakPolarHBondContact CB-SG 3.26Å; C62-C82 WeakPolarHBondContact SG-CA 3.34Å; C62-C82 WeakPolarHBondContact SG-CB 3.41Å; C62-C82 CovalentContact SG-SG 2.06Å; C62-C82 PolarHBondContact SG-SG 3.27Å; L66-C82 HydrophobicContact CD1-CB 4.1Å; L66-C82 HydrophobicContact CD2-CB 4.3Å; L66-C82 HydrophobicContact CG-CB 4.11Å; L78-C82 PolarHBondContact O-N 3.15Å; R79-C82 PolarHBondContact O-N 3.29Å; C82-V85 PolarHBondContact O-N 2.66Å; C82-T86 PolarHBondContact O-N 3.11Å; C82-T86 PolarHBondContact O-OG1 2.84Å |
| 83 | R | 84.6 | Confident | 71.4 | Confident | 116 Ų | 116 | 87 Ų | 87 | 44% | 0.438 | 46% | 0.456 | S | S | . | . | H | α-helix | trans | -60.7 | -48 | 171.7 | -176.6 | 171.1 | 70.7 | 94.5 | -7.1 | 111.7 | R79 E80 F81 V85 T86 E87 | R79-R83 WeakPolarHBondContact O-CB 3.35Å; R79-R83 PolarHBondContact O-N 2.86Å; E80-R83 WeakPolarHBondContact O-CB 3.49Å; E80-R83 PolarHBondContact O-N 2.85Å; E80-R83 IonicContact OE2-CZ 2.66Å; E80-R83 VanDerWaalsContact OE2-CZ 3.22Å; E80-R83 IonicContact OE2-NE 2.96Å; E80-R83 PolarHBondContact OE2-NE 2.75Å; E80-R83 IonicContact OE2-NH2 3.23Å; E80-R83 PolarHBondContact OE2-NH2 3.48Å; F81-R83 VanDerWaalsContact C-N 3.28Å; F81-R83 PolarHBondContact O-N 3.43Å; R83-V85 PolarHBondContact O-N 2.88Å; R83-T86 PolarHBondContact O-N 2.76Å; R83-E87 VanDerWaalsContact CG-OE1 3.25Å; R83-E87 WeakPolarHBondContact CG-OE1 3.28Å; R83-E87 IonicContact NH1-OE1 3.22Å; R83-E87 PolarHBondContact NH1-OE1 3.01Å; R83-E87 WeakPolarHBondContact O-CB 3.36Å; R83-E87 VanDerWaalsContact O-CG 3.28Å; R83-E87 WeakPolarHBondContact O-CG 3.48Å; R83-E87 PolarHBondContact O-N 3.32Å |
| 84 | L | 85.9 | Confident | 70.8 | Confident | 102 Ų | 102 | 85.8 Ų | 85.8 | 53% | 0.534 | 45% | 0.451 | S | S | . | . | H | α-helix | trans | -61.5 | -41.2 | 176.9 | -69.8 | 171.2 | 0 | 0 | 0 | 112.6 | E80 F81 E87 S88 | E80-L84 WeakPolarHBondContact O-CG 3.28Å; E80-L84 PolarHBondContact O-N 3.33Å; F81-L84 WeakPolarHBondContact O-CB 3.26Å; F81-L84 PolarHBondContact O-N 2.91Å; F81-L84 VanDerWaalsContact O-N 3.15Å; L84-E87 PolarHBondContact O-N 2.96Å; L84-S88 VanDerWaalsContact O-CB 3.28Å; L84-S88 WeakPolarHBondContact O-CB 3.4Å; L84-S88 PolarHBondContact O-N 3.19Å; L84-S88 PolarHBondContact O-OG 2.96Å |
| 85 | V | 84.8 | Confident | 70.2 | Confident | 8 Ų | 8 | 90.6 Ų | 90.6 | 5% | 0.048 | 46% | 0.464 | C | S | . | . | H | α-helix | trans | -63.5 | -49.3 | 178.1 | 171.4 | 0 | 0 | 0 | 0 | 110.8 | V58 F81 C82 R83 E87 S88 L89 | V58-V85 HydrophobicContact CG1-CG1 4.15Å; F81-V85 HydrophobicContact CD1-CG2 4.18Å; F81-V85 HydrophobicContact CD2-CG2 4.32Å; F81-V85 HydrophobicContact CE1-CG2 3.68Å; F81-V85 HydrophobicContact CE2-CG2 3.85Å; F81-V85 HydrophobicContact CG-CG2 4.48Å; F81-V85 HydrophobicContact CZ-CG2 3.5Å; F81-V85 VanDerWaalsContact CZ-CG2 3.5Å; F81-V85 WeakPolarHBondContact O-CG2 3.16Å; F81-V85 PolarHBondContact O-N 2.93Å; C82-V85 PolarHBondContact O-N 2.66Å; R83-V85 PolarHBondContact O-N 2.88Å; V85-E87 VanDerWaalsContact C-N 3.34Å; V85-E87 PolarHBondContact O-N 2.81Å; V85-S88 PolarHBondContact O-N 2.89Å; V85-S88 PolarHBondContact O-OG 3.41Å; V85-L89 PolarHBondContact O-N 3.02Å; V85-L89 VanDerWaalsContact O-N 3.11Å |
| 86 | T | 80.3 | Confident | 69 | Low | 29 Ų | 29 | 93.2 Ų | 93.2 | 18% | 0.178 | 47% | 0.473 | C | S | . | . | H | α-helix | trans | -62.5 | -39.3 | 178.2 | -53.4 | 0 | 0 | 0 | 0 | 111.9 | C82 R83 | C82-T86 PolarHBondContact O-N 3.11Å; C82-T86 PolarHBondContact O-OG1 2.84Å; R83-T86 PolarHBondContact O-N 2.76Å |
| 87 | E | 80.4 | Confident | 67.7 | Low | 95 Ų | 95 | 94.8 Ų | 94.8 | 44% | 0.444 | 47% | 0.472 | S | S | . | . | H | α-helix | trans | -66.4 | -36.7 | 174.9 | -74 | 174.7 | -163 | 0 | 0 | 112.5 | R83 L84 V85 | R83-E87 VanDerWaalsContact CG-OE1 3.25Å; R83-E87 WeakPolarHBondContact CG-OE1 3.28Å; R83-E87 IonicContact NH1-OE1 3.22Å; R83-E87 PolarHBondContact NH1-OE1 3.01Å; R83-E87 WeakPolarHBondContact O-CB 3.36Å; R83-E87 VanDerWaalsContact O-CG 3.28Å; R83-E87 WeakPolarHBondContact O-CG 3.48Å; R83-E87 PolarHBondContact O-N 3.32Å; L84-E87 PolarHBondContact O-N 2.96Å; V85-E87 VanDerWaalsContact C-N 3.34Å; V85-E87 PolarHBondContact O-N 2.81Å |
| 88 | S | 70.7 | Confident | 66.5 | Low | 70 Ų | 70 | 99.2 Ų | 99.2 | 49% | 0.49 | 48% | 0.478 | S | S | . | . | H | α-helix | trans | -72 | -32.6 | -179.4 | 72.6 | 0 | 0 | 0 | 0 | 113.2 | L84 V85 Q90 K91 | L84-S88 VanDerWaalsContact O-CB 3.28Å; L84-S88 WeakPolarHBondContact O-CB 3.4Å; L84-S88 PolarHBondContact O-N 3.19Å; L84-S88 PolarHBondContact O-OG 2.96Å; V85-S88 PolarHBondContact O-N 2.89Å; V85-S88 PolarHBondContact O-OG 3.41Å; S88-Q90 VanDerWaalsContact C-N 3.34Å; S88-Q90 PolarHBondContact O-N 3.43Å; S88-K91 PolarHBondContact O-N 3.46Å |
| 89 | L | 63.5 | Low | 64.9 | Low | 52 Ų | 52 | 104.5 Ų | 104.5 | 27% | 0.272 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -80 | -12.4 | -177.6 | -148.3 | 93 | 0 | 0 | 0 | 113.7 | W55 H59 V85 K91 P92 | W55-L89 HydrophobicContact CB-CD1 4.35Å; H59-L89 HydrophobicContact CB-CD2 4.11Å; V85-L89 PolarHBondContact O-N 3.02Å; V85-L89 VanDerWaalsContact O-N 3.11Å; L89-K91 VanDerWaalsContact C-N 3.32Å; L89-P92 WeakPolarHBondContact O-CD 2.82Å; L89-P92 VanDerWaalsContact O-CG 3.27Å; L89-P92 WeakPolarHBondContact O-CG 3.25Å |
| 90 | Q | 59.3 | Low | 63.6 | Low | 150 Ų | 150 | 104.4 Ų | 104.4 | 70% | 0.701 | 51% | 0.509 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -79.7 | -15.8 | 173.3 | -71.4 | 178.6 | -5.2 | 0 | 0 | 112.7 | S88 | S88-Q90 VanDerWaalsContact C-N 3.34Å; S88-Q90 PolarHBondContact O-N 3.43Å |
| 91 | K | 51 | Low | 62.1 | Low | 168 Ų | 168 | 105.5 Ų | 105.5 | 73% | 0.73 | 52% | 0.522 | S | S | * | . | S | Bend | trans | -91.6 | -3.1 | -179.7 | -79.9 | 178.6 | 176.8 | 173.6 | 0 | 119.3 | S88 L89 L93 | S88-K91 PolarHBondContact O-N 3.46Å; L89-K91 VanDerWaalsContact C-N 3.32Å; K91-L93 VanDerWaalsContact C-N 3.35Å; K91-L93 PolarHBondContact O-N 2.99Å |
| 92 | P | 50.4 | Low | 61.1 | Low | 72 Ų | 72 | 109.5 Ų | 109.5 | 47% | 0.468 | 54% | 0.539 | S | S | . | . | G | 310 helix | trans | -76.6 | -19.3 | -178.5 | 13.5 | -6.4 | 0 | 0 | 0 | 113.9 | L89 E94 Q95 | L89-P92 WeakPolarHBondContact O-CD 2.82Å; L89-P92 VanDerWaalsContact O-CG 3.27Å; L89-P92 WeakPolarHBondContact O-CG 3.25Å; P92-E94 PolarHBondContact O-N 3.45Å; P92-Q95 PolarHBondContact O-N 3.41Å |
| 93 | L | 41.2 | Very low | 59.8 | Low | 158 Ų | 158 | 119.3 Ų | 119.3 | 83% | 0.827 | 58% | 0.576 | S | S | * | * | G | 310 helix | trans | -65.8 | -24.6 | -169.5 | -169.6 | 58.7 | 0 | 0 | 0 | 113.3 | K91 | K91-L93 VanDerWaalsContact C-N 3.35Å; K91-L93 PolarHBondContact O-N 2.99Å |
| 94 | E | 42.3 | Very low | 58.8 | Low | 178 Ų | 178 | 121.1 Ų | 121.1 | 83% | 0.832 | 59% | 0.587 | S | S | * | * | G | 310 helix | trans | -98.2 | -11.6 | 179.7 | -66.2 | -110.1 | 146.3 | 0 | 0 | 113.6 | P92 | P92-E94 PolarHBondContact O-N 3.45Š|
| 95 | Q | 44.5 | Very low | 58 | Low | 135 Ų | 135 | 121.5 Ų | 121.5 | 63% | 0.631 | 59% | 0.589 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -92.7 | -22.7 | -173.5 | -165.3 | 168.1 | -10.6 | 0 | 0 | 113.6 | P92 H99 | P92-Q95 PolarHBondContact O-N 3.41Å; Q95-H99 PolarHBondContact O-CD2 3.43Å |
| 96 | N | 41.6 | Very low | 56.8 | Low | 122 Ų | 122 | 126.6 Ų | 126.6 | 65% | 0.652 | 61% | 0.611 | S | S | * | * | G | 310 helix | trans | -70.4 | -35.8 | 178.3 | -170.9 | -29.5 | 0 | 0 | 0 | 112.2 | K98 H99 | N96-K98 PolarHBondContact O-N 3.16Å; N96-H99 PolarHBondContact O-N 2.76Å |
| 97 | E | 46.3 | Very low | 55.4 | Low | 156 Ų | 156 | 132.4 Ų | 132.4 | 73% | 0.729 | 64% | 0.636 | S | S | * | * | G | 310 helix | trans | -68.2 | -11.2 | -172.4 | -148.8 | -178.1 | -178.7 | 0 | 0 | 114.3 | N100 | E97-N100 PolarHBondContact O-OD1 3Š|
| 98 | K | 52.3 | Low | 54.1 | Low | 164 Ų | 164 | 136.7 Ų | 136.7 | 71% | 0.713 | 65% | 0.649 | S | S | * | * | G | 310 helix | trans | -108.5 | 3.6 | -178.2 | -155.9 | 176.5 | 178.1 | 177.2 | 0 | 114.6 | N96 N100 | N96-K98 PolarHBondContact O-N 3.16Å; K98-N100 PolarHBondContact O-N 3.28Å |
| 99 | H | 47.6 | Very low | 53.1 | Low | 144 Ų | 144 | 138.5 Ų | 138.5 | 67% | 0.667 | 66% | 0.662 | S | S | * | * | S | Bend | trans | -76.3 | -9.5 | 173.4 | -75.6 | -61.2 | 0 | 0 | 0 | 113.5 | Q95 N96 | Q95-H99 PolarHBondContact O-CD2 3.43Å; N96-H99 PolarHBondContact O-N 2.76Å |
| 100 | N | 54.7 | Low | 52.3 | Low | 114 Ų | 114 | 145.6 Ų | 145.6 | 61% | 0.61 | 69% | 0.69 | S | S | * | * | S | Bend | trans | -113 | -0.6 | -174.6 | 41.3 | -32.2 | 0 | 0 | 0 | 113.6 | E97 K98 K102 | E97-N100 PolarHBondContact O-OD1 3Å; K98-N100 PolarHBondContact O-N 3.28Å; N100-K102 PolarHBondContact O-N 3.23Å |
| 101 | T | 52.3 | Low | 51.9 | Low | 108 Ų | 108 | 144.1 Ų | 144.1 | 66% | 0.663 | 69% | 0.691 | S | S | * | * | trans | -84.5 | 24.2 | 172.8 | -28.8 | 0 | 0 | 0 | 0 | 113.4 | ||||
| 102 | K | 62.8 | Low | 51.8 | Low | 154 Ų | 154 | 144.6 Ų | 144.6 | 67% | 0.67 | 70% | 0.697 | S | S | * | * | trans | -114.2 | 55.9 | 168.7 | -65.2 | -173.3 | -175.8 | 175.9 | 0 | 110 | N100 F104 | N100-K102 PolarHBondContact O-N 3.23Å; K102-F104 PolarHBondContact O-N 3.44Å | ||
| 103 | R | 59.8 | Low | 51.9 | Low | 211 Ų | 211 | 151.2 Ų | 151.2 | 80% | 0.796 | 72% | 0.718 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -70.3 | -15.3 | 179.2 | -142.9 | 175.2 | -162.4 | -136 | 2.7 | 113.5 | ||
| 104 | F | 63.3 | Low | 52.2 | Low | 154 Ų | 154 | 148.1 Ų | 148.1 | 68% | 0.675 | 71% | 0.71 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -151.2 | 48.1 | 179 | -55.5 | -75.1 | 0 | 0 | 0 | 114.5 | K102 F106 | K102-F104 PolarHBondContact O-N 3.44Å; F104-F106 HydrophobicContact CB-CE2 4.29Å; F104-F106 HydrophobicContact CD1-CE2 4.45Å; F104-F106 HydrophobicContact CD1-CZ 4.28Å |
| 105 | L | 69 | Low | 52.6 | Low | 109 Ų | 109 | 143.1 Ų | 143.1 | 57% | 0.571 | 71% | 0.706 | S | S | * | * | trans | -96.3 | 91.7 | 161.6 | -166.1 | 67.2 | 0 | 0 | 0 | 108 | H107 | L105-H107 PolarHBondContact O-CD2 3.33Å; L105-H107 PolarHBondContact O-N 3.49Å | ||
| 106 | F | 60.3 | Low | 52.9 | Low | 116 Ų | 116 | 144.4 Ų | 144.4 | 51% | 0.509 | 72% | 0.717 | S | S | . | * | trans | -63.6 | 105.3 | 172.7 | -61.9 | -83.9 | 0 | 0 | 0 | 108.3 | F104 Y108 | F104-F106 HydrophobicContact CB-CE2 4.29Å; F104-F106 HydrophobicContact CD1-CE2 4.45Å; F104-F106 HydrophobicContact CD1-CZ 4.28Å; F106-Y108 HydrophobicContact CB-CD2 4.39Å; F106-Y108 HydrophobicContact CB-CE2 3.83Å; F106-Y108 WeakPolarHBondContact O-CD2 3.27Å; F106-Y108 PolarHBondContact O-N 3.2Å; F106-Y108 VanDerWaalsContact O-N 3.17Å | ||
| 107 | H | 50 | Low | 53.1 | Low | 151 Ų | 151 | 141.7 Ų | 141.7 | 70% | 0.699 | 71% | 0.708 | S | S | * | * | trans | -75 | 100.6 | 171.1 | -74.6 | -76.2 | 0 | 0 | 0 | 108.2 | L105 S109 | L105-H107 PolarHBondContact O-CD2 3.33Å; L105-H107 PolarHBondContact O-N 3.49Å; H107-S109 PolarHBondContact O-N 3.18Å | ||
| 108 | Y | 53.7 | Low | 53.5 | Low | 185 Ų | 185 | 142.5 Ų | 142.5 | 73% | 0.725 | 72% | 0.717 | S | S | * | * | trans | -78.6 | 103.1 | 169.3 | -65.1 | -83.7 | 0 | 0 | 0 | 108.6 | F106 K110 | F106-Y108 HydrophobicContact CB-CD2 4.39Å; F106-Y108 HydrophobicContact CB-CE2 3.83Å; F106-Y108 WeakPolarHBondContact O-CD2 3.27Å; F106-Y108 PolarHBondContact O-N 3.2Å; F106-Y108 VanDerWaalsContact O-N 3.17Å; Y108-K110 PolarHBondContact O-N 3.46Å; Y108-K110 VanDerWaalsContact O-N 3.15Å | ||
| 109 | S | 49.3 | Very low | 53.2 | Low | 108 Ų | 108 | 140.5 Ų | 140.5 | 76% | 0.755 | 71% | 0.713 | S | S | * | * | trans | -69.5 | 105.1 | 159.1 | 40 | 0 | 0 | 0 | 0 | 107.4 | H107 T111 | H107-S109 PolarHBondContact O-N 3.18Å; S109-T111 PolarHBondContact O-N 3.15Å | ||
| 110 | K | 47.6 | Very low | 53.3 | Low | 200 Ų | 200 | 139.9 Ų | 139.9 | 87% | 0.87 | 72% | 0.719 | S | S | * | * | trans | -65.2 | 101.2 | 167.8 | -176.3 | 178.6 | 178.6 | -176.6 | 0 | 106.4 | Y108 E112 | Y108-K110 PolarHBondContact O-N 3.46Å; Y108-K110 VanDerWaalsContact O-N 3.15Å; K110-E112 PolarHBondContact O-N 3.29Å | ||
| 111 | T | 49.5 | Very low | 52.9 | Low | 119 Ų | 119 | 138.1 Ų | 138.1 | 73% | 0.73 | 72% | 0.716 | S | S | * | * | trans | -62.6 | 125.4 | 171.3 | 46.3 | 0 | 0 | 0 | 0 | 107.5 | S109 K113 | S109-T111 PolarHBondContact O-N 3.15Å; T111-K113 PolarHBondContact O-N 3.17Å | ||
| 112 | E | 50.4 | Low | 53.1 | Low | 179 Ų | 179 | 138.4 Ų | 138.4 | 84% | 0.836 | 72% | 0.722 | S | S | * | * | trans | -56.2 | 139.8 | 170.5 | -74 | -154.2 | 140.7 | 0 | 0 | 108.7 | K110 S114 | K110-E112 PolarHBondContact O-N 3.29Å; E112-S114 PolarHBondContact O-N 3.44Å | ||
| 113 | K | 51.3 | Low | 52.8 | Low | 211 Ų | 211 | 137.8 Ų | 137.8 | 92% | 0.917 | 73% | 0.73 | S | S | * | * | trans | -68.8 | 76.3 | 179.9 | -69.1 | 178.2 | 173.3 | -177.9 | 0 | 109 | T111 G115 | T111-K113 PolarHBondContact O-N 3.17Å; K113-G115 VanDerWaalsContact C-N 3.34Å; K113-G115 PolarHBondContact O-N 3.21Å; K113-G115 VanDerWaalsContact O-N 3.16Å | ||
| 114 | S | 47 | Very low | 53 | Low | 93 Ų | 93 | 131.2 Ų | 131.2 | 65% | 0.65 | 71% | 0.714 | S | S | * | * | trans | -75.9 | 97.5 | 157.3 | 58.2 | 0 | 0 | 0 | 0 | 106.5 | E112 N116 | E112-S114 PolarHBondContact O-N 3.44Å; S114-N116 PolarHBondContact O-N 3.31Å | ||
| 115 | G | 51.7 | Low | 52.9 | Low | 73 Ų | 73 | 127.7 Ų | 127.7 | 75% | 0.753 | 70% | 0.699 | S | S | * | * | S | Bend | trans | -54.9 | 129.3 | 171 | 0 | 0 | 0 | 0 | 0 | 108.6 | K113 | K113-G115 VanDerWaalsContact C-N 3.34Å; K113-G115 PolarHBondContact O-N 3.21Å; K113-G115 VanDerWaalsContact O-N 3.16Å |
| 116 | N | 50.3 | Low | 52.9 | Low | 161 Ų | 161 | 127 Ų | 127 | 86% | 0.861 | 70% | 0.701 | S | S | * | * | trans | 84.2 | 71 | 175.6 | -156.2 | 11.1 | 0 | 0 | 0 | 116.1 | S114 | S114-N116 PolarHBondContact O-N 3.31Š| ||
| 117 | S | 46.4 | Very low | 53.5 | Low | 66 Ų | 66 | 126.9 Ų | 126.9 | 46% | 0.462 | 71% | 0.705 | S | S | . | * | trans | -146.4 | 120.5 | 143.5 | 64.6 | 0 | 0 | 0 | 0 | 110 | I119 | S117-I119 PolarHBondContact O-N 3.47Å; S117-I119 WeakPolarHBondContact OG-CD1 3.29Å | ||
| 118 | N | 54 | Low | 54.4 | Low | 172 Ų | 172 | 123.9 Ų | 123.9 | 92% | 0.92 | 69% | 0.694 | S | S | * | * | trans | -70.1 | 54.1 | 164.5 | -91.4 | -40.3 | 0 | 0 | 0 | 109.4 | V120 | N118-V120 PolarHBondContact O-N 2.94Š| ||
| 119 | I | 45.5 | Very low | 55.2 | Low | 123 Ų | 123 | 121.6 Ų | 121.6 | 63% | 0.631 | 69% | 0.69 | S | S | * | * | trans | -84.7 | 100 | 169.5 | -66 | 169.7 | 0 | 0 | 0 | 104.5 | S117 S121 | S117-I119 PolarHBondContact O-N 3.47Å; S117-I119 WeakPolarHBondContact OG-CD1 3.29Å; I119-S121 PolarHBondContact O-N 3Å | ||
| 120 | V | 50.3 | Low | 56.4 | Low | 130 Ų | 130 | 119.9 Ų | 119.9 | 79% | 0.788 | 67% | 0.672 | S | S | * | * | trans | -56.5 | 92.7 | 160.8 | 175.4 | 0 | 0 | 0 | 0 | 105.6 | N118 S122 | N118-V120 PolarHBondContact O-N 2.94Å; V120-S122 VanDerWaalsContact C-N 3.31Å; V120-S122 PolarHBondContact O-N 3.26Å | ||
| 121 | S | 46.5 | Very low | 57.9 | Low | 78 Ų | 78 | 114.2 Ų | 114.2 | 55% | 0.545 | 65% | 0.654 | S | S | . | * | trans | -64.2 | 100.1 | 172.4 | 58.5 | 0 | 0 | 0 | 0 | 105.9 | I119 V123 V124 | I119-S121 PolarHBondContact O-N 3Å; S121-V123 PolarHBondContact O-N 3.32Å; S121-V124 VanDerWaalsContact O-CG2 3.29Å; S121-V124 WeakPolarHBondContact O-CG2 3.46Å | ||
| 122 | S | 56.5 | Low | 59.3 | Low | 114 Ų | 114 | 112.3 Ų | 112.3 | 80% | 0.797 | 64% | 0.644 | S | S | * | * | S | Bend | trans | -69 | 19 | -168.2 | -177.7 | 0 | 0 | 0 | 0 | 114.6 | V120 | V120-S122 VanDerWaalsContact C-N 3.31Å; V120-S122 PolarHBondContact O-N 3.26Å |
| 123 | V | 56.9 | Low | 60.5 | Low | 140 Ų | 140 | 108.7 Ų | 108.7 | 85% | 0.848 | 63% | 0.627 | S | S | * | * | trans | -139.5 | 70 | 171.2 | -169.8 | 0 | 0 | 0 | 0 | 108.6 | S121 | S121-V123 PolarHBondContact O-N 3.32Š| ||
| 124 | V | 64.5 | Low | 61.9 | Low | 74 Ų | 74 | 103.5 Ų | 103.5 | 45% | 0.448 | 61% | 0.608 | S | S | . | * | trans | -84.2 | 116.6 | 168.1 | -169.3 | 0 | 0 | 0 | 0 | 106.8 | S121 L128 | S121-V124 VanDerWaalsContact O-CG2 3.29Å; S121-V124 WeakPolarHBondContact O-CG2 3.46Å; V124-L128 HydrophobicContact CG1-CB 3.52Å | ||
| 125 | H | 60.9 | Low | 63.4 | Low | 80 Ų | 80 | 104.1 Ų | 104.1 | 37% | 0.37 | 60% | 0.601 | S | S | . | * | trans | -50.8 | 138.6 | 174.2 | -175.6 | -83.8 | 0 | 0 | 0 | 109.5 | L127 L128 Q129 | H125-L127 WeakPolarHBondContact ND1-CB 3.47Å; H125-L127 PolarHBondContact ND1-N 3.37Å; H125-L127 PolarHBondContact O-N 3.21Å; H125-L128 HydrophobicContact CB-CD1 4.3Å; H125-L128 HydrophobicContact CB-CG 4.32Å; H125-L128 WeakPolarHBondContact O-CA 3.5Å; H125-L128 WeakPolarHBondContact O-CB 3.47Å; H125-L128 PolarHBondContact O-N 3.02Å; H125-Q129 PolarHBondContact O-N 3.14Å | ||
| 126 | P | 69.3 | Low | 64.7 | Low | 93 Ų | 93 | 106.5 Ų | 106.5 | 60% | 0.604 | 59% | 0.592 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -51.1 | -32.5 | -174.1 | -29.6 | 34.3 | 0 | 0 | 0 | 114.4 | Q129 | P126-Q129 WeakPolarHBondContact O-CB 3.42Š|
| 127 | L | 72.1 | Confident | 66 | Low | 114 Ų | 114 | 106.5 Ų | 106.5 | 60% | 0.597 | 58% | 0.58 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -71.4 | -31 | 175.6 | -60.9 | 177.8 | 0 | 0 | 0 | 114.3 | H125 Q129 L130 | H125-L127 WeakPolarHBondContact ND1-CB 3.47Å; H125-L127 PolarHBondContact ND1-N 3.37Å; H125-L127 PolarHBondContact O-N 3.21Å; L127-Q129 VanDerWaalsContact C-N 3.3Å; L127-L130 HydrophobicContact CD2-CD1 4.18Å; L127-L130 WeakPolarHBondContact O-CB 3.46Å; L127-L130 PolarHBondContact O-N 3.27Å; L127-L130 VanDerWaalsContact O-N 3.16Å |
| 128 | L | 68 | Low | 67.5 | Low | 88 Ų | 88 | 111.9 Ų | 111.9 | 46% | 0.461 | 59% | 0.59 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -72.8 | -26.1 | 177.5 | -69.3 | 179.2 | 0 | 0 | 0 | 111.8 | V124 H125 L130 V131 | V124-L128 HydrophobicContact CG1-CB 3.52Å; H125-L128 HydrophobicContact CB-CD1 4.3Å; H125-L128 HydrophobicContact CB-CG 4.32Å; H125-L128 WeakPolarHBondContact O-CA 3.5Å; H125-L128 WeakPolarHBondContact O-CB 3.47Å; H125-L128 PolarHBondContact O-N 3.02Å; L128-L130 PolarHBondContact O-N 2.98Å; L128-V131 HydrophobicContact CD2-CG2 4.15Å; L128-V131 WeakPolarHBondContact O-CB 3.5Å; L128-V131 PolarHBondContact O-N 3.45Å |
| 129 | Q | 70.6 | Confident | 68.4 | Low | 138 Ų | 138 | 107.7 Ų | 107.7 | 65% | 0.645 | 57% | 0.566 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -63.5 | -25.2 | 169.4 | -172.6 | 178.4 | -14.1 | 0 | 0 | 112.4 | H125 P126 L127 P132 | H125-Q129 PolarHBondContact O-N 3.14Å; P126-Q129 WeakPolarHBondContact O-CB 3.42Å; L127-Q129 VanDerWaalsContact C-N 3.3Å; Q129-P132 WeakPolarHBondContact O-CD 3.34Å |
| 130 | L | 75.8 | Confident | 69.8 | Low | 72 Ų | 72 | 108.5 Ų | 108.5 | 38% | 0.377 | 57% | 0.565 | S | S | . | * | H | α-helix | trans | -82.7 | -15.5 | 178.8 | -56.2 | 177.2 | 0 | 0 | 0 | 112.8 | L127 L128 Q133 L134 | L127-L130 HydrophobicContact CD2-CD1 4.18Å; L127-L130 WeakPolarHBondContact O-CB 3.46Å; L127-L130 PolarHBondContact O-N 3.27Å; L127-L130 VanDerWaalsContact O-N 3.16Å; L128-L130 PolarHBondContact O-N 2.98Å; L130-Q133 PolarHBondContact O-N 2.77Å; L130-Q133 VanDerWaalsContact O-N 3.14Å; L130-L134 WeakPolarHBondContact O-CG 3.41Å; L130-L134 PolarHBondContact O-N 2.98Å |
| 131 | V | 79.1 | Confident | 70.6 | Confident | 80 Ų | 80 | 110.8 Ų | 110.8 | 49% | 0.485 | 56% | 0.56 | S | S | . | * | H | α-helix | trans | -59.5 | -45.4 | -176.4 | 173.4 | 0 | 0 | 0 | 0 | 112.3 | L128 Q133 L134 H135 | L128-V131 HydrophobicContact CD2-CG2 4.15Å; L128-V131 WeakPolarHBondContact O-CB 3.5Å; L128-V131 PolarHBondContact O-N 3.45Å; V131-Q133 PolarHBondContact O-N 3.16Å; V131-L134 PolarHBondContact O-N 3.24Å; V131-H135 WeakPolarHBondContact O-CB 3.41Å; V131-H135 PolarHBondContact O-N 3.47Å |
| 132 | P | 78.1 | Confident | 71.5 | Confident | 80 Ų | 80 | 113 Ų | 113 | 52% | 0.519 | 56% | 0.56 | S | S | . | * | H | α-helix | trans | -58.8 | -43.6 | 173.1 | -24.6 | 34.9 | 0 | 0 | 0 | 112.9 | Q129 L134 H135 E136 | Q129-P132 WeakPolarHBondContact O-CD 3.34Å; P132-L134 PolarHBondContact O-N 2.91Å; P132-H135 WeakPolarHBondContact O-CB 3.46Å; P132-H135 PolarHBondContact O-N 3.38Å; P132-E136 PolarHBondContact O-N 2.86Å |
| 133 | Q | 76.3 | Confident | 71.8 | Confident | 103 Ų | 103 | 113.9 Ų | 113.9 | 48% | 0.481 | 55% | 0.549 | S | S | . | . | H | α-helix | trans | -66.4 | -38.1 | 179.9 | -64.2 | -174 | -24 | 0 | 0 | 112.7 | L130 V131 R137 | L130-Q133 PolarHBondContact O-N 2.77Å; L130-Q133 VanDerWaalsContact O-N 3.14Å; V131-Q133 PolarHBondContact O-N 3.16Å; Q133-R137 WeakPolarHBondContact O-CG 3.48Å; Q133-R137 PolarHBondContact O-N 3.38Å; Q133-R137 VanDerWaalsContact O-N 3.15Å |
| 134 | L | 80 | Confident | 71.9 | Confident | 102 Ų | 102 | 113 Ų | 113 | 53% | 0.534 | 54% | 0.536 | S | S | . | . | H | α-helix | trans | -69.9 | -36.2 | 174.7 | -67.8 | 179 | 0 | 0 | 0 | 111.6 | L130 V131 P132 R137 R138 | L130-L134 WeakPolarHBondContact O-CG 3.41Å; L130-L134 PolarHBondContact O-N 2.98Å; V131-L134 PolarHBondContact O-N 3.24Å; P132-L134 PolarHBondContact O-N 2.91Å; L134-R137 PolarHBondContact O-N 2.96Å; L134-R138 WeakPolarHBondContact O-CB 3.4Å; L134-R138 PolarHBondContact O-N 2.93Å |
| 135 | H | 78.6 | Confident | 71.6 | Confident | 106 Ų | 106 | 114.8 Ų | 114.8 | 49% | 0.491 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -63.4 | -46.4 | 175.3 | 178.7 | 69.1 | 0 | 0 | 0 | 111.4 | V131 P132 R137 R138 M139 | V131-H135 WeakPolarHBondContact O-CB 3.41Å; V131-H135 PolarHBondContact O-N 3.47Å; P132-H135 WeakPolarHBondContact O-CB 3.46Å; P132-H135 PolarHBondContact O-N 3.38Å; H135-R137 PolarHBondContact O-N 3.14Å; H135-R138 WeakPolarHBondContact O-CB 3.36Å; H135-R138 PolarHBondContact O-N 3.43Å; H135-R138 VanDerWaalsContact O-N 3.14Å; H135-M139 WeakPolarHBondContact O-CG 3.36Å; H135-M139 PolarHBondContact O-N 3.15Å |
| 136 | E | 79 | Confident | 71.4 | Confident | 123 Ų | 123 | 117.3 Ų | 117.3 | 58% | 0.575 | 56% | 0.555 | S | S | * | * | H | α-helix | trans | -58.9 | -45 | 174.4 | -73.9 | -177.7 | 179.6 | 0 | 0 | 112.3 | P132 R138 M139 K140 | P132-E136 PolarHBondContact O-N 2.86Å; E136-R138 VanDerWaalsContact C-N 3.29Å; E136-R138 PolarHBondContact O-N 3.42Å; E136-M139 PolarHBondContact O-N 2.96Å; E136-K140 WeakPolarHBondContact O-CG 3.42Å; E136-K140 PolarHBondContact O-N 3.5Å |
| 137 | R | 78.2 | Confident | 70.8 | Confident | 160 Ų | 160 | 119.9 Ų | 119.9 | 60% | 0.604 | 56% | 0.559 | S | S | * | * | H | α-helix | trans | -60.5 | -38.7 | 175.5 | -74.1 | 180 | -174.7 | -177 | 2.4 | 112.1 | Q133 L134 H135 R141 | Q133-R137 WeakPolarHBondContact O-CG 3.48Å; Q133-R137 PolarHBondContact O-N 3.38Å; Q133-R137 VanDerWaalsContact O-N 3.15Å; L134-R137 PolarHBondContact O-N 2.96Å; H135-R137 PolarHBondContact O-N 3.14Å; R137-R141 WeakPolarHBondContact O-CG 3.47Å; R137-R141 PolarHBondContact O-N 3.47Å |
| 138 | R | 77.9 | Confident | 69.8 | Low | 180 Ų | 180 | 116.9 Ų | 116.9 | 68% | 0.679 | 55% | 0.547 | S | S | * | . | H | α-helix | trans | -65.9 | -43.9 | 176.1 | -177 | -176.8 | -80.9 | 171.5 | -5.2 | 111.3 | L134 H135 E136 R141 F142 | L134-R138 WeakPolarHBondContact O-CB 3.4Å; L134-R138 PolarHBondContact O-N 2.93Å; H135-R138 WeakPolarHBondContact O-CB 3.36Å; H135-R138 PolarHBondContact O-N 3.43Å; H135-R138 VanDerWaalsContact O-N 3.14Å; E136-R138 VanDerWaalsContact C-N 3.29Å; E136-R138 PolarHBondContact O-N 3.42Å; R138-R141 PolarHBondContact O-N 3.2Å; R138-F142 WeakPolarHBondContact O-CB 3.49Å; R138-F142 PolarHBondContact O-N 2.98Å |
| 139 | M | 73.1 | Confident | 69 | Low | 84 Ų | 84 | 119.2 Ų | 119.2 | 41% | 0.414 | 57% | 0.568 | S | S | . | * | H | α-helix | trans | -66.6 | -36 | 179.3 | -66.6 | -60.4 | 95.7 | 0 | 0 | 112.4 | H135 E136 F142 K143 | H135-M139 WeakPolarHBondContact O-CG 3.36Å; H135-M139 PolarHBondContact O-N 3.15Å; E136-M139 PolarHBondContact O-N 2.96Å; M139-F142 PolarHBondContact O-N 2.93Å; M139-K143 WeakPolarHBondContact O-CB 3.45Å; M139-K143 PolarHBondContact O-N 3.41Å |
| 140 | K | 73.4 | Confident | 68.3 | Low | 139 Ų | 139 | 120 Ų | 120 | 60% | 0.604 | 57% | 0.569 | S | S | * | * | H | α-helix | trans | -62.4 | -49.1 | 173.3 | -73.7 | -174.3 | -179.3 | -175.5 | 0 | 112.2 | E136 F142 K143 E144 | E136-K140 WeakPolarHBondContact O-CG 3.42Å; E136-K140 PolarHBondContact O-N 3.5Å; K140-F142 VanDerWaalsContact C-N 3.33Å; K140-F142 PolarHBondContact O-N 2.95Å; K140-K143 PolarHBondContact O-N 3.2Å; K140-E144 WeakPolarHBondContact O-CG 3.38Å; K140-E144 PolarHBondContact O-N 3.41Å |
| 141 | R | 67.4 | Low | 67.2 | Low | 178 Ų | 178 | 120.1 Ų | 120.1 | 67% | 0.672 | 58% | 0.58 | S | S | * | * | H | α-helix | trans | -61.2 | -41.3 | 176.7 | -69.7 | -178.9 | -170.9 | -169.2 | 0.9 | 112.5 | R137 R138 K143 E144 E145 | R137-R141 WeakPolarHBondContact O-CG 3.47Å; R137-R141 PolarHBondContact O-N 3.47Å; R138-R141 PolarHBondContact O-N 3.2Å; R141-K143 VanDerWaalsContact C-N 3.33Å; R141-K143 PolarHBondContact O-N 3.38Å; R141-E144 PolarHBondContact O-N 3.15Å; R141-E145 VanDerWaalsContact O-CB 3.3Å; R141-E145 WeakPolarHBondContact O-CB 3.47Å; R141-E145 PolarHBondContact O-N 3.44Å |
| 142 | F | 65.1 | Low | 66.1 | Low | 124 Ų | 124 | 119.5 Ų | 119.5 | 54% | 0.544 | 59% | 0.59 | S | S | . | * | H | α-helix | trans | -64.2 | -39.9 | 177.4 | -174.3 | -99.6 | 0 | 0 | 0 | 111.9 | R138 M139 K140 E145 L146 | R138-F142 WeakPolarHBondContact O-CB 3.49Å; R138-F142 PolarHBondContact O-N 2.98Å; M139-F142 PolarHBondContact O-N 2.93Å; K140-F142 VanDerWaalsContact C-N 3.33Å; K140-F142 PolarHBondContact O-N 2.95Å; F142-E145 PolarHBondContact O-N 3.24Å; F142-L146 WeakPolarHBondContact O-CB 3.49Å; F142-L146 PolarHBondContact O-N 3.04Å |
| 143 | K | 63.5 | Low | 65 | Low | 133 Ų | 133 | 122.6 Ų | 122.6 | 58% | 0.578 | 60% | 0.598 | S | S | * | * | H | α-helix | trans | -66.6 | -39.3 | 175.5 | -170.7 | 176.9 | 179.1 | -178.2 | 0 | 112.1 | M139 K140 R141 Q147 | M139-K143 WeakPolarHBondContact O-CB 3.45Å; M139-K143 PolarHBondContact O-N 3.41Å; K140-K143 PolarHBondContact O-N 3.2Å; R141-K143 VanDerWaalsContact C-N 3.33Å; R141-K143 PolarHBondContact O-N 3.38Å; K143-Q147 WeakPolarHBondContact O-CB 3.4Å; K143-Q147 WeakPolarHBondContact O-CG 3.3Å; K143-Q147 PolarHBondContact O-N 2.85Å; K143-Q147 VanDerWaalsContact O-N 3.15Å |
| 144 | E | 59.7 | Low | 64.1 | Low | 123 Ų | 123 | 122 Ų | 122 | 58% | 0.575 | 61% | 0.605 | S | S | * | * | H | α-helix | trans | -67.6 | -38.2 | 175 | -73.9 | 159.9 | -177.4 | 0 | 0 | 112.2 | K140 R141 Q147 S148 | K140-E144 WeakPolarHBondContact O-CG 3.38Å; K140-E144 PolarHBondContact O-N 3.41Å; R141-E144 PolarHBondContact O-N 3.15Å; E144-Q147 PolarHBondContact O-N 3.33Å; E144-S148 WeakPolarHBondContact O-CB 3.35Å; E144-S148 PolarHBondContact O-N 3.05Å |
| 145 | E | 57.4 | Low | 63.1 | Low | 111 Ų | 111 | 128.7 Ų | 128.7 | 52% | 0.519 | 62% | 0.623 | S | S | . | * | H | α-helix | trans | -68.3 | -34.2 | 176.6 | -168.5 | 169.3 | -166.9 | 0 | 0 | 112.1 | R141 F142 | R141-E145 VanDerWaalsContact O-CB 3.3Å; R141-E145 WeakPolarHBondContact O-CB 3.47Å; R141-E145 PolarHBondContact O-N 3.44Å; F142-E145 PolarHBondContact O-N 3.24Å |
| 146 | L | 57.3 | Low | 62 | Low | 132 Ų | 132 | 126.1 Ų | 126.1 | 69% | 0.691 | 63% | 0.626 | S | S | * | * | H | α-helix | trans | -75.5 | -27.2 | 175.4 | -157.3 | 81.2 | 0 | 0 | 0 | 113.3 | F142 | F142-L146 WeakPolarHBondContact O-CB 3.49Å; F142-L146 PolarHBondContact O-N 3.04Å |
| 147 | Q | 55.5 | Low | 61 | Low | 148 Ų | 148 | 129.4 Ų | 129.4 | 69% | 0.692 | 63% | 0.634 | S | S | * | * | H | α-helix | trans | -92.1 | -9.4 | 178.9 | -70.8 | -174.6 | -11.2 | 0 | 0 | 113.4 | K143 E144 | K143-Q147 WeakPolarHBondContact O-CB 3.4Å; K143-Q147 WeakPolarHBondContact O-CG 3.3Å; K143-Q147 PolarHBondContact O-N 2.85Å; K143-Q147 VanDerWaalsContact O-N 3.15Å; E144-Q147 PolarHBondContact O-N 3.33Å |
| 148 | S | 52.1 | Low | 60 | Low | 51 Ų | 51 | 131.6 Ų | 131.6 | 36% | 0.357 | 65% | 0.648 | S | S | . | * | S | Bend | trans | -77.3 | 131.5 | 175.2 | 169.1 | 0 | 0 | 0 | 0 | 110.8 | E144 F150 A151 | E144-S148 WeakPolarHBondContact O-CB 3.35Å; E144-S148 PolarHBondContact O-N 3.05Å; S148-F150 PolarHBondContact O-N 2.9Å; S148-F150 PolarHBondContact OG-N 3.27Å; S148-A151 PolarHBondContact O-N 3.5Å |
| 149 | P | 51.3 | Low | 59 | Low | 137 Ų | 137 | 130 Ų | 130 | 89% | 0.89 | 65% | 0.652 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -62 | -2 | 174.2 | -19.6 | 31 | 0 | 0 | 0 | 114.7 | ||
| 150 | F | 55.6 | Low | 57.9 | Low | 155 Ų | 155 | 134.9 Ų | 134.9 | 68% | 0.68 | 67% | 0.672 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -116.1 | 34.2 | -173.9 | -126.7 | -90.6 | 0 | 0 | 0 | 112.7 | S148 G152 | S148-F150 PolarHBondContact O-N 2.9Å; S148-F150 PolarHBondContact OG-N 3.27Å; F150-G152 PolarHBondContact O-N 3.49Å |
| 151 | A | 52.8 | Low | 57.2 | Low | 73 Ų | 73 | 138.2 Ų | 138.2 | 60% | 0.603 | 68% | 0.68 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -70.1 | 35.2 | -177.1 | 0 | 0 | 0 | 0 | 0 | 115.2 | S148 | S148-A151 PolarHBondContact O-N 3.5Š|
| 152 | G | 55.6 | Low | 56.7 | Low | 67 Ų | 67 | 133.1 Ų | 133.1 | 69% | 0.691 | 67% | 0.67 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -129.9 | 2.7 | -170.2 | 0 | 0 | 0 | 0 | 0 | 116.8 | F150 | F150-G152 PolarHBondContact O-N 3.49Š|
| 153 | Q | 55.4 | Low | 56.5 | Low | 145 Ų | 145 | 139.3 Ų | 139.3 | 68% | 0.678 | 69% | 0.69 | S | S | * | * | trans | -122.5 | 65.7 | 177.8 | -70.9 | -176.2 | 14.9 | 0 | 0 | 111.2 | R155 | Q153-R155 PolarHBondContact O-N 2.79Š| ||
| 154 | S | 57.9 | Low | 56.3 | Low | 92 Ų | 92 | 139.9 Ų | 139.9 | 64% | 0.643 | 70% | 0.699 | S | S | * | * | trans | -65.4 | 88.9 | 163.3 | 78.4 | 0 | 0 | 0 | 0 | 108.4 | G156 | S154-G156 PolarHBondContact O-N 3.16Š| ||
| 155 | R | 57.7 | Low | 56.2 | Low | 242 Ų | 242 | 137.4 Ų | 137.4 | 91% | 0.913 | 71% | 0.707 | S | S | * | * | trans | -76.1 | 92.3 | -172 | -152.7 | 177.6 | -178.5 | -167.3 | 1.5 | 109.8 | Q153 | Q153-R155 PolarHBondContact O-N 2.79Š| ||
| 156 | G | 57 | Low | 56.2 | Low | 52 Ų | 52 | 140.7 Ų | 140.7 | 54% | 0.536 | 72% | 0.719 | S | S | . | * | trans | 75 | 106.9 | 152.7 | 0 | 0 | 0 | 0 | 0 | 116.3 | S154 F158 | S154-G156 PolarHBondContact O-N 3.16Å; G156-F158 PolarHBondContact O-N 3.45Å | ||
| 157 | Y | 57.6 | Low | 56.2 | Low | 192 Ų | 192 | 144.6 Ų | 144.6 | 75% | 0.753 | 73% | 0.725 | S | S | * | * | trans | -36.9 | 130.8 | 164.6 | -44.6 | -84.6 | 0 | 0 | 0 | 112.6 | L159 | Y157-L159 PolarHBondContact O-N 2.89Š| ||
| 158 | F | 57.3 | Low | 56.3 | Low | 205 Ų | 205 | 142.7 Ų | 142.7 | 90% | 0.899 | 73% | 0.728 | S | S | * | * | trans | -71.8 | 61.9 | 165.6 | -65.7 | -88.9 | 0 | 0 | 0 | 109.8 | G156 F160 | G156-F158 PolarHBondContact O-N 3.45Å; F158-F160 PolarHBondContact O-N 3.25Å; F158-F160 VanDerWaalsContact O-N 3.16Å | ||
| 159 | L | 56.7 | Low | 56.5 | Low | 147 Ų | 147 | 145.2 Ų | 145.2 | 77% | 0.77 | 75% | 0.752 | S | S | * | * | trans | -77.6 | 99.2 | 165.6 | -68.9 | 171.2 | 0 | 0 | 0 | 106.4 | Y157 | Y157-L159 PolarHBondContact O-N 2.89Š| ||
| 160 | F | 49.7 | Very low | 56.5 | Low | 186 Ų | 186 | 141.4 Ų | 141.4 | 82% | 0.816 | 74% | 0.737 | S | S | * | * | trans | 50.1 | 95 | 159.6 | -140.7 | -96.9 | 0 | 0 | 0 | 115.3 | F158 P162 | F158-F160 PolarHBondContact O-N 3.25Å; F158-F160 VanDerWaalsContact O-N 3.16Å; F160-P162 WeakPolarHBondContact O-CD 3.2Å | ||
| 161 | R | 58.1 | Low | 55.9 | Low | 210 Ų | 210 | 143.5 Ų | 143.5 | 79% | 0.792 | 75% | 0.747 | S | S | * | * | trans | -78.5 | 111.6 | 161.7 | -97.2 | -172.8 | -177.4 | -170.7 | 2.4 | 108.5 | R163 | R161-R163 PolarHBondContact O-N 2.82Š| ||
| 162 | P | 57 | Low | 55.4 | Low | 71 Ų | 71 | 151.7 Ų | 151.7 | 46% | 0.461 | 78% | 0.778 | S | S | . | * | trans | -64.8 | 135.6 | 171.7 | -14.3 | 31 | 0 | 0 | 0 | 108.4 | F160 N164 G165 | F160-P162 WeakPolarHBondContact O-CD 3.2Å; P162-N164 PolarHBondContact O-N 2.81Å; P162-G165 PolarHBondContact O-N 2.95Å | ||
| 163 | R | 61.8 | Low | 55.4 | Low | 253 Ų | 253 | 156 Ų | 156 | 96% | 0.955 | 78% | 0.782 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -56 | -14.9 | -176.5 | -86.9 | -177.2 | 166.7 | 131.3 | -3.7 | 114.6 | R161 | R161-R163 PolarHBondContact O-N 2.82Š|
| 164 | N | 59.7 | Low | 55.4 | Low | 145 Ų | 145 | 156.5 Ų | 156.5 | 78% | 0.775 | 79% | 0.788 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -98.7 | 14.2 | -174.3 | -62.9 | -2 | 0 | 0 | 0 | 114.3 | P162 K166 | P162-N164 PolarHBondContact O-N 2.81Å; N164-K166 PolarHBondContact O-N 3.41Å |
| 165 | G | 57.7 | Low | 55.3 | Low | 71 Ų | 71 | 160.1 Ų | 160.1 | 73% | 0.732 | 80% | 0.796 | S | S | * | * | trans | 67.5 | -6.8 | 168.4 | 0 | 0 | 0 | 0 | 0 | 116.8 | P162 R167 | P162-G165 PolarHBondContact O-N 2.95Å; G165-R167 PolarHBondContact O-N 2.84Å | ||
| 166 | K | 57.6 | Low | 55.1 | Low | 180 Ų | 180 | 155.3 Ų | 155.3 | 78% | 0.783 | 79% | 0.789 | S | S | * | * | trans | -82.2 | 113.3 | 175.7 | -75 | -178 | 172 | 176.7 | 0 | 110 | N164 | N164-K166 PolarHBondContact O-N 3.41Š| ||
| 167 | R | 56.2 | Low | 55 | Low | 215 Ų | 215 | 161.8 Ų | 161.8 | 81% | 0.811 | 81% | 0.805 | S | S | * | * | trans | -75.1 | 123.7 | 164.6 | -67.9 | -178.7 | 179 | -114.5 | 5.7 | 107.3 | G165 A169 | G165-R167 PolarHBondContact O-N 2.84Å; R167-A169 PolarHBondContact O-N 2.93Å | ||
| 168 | S | 57.5 | Low | 54.9 | Low | 108 Ų | 108 | 159.7 Ų | 159.7 | 76% | 0.755 | 81% | 0.808 | S | S | * | * | trans | -68.7 | 90.3 | 162.2 | 48.3 | 0 | 0 | 0 | 0 | 107.3 | G170 | S168-G170 PolarHBondContact O-N 3.26Š| ||
| 169 | A | 57.2 | Low | 54.7 | Low | 103 Ų | 103 | 156.5 Ų | 156.5 | 85% | 0.851 | 80% | 0.802 | S | S | * | * | trans | -71.9 | 105.4 | 159.8 | 0 | 0 | 0 | 0 | 0 | 106 | R167 | R167-A169 PolarHBondContact O-N 2.93Š| ||
| 170 | G | 50.6 | Low | 54.5 | Low | 57 Ų | 57 | 157.2 Ų | 157.2 | 59% | 0.588 | 80% | 0.804 | S | S | * | * | trans | 178.5 | 69.3 | -176.9 | 0 | 0 | 0 | 0 | 0 | 110.2 | S168 | S168-G170 PolarHBondContact O-N 3.26Š| ||
| 171 | F | 43.6 | Very low | 54.9 | Low | 199 Ų | 199 | 154.8 Ų | 154.8 | 87% | 0.873 | 80% | 0.803 | S | S | * | * | trans | -133.5 | 127.9 | 153.1 | -69.6 | -74.6 | 0 | 0 | 0 | 106.8 | ||||
| 172 | I | 42.2 | Very low | 54.6 | Low | 246 Ų | 246 | 149.8 Ų | 149.8 | 100% | 1.262 | 80% | 0.804 | S | S | * | * | trans | -54.3 | 0 | -178.1 | -64.1 | 160.9 | 0 | 0 | 0 | 110.9 |
Retrieved 172 of 172 residues in 87.8 ms
(Link to these results)