| 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 | 56.7 | Low | 77.5 | Confident | 218 Ų | 218 | 124.2 Ų | 124.2 | 100% | 1.074 | 65% | 0.645 | S | S | * | * | 0 | -21.3 | 0 | -58.9 | 179.1 | 83 | 0 | 0 | 114.2 | |||||
| 2 | R | 61.4 | Low | 78 | Confident | 232 Ų | 232 | 124.2 Ų | 124.2 | 88% | 0.875 | 65% | 0.645 | S | S | * | * | trans | -79.9 | -20.1 | -177.4 | -58.8 | -179.5 | -177.4 | 179.9 | -0.2 | 114.6 | ||||
| 3 | S | 67.9 | Low | 78.1 | Confident | 77 Ų | 77 | 120.2 Ų | 120.2 | 54% | 0.538 | 63% | 0.634 | S | S | . | * | S | Bend | trans | -84.2 | -17.1 | -178 | 44.1 | 0 | 0 | 0 | 0 | 114.7 | W5 I6 L7 | S3-W5 VanDerWaalsContact C-N 3.32Å; S3-W5 PolarHBondContact O-N 2.72Å; S3-I6 PolarHBondContact O-N 2.69Å; S3-L7 PolarHBondContact O-N 2.99Å |
| 4 | G | 76.8 | Confident | 77.9 | Confident | 43 Ų | 43 | 117.9 Ų | 117.9 | 44% | 0.443 | 63% | 0.632 | S | S | . | * | H | α-helix | trans | -64.9 | -35.9 | -178.6 | 0 | 0 | 0 | 0 | 0 | 113.1 | I6 L7 L8 | G4-I6 VanDerWaalsContact C-N 3.35Å; G4-L7 PolarHBondContact O-N 3.5Å; G4-L8 WeakPolarHBondContact O-CB 3.36Å; G4-L8 PolarHBondContact O-N 3Å |
| 5 | W | 76.3 | Confident | 77.5 | Confident | 207 Ų | 207 | 118.8 Ų | 118.8 | 78% | 0.784 | 64% | 0.636 | S | S | * | * | H | α-helix | trans | -70.4 | -31.5 | 179.1 | -71.3 | 81.6 | 0 | 0 | 0 | 112.9 | S3 S9 | S3-W5 VanDerWaalsContact C-N 3.32Å; S3-W5 PolarHBondContact O-N 2.72Å; W5-S9 PolarHBondContact O-N 3.32Å; W5-S9 PolarHBondContact O-OG 2.68Å |
| 6 | I | 87.6 | Confident | 76.8 | Confident | 109 Ų | 109 | 116.6 Ų | 116.6 | 56% | 0.559 | 63% | 0.631 | S | S | * | * | H | α-helix | trans | -73.6 | -39.4 | 177.9 | -59.3 | 167.9 | 0 | 0 | 0 | 110.1 | S3 G4 L8 S9 L10 | S3-I6 PolarHBondContact O-N 2.69Å; G4-I6 VanDerWaalsContact C-N 3.35Å; I6-L8 VanDerWaalsContact C-N 3.35Å; I6-S9 PolarHBondContact O-N 2.9Å; I6-S9 PolarHBondContact O-OG 3.45Å; I6-L10 VanDerWaalsContact O-CB 3.28Å; I6-L10 WeakPolarHBondContact O-CB 3.28Å; I6-L10 PolarHBondContact O-N 3.21Å |
| 7 | L | 85.5 | Confident | 76 | Confident | 119 Ų | 119 | 111.3 Ų | 111.3 | 62% | 0.623 | 61% | 0.61 | S | S | * | * | H | α-helix | trans | -69.1 | -35.7 | 175.6 | -66.7 | 174.2 | 0 | 0 | 0 | 111.7 | S3 G4 A11 | S3-L7 PolarHBondContact O-N 2.99Å; G4-L7 PolarHBondContact O-N 3.5Å; L7-A11 VanDerWaalsContact O-CB 3.25Å; L7-A11 WeakPolarHBondContact O-CB 3.3Å; L7-A11 PolarHBondContact O-N 2.7Å |
| 8 | L | 84.3 | Confident | 75 | Confident | 116 Ų | 116 | 108.3 Ų | 108.3 | 61% | 0.607 | 60% | 0.603 | S | S | * | * | H | α-helix | trans | -66.2 | -43.5 | 175 | -168 | 106.4 | 0 | 0 | 0 | 111.8 | G4 I6 A11 L12 | G4-L8 WeakPolarHBondContact O-CB 3.36Å; G4-L8 PolarHBondContact O-N 3Å; I6-L8 VanDerWaalsContact C-N 3.35Å; L8-A11 PolarHBondContact O-N 3.06Å; L8-L12 WeakPolarHBondContact O-CB 3.42Å; L8-L12 PolarHBondContact O-N 3.39Å |
| 9 | S | 88.1 | Confident | 74.1 | Confident | 69 Ų | 69 | 105.8 Ų | 105.8 | 48% | 0.483 | 60% | 0.597 | S | S | . | * | H | α-helix | trans | -68.5 | -36.6 | 177.7 | 65.5 | 0 | 0 | 0 | 0 | 112.3 | W5 I6 S13 | W5-S9 PolarHBondContact O-N 3.32Å; W5-S9 PolarHBondContact O-OG 2.68Å; I6-S9 PolarHBondContact O-N 2.9Å; I6-S9 PolarHBondContact O-OG 3.45Å; S9-S13 WeakPolarHBondContact O-CB 3.4Å; S9-S13 PolarHBondContact O-N 3.41Å; S9-S13 PolarHBondContact O-OG 2.98Å |
| 10 | L | 84.4 | Confident | 73.3 | Confident | 115 Ų | 115 | 105.3 Ų | 105.3 | 60% | 0.602 | 60% | 0.596 | S | S | * | * | H | α-helix | trans | -69.2 | -38.9 | 176.1 | -160.4 | 118.6 | 0 | 0 | 0 | 111.8 | I6 S13 C14 | I6-L10 VanDerWaalsContact O-CB 3.28Å; I6-L10 WeakPolarHBondContact O-CB 3.28Å; I6-L10 PolarHBondContact O-N 3.21Å; L10-S13 WeakPolarHBondContact CA-OG 3.25Å; L10-S13 PolarHBondContact O-OG 2.87Å; L10-C14 VanDerWaalsContact O-CB 3.3Å; L10-C14 WeakPolarHBondContact O-CB 3.49Å; L10-C14 PolarHBondContact O-N 3.45Å |
| 11 | A | 83.9 | Confident | 72.4 | Confident | 61 Ų | 61 | 108.1 Ų | 108.1 | 50% | 0.504 | 60% | 0.602 | S | S | . | * | H | α-helix | trans | -67 | -42.6 | 174.8 | 0 | 0 | 0 | 0 | 0 | 112 | L7 L8 C14 L15 | L7-A11 VanDerWaalsContact O-CB 3.25Å; L7-A11 WeakPolarHBondContact O-CB 3.3Å; L7-A11 PolarHBondContact O-N 2.7Å; L8-A11 PolarHBondContact O-N 3.06Å; A11-C14 PolarHBondContact O-N 2.91Å; A11-L15 WeakPolarHBondContact O-CB 3.45Å; A11-L15 PolarHBondContact O-N 3.43Å |
| 12 | L | 82.5 | Confident | 72.3 | Confident | 124 Ų | 124 | 104.1 Ų | 104.1 | 65% | 0.649 | 58% | 0.581 | S | S | * | * | H | α-helix | trans | -67.2 | -40.2 | 180 | -165.7 | 72.6 | 0 | 0 | 0 | 111.9 | L8 L15 C16 | L8-L12 WeakPolarHBondContact O-CB 3.42Å; L8-L12 PolarHBondContact O-N 3.39Å; L12-L15 PolarHBondContact O-N 3.39Å; L12-C16 WeakPolarHBondContact O-CB 3.2Å; L12-C16 PolarHBondContact O-N 2.8Å |
| 13 | S | 80.4 | Confident | 71.9 | Confident | 72 Ų | 72 | 96.1 Ų | 96.1 | 50% | 0.503 | 56% | 0.564 | S | S | . | * | H | α-helix | trans | -67 | -38.7 | 175 | 54.3 | 0 | 0 | 0 | 0 | 112.6 | S9 L10 C16 G17 | S9-S13 WeakPolarHBondContact O-CB 3.4Å; S9-S13 PolarHBondContact O-N 3.41Å; S9-S13 PolarHBondContact O-OG 2.98Å; L10-S13 WeakPolarHBondContact CA-OG 3.25Å; L10-S13 PolarHBondContact O-OG 2.87Å; S13-C16 PolarHBondContact O-N 2.74Å; S13-G17 PolarHBondContact O-N 3.03Å |
| 14 | C | 74.8 | Confident | 71.2 | Confident | 89 Ų | 89 | 94.6 Ų | 94.6 | 60% | 0.601 | 56% | 0.557 | S | S | * | * | H | α-helix | trans | -65.9 | -41.4 | 176.1 | -162.9 | 0 | 0 | 0 | 0 | 112 | L10 A11 G17 A18 | L10-C14 VanDerWaalsContact O-CB 3.3Å; L10-C14 WeakPolarHBondContact O-CB 3.49Å; L10-C14 PolarHBondContact O-N 3.45Å; A11-C14 PolarHBondContact O-N 2.91Å; C14-G17 PolarHBondContact O-N 2.99Å; C14-A18 WeakPolarHBondContact O-CB 3.45Å; C14-A18 PolarHBondContact O-N 2.97Å |
| 15 | L | 71.6 | Confident | 70.1 | Confident | 131 Ų | 131 | 96 Ų | 96 | 69% | 0.686 | 56% | 0.564 | S | S | * | * | H | α-helix | trans | -66.8 | -38.7 | 177.4 | -160.9 | 75 | 0 | 0 | 0 | 112.1 | A11 L12 A19 | A11-L15 WeakPolarHBondContact O-CB 3.45Å; A11-L15 PolarHBondContact O-N 3.43Å; L12-L15 PolarHBondContact O-N 3.39Å; L15-A19 PolarHBondContact O-N 3.16Å |
| 16 | C | 66.8 | Low | 68.8 | Low | 83 Ų | 83 | 96.7 Ų | 96.7 | 56% | 0.561 | 57% | 0.567 | S | S | * | * | H | α-helix | trans | -70.5 | -41 | 176.6 | -139.1 | 0 | 0 | 0 | 0 | 111.7 | L12 S13 A19 V20 | L12-C16 WeakPolarHBondContact O-CB 3.2Å; L12-C16 PolarHBondContact O-N 2.8Å; S13-C16 PolarHBondContact O-N 2.74Å; C16-A19 PolarHBondContact O-N 3.03Å; C16-V20 VanDerWaalsContact O-CG2 3.29Å; C16-V20 WeakPolarHBondContact O-CG2 3.43Å; C16-V20 PolarHBondContact O-N 2.91Å; C16-V20 VanDerWaalsContact O-N 3.1Å |
| 17 | G | 63.3 | Low | 66.8 | Low | 27 Ų | 27 | 96 Ų | 96 | 28% | 0.278 | 57% | 0.572 | S | S | . | * | H | α-helix | trans | -60.4 | -48.1 | 174.8 | 0 | 0 | 0 | 0 | 0 | 112.2 | S13 C14 A19 V20 F21 | S13-G17 PolarHBondContact O-N 3.03Å; C14-G17 PolarHBondContact O-N 2.99Å; G17-A19 VanDerWaalsContact C-N 3.34Å; G17-A19 PolarHBondContact O-N 3.33Å; G17-V20 PolarHBondContact O-N 2.84Å; G17-F21 WeakPolarHBondContact O-CD2 3.34Å; G17-F21 PolarHBondContact O-N 3.25Å |
| 18 | A | 58.3 | Low | 65 | Low | 58 Ų | 58 | 94.2 Ų | 94.2 | 48% | 0.479 | 57% | 0.569 | S | S | . | * | H | α-helix | trans | -61.7 | -38.8 | 179.5 | 0 | 0 | 0 | 0 | 0 | 113 | C14 Q22 | C14-A18 WeakPolarHBondContact O-CB 3.45Å; C14-A18 PolarHBondContact O-N 2.97Å; A18-Q22 VanDerWaalsContact O-CB 3.26Å; A18-Q22 WeakPolarHBondContact O-CB 3.48Å; A18-Q22 PolarHBondContact O-N 2.98Å |
| 19 | A | 56.5 | Low | 63.3 | Low | 60 Ų | 60 | 93.3 Ų | 93.3 | 50% | 0.496 | 57% | 0.573 | S | S | . | * | H | α-helix | trans | -68.1 | -38.5 | 177 | 0 | 0 | 0 | 0 | 0 | 112.6 | L15 C16 G17 A23 | L15-A19 PolarHBondContact O-N 3.16Å; C16-A19 PolarHBondContact O-N 3.03Å; G17-A19 VanDerWaalsContact C-N 3.34Å; G17-A19 PolarHBondContact O-N 3.33Å; A19-A23 WeakPolarHBondContact O-CB 3.39Å; A19-A23 PolarHBondContact O-N 3.44Å |
| 20 | V | 58.2 | Low | 61.4 | Low | 96 Ų | 96 | 96.2 Ų | 96.2 | 58% | 0.582 | 59% | 0.59 | S | S | * | * | H | α-helix | trans | -70.9 | -40.6 | 177.3 | 174.9 | 0 | 0 | 0 | 0 | 111.3 | C16 G17 A23 A24 | C16-V20 VanDerWaalsContact O-CG2 3.29Å; C16-V20 WeakPolarHBondContact O-CG2 3.43Å; C16-V20 PolarHBondContact O-N 2.91Å; C16-V20 VanDerWaalsContact O-N 3.1Å; G17-V20 PolarHBondContact O-N 2.84Å; V20-A23 PolarHBondContact O-N 2.89Å; V20-A24 VanDerWaalsContact O-CB 3.25Å; V20-A24 WeakPolarHBondContact O-CB 3.47Å; V20-A24 PolarHBondContact O-N 3.43Å |
| 21 | F | 54 | Low | 59.6 | Low | 164 Ų | 164 | 95.9 Ų | 95.9 | 72% | 0.719 | 59% | 0.592 | S | S | * | * | H | α-helix | trans | -66.6 | -37.5 | 174.5 | -85 | -74.7 | 0 | 0 | 0 | 112.4 | G17 A24 A25 | G17-F21 WeakPolarHBondContact O-CD2 3.34Å; G17-F21 PolarHBondContact O-N 3.25Å; F21-A24 PolarHBondContact O-N 3.38Å; F21-A25 WeakPolarHBondContact O-CB 3.21Å; F21-A25 PolarHBondContact O-N 2.98Å |
| 22 | Q | 55.1 | Low | 57.9 | Low | 135 Ų | 135 | 99.4 Ų | 99.4 | 63% | 0.631 | 60% | 0.603 | S | S | * | * | H | α-helix | trans | -74 | -28.7 | 178.1 | -163.9 | 162.1 | 40.9 | 0 | 0 | 112.9 | A18 R26 | A18-Q22 VanDerWaalsContact O-CB 3.26Å; A18-Q22 WeakPolarHBondContact O-CB 3.48Å; A18-Q22 PolarHBondContact O-N 2.98Å; Q22-R26 PolarHBondContact O-N 3.5Å |
| 23 | A | 52.6 | Low | 56.5 | Low | 63 Ų | 63 | 100.7 Ų | 100.7 | 52% | 0.521 | 61% | 0.611 | S | S | . | * | H | α-helix | trans | -73.9 | -40.7 | 170.1 | 0 | 0 | 0 | 0 | 0 | 112.1 | A19 V20 R26 S27 | A19-A23 WeakPolarHBondContact O-CB 3.39Å; A19-A23 PolarHBondContact O-N 3.44Å; V20-A23 PolarHBondContact O-N 2.89Å; A23-R26 PolarHBondContact O-N 2.96Å; A23-S27 PolarHBondContact O-N 2.87Å |
| 24 | A | 53.4 | Low | 55 | Low | 46 Ų | 46 | 106 Ų | 106 | 38% | 0.38 | 63% | 0.632 | S | S | . | * | H | α-helix | trans | -70.7 | -32.5 | 177.2 | 0 | 0 | 0 | 0 | 0 | 113.3 | V20 F21 R26 S27 S28 | V20-A24 VanDerWaalsContact O-CB 3.25Å; V20-A24 WeakPolarHBondContact O-CB 3.47Å; V20-A24 PolarHBondContact O-N 3.43Å; F21-A24 PolarHBondContact O-N 3.38Å; A24-R26 VanDerWaalsContact C-N 3.25Å; A24-R26 PolarHBondContact O-N 3.45Å; A24-S27 PolarHBondContact O-N 3.03Å; A24-S27 PolarHBondContact O-OG 3Å; A24-S28 PolarHBondContact O-N 3.41Å; A24-S28 PolarHBondContact O-OG 2.82Å; A24-S28 VanDerWaalsContact O-OG 3.08Å |
| 25 | A | 53.4 | Low | 53.5 | Low | 73 Ų | 73 | 111.3 Ų | 111.3 | 60% | 0.603 | 64% | 0.641 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -71.5 | -19.2 | 173.6 | 0 | 0 | 0 | 0 | 0 | 112.9 | F21 | F21-A25 WeakPolarHBondContact O-CB 3.21Å; F21-A25 PolarHBondContact O-N 2.98Å |
| 26 | R | 49.7 | Very low | 52.5 | Low | 220 Ų | 220 | 110.8 Ų | 110.8 | 83% | 0.83 | 64% | 0.638 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -89.3 | -11.8 | 171.7 | -82.5 | -173.4 | 173.4 | 153.3 | -1 | 113.8 | Q22 A23 A24 | Q22-R26 PolarHBondContact O-N 3.5Å; A23-R26 PolarHBondContact O-N 2.96Å; A24-R26 VanDerWaalsContact C-N 3.25Å; A24-R26 PolarHBondContact O-N 3.45Å |
| 27 | S | 46 | Very low | 51.6 | Low | 96 Ų | 96 | 113.8 Ų | 113.8 | 67% | 0.671 | 65% | 0.649 | S | S | * | * | S | Bend | trans | -107.7 | 2.6 | -178.1 | 67.9 | 0 | 0 | 0 | 0 | 114.5 | A23 A24 | A23-S27 PolarHBondContact O-N 2.87Å; A24-S27 PolarHBondContact O-N 3.03Å; A24-S27 PolarHBondContact O-OG 3Å |
| 28 | S | 48.3 | Very low | 51 | Low | 81 Ų | 81 | 119.8 Ų | 119.8 | 57% | 0.566 | 67% | 0.674 | S | S | * | * | trans | -116.3 | 76.7 | 175.6 | 48.6 | 0 | 0 | 0 | 0 | 110.6 | A24 P30 | A24-S28 PolarHBondContact O-N 3.41Å; A24-S28 PolarHBondContact O-OG 2.82Å; A24-S28 VanDerWaalsContact O-OG 3.08Å; S28-P30 WeakPolarHBondContact O-CD 3.09Å | ||
| 29 | S | 47.5 | Very low | 50.6 | Low | 97 Ų | 97 | 122.5 Ų | 122.5 | 68% | 0.678 | 69% | 0.687 | S | S | * | * | trans | -70.5 | 122.7 | 158.6 | 52.7 | 0 | 0 | 0 | 0 | 108.4 | T31 | S29-T31 PolarHBondContact O-N 3.46Š| ||
| 30 | P | 48.4 | Very low | 49.9 | Very low | 130 Ų | 130 | 123.2 Ų | 123.2 | 84% | 0.844 | 70% | 0.701 | S | S | * | * | trans | -73.2 | 109.4 | 167.5 | -0.6 | 17.8 | 0 | 0 | 0 | 107.2 | S28 | S28-P30 WeakPolarHBondContact O-CD 3.09Š| ||
| 31 | T | 46.7 | Very low | 49.5 | Very low | 107 Ų | 107 | 124.9 Ų | 124.9 | 66% | 0.656 | 72% | 0.716 | S | S | * | * | trans | -78.7 | 150.2 | 158.7 | 51.1 | 0 | 0 | 0 | 0 | 108.7 | S29 | S29-T31 PolarHBondContact O-N 3.46Š| ||
| 32 | D | 48.4 | Very low | 49.5 | Very low | 136 Ų | 136 | 120.7 Ų | 120.7 | 73% | 0.727 | 72% | 0.72 | S | S | * | * | trans | 98.8 | 121.1 | 163.5 | -50.1 | -46.8 | 0 | 0 | 0 | 117.1 | ||||
| 33 | D | 53 | Low | 49.4 | Very low | 151 Ų | 151 | 118 Ų | 118 | 81% | 0.807 | 73% | 0.727 | S | S | * | * | trans | 94.5 | 66.8 | 152.3 | -49.4 | -25.1 | 0 | 0 | 0 | 119.7 | ||||
| 34 | L | 49.6 | Very low | 49.3 | Very low | 182 Ų | 182 | 125.1 Ų | 125.1 | 95% | 0.953 | 74% | 0.742 | S | S | * | * | trans | -136 | 97.2 | 143 | -93.8 | 166.9 | 0 | 0 | 0 | 110.6 | ||||
| 35 | Y | 42.5 | Very low | 49.1 | Very low | 202 Ų | 202 | 133.6 Ų | 133.6 | 79% | 0.792 | 77% | 0.766 | S | S | * | * | trans | -80.9 | 142.7 | 178.7 | -164.2 | -123.5 | 0 | 0 | 0 | 110.5 | ||||
| 36 | L | 51.5 | Low | 49.4 | Very low | 119 Ų | 119 | 135.3 Ų | 135.3 | 62% | 0.623 | 77% | 0.771 | S | S | * | * | trans | 82 | 113.2 | 159.7 | -52.9 | 177 | 0 | 0 | 0 | 120.7 | ||||
| 37 | D | 48.3 | Very low | 49.6 | Very low | 147 Ų | 147 | 133.3 Ų | 133.3 | 79% | 0.786 | 77% | 0.771 | S | S | * | * | 178.6 | 102.5 | 98 | -86.7 | -32.1 | 0 | 0 | 0 | 112.5 | |||||
| 38 | D | 49 | Very low | 50.2 | Low | 152 Ų | 152 | 135.3 Ų | 135.3 | 81% | 0.813 | 77% | 0.774 | S | S | * | * | trans | 59.2 | 168.3 | 135 | -115.5 | -27.7 | 0 | 0 | 0 | 122.6 | ||||
| 39 | P | 50.8 | Low | 50.7 | Low | 116 Ų | 116 | 138.8 Ų | 138.8 | 75% | 0.753 | 79% | 0.786 | S | S | * | * | -117 | 130.7 | -114.8 | 38.9 | -22.1 | 0 | 0 | 0 | 112.7 | |||||
| 40 | G | 41 | Very low | 51.2 | Low | 75 Ų | 75 | 140 Ų | 140 | 77% | 0.773 | 79% | 0.785 | S | S | * | * | trans | -131.1 | 82.7 | -174.7 | 0 | 0 | 0 | 0 | 0 | 113.8 | ||||
| 41 | S | 51.2 | Low | 51.6 | Low | 131 Ų | 131 | 141.5 Ų | 141.5 | 92% | 0.916 | 79% | 0.787 | S | S | * | * | trans | 47.1 | 118.9 | 134.9 | -162.4 | 0 | 0 | 0 | 0 | 120.1 | ||||
| 42 | G | 52.6 | Low | 52.1 | Low | 76 Ų | 76 | 146.1 Ų | 146.1 | 78% | 0.784 | 80% | 0.798 | S | S | * | * | trans | 94.1 | 97.8 | 153 | 0 | 0 | 0 | 0 | 0 | 113 | ||||
| 43 | G | 53.6 | Low | 52.3 | Low | 77 Ų | 77 | 147 Ų | 147 | 79% | 0.794 | 80% | 0.802 | S | S | * | * | 80.2 | 71.9 | 53.4 | 0 | 0 | 0 | 0 | 0 | 109.5 | |||||
| 44 | Y | 49.5 | Very low | 52.6 | Low | 213 Ų | 213 | 144.3 Ų | 144.3 | 84% | 0.835 | 80% | 0.795 | S | S | * | * | trans | -161.3 | 87.2 | 158.2 | -133.8 | -94.4 | 0 | 0 | 0 | 109.7 | P46 | Y44-P46 HydrophobicContact CD1-CG 4.31Š| ||
| 45 | Y | 51 | Low | 52.5 | Low | 224 Ų | 224 | 139 Ų | 139 | 88% | 0.878 | 78% | 0.784 | S | S | * | * | trans | -91.9 | 121.4 | 157.2 | -79.6 | -86.3 | 0 | 0 | 0 | 106.9 | ||||
| 46 | P | 59.7 | Low | 52.9 | Low | 109 Ų | 109 | 135.1 Ų | 135.1 | 71% | 0.708 | 79% | 0.787 | S | S | * | * | trans | -80.7 | 110.7 | 151.4 | -10 | 27.8 | 0 | 0 | 0 | 107.1 | Y44 | Y44-P46 HydrophobicContact CD1-CG 4.31Š| ||
| 47 | E | 53.9 | Low | 52.5 | Low | 178 Ų | 178 | 133.3 Ų | 133.3 | 83% | 0.832 | 80% | 0.797 | S | S | * | * | trans | -61.2 | 145.5 | 162.4 | -67.2 | -168.7 | 148.5 | 0 | 0 | 110.1 | ||||
| 48 | D | 57.5 | Low | 52.7 | Low | 139 Ų | 139 | 132.2 Ų | 132.2 | 74% | 0.743 | 80% | 0.801 | S | S | * | * | trans | 9.4 | 125.7 | 148.8 | -120.9 | -5.8 | 0 | 0 | 0 | 118.1 | ||||
| 49 | D | 58.9 | Low | 52.5 | Low | 153 Ų | 153 | 128.4 Ų | 128.4 | 82% | 0.818 | 80% | 0.797 | S | S | * | * | trans | -152.5 | 91.9 | 146.7 | -86.2 | -36 | 0 | 0 | 0 | 107 | ||||
| 50 | D | 57.3 | Low | 51.9 | Low | 122 Ų | 122 | 126.3 Ų | 126.3 | 65% | 0.652 | 80% | 0.797 | S | S | * | * | trans | 28.3 | 108.6 | 132.6 | -45.4 | -28.8 | 0 | 0 | 0 | 117.2 | ||||
| 51 | D | 58.4 | Low | 51.8 | Low | 163 Ų | 163 | 130.2 Ų | 130.2 | 87% | 0.872 | 80% | 0.8 | S | S | * | * | trans | -168.6 | 61.8 | 141.9 | -90.9 | -25.3 | 0 | 0 | 0 | 110.9 | N53 | D51-N53 PolarHBondContact O-N 3.45Š| ||
| 52 | F | 55.8 | Low | 51.7 | Low | 204 Ų | 204 | 132.8 Ų | 132.8 | 90% | 0.895 | 80% | 0.798 | S | S | * | * | trans | -68.6 | 83.5 | 157 | -94.4 | -86.9 | 0 | 0 | 0 | 108.6 | S54 | F52-S54 PolarHBondContact O-N 3.05Š| ||
| 53 | N | 53.3 | Low | 51.3 | Low | 154 Ų | 154 | 138.5 Ų | 138.5 | 82% | 0.824 | 80% | 0.804 | S | S | * | * | trans | -75.2 | 73 | 164 | -169.4 | 23.2 | 0 | 0 | 0 | 109.4 | D51 G55 | D51-N53 PolarHBondContact O-N 3.45Å; N53-G55 PolarHBondContact O-N 3.11Å | ||
| 54 | S | 58.5 | Low | 50.9 | Low | 94 Ų | 94 | 142.2 Ų | 142.2 | 66% | 0.657 | 80% | 0.804 | S | S | * | * | trans | -73.8 | 78.8 | 167.1 | -67.7 | 0 | 0 | 0 | 0 | 109.7 | F52 S56 | F52-S54 PolarHBondContact O-N 3.05Å; S54-S56 VanDerWaalsContact C-N 3.32Å; S54-S56 PolarHBondContact O-N 3.01Å | ||
| 55 | G | 47.3 | Very low | 50.5 | Low | 70 Ų | 70 | 139.2 Ų | 139.2 | 72% | 0.722 | 80% | 0.802 | S | S | * | * | trans | -75.4 | 80.5 | 168.8 | 0 | 0 | 0 | 0 | 0 | 111.6 | N53 G57 | N53-G55 PolarHBondContact O-N 3.11Å; G55-G57 PolarHBondContact O-N 2.89Å | ||
| 56 | S | 52.7 | Low | 50.1 | Low | 121 Ų | 121 | 136.2 Ų | 136.2 | 85% | 0.846 | 80% | 0.796 | S | S | * | * | trans | -72.1 | 102 | 164.7 | -81.5 | 0 | 0 | 0 | 0 | 110.1 | S54 | S54-S56 VanDerWaalsContact C-N 3.32Å; S54-S56 PolarHBondContact O-N 3.01Å | ||
| 57 | G | 42.7 | Very low | 49.7 | Very low | 82 Ų | 82 | 139.7 Ų | 139.7 | 85% | 0.845 | 80% | 0.803 | S | S | * | * | trans | -97.3 | 86.3 | 170.3 | 0 | 0 | 0 | 0 | 0 | 111.3 | G55 G59 | G55-G57 PolarHBondContact O-N 2.89Å; G57-G59 PolarHBondContact O-N 3.26Å | ||
| 58 | S | 52.8 | Low | 49 | Very low | 124 Ų | 124 | 137 Ų | 137 | 87% | 0.867 | 80% | 0.799 | S | S | * | * | trans | -80.2 | 106.6 | 165.5 | 174.4 | 0 | 0 | 0 | 0 | 108.5 | ||||
| 59 | G | 43.2 | Very low | 48.3 | Very low | 71 Ų | 71 | 136 Ų | 136 | 73% | 0.732 | 80% | 0.797 | S | S | * | * | trans | -119 | 89.4 | 164.8 | 0 | 0 | 0 | 0 | 0 | 107.4 | G57 | G57-G59 PolarHBondContact O-N 3.26Š| ||
| 60 | G | 38.3 | Very low | 47.3 | Very low | 73 Ų | 73 | 135.1 Ų | 135.1 | 75% | 0.753 | 80% | 0.797 | S | S | * | * | trans | -82.9 | 121.7 | 168.2 | 0 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 61 | D | 40.6 | Very low | 46.5 | Very low | 156 Ų | 156 | 134.1 Ų | 134.1 | 83% | 0.834 | 80% | 0.796 | S | S | * | * | trans | -126.6 | 99.7 | 150 | 58.9 | -29.8 | 0 | 0 | 0 | 107.8 | ||||
| 62 | E | 47.5 | Very low | 45.9 | Very low | 186 Ų | 186 | 131.4 Ų | 131.4 | 87% | 0.869 | 79% | 0.789 | S | S | * | * | trans | -79.6 | 112.7 | 169.1 | 56.6 | -154.7 | 141 | 0 | 0 | 108.9 | ||||
| 63 | E | 45.3 | Very low | 45.2 | Very low | 195 Ų | 195 | 132.5 Ų | 132.5 | 91% | 0.911 | 79% | 0.788 | S | S | * | * | trans | -142.7 | 111 | 144.1 | -120.2 | 178 | -166.5 | 0 | 0 | 110 | ||||
| 64 | I | 45.3 | Very low | 44.8 | Very low | 155 Ų | 155 | 132.1 Ų | 132.1 | 80% | 0.795 | 78% | 0.784 | S | S | * | * | trans | -61.8 | 123.5 | 176 | -64 | 154.6 | 0 | 0 | 0 | 108.9 | ||||
| 65 | L | 40.9 | Very low | 44 | Very low | 151 Ų | 151 | 137.1 Ų | 137.1 | 79% | 0.791 | 79% | 0.79 | S | S | * | * | trans | -156 | 107.6 | 139.3 | -83.5 | -170.6 | 0 | 0 | 0 | 110.8 | ||||
| 66 | E | 41.4 | Very low | 44.2 | Very low | 161 Ų | 161 | 140.6 Ų | 140.6 | 75% | 0.752 | 79% | 0.791 | S | S | * | * | trans | 57.1 | 103.8 | 139.7 | -59.8 | -173.7 | 172 | 0 | 0 | 120 | T68 | E66-T68 PolarHBondContact O-N 3.06Š| ||
| 67 | E | 51.7 | Low | 43.9 | Very low | 182 Ų | 182 | 142.7 Ų | 142.7 | 85% | 0.85 | 79% | 0.787 | S | S | * | * | 11.3 | 94.6 | 127.9 | -168.8 | 180 | 167.2 | 0 | 0 | 116.2 | |||||
| 68 | T | 39.8 | Very low | 44 | Very low | 121 Ų | 121 | 144 Ų | 144 | 74% | 0.742 | 78% | 0.78 | S | S | * | * | trans | -135.3 | 100.4 | 151.8 | 52.3 | 0 | 0 | 0 | 0 | 110.1 | E66 T70 | E66-T68 PolarHBondContact O-N 3.06Å; T68-T70 PolarHBondContact O-N 3.21Å | ||
| 69 | V | 41.8 | Very low | 43.4 | Very low | 118 Ų | 118 | 148 Ų | 148 | 72% | 0.715 | 78% | 0.782 | S | S | * | * | trans | -53 | 108.5 | 165 | 178.7 | 0 | 0 | 0 | 0 | 108 | V71 | V69-V71 HydrophobicContact CG1-CG2 3.85Å; V69-V71 PolarHBondContact O-N 3.08Å | ||
| 70 | T | 37.8 | Very low | 43.7 | Very low | 134 Ų | 134 | 149.7 Ų | 149.7 | 82% | 0.822 | 79% | 0.789 | S | S | * | * | trans | -74.2 | 77.7 | 175.3 | 36.2 | 0 | 0 | 0 | 0 | 109.6 | T68 S72 | T68-T70 PolarHBondContact O-N 3.21Å; T70-S72 PolarHBondContact O-N 3.4Å; T70-S72 VanDerWaalsContact O-N 3.1Å | ||
| 71 | V | 42.2 | Very low | 44 | Very low | 101 Ų | 101 | 151 Ų | 151 | 61% | 0.612 | 79% | 0.792 | S | S | * | * | trans | -66.9 | 104.7 | 165 | 178.1 | 0 | 0 | 0 | 0 | 107.7 | V69 R73 | V69-V71 HydrophobicContact CG1-CG2 3.85Å; V69-V71 PolarHBondContact O-N 3.08Å; V71-R73 HydrophobicContact CG1-CG 4.11Å; V71-R73 PolarHBondContact O-N 3.19Å | ||
| 72 | S | 44.3 | Very low | 44.2 | Very low | 106 Ų | 106 | 152.1 Ų | 152.1 | 74% | 0.741 | 79% | 0.793 | S | S | * | * | trans | -56.8 | 99.8 | 163.5 | 170.2 | 0 | 0 | 0 | 0 | 109.2 | T70 | T70-S72 PolarHBondContact O-N 3.4Å; T70-S72 VanDerWaalsContact O-N 3.1Å | ||
| 73 | R | 42.8 | Very low | 43.8 | Very low | 227 Ų | 227 | 149.2 Ų | 149.2 | 86% | 0.857 | 79% | 0.79 | S | S | * | * | trans | -89.3 | 107.9 | 168.2 | -69.2 | -174.1 | 179.6 | -178.3 | 1.2 | 108 | V71 Y75 | V71-R73 HydrophobicContact CG1-CG 4.11Å; V71-R73 PolarHBondContact O-N 3.19Å; R73-Y75 PolarHBondContact O-N 3.27Å | ||
| 74 | I | 44 | Very low | 43.7 | Very low | 146 Ų | 146 | 146.8 Ų | 146.8 | 75% | 0.749 | 79% | 0.789 | S | S | * | * | trans | -68.5 | 113.3 | 169.6 | -61.3 | 171.1 | 0 | 0 | 0 | 107.6 | I76 | I74-I76 HydrophobicContact CG2-CG1 4.3Š| ||
| 75 | Y | 41.6 | Very low | 43.7 | Very low | 200 Ų | 200 | 149.3 Ų | 149.3 | 78% | 0.784 | 79% | 0.794 | S | S | * | * | P | Polyproline II helix | trans | -84.5 | 117.2 | 173 | -173.4 | -98.6 | 0 | 0 | 0 | 109 | R73 E77 | R73-Y75 PolarHBondContact O-N 3.27Å; Y75-E77 HydrophobicContact CE1-CB 4.33Å |
| 76 | I | 51.6 | Low | 43.4 | Very low | 143 Ų | 143 | 149.2 Ų | 149.2 | 73% | 0.733 | 79% | 0.794 | S | S | * | * | P | Polyproline II helix | trans | -101.1 | 117 | 171.4 | -60.6 | 171 | 0 | 0 | 0 | 107.1 | I74 P78 | I74-I76 HydrophobicContact CG2-CG1 4.3Å; I76-P78 WeakPolarHBondContact O-CD 3.48Å |
| 77 | E | 46.7 | Very low | 43.2 | Very low | 164 Ų | 164 | 146.9 Ų | 146.9 | 77% | 0.766 | 80% | 0.795 | S | S | * | * | P | Polyproline II helix | trans | -76 | 118.5 | 175.9 | -171.4 | 176.7 | -179.3 | 0 | 0 | 110.1 | Y75 K79 | Y75-E77 HydrophobicContact CE1-CB 4.33Å; E77-K79 PolarHBondContact O-N 3.44Å |
| 78 | P | 44.9 | Very low | 42.9 | Very low | 109 Ų | 109 | 142.6 Ų | 142.6 | 71% | 0.708 | 78% | 0.782 | S | S | * | * | P | Polyproline II helix | trans | -81.6 | 116.5 | 176.9 | 30.3 | -28.6 | 0 | 0 | 0 | 109.9 | I76 | I76-P78 WeakPolarHBondContact O-CD 3.48Š|
| 79 | K | 40.8 | Very low | 42.9 | Very low | 210 Ų | 210 | 146 Ų | 146 | 91% | 0.913 | 79% | 0.787 | S | S | * | * | P | Polyproline II helix | trans | -62.2 | 134.7 | 169.3 | -110.6 | -178 | 177.3 | 179.9 | 0 | 110.4 | E77 | E77-K79 PolarHBondContact O-N 3.44Š|
| 80 | A | 47.8 | Very low | 42.7 | Very low | 105 Ų | 105 | 148.9 Ų | 148.9 | 87% | 0.868 | 79% | 0.79 | S | S | * | * | trans | -33.1 | 124.3 | 178.7 | 0 | 0 | 0 | 0 | 0 | 116 | ||||
| 81 | A | 45.4 | Very low | 42.4 | Very low | 100 Ų | 100 | 152.5 Ų | 152.5 | 83% | 0.826 | 80% | 0.795 | S | S | * | * | trans | -120.9 | 127.5 | 158.1 | 0 | 0 | 0 | 0 | 0 | 108.2 | ||||
| 82 | E | 44.4 | Very low | 42.2 | Very low | 181 Ų | 181 | 152.8 Ų | 152.8 | 85% | 0.846 | 80% | 0.801 | S | S | * | * | trans | -71.6 | 146.6 | -173.8 | -61.5 | 177.5 | 168.5 | 0 | 0 | 112.3 | T84 | E82-T84 PolarHBondContact O-N 3.49Š| ||
| 83 | P | 40.6 | Very low | 41.9 | Very low | 124 Ų | 124 | 154.3 Ų | 154.3 | 81% | 0.805 | 81% | 0.808 | S | S | * | * | trans | -85.2 | 112.2 | -177.4 | 32 | -30.4 | 0 | 0 | 0 | 111.5 | K85 | P83-K85 PolarHBondContact O-N 3.27Š| ||
| 84 | T | 42.1 | Very low | 41.4 | Very low | 144 Ų | 144 | 153 Ų | 153 | 88% | 0.883 | 81% | 0.808 | S | S | * | * | P | Polyproline II helix | trans | -72 | 120.1 | 164.3 | 34.3 | 0 | 0 | 0 | 0 | 110.2 | E82 | E82-T84 PolarHBondContact O-N 3.49Š|
| 85 | K | 45.3 | Very low | 40.9 | Very low | 209 Ų | 209 | 153.8 Ų | 153.8 | 91% | 0.909 | 81% | 0.811 | S | S | * | * | P | Polyproline II helix | trans | -65 | 133.3 | -179.4 | -65.8 | 177.5 | 177.5 | 176.8 | 0 | 111.5 | P83 | P83-K85 PolarHBondContact O-N 3.27Š|
| 86 | D | 34.9 | Very low | 40.6 | Very low | 149 Ų | 149 | 151.6 Ų | 151.6 | 80% | 0.797 | 81% | 0.808 | S | S | * | * | P | Polyproline II helix | trans | -87.8 | 139.6 | 171.3 | -156.5 | -5.9 | 0 | 0 | 0 | 110.4 | ||
| 87 | S | 37.9 | Very low | 40.2 | Very low | 111 Ų | 111 | 150.5 Ų | 150.5 | 78% | 0.776 | 81% | 0.81 | S | S | * | * | trans | -147.5 | 89.2 | 165.1 | -160.1 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 88 | T | 44.2 | Very low | 39.5 | Very low | 93 Ų | 93 | 145.7 Ų | 145.7 | 57% | 0.571 | 81% | 0.805 | S | S | * | * | trans | -31 | 125.9 | 156.1 | -50.1 | 0 | 0 | 0 | 0 | 113.7 | F90 | T88-F90 HydrophobicContact CG2-CD2 4.27Å; T88-F90 HydrophobicContact CG2-CE2 4.31Å | ||
| 89 | K | 39.8 | Very low | 39.4 | Very low | 193 Ų | 193 | 146 Ų | 146 | 84% | 0.839 | 81% | 0.807 | S | S | * | * | trans | -152 | 116 | 133.5 | -68.8 | -156.2 | -178.2 | 178.7 | 0 | 111.8 | ||||
| 90 | F | 36.9 | Very low | 38.9 | Very low | 178 Ų | 178 | 145.5 Ų | 145.5 | 78% | 0.781 | 81% | 0.808 | S | S | * | * | trans | -23.5 | 137.1 | 151.3 | -71.9 | -104 | 0 | 0 | 0 | 114.3 | T88 | T88-F90 HydrophobicContact CG2-CD2 4.27Å; T88-F90 HydrophobicContact CG2-CE2 4.31Å | ||
| 91 | F | 33.4 | Very low | 38.2 | Very low | 210 Ų | 210 | 144 Ų | 144 | 92% | 0.921 | 80% | 0.802 | S | S | * | * | trans | -165.8 | 128.7 | 137 | -101.7 | -72.2 | 0 | 0 | 0 | 111.9 | ||||
| 92 | S | 37.8 | Very low | 37.6 | Very low | 107 Ų | 107 | 151.1 Ų | 151.1 | 75% | 0.748 | 81% | 0.808 | S | S | * | * | trans | -63.2 | 152.2 | 176.9 | -44.3 | 0 | 0 | 0 | 0 | 113.5 | ||||
| 93 | P | 36.9 | Very low | 37 | Very low | 137 Ų | 137 | 147.2 Ų | 147.2 | 89% | 0.89 | 81% | 0.806 | S | S | * | * | trans | -87.1 | 117.3 | 167 | 15.3 | 0.7 | 0 | 0 | 0 | 110.5 | ||||
| 94 | K | 32 | Very low | 36.8 | Very low | 199 Ų | 199 | 152.6 Ų | 152.6 | 87% | 0.865 | 81% | 0.811 | S | S | * | * | trans | -120.2 | 113.3 | 171.1 | -171.4 | 168.8 | -177.7 | 170.9 | 0 | 109.8 | ||||
| 95 | M | 34.7 | Very low | 36.3 | Very low | 163 Ų | 163 | 153.6 Ų | 153.6 | 80% | 0.803 | 81% | 0.81 | S | S | * | * | trans | 5.1 | 121.3 | 147.7 | -165.1 | 73 | -177.7 | 0 | 0 | 119.7 | ||||
| 96 | E | 34.9 | Very low | 35.8 | Very low | 154 Ų | 154 | 146.1 Ų | 146.1 | 72% | 0.72 | 79% | 0.793 | S | S | * | * | trans | 43.4 | 153.9 | 144.4 | -77.3 | -99.9 | 148.2 | 0 | 0 | 121.4 | ||||
| 97 | P | 43.7 | Very low | 35.9 | Very low | 120 Ų | 120 | 145.9 Ų | 145.9 | 78% | 0.779 | 80% | 0.797 | S | S | * | * | cis | -149 | 156.5 | 39.7 | 38.5 | -16.1 | 0 | 0 | 0 | 120.7 | ||||
| 98 | G | 30.4 | Very low | 35.8 | Very low | 63 Ų | 63 | 144.6 Ų | 144.6 | 65% | 0.649 | 79% | 0.793 | S | S | * | * | trans | 57.2 | 172 | 145.6 | 0 | 0 | 0 | 0 | 0 | 123 | ||||
| 99 | P | 43.2 | Very low | 35.4 | Very low | 117 Ų | 117 | 151.8 Ų | 151.8 | 76% | 0.76 | 81% | 0.81 | S | S | * | * | cis | -136.9 | 177.3 | -11.8 | 45.5 | -28.2 | 0 | 0 | 0 | 115.1 | ||||
| 100 | E | 30.4 | Very low | 35.1 | Very low | 198 Ų | 198 | 152.2 Ų | 152.2 | 93% | 0.925 | 81% | 0.812 | S | S | * | * | trans | 66 | 121 | 157.8 | -54 | -167.5 | 165 | 0 | 0 | 122.4 | ||||
| 101 | G | 32.6 | Very low | 35.5 | Very low | 73 Ų | 73 | 148.4 Ų | 148.4 | 75% | 0.753 | 81% | 0.805 | S | S | * | * | trans | 156.8 | 89.7 | 152.4 | 0 | 0 | 0 | 0 | 0 | 119.2 | ||||
| 102 | R | 33.2 | Very low | 35.5 | Very low | 251 Ų | 251 | 144.5 Ų | 144.5 | 95% | 0.947 | 80% | 0.798 | S | S | * | * | trans | 75.8 | 97.7 | 148.2 | -63.2 | -172.7 | 179.3 | -175.6 | 0.8 | 122 | ||||
| 103 | A | 32.7 | Very low | 35.3 | Very low | 98 Ų | 98 | 150 Ų | 150 | 81% | 0.81 | 80% | 0.802 | S | S | * | * | 21.6 | 118.4 | 123.6 | 0 | 0 | 0 | 0 | 0 | 122.3 | |||||
| 104 | R | 37 | Very low | 35.3 | Very low | 238 Ų | 238 | 148.7 Ų | 148.7 | 90% | 0.898 | 79% | 0.792 | S | S | * | * | 172.5 | 111.8 | 124.9 | -102.1 | -177.9 | 166.7 | 173.6 | -3.4 | 108 | |||||
| 105 | D | 31.2 | Very low | 35.6 | Very low | 164 Ų | 164 | 147.6 Ų | 147.6 | 88% | 0.877 | 79% | 0.79 | S | S | * | * | 101.8 | 136.7 | 86.3 | -166.8 | 17.5 | 0 | 0 | 0 | 110.7 | |||||
| 106 | G | 34.5 | Very low | 36.3 | Very low | 53 Ų | 53 | 145 Ų | 145 | 55% | 0.546 | 79% | 0.785 | S | S | . | * | trans | 110.6 | 83.9 | 173.8 | 0 | 0 | 0 | 0 | 0 | 117.6 | ||||
| 107 | T | 37.4 | Very low | 36.8 | Very low | 143 Ų | 143 | 143 Ų | 143 | 88% | 0.877 | 79% | 0.785 | S | S | * | * | 35.8 | 137.9 | 129.5 | 60.1 | 0 | 0 | 0 | 0 | 119.7 | |||||
| 108 | A | 34.3 | Very low | 36.9 | Very low | 84 Ų | 84 | 142.5 Ų | 142.5 | 69% | 0.694 | 78% | 0.78 | S | S | * | * | cis | -174.7 | 144.4 | 0.5 | 0 | 0 | 0 | 0 | 0 | 107.8 | ||||
| 109 | R | 36.5 | Very low | 37.6 | Very low | 245 Ų | 245 | 145.7 Ų | 145.7 | 93% | 0.925 | 79% | 0.789 | S | S | * | * | trans | 59.3 | 88.7 | 147.2 | -61.1 | 178.6 | 178.5 | 174 | -0.2 | 121.1 | ||||
| 110 | K | 33.7 | Very low | 37.5 | Very low | 202 Ų | 202 | 145.6 Ų | 145.6 | 88% | 0.878 | 79% | 0.786 | S | S | * | * | 10.4 | 163.8 | 120.5 | -97.4 | -166 | 175.4 | -172.9 | 0 | 120.3 | |||||
| 111 | P | 44.4 | Very low | 38.2 | Very low | 98 Ų | 98 | 141.7 Ų | 141.7 | 64% | 0.636 | 78% | 0.776 | S | S | * | * | -145.2 | -165.2 | -57.3 | 34.1 | -9.2 | 0 | 0 | 0 | 113.3 | |||||
| 112 | V | 34.6 | Very low | 38.9 | Very low | 127 Ų | 127 | 147.1 Ų | 147.1 | 77% | 0.77 | 78% | 0.782 | S | S | * | * | trans | 81.9 | 122.3 | 159.6 | -148.1 | 0 | 0 | 0 | 0 | 114 | ||||
| 113 | R | 33.9 | Very low | 39.1 | Very low | 222 Ų | 222 | 141.7 Ų | 141.7 | 84% | 0.838 | 77% | 0.772 | S | S | * | * | -179.2 | 128.8 | 63.3 | -169.7 | 164.3 | 173.8 | -171 | -3.3 | 112.2 | |||||
| 114 | T | 35.6 | Very low | 39.9 | Very low | 110 Ų | 110 | 146.3 Ų | 146.3 | 68% | 0.675 | 78% | 0.776 | S | S | * | * | trans | 58 | 131.6 | 140 | -42.6 | 0 | 0 | 0 | 0 | 118.4 | ||||
| 115 | E | 39.2 | Very low | 40.4 | Very low | 176 Ų | 176 | 143.8 Ų | 143.8 | 82% | 0.822 | 78% | 0.775 | S | S | * | * | cis | -165.8 | 169 | 8.7 | -118.1 | 177.6 | 173.1 | 0 | 0 | 108.1 | ||||
| 116 | P | 49.6 | Very low | 40.9 | Very low | 110 Ų | 110 | 147 Ų | 147 | 71% | 0.714 | 78% | 0.775 | S | S | * | * | trans | -88.1 | 179 | -176.4 | 40.8 | -33.6 | 0 | 0 | 0 | 111.5 | ||||
| 117 | P | 45.6 | Very low | 41.6 | Very low | 110 Ų | 110 | 152.3 Ų | 152.3 | 71% | 0.714 | 79% | 0.791 | S | S | * | * | cis | -154 | 170.4 | 35.3 | 45.6 | -22.8 | 0 | 0 | 0 | 119.4 | ||||
| 118 | V | 44.9 | Very low | 42 | Very low | 110 Ų | 110 | 154.2 Ų | 154.2 | 67% | 0.667 | 79% | 0.79 | S | S | * | * | trans | 58.7 | 123.2 | 157.5 | -147.5 | 0 | 0 | 0 | 0 | 120.3 | V120 | V118-V120 HydrophobicContact CG1-CG2 3.74Š| ||
| 119 | P | 45.4 | Very low | 42.7 | Very low | 131 Ų | 131 | 157.8 Ų | 157.8 | 85% | 0.851 | 80% | 0.796 | S | S | * | * | trans | -110 | 104.7 | 143.6 | 29.2 | -15.5 | 0 | 0 | 0 | 109.8 | ||||
| 120 | V | 40.6 | Very low | 42.8 | Very low | 115 Ų | 115 | 152.4 Ų | 152.4 | 70% | 0.697 | 79% | 0.791 | S | S | * | * | trans | -78.5 | 132.3 | 158.4 | 166.8 | 0 | 0 | 0 | 0 | 106.8 | V118 | V118-V120 HydrophobicContact CG1-CG2 3.74Š| ||
| 121 | T | 45.9 | Very low | 43 | Very low | 116 Ų | 116 | 153.9 Ų | 153.9 | 71% | 0.712 | 79% | 0.791 | S | S | * | * | trans | -15.4 | 131.4 | 166.9 | -26.7 | 0 | 0 | 0 | 0 | 116 | D123 | T121-D123 PolarHBondContact O-N 2.87Š| ||
| 122 | E | 45.9 | Very low | 42.7 | Very low | 187 Ų | 187 | 156.3 Ų | 156.3 | 87% | 0.874 | 80% | 0.804 | S | S | * | * | trans | -67.2 | 95.4 | 174.6 | -63.2 | 179.4 | 145.9 | 0 | 0 | 111.3 | Q124 | E122-Q124 PolarHBondContact O-N 3.46Š| ||
| 123 | D | 39.3 | Very low | 43.1 | Very low | 136 Ų | 136 | 155.6 Ų | 155.6 | 73% | 0.727 | 80% | 0.8 | S | S | * | * | trans | -82.8 | 89.9 | 166.6 | -70 | -36.9 | 0 | 0 | 0 | 110.1 | T121 Q125 | T121-D123 PolarHBondContact O-N 2.87Å; D123-Q125 PolarHBondContact O-N 2.89Å | ||
| 124 | Q | 48.3 | Very low | 43.4 | Very low | 195 Ų | 195 | 153.6 Ų | 153.6 | 91% | 0.911 | 80% | 0.8 | S | S | * | * | trans | -71 | 51.4 | 164.8 | -85.9 | -163.4 | -7.8 | 0 | 0 | 112 | E122 | E122-Q124 PolarHBondContact O-N 3.46Š| ||
| 125 | Q | 48.1 | Very low | 44.3 | Very low | 185 Ų | 185 | 153.6 Ų | 153.6 | 86% | 0.864 | 80% | 0.802 | S | S | * | * | trans | -137.9 | 43.8 | -179.4 | -146.3 | 178.1 | -3.3 | 0 | 0 | 112.6 | D123 | D123-Q125 PolarHBondContact O-N 2.89Š| ||
| 126 | R | 41.5 | Very low | 45.1 | Very low | 231 Ų | 231 | 151.2 Ų | 151.2 | 87% | 0.872 | 80% | 0.802 | S | S | * | * | trans | -141.4 | 65.2 | 173.8 | -161.4 | -174.9 | -172.6 | -161.6 | 2.7 | 112.3 | ||||
| 127 | N | 49 | Very low | 44.2 | Very low | 165 Ų | 165 | 149.5 Ų | 149.5 | 88% | 0.882 | 81% | 0.805 | S | S | * | * | S | Bend | trans | -133.5 | 26.7 | 163.2 | -106 | 5 | 0 | 0 | 0 | 113.1 | ||
| 128 | Q | 46.4 | Very low | 44.9 | Very low | 184 Ų | 184 | 150 Ų | 150 | 86% | 0.86 | 81% | 0.807 | S | S | * | * | S | Bend | trans | -138.4 | 61.3 | 179.7 | -68.9 | -102 | 67.5 | 0 | 0 | 110.2 | ||
| 129 | L | 49.2 | Very low | 45 | Very low | 158 Ų | 158 | 150 Ų | 150 | 83% | 0.827 | 81% | 0.81 | S | S | * | * | S | Bend | trans | -178.6 | 128.3 | 147.7 | -129.4 | 60.7 | 0 | 0 | 0 | 111.5 | ||
| 130 | T | 37.8 | Very low | 45.5 | Very low | 132 Ų | 132 | 151.3 Ų | 151.3 | 81% | 0.81 | 81% | 0.809 | S | S | * | * | trans | 63.2 | 102.4 | 152.3 | 51.2 | 0 | 0 | 0 | 0 | 118.5 | ||||
| 131 | R | 37.8 | Very low | 46.2 | Very low | 233 Ų | 233 | 154.1 Ų | 154.1 | 88% | 0.879 | 81% | 0.814 | S | S | * | * | 176.8 | 108.6 | 110.1 | -141.2 | 178.4 | -176.9 | 175.6 | -0.2 | 111 | |||||
| 132 | T | 37.6 | Very low | 46.6 | Very low | 149 Ų | 149 | 153.7 Ų | 153.7 | 91% | 0.914 | 81% | 0.814 | S | S | * | * | trans | -148.4 | 120.9 | 142.8 | -28.6 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 133 | T | 43.4 | Very low | 47 | Very low | 113 Ų | 113 | 150.7 Ų | 150.7 | 69% | 0.693 | 81% | 0.808 | S | S | * | * | trans | -107.3 | 126.2 | 179.6 | -66.9 | 0 | 0 | 0 | 0 | 107.1 | ||||
| 134 | E | 41 | Very low | 47.8 | Very low | 179 Ų | 179 | 152.2 Ų | 152.2 | 84% | 0.836 | 81% | 0.811 | S | S | * | * | trans | 103.7 | 143 | 159.4 | -55.3 | -113.4 | 150.6 | 0 | 0 | 121.2 | ||||
| 135 | P | 54 | Low | 48.3 | Very low | 110 Ų | 110 | 148 Ų | 148 | 71% | 0.714 | 80% | 0.798 | S | S | * | * | trans | -121.8 | -160.3 | -161.5 | 41.5 | -21 | 0 | 0 | 0 | 112.9 | ||||
| 136 | P | 54.8 | Low | 48.6 | Very low | 126 Ų | 126 | 148.9 Ų | 148.9 | 82% | 0.818 | 79% | 0.794 | S | S | * | * | cis | -125.3 | 154.3 | -17.3 | 37.4 | -20.5 | 0 | 0 | 0 | 114.6 | ||||
| 137 | G | 31.8 | Very low | 49.4 | Very low | 75 Ų | 75 | 142.9 Ų | 142.9 | 77% | 0.773 | 78% | 0.783 | S | S | * | * | trans | 175.6 | 110.9 | 163.1 | 0 | 0 | 0 | 0 | 0 | 113.8 | ||||
| 138 | P | 59.8 | Low | 50 | Low | 119 Ų | 119 | 141.8 Ų | 141.8 | 77% | 0.773 | 77% | 0.772 | S | S | * | * | trans | -98.3 | 161.8 | 170.3 | 37.1 | -27.6 | 0 | 0 | 0 | 110.5 | ||||
| 139 | P | 48 | Very low | 51.1 | Low | 112 Ų | 112 | 136.6 Ų | 136.6 | 73% | 0.727 | 75% | 0.751 | S | S | * | * | cis | -135.5 | 134.9 | 41 | 31.3 | -9.4 | 0 | 0 | 0 | 116.9 | ||||
| 140 | L | 56.2 | Low | 51.8 | Low | 157 Ų | 157 | 134.5 Ų | 134.5 | 82% | 0.822 | 74% | 0.74 | S | S | * | * | trans | 59.1 | 67.9 | 133.7 | -49.7 | 174.5 | 0 | 0 | 0 | 115.8 | P142 | L140-P142 WeakPolarHBondContact O-CD 3.19Š| ||
| 141 | E | 54 | Low | 53 | Low | 174 Ų | 174 | 136.1 Ų | 136.1 | 81% | 0.813 | 74% | 0.736 | S | S | * | * | trans | -62.3 | 118 | 141.9 | -74.4 | -69.1 | 146.8 | 0 | 0 | 105.7 | V143 | E141-V143 PolarHBondContact O-N 3Š| ||
| 142 | P | 54.2 | Low | 54.7 | Low | 107 Ų | 107 | 132.1 Ų | 132.1 | 70% | 0.695 | 73% | 0.727 | S | S | * | * | trans | -57.5 | 115.5 | 170.4 | 25.2 | -30 | 0 | 0 | 0 | 105 | L140 E144 | L140-P142 WeakPolarHBondContact O-CD 3.19Å; P142-E144 PolarHBondContact O-N 3.44Å | ||
| 143 | V | 54.5 | Low | 56.9 | Low | 125 Ų | 125 | 132 Ų | 132 | 76% | 0.758 | 71% | 0.71 | S | S | * | * | trans | -53.2 | 96.3 | 158.6 | 173.6 | 0 | 0 | 0 | 0 | 103.6 | E141 V145 | E141-V143 PolarHBondContact O-N 3Å; V143-V145 HydrophobicContact CG1-CG2 4.15Å; V143-V145 PolarHBondContact O-N 2.96Å | ||
| 144 | E | 57 | Low | 58.9 | Low | 167 Ų | 167 | 131.8 Ų | 131.8 | 78% | 0.78 | 71% | 0.709 | S | S | * | * | trans | -63.2 | 88.1 | 164.9 | -167 | 177.5 | -166.5 | 0 | 0 | 102.2 | P142 R146 | P142-E144 PolarHBondContact O-N 3.44Å; E144-R146 PolarHBondContact O-N 3.1Å | ||
| 145 | V | 57.5 | Low | 61.1 | Low | 108 Ų | 108 | 130.5 Ų | 130.5 | 66% | 0.655 | 70% | 0.703 | S | S | * | * | trans | -53.5 | 96.3 | 167.8 | 177.9 | 0 | 0 | 0 | 0 | 102 | V143 T147 | V143-V145 HydrophobicContact CG1-CG2 4.15Å; V143-V145 PolarHBondContact O-N 2.96Å; V145-T147 PolarHBondContact O-N 3.26Å | ||
| 146 | R | 55.3 | Low | 62.9 | Low | 202 Ų | 202 | 128.1 Ų | 128.1 | 76% | 0.762 | 69% | 0.686 | S | S | * | * | trans | -60.2 | 93.2 | 175.5 | -79.3 | -176.3 | 169.2 | -169.6 | -2.2 | 103.8 | E144 E148 | E144-R146 PolarHBondContact O-N 3.1Å; R146-E148 PolarHBondContact O-N 2.83Å | ||
| 147 | T | 57.6 | Low | 64.6 | Low | 106 Ų | 106 | 125.7 Ų | 125.7 | 65% | 0.65 | 67% | 0.666 | S | S | * | * | trans | -63.1 | 81 | 158.4 | 52.6 | 0 | 0 | 0 | 0 | 103.4 | V145 N149 | V145-T147 PolarHBondContact O-N 3.26Å; T147-N149 VanDerWaalsContact C-N 3.31Å; T147-N149 PolarHBondContact O-N 2.81Å; T147-N149 PolarHBondContact O-OD1 3.35Å | ||
| 148 | E | 62.4 | Low | 67.5 | Low | 141 Ų | 141 | 124.8 Ų | 124.8 | 66% | 0.659 | 65% | 0.651 | S | S | * | * | trans | -53.2 | 105.3 | 172.6 | 40.2 | -107.3 | 171.7 | 0 | 0 | 106.4 | R146 L150 | R146-E148 PolarHBondContact O-N 2.83Å; E148-L150 PolarHBondContact O-N 3.42Å | ||
| 149 | N | 68.6 | Low | 69.1 | Low | 76 Ų | 76 | 122.1 Ų | 122.1 | 41% | 0.406 | 64% | 0.639 | S | S | . | * | trans | -62.1 | 107.7 | -169 | -63.3 | -67.2 | 0 | 0 | 0 | 107.2 | T147 F151 Q152 | T147-N149 VanDerWaalsContact C-N 3.31Å; T147-N149 PolarHBondContact O-N 2.81Å; T147-N149 PolarHBondContact O-OD1 3.35Å; N149-F151 PolarHBondContact O-N 2.92Å; N149-Q152 HydrophobicContact CB-CB 4.19Å; N149-Q152 HydrophobicContact CB-CG 3.93Å; N149-Q152 PolarHBondContact ND2-OE1 3.32Å; N149-Q152 WeakPolarHBondContact O-CB 3.26Å; N149-Q152 PolarHBondContact O-N 2.82Å | ||
| 150 | L | 64.6 | Low | 71.4 | Confident | 113 Ų | 113 | 121.5 Ų | 121.5 | 59% | 0.592 | 63% | 0.633 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -54.2 | -22 | 173 | -63.6 | 174.2 | 0 | 0 | 0 | 111.1 | E148 V156 | E148-L150 PolarHBondContact O-N 3.42Å; L150-V156 WeakPolarHBondContact O-CB 3.25Å |
| 151 | F | 62.6 | Low | 73.2 | Confident | 167 Ų | 167 | 118.9 Ų | 118.9 | 73% | 0.732 | 62% | 0.619 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -78.8 | -16.1 | 174.5 | -62.4 | -73.8 | 0 | 0 | 0 | 115.8 | N149 R153 | N149-F151 PolarHBondContact O-N 2.92Å; F151-R153 VanDerWaalsContact C-N 3.32Å |
| 152 | Q | 74.1 | Confident | 75.2 | Confident | 149 Ų | 149 | 112.9 Ų | 112.9 | 70% | 0.696 | 60% | 0.599 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -78.7 | -20.1 | 173.1 | -84.5 | 172.8 | -26 | 0 | 0 | 112.1 | N149 T154 | N149-Q152 HydrophobicContact CB-CB 4.19Å; N149-Q152 HydrophobicContact CB-CG 3.93Å; N149-Q152 PolarHBondContact ND2-OE1 3.32Å; N149-Q152 WeakPolarHBondContact O-CB 3.26Å; N149-Q152 PolarHBondContact O-N 2.82Å; Q152-T154 PolarHBondContact O-N 2.82Å; Q152-T154 VanDerWaalsContact O-N 3.16Å |
| 153 | R | 82.8 | Confident | 77.2 | Confident | 146 Ų | 146 | 109.9 Ų | 109.9 | 55% | 0.551 | 59% | 0.587 | S | S | * | * | trans | -76.8 | 103.2 | 173.2 | -63.6 | -179.4 | -175.6 | -99.7 | 0.7 | 108.1 | F151 E155 V156 L157 | F151-R153 VanDerWaalsContact C-N 3.32Å; R153-E155 PolarHBondContact O-N 3.37Å; R153-E155 VanDerWaalsContact O-N 3.11Å; R153-V156 HydrophobicContact CB-CB 4.23Å; R153-V156 HydrophobicContact CB-CG2 3.83Å; R153-V156 PolarHBondContact O-N 3.5Å; R153-L157 PolarHBondContact O-N 2.98Å | ||
| 154 | T | 85.7 | Confident | 79.3 | Confident | 109 Ų | 109 | 106 Ų | 106 | 67% | 0.669 | 57% | 0.572 | S | S | * | * | H | α-helix | trans | -54.3 | -28.8 | 175.4 | 48.5 | 0 | 0 | 0 | 0 | 112.1 | Q152 A158 | Q152-T154 PolarHBondContact O-N 2.82Å; Q152-T154 VanDerWaalsContact O-N 3.16Å; T154-A158 WeakPolarHBondContact O-CB 3.29Å; T154-A158 PolarHBondContact O-N 3.34Å |
| 155 | E | 87.6 | Confident | 81.2 | Confident | 152 Ų | 152 | 102 Ų | 102 | 71% | 0.71 | 56% | 0.559 | S | S | * | * | H | α-helix | trans | -61.2 | -49.1 | 172.9 | -62.4 | 175.9 | 177.1 | 0 | 0 | 112.7 | R153 A158 A159 | R153-E155 PolarHBondContact O-N 3.37Å; R153-E155 VanDerWaalsContact O-N 3.11Å; E155-A158 PolarHBondContact O-N 3.46Å; E155-A159 WeakPolarHBondContact O-CB 3.12Å; E155-A159 PolarHBondContact O-N 3.28Å |
| 156 | V | 91.4 | Very high | 83.2 | Confident | 59 Ų | 59 | 102.4 Ų | 102.4 | 36% | 0.358 | 56% | 0.556 | S | S | . | * | H | α-helix | trans | -69 | -43.6 | -179.9 | -179.2 | 0 | 0 | 0 | 0 | 109.7 | L150 R153 A158 A159 V160 | L150-V156 WeakPolarHBondContact O-CB 3.25Å; R153-V156 HydrophobicContact CB-CB 4.23Å; R153-V156 HydrophobicContact CB-CG2 3.83Å; R153-V156 PolarHBondContact O-N 3.5Å; V156-A158 VanDerWaalsContact C-N 3.35Å; V156-A158 PolarHBondContact O-N 2.98Å; V156-A159 PolarHBondContact O-N 3.43Å; V156-V160 WeakPolarHBondContact O-CG2 3.33Å; V156-V160 PolarHBondContact O-N 3.42Å |
| 157 | L | 90.3 | Very high | 85.2 | Confident | 76 Ų | 76 | 94.5 Ų | 94.5 | 40% | 0.398 | 54% | 0.538 | S | S | . | . | H | α-helix | trans | -59.9 | -45.7 | 176.2 | -175.1 | 67.5 | 0 | 0 | 0 | 111.4 | R153 V160 I161 | R153-L157 PolarHBondContact O-N 2.98Å; L157-V160 PolarHBondContact O-N 3.3Å; L157-I161 HydrophobicContact CD1-CD1 4.16Å; L157-I161 HydrophobicContact CG-CD1 3.87Å; L157-I161 WeakPolarHBondContact O-CD1 3.5Å; L157-I161 WeakPolarHBondContact O-CG1 3.33Å; L157-I161 PolarHBondContact O-N 2.91Å |
| 158 | A | 92.9 | Very high | 87 | Confident | 55 Ų | 55 | 96 Ų | 96 | 46% | 0.455 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -64.5 | -41.7 | 177.7 | 0 | 0 | 0 | 0 | 0 | 111.7 | T154 E155 V156 V160 I161 A162 | T154-A158 WeakPolarHBondContact O-CB 3.29Å; T154-A158 PolarHBondContact O-N 3.34Å; E155-A158 PolarHBondContact O-N 3.46Å; V156-A158 VanDerWaalsContact C-N 3.35Å; V156-A158 PolarHBondContact O-N 2.98Å; A158-V160 PolarHBondContact O-N 2.82Å; A158-I161 PolarHBondContact O-N 2.94Å; A158-A162 WeakPolarHBondContact O-CB 3.34Å; A158-A162 PolarHBondContact O-N 2.94Å |
| 159 | A | 94 | Very high | 88.7 | Confident | 64 Ų | 64 | 94.5 Ų | 94.5 | 53% | 0.529 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -62.7 | -41.9 | 177.4 | 0 | 0 | 0 | 0 | 0 | 112.1 | E155 V156 G163 | E155-A159 WeakPolarHBondContact O-CB 3.12Å; E155-A159 PolarHBondContact O-N 3.28Å; V156-A159 PolarHBondContact O-N 3.43Å; A159-G163 WeakPolarHBondContact O-CA 3.49Å; A159-G163 PolarHBondContact O-N 3.48Å |
| 160 | V | 95.5 | Very high | 90.1 | Very high | 99 Ų | 99 | 96.8 Ų | 96.8 | 60% | 0.6 | 54% | 0.538 | S | S | * | . | H | α-helix | trans | -67.6 | -41.8 | 177.2 | 174.4 | 0 | 0 | 0 | 0 | 111.2 | V156 L157 A158 G164 | V156-V160 WeakPolarHBondContact O-CG2 3.33Å; V156-V160 PolarHBondContact O-N 3.42Å; L157-V160 PolarHBondContact O-N 3.3Å; A158-V160 PolarHBondContact O-N 2.82Å; V160-G164 WeakPolarHBondContact O-CA 3.39Å; V160-G164 PolarHBondContact O-N 3.4Å |
| 161 | I | 94.4 | Very high | 91.6 | Very high | 102 Ų | 102 | 93.5 Ų | 93.5 | 52% | 0.523 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -66.2 | -47.4 | 177.4 | -65.8 | 165.7 | 0 | 0 | 0 | 110.5 | L157 A158 G164 V165 | L157-I161 HydrophobicContact CD1-CD1 4.16Å; L157-I161 HydrophobicContact CG-CD1 3.87Å; L157-I161 WeakPolarHBondContact O-CD1 3.5Å; L157-I161 WeakPolarHBondContact O-CG1 3.33Å; L157-I161 PolarHBondContact O-N 2.91Å; A158-I161 PolarHBondContact O-N 2.94Å; I161-G164 PolarHBondContact O-N 2.99Å; I161-V165 WeakPolarHBondContact O-CG2 3.43Å; I161-V165 PolarHBondContact O-N 3.48Å |
| 162 | A | 95.9 | Very high | 93.2 | Very high | 48 Ų | 48 | 88.6 Ų | 88.6 | 40% | 0.397 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -63 | -48.3 | 178.7 | 0 | 0 | 0 | 0 | 0 | 111.2 | A158 G164 V165 I166 | A158-A162 WeakPolarHBondContact O-CB 3.34Å; A158-A162 PolarHBondContact O-N 2.94Å; A162-G164 VanDerWaalsContact C-N 3.31Å; A162-G164 PolarHBondContact O-N 2.8Å; A162-V165 PolarHBondContact O-N 2.81Å; A162-I166 WeakPolarHBondContact O-CB 3.42Å; A162-I166 WeakPolarHBondContact O-CD1 3.34Å; A162-I166 VanDerWaalsContact O-CG1 3.26Å; A162-I166 WeakPolarHBondContact O-CG1 3.21Å; A162-I166 PolarHBondContact O-N 2.77Å |
| 163 | G | 97.5 | Very high | 94.2 | Very high | 43 Ų | 43 | 87.4 Ų | 87.4 | 44% | 0.443 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -61.5 | -38.3 | 176.2 | 0 | 0 | 0 | 0 | 0 | 112.5 | A159 G167 | A159-G163 WeakPolarHBondContact O-CA 3.49Å; A159-G163 PolarHBondContact O-N 3.48Å; G163-G167 WeakPolarHBondContact O-CA 3.5Å; G163-G167 PolarHBondContact O-N 3.18Å |
| 164 | G | 97.4 | Very high | 94.7 | Very high | 43 Ų | 43 | 84.5 Ų | 84.5 | 44% | 0.443 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -64.2 | -48.1 | 174.6 | 0 | 0 | 0 | 0 | 0 | 112.6 | V160 I161 A162 F168 | V160-G164 WeakPolarHBondContact O-CA 3.39Å; V160-G164 PolarHBondContact O-N 3.4Å; I161-G164 PolarHBondContact O-N 2.99Å; A162-G164 VanDerWaalsContact C-N 3.31Å; A162-G164 PolarHBondContact O-N 2.8Å; G164-F168 WeakPolarHBondContact O-CB 3.33Å; G164-F168 PolarHBondContact O-N 2.9Å |
| 165 | V | 97.8 | Very high | 95.1 | Very high | 83 Ų | 83 | 84.4 Ų | 84.4 | 50% | 0.503 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -65.8 | -45.8 | 178.8 | 174.7 | 0 | 0 | 0 | 0 | 111.1 | I161 A162 F168 L169 | I161-V165 WeakPolarHBondContact O-CG2 3.43Å; I161-V165 PolarHBondContact O-N 3.48Å; A162-V165 PolarHBondContact O-N 2.81Å; V165-F168 PolarHBondContact O-N 2.94Å; V165-L169 HydrophobicContact CG1-CD1 4.19Å; V165-L169 WeakPolarHBondContact O-CB 3.29Å; V165-L169 VanDerWaalsContact O-CG 3.32Å; V165-L169 WeakPolarHBondContact O-CG 3.34Å; V165-L169 PolarHBondContact O-N 2.86Å |
| 166 | I | 97.9 | Very high | 95.2 | Very high | 118 Ų | 118 | 82.4 Ų | 82.4 | 61% | 0.605 | 48% | 0.483 | S | S | * | . | H | α-helix | trans | -63.5 | -46.3 | 178 | -69.5 | 158.6 | 0 | 0 | 0 | 110.4 | A162 L169 F170 | A162-I166 WeakPolarHBondContact O-CB 3.42Å; A162-I166 WeakPolarHBondContact O-CD1 3.34Å; A162-I166 VanDerWaalsContact O-CG1 3.26Å; A162-I166 WeakPolarHBondContact O-CG1 3.21Å; A162-I166 PolarHBondContact O-N 2.77Å; I166-L169 PolarHBondContact O-N 3.46Å; I166-F170 VanDerWaalsContact O-CB 3.29Å; I166-F170 WeakPolarHBondContact O-CB 3.32Å; I166-F170 PolarHBondContact O-N 3.22Å |
| 167 | G | 97.8 | Very high | 95 | Very high | 36 Ų | 36 | 83.1 Ų | 83.1 | 37% | 0.371 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -65.2 | -37.6 | 178.3 | 0 | 0 | 0 | 0 | 0 | 112.8 | G163 F170 A171 | G163-G167 WeakPolarHBondContact O-CA 3.5Å; G163-G167 PolarHBondContact O-N 3.18Å; G167-F170 PolarHBondContact O-N 3.48Å; G167-A171 WeakPolarHBondContact O-CB 3.26Å; G167-A171 PolarHBondContact O-N 3.22Å |
| 168 | F | 96.9 | Very high | 94.8 | Very high | 137 Ų | 137 | 84.2 Ų | 84.2 | 60% | 0.601 | 49% | 0.49 | S | S | * | . | H | α-helix | trans | -68.1 | -45.3 | 176.9 | -176.3 | -109.8 | 0 | 0 | 0 | 112.1 | G164 V165 F170 A171 I172 | G164-F168 WeakPolarHBondContact O-CB 3.33Å; G164-F168 PolarHBondContact O-N 2.9Å; V165-F168 PolarHBondContact O-N 2.94Å; F168-F170 VanDerWaalsContact C-N 3.29Å; F168-F170 PolarHBondContact O-N 3.43Å; F168-A171 PolarHBondContact O-N 3.26Å; F168-I172 HydrophobicContact CD1-CD1 3.77Å; F168-I172 HydrophobicContact CE1-CD1 3.36Å; F168-I172 HydrophobicContact CE1-CG1 4.41Å; F168-I172 HydrophobicContact CE2-CD1 4.3Å; F168-I172 HydrophobicContact CG-CD1 4.41Å; F168-I172 HydrophobicContact CZ-CD1 3.66Å; F168-I172 HydrophobicContact CZ-CG1 4.36Å; F168-I172 WeakPolarHBondContact O-CG1 3.32Å; F168-I172 PolarHBondContact O-N 2.73Å |
| 169 | L | 97.1 | Very high | 94.7 | Very high | 109 Ų | 109 | 85.5 Ų | 85.5 | 57% | 0.571 | 49% | 0.492 | S | S | * | . | H | α-helix | trans | -60.6 | -41.5 | 173.4 | -70.9 | 174.3 | 0 | 0 | 0 | 111.3 | V165 I166 I172 F173 | V165-L169 HydrophobicContact CG1-CD1 4.19Å; V165-L169 WeakPolarHBondContact O-CB 3.29Å; V165-L169 VanDerWaalsContact O-CG 3.32Å; V165-L169 WeakPolarHBondContact O-CG 3.34Å; V165-L169 PolarHBondContact O-N 2.86Å; I166-L169 PolarHBondContact O-N 3.46Å; L169-I172 PolarHBondContact O-N 3.16Å; L169-F173 WeakPolarHBondContact O-CB 3.33Å; L169-F173 PolarHBondContact O-N 2.75Å |
| 170 | F | 97.4 | Very high | 94.2 | Very high | 125 Ų | 125 | 88.9 Ų | 88.9 | 55% | 0.548 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -64.9 | -41.7 | 176.6 | -170.5 | -107.1 | 0 | 0 | 0 | 112.1 | I166 G167 F168 F173 L174 | I166-F170 VanDerWaalsContact O-CB 3.29Å; I166-F170 WeakPolarHBondContact O-CB 3.32Å; I166-F170 PolarHBondContact O-N 3.22Å; G167-F170 PolarHBondContact O-N 3.48Å; F168-F170 VanDerWaalsContact C-N 3.29Å; F168-F170 PolarHBondContact O-N 3.43Å; F170-F173 WeakPolarHBondContact O-CB 3.34Å; F170-F173 PolarHBondContact O-N 3.49Å; F170-L174 HydrophobicContact CD1-CD1 3.89Å; F170-L174 HydrophobicContact CD1-CG 4.22Å; F170-L174 HydrophobicContact CE1-CD1 3.53Å; F170-L174 HydrophobicContact CE1-CD2 4.34Å; F170-L174 HydrophobicContact CE1-CG 3.97Å; F170-L174 HydrophobicContact CZ-CD1 4.21Å; F170-L174 HydrophobicContact CZ-CD2 4.19Å; F170-L174 HydrophobicContact CZ-CG 4.25Å; F170-L174 WeakPolarHBondContact O-CG 3.11Å; F170-L174 PolarHBondContact O-N 2.65Å |
| 171 | A | 96.9 | Very high | 93.6 | Very high | 43 Ų | 43 | 90.5 Ų | 90.5 | 36% | 0.355 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -62.5 | -44.8 | 176.2 | 0 | 0 | 0 | 0 | 0 | 111.8 | G167 F168 F173 L174 I175 | G167-A171 WeakPolarHBondContact O-CB 3.26Å; G167-A171 PolarHBondContact O-N 3.22Å; F168-A171 PolarHBondContact O-N 3.26Å; A171-F173 VanDerWaalsContact C-N 3.32Å; A171-F173 PolarHBondContact O-N 2.73Å; A171-L174 PolarHBondContact O-N 2.7Å; A171-I175 WeakPolarHBondContact O-CG1 3.49Å; A171-I175 PolarHBondContact O-N 2.93Å |
| 172 | I | 96.2 | Very high | 92.8 | Very high | 65 Ų | 65 | 91.8 Ų | 91.8 | 33% | 0.333 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -60.7 | -44.2 | 174.1 | -65.9 | 165.7 | 0 | 0 | 0 | 110.3 | F168 L169 L174 I175 L176 | F168-I172 HydrophobicContact CD1-CD1 3.77Å; F168-I172 HydrophobicContact CE1-CD1 3.36Å; F168-I172 HydrophobicContact CE1-CG1 4.41Å; F168-I172 HydrophobicContact CE2-CD1 4.3Å; F168-I172 HydrophobicContact CG-CD1 4.41Å; F168-I172 HydrophobicContact CZ-CD1 3.66Å; F168-I172 HydrophobicContact CZ-CG1 4.36Å; F168-I172 WeakPolarHBondContact O-CG1 3.32Å; F168-I172 PolarHBondContact O-N 2.73Å; L169-I172 PolarHBondContact O-N 3.16Å; I172-L174 VanDerWaalsContact C-N 3.33Å; I172-L174 PolarHBondContact O-N 2.72Å; I172-I175 PolarHBondContact O-N 3.3Å; I172-L176 HydrophobicContact CG2-CD1 3.82Å; I172-L176 HydrophobicContact CG2-CG 4.13Å; I172-L176 WeakPolarHBondContact O-CB 3.45Å; I172-L176 WeakPolarHBondContact O-CG 3.34Å; I172-L176 PolarHBondContact O-N 3.35Å |
| 173 | F | 94.4 | Very high | 92.1 | Very high | 124 Ų | 124 | 99.4 Ų | 99.4 | 54% | 0.544 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -61.2 | -40.7 | 177.7 | -170.7 | -99.2 | 0 | 0 | 0 | 112 | L169 F170 A171 L176 L177 | L169-F173 WeakPolarHBondContact O-CB 3.33Å; L169-F173 PolarHBondContact O-N 2.75Å; F170-F173 WeakPolarHBondContact O-CB 3.34Å; F170-F173 PolarHBondContact O-N 3.49Å; A171-F173 VanDerWaalsContact C-N 3.32Å; A171-F173 PolarHBondContact O-N 2.73Å; F173-L176 PolarHBondContact O-N 3.46Å; F173-L177 HydrophobicContact CE1-CD1 3.85Å; F173-L177 HydrophobicContact CZ-CD1 4.39Å; F173-L177 WeakPolarHBondContact O-CB 3.41Å; F173-L177 PolarHBondContact O-N 3.33Å |
| 174 | L | 92.9 | Very high | 90.8 | Very high | 85 Ų | 85 | 101.7 Ų | 101.7 | 45% | 0.445 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -65.5 | -39.9 | 174.6 | -71.5 | -178.7 | 0 | 0 | 0 | 112.4 | F170 A171 I172 L177 L178 | F170-L174 HydrophobicContact CD1-CD1 3.89Å; F170-L174 HydrophobicContact CD1-CG 4.22Å; F170-L174 HydrophobicContact CE1-CD1 3.53Å; F170-L174 HydrophobicContact CE1-CD2 4.34Å; F170-L174 HydrophobicContact CE1-CG 3.97Å; F170-L174 HydrophobicContact CZ-CD1 4.21Å; F170-L174 HydrophobicContact CZ-CD2 4.19Å; F170-L174 HydrophobicContact CZ-CG 4.25Å; F170-L174 WeakPolarHBondContact O-CG 3.11Å; F170-L174 PolarHBondContact O-N 2.65Å; A171-L174 PolarHBondContact O-N 2.7Å; I172-L174 VanDerWaalsContact C-N 3.33Å; I172-L174 PolarHBondContact O-N 2.72Å; L174-L177 CarbonylContact O-C 3.6Å; L174-L177 PolarHBondContact O-N 3.47Å; L174-L178 WeakPolarHBondContact O-CA 3.49Å; L174-L178 WeakPolarHBondContact O-CB 2.84Å; L174-L178 PolarHBondContact O-N 3.06Å |
| 175 | I | 94 | Very high | 89.1 | Confident | 106 Ų | 106 | 104.2 Ų | 104.2 | 54% | 0.544 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -67.3 | -45.8 | 176.1 | -65.4 | 165.8 | 0 | 0 | 0 | 110.2 | A171 I172 L177 L178 V179 | A171-I175 WeakPolarHBondContact O-CG1 3.49Å; A171-I175 PolarHBondContact O-N 2.93Å; I172-I175 PolarHBondContact O-N 3.3Å; I175-L177 VanDerWaalsContact C-N 3.33Å; I175-L177 PolarHBondContact O-N 2.64Å; I175-L178 PolarHBondContact O-N 3.15Å; I175-V179 HydrophobicContact CG2-CG2 4.34Å; I175-V179 WeakPolarHBondContact O-CB 3.28Å; I175-V179 WeakPolarHBondContact O-CG2 3.4Å; I175-V179 PolarHBondContact O-N 2.78Å |
| 176 | L | 90.4 | Very high | 86.9 | Confident | 110 Ų | 110 | 107.5 Ų | 107.5 | 58% | 0.576 | 52% | 0.523 | S | S | * | . | H | α-helix | trans | -61.8 | -42.9 | 175.5 | -73 | 174.8 | 0 | 0 | 0 | 110.9 | I172 F173 L178 Y180 | I172-L176 HydrophobicContact CG2-CD1 3.82Å; I172-L176 HydrophobicContact CG2-CG 4.13Å; I172-L176 WeakPolarHBondContact O-CB 3.45Å; I172-L176 WeakPolarHBondContact O-CG 3.34Å; I172-L176 PolarHBondContact O-N 3.35Å; F173-L176 PolarHBondContact O-N 3.46Å; L176-L178 VanDerWaalsContact C-N 3.33Å; L176-Y180 WeakPolarHBondContact O-CA 3.43Å; L176-Y180 WeakPolarHBondContact O-CB 2.95Å; L176-Y180 PolarHBondContact O-N 3.42Å |
| 177 | L | 86.8 | Confident | 85 | Confident | 75 Ų | 75 | 108.9 Ų | 108.9 | 39% | 0.393 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -66.9 | -35.9 | 175.4 | -169.8 | 149.8 | 0 | 0 | 0 | 110.6 | F173 L174 I175 R181 | F173-L177 HydrophobicContact CE1-CD1 3.85Å; F173-L177 HydrophobicContact CZ-CD1 4.39Å; F173-L177 WeakPolarHBondContact O-CB 3.41Å; F173-L177 PolarHBondContact O-N 3.33Å; L174-L177 CarbonylContact O-C 3.6Å; L174-L177 PolarHBondContact O-N 3.47Å; I175-L177 VanDerWaalsContact C-N 3.33Å; I175-L177 PolarHBondContact O-N 2.64Å; L177-R181 HydrophobicContact CD2-CB 4.37Å; L177-R181 VanDerWaalsContact O-CA 3.28Å; L177-R181 WeakPolarHBondContact O-CA 3.07Å; L177-R181 WeakPolarHBondContact O-CB 3.12Å; L177-R181 PolarHBondContact O-N 3.18Å |
| 178 | L | 87.3 | Confident | 83.2 | Confident | 98 Ų | 98 | 109 Ų | 109 | 51% | 0.513 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -70 | -46.9 | 177.2 | -174.2 | 121.5 | 0 | 0 | 0 | 110.7 | L174 I175 L176 R181 M182 | L174-L178 WeakPolarHBondContact O-CA 3.49Å; L174-L178 WeakPolarHBondContact O-CB 2.84Å; L174-L178 PolarHBondContact O-N 3.06Å; I175-L178 PolarHBondContact O-N 3.15Å; L176-L178 VanDerWaalsContact C-N 3.33Å; L178-R181 CarbonylContact O-C 3.47Å; L178-R181 PolarHBondContact O-N 3.19Å; L178-M182 HydrophobicContact CD2-SD 4.03Å; L178-M182 HydrophobicContact CG-SD 4.37Å; L178-M182 WeakPolarHBondContact O-CB 3.14Å; L178-M182 WeakPolarHBondContact O-CG 3.41Å; L178-M182 PolarHBondContact O-N 3.4Å |
| 179 | V | 89.3 | Confident | 81.3 | Confident | 82 Ų | 82 | 107.1 Ų | 107.1 | 50% | 0.497 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -64 | -45.2 | 174.1 | 174 | 0 | 0 | 0 | 0 | 110 | I175 R181 M182 R183 | I175-V179 HydrophobicContact CG2-CG2 4.34Å; I175-V179 WeakPolarHBondContact O-CB 3.28Å; I175-V179 WeakPolarHBondContact O-CG2 3.4Å; I175-V179 PolarHBondContact O-N 2.78Å; V179-R181 PolarHBondContact O-N 3.04Å; V179-M182 PolarHBondContact O-N 3.44Å; V179-M182 VanDerWaalsContact O-N 3.16Å; V179-R183 WeakPolarHBondContact O-CB 3.29Å; V179-R183 PolarHBondContact O-N 2.95Å |
| 180 | Y | 85.3 | Confident | 79.4 | Confident | 136 Ų | 136 | 110.8 Ų | 110.8 | 53% | 0.533 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -61.7 | -44 | 174.7 | 178.3 | -89.3 | 0 | 0 | 0 | 111.4 | L176 M182 K184 | L176-Y180 WeakPolarHBondContact O-CA 3.43Å; L176-Y180 WeakPolarHBondContact O-CB 2.95Å; L176-Y180 PolarHBondContact O-N 3.42Å; Y180-M182 VanDerWaalsContact C-N 3.29Å; Y180-M182 PolarHBondContact O-N 3.1Å; Y180-K184 HydrophobicContact CD1-CD 4.42Å; Y180-K184 HydrophobicContact CD2-CD 3.98Å; Y180-K184 HydrophobicContact CD2-CG 4.36Å; Y180-K184 HydrophobicContact CE1-CD 3.9Å; Y180-K184 HydrophobicContact CE2-CD 3.47Å; Y180-K184 VanDerWaalsContact CE2-CD 3.47Å; Y180-K184 HydrophobicContact CE2-CG 4.32Å; Y180-K184 HydrophobicContact CG-CD 4.44Å; Y180-K184 VanDerWaalsContact CZ-CE 3.47Å; Y180-K184 VanDerWaalsContact CZ-NZ 3.32Å; Y180-K184 WeakPolarHBondContact O-CA 3.36Å; Y180-K184 WeakPolarHBondContact O-CB 3.19Å; Y180-K184 WeakPolarHBondContact O-CG 2.75Å; Y180-K184 PolarHBondContact O-N 3.27Å; Y180-K184 PolarHBondContact OH-NZ 2.92Å |
| 181 | R | 82.8 | Confident | 77.6 | Confident | 132 Ų | 132 | 110 Ų | 110 | 50% | 0.498 | 54% | 0.541 | S | S | . | . | H | α-helix | trans | -63 | -36.6 | 174.6 | -178.9 | -179.2 | 177.3 | 139.1 | 2.2 | 109.3 | L177 L178 V179 K185 | L177-R181 HydrophobicContact CD2-CB 4.37Å; L177-R181 VanDerWaalsContact O-CA 3.28Å; L177-R181 WeakPolarHBondContact O-CA 3.07Å; L177-R181 WeakPolarHBondContact O-CB 3.12Å; L177-R181 PolarHBondContact O-N 3.18Å; L178-R181 CarbonylContact O-C 3.47Å; L178-R181 PolarHBondContact O-N 3.19Å; V179-R181 PolarHBondContact O-N 3.04Å; R181-K185 HydrophobicContact CB-CD 4.47Å; R181-K185 HydrophobicContact CB-CG 4.42Å; R181-K185 HydrophobicContact CG-CB 4.14Å; R181-K185 HydrophobicContact CG-CD 3.26Å; R181-K185 VanDerWaalsContact CG-CE 3.44Å; R181-K185 HydrophobicContact CG-CG 3.59Å; R181-K185 VanDerWaalsContact NH1-NZ 3.11Å; R181-K185 WeakPolarHBondContact O-CA 3.05Å; R181-K185 WeakPolarHBondContact O-CB 3.05Å; R181-K185 WeakPolarHBondContact O-CG 3.38Å; R181-K185 PolarHBondContact O-N 3.02Å |
| 182 | M | 77.6 | Confident | 75.8 | Confident | 129 Ų | 129 | 115.7 Ų | 115.7 | 64% | 0.635 | 56% | 0.564 | S | S | * | * | H | α-helix | trans | -78.6 | -48.9 | 178.8 | -71.6 | -173.3 | 80.2 | 0 | 0 | 110.4 | L178 V179 Y180 K184 K185 D186 | L178-M182 HydrophobicContact CD2-SD 4.03Å; L178-M182 HydrophobicContact CG-SD 4.37Å; L178-M182 WeakPolarHBondContact O-CB 3.14Å; L178-M182 WeakPolarHBondContact O-CG 3.41Å; L178-M182 PolarHBondContact O-N 3.4Å; V179-M182 PolarHBondContact O-N 3.44Å; V179-M182 VanDerWaalsContact O-N 3.16Å; Y180-M182 VanDerWaalsContact C-N 3.29Å; Y180-M182 PolarHBondContact O-N 3.1Å; M182-K184 PolarHBondContact O-N 3.42Å; M182-K184 VanDerWaalsContact O-N 3.15Å; M182-K185 PolarHBondContact O-N 3.19Å; M182-D186 PolarHBondContact O-N 2.84Å |
| 183 | R | 80.8 | Confident | 74 | Confident | 208 Ų | 208 | 114.8 Ų | 114.8 | 79% | 0.785 | 57% | 0.571 | S | S | * | * | H | α-helix | trans | -64.9 | -19.9 | 179.5 | -141.7 | -74.9 | -164.2 | 174.7 | 0.8 | 113.2 | V179 | V179-R183 WeakPolarHBondContact O-CB 3.29Å; V179-R183 PolarHBondContact O-N 2.95Å |
| 184 | K | 70.9 | Confident | 72.2 | Confident | 91 Ų | 91 | 116.6 Ų | 116.6 | 40% | 0.396 | 58% | 0.581 | S | S | . | * | H | α-helix | trans | -119.4 | -8.2 | 174 | -54.9 | -160.3 | -175.7 | -176.7 | 0 | 114.6 | Y180 M182 E187 | Y180-K184 HydrophobicContact CD1-CD 4.42Å; Y180-K184 HydrophobicContact CD2-CD 3.98Å; Y180-K184 HydrophobicContact CD2-CG 4.36Å; Y180-K184 HydrophobicContact CE1-CD 3.9Å; Y180-K184 HydrophobicContact CE2-CD 3.47Å; Y180-K184 VanDerWaalsContact CE2-CD 3.47Å; Y180-K184 HydrophobicContact CE2-CG 4.32Å; Y180-K184 HydrophobicContact CG-CD 4.44Å; Y180-K184 VanDerWaalsContact CZ-CE 3.47Å; Y180-K184 VanDerWaalsContact CZ-NZ 3.32Å; Y180-K184 WeakPolarHBondContact O-CA 3.36Å; Y180-K184 WeakPolarHBondContact O-CB 3.19Å; Y180-K184 WeakPolarHBondContact O-CG 2.75Å; Y180-K184 PolarHBondContact O-N 3.27Å; Y180-K184 PolarHBondContact OH-NZ 2.92Å; M182-K184 PolarHBondContact O-N 3.42Å; M182-K184 VanDerWaalsContact O-N 3.15Å; K184-E187 WeakPolarHBondContact O-CA 3.41Å; K184-E187 WeakPolarHBondContact O-CB 3.07Å; K184-E187 VanDerWaalsContact O-CG 3.29Å; K184-E187 WeakPolarHBondContact O-CG 3.43Å; K184-E187 PolarHBondContact O-N 3.38Å |
| 185 | K | 60.8 | Low | 70.4 | Confident | 96 Ų | 96 | 124.1 Ų | 124.1 | 42% | 0.417 | 60% | 0.603 | S | S | . | * | H | α-helix | trans | -99.4 | 17.3 | 171.9 | -59.6 | -164.8 | -175.4 | 164.6 | 0 | 114.6 | R181 M182 E187 G188 | R181-K185 HydrophobicContact CB-CD 4.47Å; R181-K185 HydrophobicContact CB-CG 4.42Å; R181-K185 HydrophobicContact CG-CB 4.14Å; R181-K185 HydrophobicContact CG-CD 3.26Å; R181-K185 VanDerWaalsContact CG-CE 3.44Å; R181-K185 HydrophobicContact CG-CG 3.59Å; R181-K185 VanDerWaalsContact NH1-NZ 3.11Å; R181-K185 WeakPolarHBondContact O-CA 3.05Å; R181-K185 WeakPolarHBondContact O-CB 3.05Å; R181-K185 WeakPolarHBondContact O-CG 3.38Å; R181-K185 PolarHBondContact O-N 3.02Å; M182-K185 PolarHBondContact O-N 3.19Å; K185-E187 PolarHBondContact O-N 3.49Å; K185-G188 VanDerWaalsContact C-N 3.34Å; K185-G188 VanDerWaalsContact CA-N 3.28Å; K185-G188 PolarHBondContact O-N 2.65Å |
| 186 | D | 52.2 | Low | 68.6 | Low | 152 Ų | 152 | 127.6 Ų | 127.6 | 81% | 0.813 | 61% | 0.614 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -62.5 | -13.1 | 136.5 | -65.1 | -27.5 | 0 | 0 | 0 | 111.1 | M182 | M182-D186 PolarHBondContact O-N 2.84Š|
| 187 | E | 56.3 | Low | 66.8 | Low | 148 Ų | 148 | 127 Ų | 127 | 69% | 0.692 | 62% | 0.618 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -97.6 | 4.9 | 165.5 | -42.4 | 173.9 | 174.8 | 0 | 0 | 113.1 | K184 K185 | K184-E187 WeakPolarHBondContact O-CA 3.41Å; K184-E187 WeakPolarHBondContact O-CB 3.07Å; K184-E187 VanDerWaalsContact O-CG 3.29Å; K184-E187 WeakPolarHBondContact O-CG 3.43Å; K184-E187 PolarHBondContact O-N 3.38Å; K185-E187 PolarHBondContact O-N 3.49Å |
| 188 | G | 61 | Low | 65.3 | Low | 37 Ų | 37 | 128.5 Ų | 128.5 | 38% | 0.381 | 63% | 0.634 | S | S | . | * | trans | -91.7 | -9.9 | 179.5 | 0 | 0 | 0 | 0 | 0 | 113.2 | K185 Y190 | K185-G188 VanDerWaalsContact C-N 3.34Å; K185-G188 VanDerWaalsContact CA-N 3.28Å; K185-G188 PolarHBondContact O-N 2.65Å; G188-Y190 PolarHBondContact O-N 3Å | ||
| 189 | S | 57.8 | Low | 63.6 | Low | 99 Ų | 99 | 127.4 Ų | 127.4 | 69% | 0.692 | 65% | 0.647 | S | S | * | * | S | Bend | trans | -73.9 | 88.2 | 141.2 | -166.9 | 0 | 0 | 0 | 0 | 105 | D191 | S189-D191 PolarHBondContact O-N 2.89Š|
| 190 | Y | 56.7 | Low | 62.1 | Low | 186 Ų | 186 | 128.1 Ų | 128.1 | 73% | 0.729 | 66% | 0.661 | S | S | * | * | trans | -44.9 | 130.4 | 154.5 | -79.9 | -90.6 | 0 | 0 | 0 | 106.1 | G188 L192 | G188-Y190 PolarHBondContact O-N 3Å; Y190-L192 PolarHBondContact O-N 3.04Å | ||
| 191 | D | 59.6 | Low | 60.8 | Low | 109 Ų | 109 | 125.5 Ų | 125.5 | 58% | 0.583 | 67% | 0.668 | S | S | * | * | trans | -64.9 | 73.4 | 175.5 | -153.6 | -9 | 0 | 0 | 0 | 109.4 | S189 G193 E194 | S189-D191 PolarHBondContact O-N 2.89Å; D191-G193 PolarHBondContact O-N 3.28Å; D191-G193 PolarHBondContact OD1-N 3.21Å; D191-E194 PolarHBondContact OD1-N 3.47Å | ||
| 192 | L | 58.9 | Low | 59.4 | Low | 161 Ų | 161 | 129.5 Ų | 129.5 | 84% | 0.843 | 68% | 0.684 | S | S | * | * | trans | -81.3 | 11.5 | 161.5 | -86.7 | 89.3 | 0 | 0 | 0 | 109.6 | Y190 | Y190-L192 PolarHBondContact O-N 3.04Š| ||
| 193 | G | 58.6 | Low | 58.3 | Low | 46 Ų | 46 | 132.1 Ų | 132.1 | 47% | 0.474 | 70% | 0.695 | S | S | . | * | S | Bend | trans | -96 | -30 | 179.6 | 0 | 0 | 0 | 0 | 0 | 113.6 | D191 R195 | D191-G193 PolarHBondContact O-N 3.28Å; D191-G193 PolarHBondContact OD1-N 3.21Å; G193-R195 PolarHBondContact O-N 3.46Å |
| 194 | E | 56.4 | Low | 57.3 | Low | 162 Ų | 162 | 131.1 Ų | 131.1 | 76% | 0.757 | 70% | 0.696 | S | S | * | * | S | Bend | trans | -97 | 29.1 | -176.4 | -65.8 | -161.6 | -173.2 | 0 | 0 | 115.4 | D191 | D191-E194 PolarHBondContact OD1-N 3.47Š|
| 195 | R | 56 | Low | 57.2 | Low | 243 Ų | 243 | 130.2 Ų | 130.2 | 92% | 0.917 | 71% | 0.705 | S | S | * | * | S | Bend | trans | -101.5 | 60.2 | 141.5 | -77.7 | -165.3 | 178 | -175.7 | 1.5 | 110.2 | G193 | G193-R195 PolarHBondContact O-N 3.46Š|
| 196 | K | 55.5 | Low | 57.4 | Low | 179 Ų | 179 | 131.5 Ų | 131.5 | 78% | 0.778 | 72% | 0.724 | S | S | * | * | trans | -69.2 | 158.7 | 151.7 | -85.3 | 177.1 | 177.9 | 175.3 | 0 | 109.2 | ||||
| 197 | P | 51.5 | Low | 58.1 | Low | 99 Ų | 99 | 129.7 Ų | 129.7 | 64% | 0.643 | 72% | 0.718 | S | S | * | * | S | Bend | cis | -121.4 | 168.1 | -17.5 | 38.4 | -23.8 | 0 | 0 | 0 | 110.5 | G199 | P197-G199 PolarHBondContact O-N 2.76Š|
| 198 | S | 55.8 | Low | 58.4 | Low | 106 Ų | 106 | 130.3 Ų | 130.3 | 74% | 0.741 | 72% | 0.719 | S | S | * | * | trans | 12.6 | 70.7 | 145 | 64.6 | 0 | 0 | 0 | 0 | 117.3 | A200 | S198-A200 PolarHBondContact O-N 3.44Š| ||
| 199 | G | 51.2 | Low | 58.7 | Low | 75 Ų | 75 | 135.6 Ų | 135.6 | 77% | 0.773 | 73% | 0.734 | S | S | * | * | trans | -79.2 | -1 | 168.7 | 0 | 0 | 0 | 0 | 0 | 112.4 | P197 A201 | P197-G199 PolarHBondContact O-N 2.76Å; G199-A201 PolarHBondContact O-N 2.95Å | ||
| 200 | A | 58 | Low | 59 | Low | 97 Ų | 97 | 138.7 Ų | 138.7 | 80% | 0.802 | 74% | 0.735 | S | S | * | * | trans | -73 | 41.9 | 161.9 | 0 | 0 | 0 | 0 | 0 | 110.9 | S198 Y202 | S198-A200 PolarHBondContact O-N 3.44Å; A200-Y202 PolarHBondContact O-N 2.92Å | ||
| 201 | A | 57.7 | Low | 59.4 | Low | 81 Ų | 81 | 140.3 Ų | 140.3 | 67% | 0.669 | 74% | 0.741 | S | S | * | * | trans | -73.6 | 82.2 | 153.7 | 0 | 0 | 0 | 0 | 0 | 105.5 | G199 Q203 | G199-A201 PolarHBondContact O-N 2.95Å; A201-Q203 PolarHBondContact O-N 2.94Å | ||
| 202 | Y | 53.3 | Low | 59.8 | Low | 215 Ų | 215 | 143.7 Ų | 143.7 | 84% | 0.843 | 78% | 0.784 | S | S | * | * | trans | -9.6 | 101.9 | 153.2 | -145.6 | -95.9 | 0 | 0 | 0 | 109.9 | A200 K204 | A200-Y202 PolarHBondContact O-N 2.92Å; Y202-K204 PolarHBondContact O-N 3.02Å | ||
| 203 | Q | 56.4 | Low | 59.8 | Low | 185 Ų | 185 | 142.8 Ų | 142.8 | 86% | 0.864 | 78% | 0.781 | S | S | * | * | trans | -61.6 | 93.6 | 177.7 | -172.9 | 174.1 | -3.3 | 0 | 0 | 105.9 | A201 A205 | A201-Q203 PolarHBondContact O-N 2.94Å; Q203-A205 PolarHBondContact O-N 2.74Å | ||
| 204 | K | 58.8 | Low | 59.9 | Low | 187 Ų | 187 | 147.9 Ų | 147.9 | 81% | 0.813 | 80% | 0.797 | S | S | * | * | trans | -54.7 | 118.6 | 173.7 | -86.6 | -164.9 | 177.5 | -172.8 | 0 | 106.2 | Y202 | Y202-K204 PolarHBondContact O-N 3.02Š| ||
| 205 | A | 68.3 | Low | 60.1 | Low | 71 Ų | 71 | 147.1 Ų | 147.1 | 59% | 0.587 | 80% | 0.8 | S | S | * | * | trans | -52 | 134.7 | 171.6 | 0 | 0 | 0 | 0 | 0 | 108.4 | Q203 T207 | Q203-A205 PolarHBondContact O-N 2.74Å; A205-T207 PolarHBondContact O-N 2.78Å | ||
| 206 | P | 66 | Low | 60.3 | Low | 124 Ų | 124 | 141.5 Ų | 141.5 | 81% | 0.805 | 79% | 0.793 | S | S | * | * | trans | -63.4 | 88.7 | 169.4 | -18.1 | 30.6 | 0 | 0 | 0 | 108.9 | K208 | P206-K208 PolarHBondContact O-N 2.98Š| ||
| 207 | T | 66.3 | Low | 60.6 | Low | 114 Ų | 114 | 139.1 Ų | 139.1 | 70% | 0.699 | 79% | 0.794 | S | S | * | * | trans | -75.1 | 77.9 | 165.9 | 55 | 0 | 0 | 0 | 0 | 106.8 | A205 E209 | A205-T207 PolarHBondContact O-N 2.78Å; T207-E209 PolarHBondContact O-N 2.87Å | ||
| 208 | K | 61.9 | Low | 61.2 | Low | 160 Ų | 160 | 141.8 Ų | 141.8 | 70% | 0.696 | 80% | 0.804 | S | S | * | * | trans | -74.9 | 84.8 | 172.4 | -154.3 | -179 | -158.4 | -164.5 | 0 | 106.8 | P206 F210 | P206-K208 PolarHBondContact O-N 2.98Å; K208-F210 HydrophobicContact CD-CD2 3.85Å; K208-F210 HydrophobicContact CD-CE2 3.23Å; K208-F210 HydrophobicContact CD-CZ 3.98Å; K208-F210 HydrophobicContact CG-CD2 3.75Å; K208-F210 HydrophobicContact CG-CE2 3.46Å; K208-F210 VanDerWaalsContact CG-CE2 3.46Å; K208-F210 HydrophobicContact CG-CZ 4.03Å; K208-F210 PolarHBondContact O-N 3.25Å | ||
| 209 | E | 67.8 | Low | 61.6 | Low | 149 Ų | 149 | 144.4 Ų | 144.4 | 70% | 0.696 | 81% | 0.808 | S | S | * | * | trans | -67.3 | 110.9 | 165.5 | -48.8 | -172.9 | -148.7 | 0 | 0 | 107.1 | T207 | T207-E209 PolarHBondContact O-N 2.87Š| ||
| 210 | F | 64.5 | Low | 62.4 | Low | 164 Ų | 164 | 149.7 Ų | 149.7 | 72% | 0.719 | 81% | 0.811 | S | S | * | * | trans | -119.2 | 104.7 | 160.5 | -74.7 | -59.7 | 0 | 0 | 0 | 108.1 | K208 | K208-F210 HydrophobicContact CD-CD2 3.85Å; K208-F210 HydrophobicContact CD-CE2 3.23Å; K208-F210 HydrophobicContact CD-CZ 3.98Å; K208-F210 HydrophobicContact CG-CD2 3.75Å; K208-F210 HydrophobicContact CG-CE2 3.46Å; K208-F210 VanDerWaalsContact CG-CE2 3.46Å; K208-F210 HydrophobicContact CG-CZ 4.03Å; K208-F210 PolarHBondContact O-N 3.25Å | ||
| 211 | Y | 64.3 | Low | 62.8 | Low | 219 Ų | 219 | 154.1 Ų | 154.1 | 86% | 0.859 | 81% | 0.812 | S | S | * | * | trans | -89.5 | 119.1 | 154.8 | -81.7 | -89.6 | 0 | 0 | 0 | 107.9 | ||||
| 212 | A | 67.9 | Low | 63.2 | Low | 180 Ų | 180 | 160.7 Ų | 160.7 | 100% | 1.488 | 83% | 0.825 | S | S | * | * | trans | -167.5 | 0 | 149.8 | 0 | 0 | 0 | 0 | 0 | 108.6 |
Retrieved 212 of 212 residues in 175 ms
(Link to these results)