| 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 | 47.7 | Very low | 76.8 | Confident | 235 Ų | 235 | 116.4 Ų | 116.4 | 100% | 1.158 | 64% | 0.636 | S | S | * | * | 0 | 56.6 | 0 | -64.1 | -175.7 | -139.8 | 0 | 0 | 109.8 | |||||
| 2 | N | 54.5 | Low | 78.2 | Confident | 126 Ų | 126 | 110.8 Ų | 110.8 | 67% | 0.674 | 62% | 0.616 | S | S | * | * | trans | -105.4 | -11.6 | -174.4 | -68.6 | 20.4 | 0 | 0 | 0 | 113.1 | S4 | N2-S4 PolarHBondContact O-N 2.9Š| ||
| 3 | C | 60.4 | Low | 79.4 | Confident | 87 Ų | 87 | 113.2 Ų | 113.2 | 59% | 0.588 | 62% | 0.617 | S | S | * | * | H | α-helix | trans | -81.7 | -2 | -173.6 | -57 | 0 | 0 | 0 | 0 | 115.6 | K7 | C3-K7 WeakPolarHBondContact O-CD 3.46Å; C3-K7 VanDerWaalsContact O-CG 3.28Å; C3-K7 WeakPolarHBondContact O-CG 3.45Å |
| 4 | S | 73.3 | Confident | 80.4 | Confident | 90 Ų | 90 | 108.6 Ų | 108.6 | 63% | 0.629 | 60% | 0.597 | S | S | * | * | H | α-helix | trans | -88.5 | -42.7 | 177.7 | 171.8 | 0 | 0 | 0 | 0 | 111.8 | N2 K7 V8 | N2-S4 PolarHBondContact O-N 2.9Å; S4-K7 PolarHBondContact O-N 3.46Å; S4-V8 WeakPolarHBondContact O-CG2 3.43Å; S4-V8 PolarHBondContact O-N 3.33Å |
| 5 | L | 79.3 | Confident | 81.4 | Confident | 122 Ų | 122 | 107.3 Ų | 107.3 | 64% | 0.639 | 59% | 0.588 | S | S | * | * | H | α-helix | trans | -68.9 | -38.5 | 179.5 | -175.7 | 63.7 | 0 | 0 | 0 | 112 | K7 V8 L9 | L5-K7 VanDerWaalsContact C-N 3.33Å; L5-K7 PolarHBondContact O-N 3.23Å; L5-V8 PolarHBondContact O-N 2.93Å; L5-L9 HydrophobicContact CG-CD1 4.21Å; L5-L9 WeakPolarHBondContact O-CB 3.37Å; L5-L9 PolarHBondContact O-N 3.35Å |
| 6 | E | 83.6 | Confident | 82.3 | Confident | 130 Ų | 130 | 106.6 Ų | 106.6 | 61% | 0.607 | 59% | 0.588 | S | S | * | * | H | α-helix | trans | -63.4 | -37.7 | 176.4 | -71.3 | 177.9 | 166.1 | 0 | 0 | 112.5 | L9 A10 | E6-L9 PolarHBondContact O-N 3.01Å; E6-A10 WeakPolarHBondContact O-CB 3.3Å; E6-A10 PolarHBondContact O-N 3.15Å |
| 7 | K | 86 | Confident | 83 | Confident | 143 Ų | 143 | 108 Ų | 108 | 62% | 0.622 | 59% | 0.589 | S | S | * | * | H | α-helix | trans | -66.8 | -45.3 | 175.2 | -72.8 | 179.3 | -177.4 | -173.3 | 0 | 111.7 | C3 S4 L5 L9 A10 D11 | C3-K7 WeakPolarHBondContact O-CD 3.46Å; C3-K7 VanDerWaalsContact O-CG 3.28Å; C3-K7 WeakPolarHBondContact O-CG 3.45Å; S4-K7 PolarHBondContact O-N 3.46Å; L5-K7 VanDerWaalsContact C-N 3.33Å; L5-K7 PolarHBondContact O-N 3.23Å; K7-L9 VanDerWaalsContact C-N 3.3Å; K7-L9 PolarHBondContact O-N 3.42Å; K7-A10 PolarHBondContact O-N 2.88Å; K7-A10 VanDerWaalsContact O-N 3.16Å; K7-D11 PolarHBondContact O-N 3.48Å |
| 8 | V | 89.1 | Confident | 83.8 | Confident | 89 Ų | 89 | 109.2 Ų | 109.2 | 54% | 0.539 | 58% | 0.583 | S | S | . | * | H | α-helix | trans | -61.6 | -39.9 | 175.9 | 173.9 | 0 | 0 | 0 | 0 | 111.2 | S4 L5 D11 A12 | S4-V8 WeakPolarHBondContact O-CG2 3.43Å; S4-V8 PolarHBondContact O-N 3.33Å; L5-V8 PolarHBondContact O-N 2.93Å; V8-D11 PolarHBondContact O-N 3.32Å; V8-A12 WeakPolarHBondContact O-CB 3.45Å; V8-A12 PolarHBondContact O-N 2.94Å |
| 9 | L | 89.4 | Confident | 84.5 | Confident | 94 Ų | 94 | 108.1 Ų | 108.1 | 49% | 0.492 | 58% | 0.577 | S | S | . | * | H | α-helix | trans | -64.6 | -39.7 | 174.2 | -91.2 | 160.5 | 0 | 0 | 0 | 112.6 | L5 E6 K7 K13 | L5-L9 HydrophobicContact CG-CD1 4.21Å; L5-L9 WeakPolarHBondContact O-CB 3.37Å; L5-L9 PolarHBondContact O-N 3.35Å; E6-L9 PolarHBondContact O-N 3.01Å; K7-L9 VanDerWaalsContact C-N 3.3Å; K7-L9 PolarHBondContact O-N 3.42Å; L9-K13 VanDerWaalsContact O-CG 3.32Å; L9-K13 WeakPolarHBondContact O-CG 3.49Å; L9-K13 PolarHBondContact O-N 3.27Å |
| 10 | A | 90.3 | Very high | 85.1 | Confident | 57 Ų | 57 | 111.5 Ų | 111.5 | 47% | 0.471 | 58% | 0.581 | S | S | . | * | H | α-helix | trans | -66.2 | -42.8 | 175.7 | 0 | 0 | 0 | 0 | 0 | 111.8 | E6 K7 K13 S14 | E6-A10 WeakPolarHBondContact O-CB 3.3Å; E6-A10 PolarHBondContact O-N 3.15Å; K7-A10 PolarHBondContact O-N 2.88Å; K7-A10 VanDerWaalsContact O-N 3.16Å; A10-K13 PolarHBondContact O-N 2.87Å; A10-S14 PolarHBondContact O-N 3.14Å |
| 11 | D | 91.4 | Very high | 85.6 | Confident | 107 Ų | 107 | 110.9 Ų | 110.9 | 57% | 0.572 | 58% | 0.579 | S | S | * | * | H | α-helix | trans | -65.4 | -41 | 177.2 | -71.3 | -19.2 | 0 | 0 | 0 | 111.7 | K7 V8 K13 S14 L15 | K7-D11 PolarHBondContact O-N 3.48Å; V8-D11 PolarHBondContact O-N 3.32Å; D11-K13 PolarHBondContact O-N 2.95Å; D11-S14 PolarHBondContact O-N 3.45Å; D11-L15 WeakPolarHBondContact O-CB 3.38Å; D11-L15 PolarHBondContact O-N 3.39Å |
| 12 | A | 93.6 | Very high | 87.9 | Confident | 49 Ų | 49 | 105.7 Ų | 105.7 | 41% | 0.405 | 55% | 0.552 | S | S | . | * | H | α-helix | trans | -62.2 | -41.6 | 174.4 | 0 | 0 | 0 | 0 | 0 | 111.8 | V8 L15 V16 | V8-A12 WeakPolarHBondContact O-CB 3.45Å; V8-A12 PolarHBondContact O-N 2.94Å; A12-L15 PolarHBondContact O-N 2.8Å; A12-V16 VanDerWaalsContact O-CG2 3.29Å; A12-V16 WeakPolarHBondContact O-CG2 3.29Å; A12-V16 PolarHBondContact O-N 2.91Å |
| 13 | K | 93.1 | Very high | 89.9 | Confident | 143 Ų | 143 | 104.6 Ų | 104.6 | 62% | 0.622 | 55% | 0.546 | S | S | * | . | H | α-helix | trans | -62.7 | -45.5 | 174.3 | -74.7 | 175.7 | -179 | -177.2 | 0 | 112 | L9 A10 D11 L15 V16 E17 | L9-K13 VanDerWaalsContact O-CG 3.32Å; L9-K13 WeakPolarHBondContact O-CG 3.49Å; L9-K13 PolarHBondContact O-N 3.27Å; A10-K13 PolarHBondContact O-N 2.87Å; D11-K13 PolarHBondContact O-N 2.95Å; K13-L15 VanDerWaalsContact C-N 3.3Å; K13-L15 PolarHBondContact O-N 3.46Å; K13-V16 PolarHBondContact O-N 3.4Å; K13-E17 PolarHBondContact O-N 3.22Å |
| 14 | S | 93.3 | Very high | 91.6 | Very high | 48 Ų | 48 | 104 Ų | 104 | 34% | 0.336 | 54% | 0.536 | S | S | . | . | H | α-helix | trans | -61.9 | -37.3 | 175.9 | 174 | 0 | 0 | 0 | 0 | 112.5 | A10 D11 R18 | A10-S14 PolarHBondContact O-N 3.14Å; D11-S14 PolarHBondContact O-N 3.45Å; S14-R18 WeakPolarHBondContact O-CB 3.35Å; S14-R18 PolarHBondContact O-N 2.97Å; S14-R18 PolarHBondContact O-NE 3.42Å; S14-R18 PolarHBondContact OG-NH2 2.93Å |
| 15 | L | 95.3 | Very high | 92.7 | Very high | 89 Ų | 89 | 101.6 Ų | 101.6 | 47% | 0.466 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -67.6 | -43.4 | 176 | -177 | 63.6 | 0 | 0 | 0 | 111.3 | D11 A12 K13 R18 L19 | D11-L15 WeakPolarHBondContact O-CB 3.38Å; D11-L15 PolarHBondContact O-N 3.39Å; A12-L15 PolarHBondContact O-N 2.8Å; K13-L15 VanDerWaalsContact C-N 3.3Å; K13-L15 PolarHBondContact O-N 3.46Å; L15-R18 PolarHBondContact O-N 3.44Å; L15-L19 HydrophobicContact CG-CD1 4.21Å; L15-L19 WeakPolarHBondContact O-CG 3.33Å; L15-L19 PolarHBondContact O-N 3.42Å |
| 16 | V | 96.4 | Very high | 93.6 | Very high | 96 Ų | 96 | 97.9 Ų | 97.9 | 58% | 0.582 | 51% | 0.51 | S | S | * | . | H | α-helix | trans | -62.3 | -42.4 | 176.4 | 169.9 | 0 | 0 | 0 | 0 | 111.2 | A12 K13 L19 R20 | A12-V16 VanDerWaalsContact O-CG2 3.29Å; A12-V16 WeakPolarHBondContact O-CG2 3.29Å; A12-V16 PolarHBondContact O-N 2.91Å; K13-V16 PolarHBondContact O-N 3.4Å; V16-L19 PolarHBondContact O-N 2.93Å; V16-R20 WeakPolarHBondContact O-CB 3.5Å; V16-R20 PolarHBondContact O-N 3.26Å |
| 17 | E | 95 | Very high | 94.2 | Very high | 131 Ų | 131 | 97.9 Ų | 97.9 | 61% | 0.612 | 51% | 0.51 | S | S | * | . | H | α-helix | trans | -62.5 | -41.6 | 174.3 | -77.1 | -178.7 | 172.9 | 0 | 0 | 112.1 | K13 R20 N21 | K13-E17 PolarHBondContact O-N 3.22Å; E17-R20 PolarHBondContact O-N 2.82Å; E17-N21 WeakPolarHBondContact O-CB 3.37Å; E17-N21 PolarHBondContact O-N 3.45Å; E17-N21 PolarHBondContact O-ND2 3.16Å |
| 18 | R | 96.7 | Very high | 94.7 | Very high | 129 Ų | 129 | 96.5 Ų | 96.5 | 49% | 0.487 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -63.8 | -44.7 | 175.2 | -87 | -178.4 | -76.4 | 163.1 | -7.4 | 112.7 | S14 L15 R20 N21 H22 | S14-R18 WeakPolarHBondContact O-CB 3.35Å; S14-R18 PolarHBondContact O-N 2.97Å; S14-R18 PolarHBondContact O-NE 3.42Å; S14-R18 PolarHBondContact OG-NH2 2.93Å; L15-R18 PolarHBondContact O-N 3.44Å; R18-R20 VanDerWaalsContact C-N 3.32Å; R18-R20 PolarHBondContact O-N 2.93Å; R18-N21 PolarHBondContact O-N 3.28Å; R18-H22 PolarHBondContact O-CD2 2.94Å; R18-H22 PolarHBondContact O-N 2.93Å |
| 19 | L | 96.1 | Very high | 95.1 | Very high | 89 Ų | 89 | 97.1 Ų | 97.1 | 47% | 0.466 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -60.9 | -44.6 | 176.5 | -74 | 172.1 | 0 | 0 | 0 | 110.7 | L15 V16 N21 H22 D23 | L15-L19 HydrophobicContact CG-CD1 4.21Å; L15-L19 WeakPolarHBondContact O-CG 3.33Å; L15-L19 PolarHBondContact O-N 3.42Å; V16-L19 PolarHBondContact O-N 2.93Å; L19-N21 VanDerWaalsContact C-N 3.32Å; L19-N21 PolarHBondContact O-N 3.44Å; L19-H22 WeakPolarHBondContact O-CB 3.36Å; L19-H22 PolarHBondContact O-N 3.15Å; L19-H22 VanDerWaalsContact O-N 3.14Å; L19-D23 PolarHBondContact O-N 2.93Å |
| 20 | R | 96.4 | Very high | 95.5 | Very high | 175 Ų | 175 | 97.9 Ų | 97.9 | 66% | 0.66 | 51% | 0.51 | S | S | * | . | H | α-helix | trans | -61.2 | -40.4 | 175.9 | -170.6 | 178.9 | -179.8 | -177.5 | -0.4 | 112.5 | V16 E17 R18 H22 D23 N24 | V16-R20 WeakPolarHBondContact O-CB 3.5Å; V16-R20 PolarHBondContact O-N 3.26Å; E17-R20 PolarHBondContact O-N 2.82Å; R18-R20 VanDerWaalsContact C-N 3.32Å; R18-R20 PolarHBondContact O-N 2.93Å; R20-H22 VanDerWaalsContact C-N 3.34Å; R20-D23 PolarHBondContact O-N 3.39Å; R20-N24 WeakPolarHBondContact O-CB 3.26Å; R20-N24 PolarHBondContact O-N 3.4Å; R20-N24 PolarHBondContact O-ND2 3.27Å; R20-N24 PolarHBondContact O-OD1 3.43Å |
| 21 | N | 96.1 | Very high | 95.8 | Very high | 99 Ų | 99 | 101.8 Ų | 101.8 | 53% | 0.529 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -66.8 | -37.1 | 176 | -69.3 | -21.6 | 0 | 0 | 0 | 112 | E17 R18 L19 A25 | E17-N21 WeakPolarHBondContact O-CB 3.37Å; E17-N21 PolarHBondContact O-N 3.45Å; E17-N21 PolarHBondContact O-ND2 3.16Å; R18-N21 PolarHBondContact O-N 3.28Å; L19-N21 VanDerWaalsContact C-N 3.32Å; L19-N21 PolarHBondContact O-N 3.44Å; N21-A25 WeakPolarHBondContact O-CB 3.49Å; N21-A25 PolarHBondContact O-N 2.82Å |
| 22 | H | 96.8 | Very high | 96.1 | Very high | 127 Ų | 127 | 102.5 Ų | 102.5 | 59% | 0.588 | 52% | 0.518 | S | S | * | . | H | α-helix | trans | -67.8 | -41.6 | 174.3 | -71.6 | -172.2 | 0 | 0 | 0 | 112 | R18 L19 R20 A25 A26 | R18-H22 PolarHBondContact O-CD2 2.94Å; R18-H22 PolarHBondContact O-N 2.93Å; L19-H22 WeakPolarHBondContact O-CB 3.36Å; L19-H22 PolarHBondContact O-N 3.15Å; L19-H22 VanDerWaalsContact O-N 3.14Å; R20-H22 VanDerWaalsContact C-N 3.34Å; H22-A25 PolarHBondContact O-N 3.19Å; H22-A26 WeakPolarHBondContact O-CB 3.42Å; H22-A26 PolarHBondContact O-N 2.95Å |
| 23 | D | 96.6 | Very high | 96.3 | Very high | 102 Ų | 102 | 104.6 Ų | 104.6 | 55% | 0.545 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -61.9 | -45.6 | 176.1 | -71.2 | -19.8 | 0 | 0 | 0 | 110.6 | L19 R20 A25 A26 E27 | L19-D23 PolarHBondContact O-N 2.93Å; R20-D23 PolarHBondContact O-N 3.39Å; D23-A25 VanDerWaalsContact C-N 3.31Å; D23-A25 PolarHBondContact O-N 3.29Å; D23-A26 WeakPolarHBondContact O-CB 3.39Å; D23-A26 PolarHBondContact O-N 2.85Å; D23-A26 VanDerWaalsContact O-N 3.16Å; D23-E27 PolarHBondContact O-N 3.21Å |
| 24 | N | 96.2 | Very high | 96.5 | Very high | 74 Ų | 74 | 101 Ų | 101 | 40% | 0.396 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -60 | -39.8 | 173.9 | -67.5 | -17.1 | 0 | 0 | 0 | 112.2 | R20 E27 M28 | R20-N24 WeakPolarHBondContact O-CB 3.26Å; R20-N24 PolarHBondContact O-N 3.4Å; R20-N24 PolarHBondContact O-ND2 3.27Å; R20-N24 PolarHBondContact O-OD1 3.43Å; N24-E27 PolarHBondContact O-N 3.48Å; N24-M28 WeakPolarHBondContact O-CG 3.24Å; N24-M28 PolarHBondContact O-N 3.35Å; N24-M28 VanDerWaalsContact O-N 3.09Å |
| 25 | A | 96.7 | Very high | 96.6 | Very high | 40 Ų | 40 | 101.8 Ų | 101.8 | 33% | 0.331 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -67.6 | -37.3 | 176.5 | 0 | 0 | 0 | 0 | 0 | 112.2 | N21 H22 D23 M28 L29 | N21-A25 WeakPolarHBondContact O-CB 3.49Å; N21-A25 PolarHBondContact O-N 2.82Å; H22-A25 PolarHBondContact O-N 3.19Å; D23-A25 VanDerWaalsContact C-N 3.31Å; D23-A25 PolarHBondContact O-N 3.29Å; A25-M28 HydrophobicContact CB-CE 4.5Å; A25-M28 PolarHBondContact O-N 3.16Å; A25-L29 WeakPolarHBondContact O-CG 3.33Å; A25-L29 PolarHBondContact O-N 3.13Å |
| 26 | A | 97.1 | Very high | 96.7 | Very high | 45 Ų | 45 | 101.6 Ų | 101.6 | 37% | 0.372 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -65.8 | -41.8 | 174.8 | 0 | 0 | 0 | 0 | 0 | 111.5 | H22 D23 L29 I30 | H22-A26 WeakPolarHBondContact O-CB 3.42Å; H22-A26 PolarHBondContact O-N 2.95Å; D23-A26 WeakPolarHBondContact O-CB 3.39Å; D23-A26 PolarHBondContact O-N 2.85Å; D23-A26 VanDerWaalsContact O-N 3.16Å; A26-L29 PolarHBondContact O-N 3.47Å; A26-I30 VanDerWaalsContact O-CG1 3.31Å; A26-I30 WeakPolarHBondContact O-CG1 3.24Å; A26-I30 PolarHBondContact O-N 3.39Å |
| 27 | E | 96.7 | Very high | 96.8 | Very high | 130 Ų | 130 | 100.9 Ų | 100.9 | 61% | 0.607 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -60.2 | -45.2 | 174.3 | -74.8 | -178.3 | 179.4 | 0 | 0 | 111.9 | D23 N24 L29 I30 E31 | D23-E27 PolarHBondContact O-N 3.21Å; N24-E27 PolarHBondContact O-N 3.48Å; E27-L29 VanDerWaalsContact C-N 3.31Å; E27-L29 PolarHBondContact O-N 3.25Å; E27-I30 PolarHBondContact O-N 3.38Å; E27-E31 PolarHBondContact O-N 3.19Å |
| 28 | M | 96.7 | Very high | 96.9 | Very high | 114 Ų | 114 | 101.6 Ų | 101.6 | 56% | 0.562 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -60.6 | -39.7 | 174.7 | -71.6 | -167.5 | -60.2 | 0 | 0 | 112.4 | N24 A25 I30 E31 Q32 | N24-M28 WeakPolarHBondContact O-CG 3.24Å; N24-M28 PolarHBondContact O-N 3.35Å; N24-M28 VanDerWaalsContact O-N 3.09Å; A25-M28 HydrophobicContact CB-CE 4.5Å; A25-M28 PolarHBondContact O-N 3.16Å; M28-I30 VanDerWaalsContact C-N 3.34Å; M28-E31 PolarHBondContact O-N 3.43Å; M28-Q32 WeakPolarHBondContact O-CB 3.38Å; M28-Q32 VanDerWaalsContact O-CG 3.32Å; M28-Q32 WeakPolarHBondContact O-CG 3.45Å; M28-Q32 PolarHBondContact O-N 2.75Å |
| 29 | L | 97.3 | Very high | 96.9 | Very high | 102 Ų | 102 | 103 Ų | 103 | 53% | 0.534 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -66.4 | -36.4 | 176.5 | -75.1 | 172.1 | 0 | 0 | 0 | 112.2 | A25 A26 E27 Q32 T33 | A25-L29 WeakPolarHBondContact O-CG 3.33Å; A25-L29 PolarHBondContact O-N 3.13Å; A26-L29 PolarHBondContact O-N 3.47Å; E27-L29 VanDerWaalsContact C-N 3.31Å; E27-L29 PolarHBondContact O-N 3.25Å; L29-Q32 PolarHBondContact O-N 2.91Å; L29-T33 VanDerWaalsContact O-CB 3.28Å; L29-T33 WeakPolarHBondContact O-CB 3.4Å; L29-T33 PolarHBondContact O-N 2.89Å; L29-T33 PolarHBondContact O-OG1 3.39Å |
| 30 | I | 97.1 | Very high | 97 | Very high | 110 Ų | 110 | 101.7 Ų | 101.7 | 56% | 0.564 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -65.3 | -44.2 | 174.5 | -68.9 | 164.9 | 0 | 0 | 0 | 110 | A26 E27 M28 Q32 T33 T34 | A26-I30 VanDerWaalsContact O-CG1 3.31Å; A26-I30 WeakPolarHBondContact O-CG1 3.24Å; A26-I30 PolarHBondContact O-N 3.39Å; E27-I30 PolarHBondContact O-N 3.38Å; M28-I30 VanDerWaalsContact C-N 3.34Å; I30-Q32 PolarHBondContact O-N 2.98Å; I30-T33 PolarHBondContact O-N 3.39Å; I30-T34 HydrophobicContact CG2-CG2 4.27Å; I30-T34 WeakPolarHBondContact O-CB 3.46Å; I30-T34 VanDerWaalsContact O-CG2 3.25Å; I30-T34 WeakPolarHBondContact O-CG2 3.36Å; I30-T34 PolarHBondContact O-N 3.37Å; I30-T34 PolarHBondContact O-OG1 3.08Å |
| 31 | E | 97.3 | Very high | 97 | Very high | 138 Ų | 138 | 97.9 Ų | 97.9 | 65% | 0.645 | 51% | 0.505 | S | S | * | . | H | α-helix | trans | -62.6 | -43.7 | 176.7 | -169.9 | 177.4 | -169.8 | 0 | 0 | 112 | E27 M28 T33 T34 S35 | E27-E31 PolarHBondContact O-N 3.19Å; M28-E31 PolarHBondContact O-N 3.43Å; E31-T33 PolarHBondContact O-N 3.02Å; E31-T34 WeakPolarHBondContact CA-OG1 3.43Å; E31-T34 PolarHBondContact O-N 3.24Å; E31-T34 PolarHBondContact O-OG1 3.01Å; E31-S35 WeakPolarHBondContact O-CB 3.47Å; E31-S35 PolarHBondContact O-N 3Å; E31-S35 PolarHBondContact O-OG 2.88Å |
| 32 | Q | 97.4 | Very high | 97 | Very high | 123 Ų | 123 | 94.9 Ų | 94.9 | 58% | 0.575 | 49% | 0.494 | S | S | * | . | H | α-helix | trans | -63.1 | -40.8 | 174.4 | -74 | -179.9 | -8.8 | 0 | 0 | 112.2 | M28 L29 I30 S35 L36 | M28-Q32 WeakPolarHBondContact O-CB 3.38Å; M28-Q32 VanDerWaalsContact O-CG 3.32Å; M28-Q32 WeakPolarHBondContact O-CG 3.45Å; M28-Q32 PolarHBondContact O-N 2.75Å; L29-Q32 PolarHBondContact O-N 2.91Å; I30-Q32 PolarHBondContact O-N 2.98Å; Q32-S35 WeakPolarHBondContact CA-OG 3.48Å; Q32-S35 PolarHBondContact O-OG 3.48Å; Q32-L36 VanDerWaalsContact O-CB 3.24Å; Q32-L36 WeakPolarHBondContact O-CB 3.45Å; Q32-L36 PolarHBondContact O-N 2.82Å |
| 33 | T | 97.4 | Very high | 97 | Very high | 92 Ų | 92 | 94.6 Ų | 94.6 | 56% | 0.564 | 49% | 0.494 | S | S | * | . | H | α-helix | trans | -68.3 | -41.8 | 179.4 | -59.6 | 0 | 0 | 0 | 0 | 111.3 | L29 I30 E31 L36 N37 | L29-T33 VanDerWaalsContact O-CB 3.28Å; L29-T33 WeakPolarHBondContact O-CB 3.4Å; L29-T33 PolarHBondContact O-N 2.89Å; L29-T33 PolarHBondContact O-OG1 3.39Å; I30-T33 PolarHBondContact O-N 3.39Å; E31-T33 PolarHBondContact O-N 3.02Å; T33-L36 PolarHBondContact O-N 3.49Å; T33-N37 WeakPolarHBondContact O-CB 3.43Å; T33-N37 PolarHBondContact O-N 3.47Å |
| 34 | T | 97.1 | Very high | 96.9 | Very high | 68 Ų | 68 | 96.1 Ų | 96.1 | 42% | 0.417 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -69.9 | -40.1 | 179.3 | 54 | 0 | 0 | 0 | 0 | 112.1 | I30 E31 N37 K38 | I30-T34 HydrophobicContact CG2-CG2 4.27Å; I30-T34 WeakPolarHBondContact O-CB 3.46Å; I30-T34 VanDerWaalsContact O-CG2 3.25Å; I30-T34 WeakPolarHBondContact O-CG2 3.36Å; I30-T34 PolarHBondContact O-N 3.37Å; I30-T34 PolarHBondContact O-OG1 3.08Å; E31-T34 WeakPolarHBondContact CA-OG1 3.43Å; E31-T34 PolarHBondContact O-N 3.24Å; E31-T34 PolarHBondContact O-OG1 3.01Å; T34-N37 PolarHBondContact O-N 3.35Å; T34-K38 WeakPolarHBondContact O-CG 3.35Å; T34-K38 PolarHBondContact O-N 3.4Å |
| 35 | S | 97.3 | Very high | 96.9 | Very high | 65 Ų | 65 | 98.1 Ų | 98.1 | 46% | 0.455 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -64.6 | -41.1 | 173 | 57.7 | 0 | 0 | 0 | 0 | 112 | E31 Q32 K38 R39 | E31-S35 WeakPolarHBondContact O-CB 3.47Å; E31-S35 PolarHBondContact O-N 3Å; E31-S35 PolarHBondContact O-OG 2.88Å; Q32-S35 WeakPolarHBondContact CA-OG 3.48Å; Q32-S35 PolarHBondContact O-OG 3.48Å; S35-K38 PolarHBondContact O-N 3.21Å; S35-R39 PolarHBondContact O-N 3.45Å; S35-R39 VanDerWaalsContact O-N 3.13Å |
| 36 | L | 97.4 | Very high | 96.8 | Very high | 84 Ų | 84 | 103.4 Ų | 103.4 | 44% | 0.44 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -62.5 | -43.3 | 173.4 | -178 | 61.3 | 0 | 0 | 0 | 111.7 | Q32 T33 R39 V40 | Q32-L36 VanDerWaalsContact O-CB 3.24Å; Q32-L36 WeakPolarHBondContact O-CB 3.45Å; Q32-L36 PolarHBondContact O-N 2.82Å; T33-L36 PolarHBondContact O-N 3.49Å; L36-R39 WeakPolarHBondContact O-CB 3.48Å; L36-R39 PolarHBondContact O-N 2.79Å; L36-V40 WeakPolarHBondContact O-CG2 3.36Å; L36-V40 PolarHBondContact O-N 3.22Å |
| 37 | N | 97.3 | Very high | 96.6 | Very high | 81 Ų | 81 | 106 Ų | 106 | 43% | 0.433 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -61.2 | -46.1 | 178.9 | -172.2 | 60.5 | 0 | 0 | 0 | 111.8 | T33 T34 R39 V40 E41 | T33-N37 WeakPolarHBondContact O-CB 3.43Å; T33-N37 PolarHBondContact O-N 3.47Å; T34-N37 PolarHBondContact O-N 3.35Å; N37-R39 VanDerWaalsContact C-N 3.26Å; N37-R39 PolarHBondContact O-N 3.3Å; N37-V40 PolarHBondContact O-N 2.94Å; N37-V40 VanDerWaalsContact O-N 3.1Å; N37-E41 PolarHBondContact ND2-OE1 2.89Å; N37-E41 WeakPolarHBondContact O-CG 3.43Å; N37-E41 PolarHBondContact O-N 3.31Å |
| 38 | K | 97.7 | Very high | 96.4 | Very high | 146 Ų | 146 | 106.2 Ų | 106.2 | 64% | 0.635 | 52% | 0.521 | S | S | * | . | H | α-helix | trans | -56.8 | -40.4 | 174.3 | -72.1 | 175.5 | -177.7 | 178.8 | 0 | 112.1 | T34 S35 E41 A42 | T34-K38 WeakPolarHBondContact O-CG 3.35Å; T34-K38 PolarHBondContact O-N 3.4Å; S35-K38 PolarHBondContact O-N 3.21Å; K38-E41 PolarHBondContact O-N 2.86Å; K38-A42 PolarHBondContact O-N 2.99Å |
| 39 | R | 97.1 | Very high | 96.2 | Very high | 159 Ų | 159 | 106.2 Ų | 106.2 | 60% | 0.6 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -65.9 | -40.5 | 176.9 | -171.5 | 175.5 | 66.6 | 136.6 | 0.3 | 112.2 | S35 L36 N37 A42 M43 | S35-R39 PolarHBondContact O-N 3.45Å; S35-R39 VanDerWaalsContact O-N 3.13Å; L36-R39 WeakPolarHBondContact O-CB 3.48Å; L36-R39 PolarHBondContact O-N 2.79Å; N37-R39 VanDerWaalsContact C-N 3.26Å; N37-R39 PolarHBondContact O-N 3.3Å; R39-A42 PolarHBondContact O-N 2.97Å; R39-M43 WeakPolarHBondContact O-CG 3.32Å; R39-M43 PolarHBondContact O-N 2.89Å |
| 40 | V | 97.2 | Very high | 95.5 | Very high | 61 Ų | 61 | 105.4 Ų | 105.4 | 37% | 0.37 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -65.5 | -41.1 | 176.7 | 170.8 | 0 | 0 | 0 | 0 | 111.1 | L36 N37 M43 K44 | L36-V40 WeakPolarHBondContact O-CG2 3.36Å; L36-V40 PolarHBondContact O-N 3.22Å; N37-V40 PolarHBondContact O-N 2.94Å; N37-V40 VanDerWaalsContact O-N 3.1Å; V40-M43 PolarHBondContact O-N 3.4Å; V40-K44 PolarHBondContact O-N 2.91Å |
| 41 | E | 96.6 | Very high | 94.9 | Very high | 96 Ų | 96 | 103.7 Ų | 103.7 | 45% | 0.449 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -61.2 | -45.3 | 175.3 | -72.9 | 170.2 | -177.1 | 0 | 0 | 111.7 | N37 K38 M43 K44 Q45 | N37-E41 PolarHBondContact ND2-OE1 2.89Å; N37-E41 WeakPolarHBondContact O-CG 3.43Å; N37-E41 PolarHBondContact O-N 3.31Å; K38-E41 PolarHBondContact O-N 2.86Å; E41-M43 VanDerWaalsContact C-N 3.34Å; E41-M43 PolarHBondContact O-N 2.97Å; E41-K44 PolarHBondContact O-N 3.19Å; E41-Q45 PolarHBondContact O-N 2.79Å; E41-Q45 VanDerWaalsContact O-N 3.08Å |
| 42 | A | 97 | Very high | 94.4 | Very high | 35 Ų | 35 | 100.1 Ų | 100.1 | 29% | 0.289 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -59.2 | -44.2 | 174.2 | 0 | 0 | 0 | 0 | 0 | 111.8 | K38 R39 K44 Q45 Y46 | K38-A42 PolarHBondContact O-N 2.99Å; R39-A42 PolarHBondContact O-N 2.97Å; A42-K44 VanDerWaalsContact C-N 3.31Å; A42-K44 PolarHBondContact O-N 3Å; A42-Q45 PolarHBondContact O-N 2.99Å; A42-Y46 HydrophobicContact CB-CE2 4.33Å; A42-Y46 WeakPolarHBondContact O-CD2 3.42Å; A42-Y46 PolarHBondContact O-N 2.85Å |
| 43 | M | 95.1 | Very high | 93.6 | Very high | 122 Ų | 122 | 99.7 Ų | 99.7 | 60% | 0.601 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -61.7 | -36 | 176.9 | -73.1 | -179.3 | 70.8 | 0 | 0 | 113 | R39 V40 E41 Q47 | R39-M43 WeakPolarHBondContact O-CG 3.32Å; R39-M43 PolarHBondContact O-N 2.89Å; V40-M43 PolarHBondContact O-N 3.4Å; E41-M43 VanDerWaalsContact C-N 3.34Å; E41-M43 PolarHBondContact O-N 2.97Å; M43-Q47 WeakPolarHBondContact O-CB 3.37Å; M43-Q47 PolarHBondContact O-N 3.44Å |
| 44 | K | 96.3 | Very high | 92.5 | Very high | 133 Ų | 133 | 98.9 Ų | 98.9 | 58% | 0.578 | 49% | 0.491 | S | S | * | . | H | α-helix | trans | -65.6 | -45.8 | 174.9 | -74 | -175.9 | 179 | -179.7 | 0 | 111.7 | V40 E41 A42 Y46 Q47 E48 | V40-K44 PolarHBondContact O-N 2.91Å; E41-K44 PolarHBondContact O-N 3.19Å; A42-K44 VanDerWaalsContact C-N 3.31Å; A42-K44 PolarHBondContact O-N 3Å; K44-Y46 VanDerWaalsContact C-N 3.35Å; K44-Y46 PolarHBondContact O-N 2.98Å; K44-Q47 WeakPolarHBondContact O-CB 3.43Å; K44-Q47 PolarHBondContact O-N 3.28Å; K44-Q47 VanDerWaalsContact O-N 3.14Å; K44-E48 WeakPolarHBondContact O-CG 3.33Å; K44-E48 PolarHBondContact O-N 2.94Å |
| 45 | Q | 96.4 | Very high | 91.5 | Very high | 117 Ų | 117 | 101.9 Ų | 101.9 | 55% | 0.547 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -59.8 | -45.8 | 176.9 | -69.7 | 175 | -5.3 | 0 | 0 | 111.2 | E41 A42 Q47 E48 E49 | E41-Q45 PolarHBondContact O-N 2.79Å; E41-Q45 VanDerWaalsContact O-N 3.08Å; A42-Q45 PolarHBondContact O-N 2.99Å; Q45-Q47 VanDerWaalsContact C-N 3.3Å; Q45-Q47 PolarHBondContact O-N 3.4Å; Q45-E48 PolarHBondContact O-N 3.31Å; Q45-E49 WeakPolarHBondContact O-CG 3.4Å; Q45-E49 PolarHBondContact O-N 3.3Å |
| 46 | Y | 94.1 | Very high | 90.3 | Very high | 151 Ų | 151 | 103.7 Ų | 103.7 | 59% | 0.592 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -59.5 | -39.7 | 174.5 | -75.2 | -58.3 | 0 | 0 | 0 | 112.8 | A42 K44 E49 I50 | A42-Y46 HydrophobicContact CB-CE2 4.33Å; A42-Y46 WeakPolarHBondContact O-CD2 3.42Å; A42-Y46 PolarHBondContact O-N 2.85Å; K44-Y46 VanDerWaalsContact C-N 3.35Å; K44-Y46 PolarHBondContact O-N 2.98Å; Y46-E49 PolarHBondContact O-N 2.86Å; Y46-I50 WeakPolarHBondContact O-CB 3.47Å; Y46-I50 VanDerWaalsContact O-CG1 3.24Å; Y46-I50 WeakPolarHBondContact O-CG1 3.35Å; Y46-I50 PolarHBondContact O-N 3.15Å |
| 47 | Q | 91.8 | Very high | 88.6 | Confident | 100 Ų | 100 | 103.5 Ų | 103.5 | 47% | 0.467 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -65.9 | -43.4 | 177.8 | -174.1 | 58.6 | 46.3 | 0 | 0 | 111.7 | M43 K44 Q45 I50 D51 | M43-Q47 WeakPolarHBondContact O-CB 3.37Å; M43-Q47 PolarHBondContact O-N 3.44Å; K44-Q47 WeakPolarHBondContact O-CB 3.43Å; K44-Q47 PolarHBondContact O-N 3.28Å; K44-Q47 VanDerWaalsContact O-N 3.14Å; Q45-Q47 VanDerWaalsContact C-N 3.3Å; Q45-Q47 PolarHBondContact O-N 3.4Å; Q47-I50 PolarHBondContact O-N 3.3Å; Q47-D51 PolarHBondContact NE2-OD1 2.97Å; Q47-D51 PolarHBondContact NE2-OD2 3.3Å; Q47-D51 VanDerWaalsContact NE2-OD2 3.13Å; Q47-D51 WeakPolarHBondContact O-CB 3.25Å; Q47-D51 PolarHBondContact O-N 2.91Å |
| 48 | E | 93.2 | Very high | 87 | Confident | 133 Ų | 133 | 109 Ų | 109 | 62% | 0.621 | 53% | 0.533 | S | S | * | . | H | α-helix | trans | -61.8 | -42.3 | 175.4 | -71.4 | 171.1 | -169.8 | 0 | 0 | 111.8 | K44 Q45 D51 S52 | K44-E48 WeakPolarHBondContact O-CG 3.33Å; K44-E48 PolarHBondContact O-N 2.94Å; Q45-E48 PolarHBondContact O-N 3.31Å; E48-D51 PolarHBondContact O-N 2.88Å; E48-S52 WeakPolarHBondContact O-CB 3.26Å; E48-S52 PolarHBondContact O-N 3.08Å |
| 49 | E | 91.7 | Very high | 85.1 | Confident | 115 Ų | 115 | 109 Ų | 109 | 54% | 0.537 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -63 | -45.2 | 175.1 | -74.4 | 177.3 | -169.1 | 0 | 0 | 111.9 | Q45 Y46 D51 S52 L53 | Q45-E49 WeakPolarHBondContact O-CG 3.4Å; Q45-E49 PolarHBondContact O-N 3.3Å; Y46-E49 PolarHBondContact O-N 2.86Å; E49-D51 VanDerWaalsContact C-N 3.32Å; E49-D51 PolarHBondContact O-N 2.92Å; E49-S52 PolarHBondContact O-N 3.01Å; E49-S52 PolarHBondContact O-OG 2.95Å; E49-L53 WeakPolarHBondContact O-CB 3.49Å; E49-L53 PolarHBondContact O-N 3.27Å |
| 50 | I | 84.2 | Confident | 83.6 | Confident | 85 Ų | 85 | 110.9 Ų | 110.9 | 44% | 0.436 | 54% | 0.542 | S | S | . | . | H | α-helix | trans | -60.1 | -43.5 | 175.4 | -73.7 | 168.5 | 0 | 0 | 0 | 110.8 | Y46 Q47 L53 N54 | Y46-I50 WeakPolarHBondContact O-CB 3.47Å; Y46-I50 VanDerWaalsContact O-CG1 3.24Å; Y46-I50 WeakPolarHBondContact O-CG1 3.35Å; Y46-I50 PolarHBondContact O-N 3.15Å; Q47-I50 PolarHBondContact O-N 3.3Å; I50-L53 PolarHBondContact O-N 3.43Å; I50-N54 WeakPolarHBondContact CG2-ND2 3.45Å; I50-N54 VanDerWaalsContact O-CB 3.28Å; I50-N54 WeakPolarHBondContact O-CB 3.41Å; I50-N54 VanDerWaalsContact O-CG 3.24Å; I50-N54 PolarHBondContact O-N 2.82Å; I50-N54 PolarHBondContact O-ND2 3.02Å; I50-N54 VanDerWaalsContact O-ND2 3.13Å |
| 51 | D | 83.3 | Confident | 82 | Confident | 73 Ų | 73 | 112.3 Ų | 112.3 | 39% | 0.39 | 55% | 0.552 | S | S | . | * | H | α-helix | trans | -68.2 | -37 | 179.5 | -72.5 | -30.4 | 0 | 0 | 0 | 111.9 | Q47 E48 E49 N54 Q55 | Q47-D51 PolarHBondContact NE2-OD1 2.97Å; Q47-D51 PolarHBondContact NE2-OD2 3.3Å; Q47-D51 VanDerWaalsContact NE2-OD2 3.13Å; Q47-D51 WeakPolarHBondContact O-CB 3.25Å; Q47-D51 PolarHBondContact O-N 2.91Å; E48-D51 PolarHBondContact O-N 2.88Å; E49-D51 VanDerWaalsContact C-N 3.32Å; E49-D51 PolarHBondContact O-N 2.92Å; D51-N54 PolarHBondContact O-N 3.46Å; D51-Q55 WeakPolarHBondContact O-CG 3.37Å; D51-Q55 PolarHBondContact O-N 3.12Å |
| 52 | S | 86.9 | Confident | 80.8 | Confident | 64 Ų | 64 | 117.4 Ų | 117.4 | 45% | 0.448 | 57% | 0.568 | S | S | . | * | H | α-helix | trans | -63.9 | -44.6 | 172.7 | 80.9 | 0 | 0 | 0 | 0 | 111.8 | E48 E49 N54 Q55 V56 | E48-S52 WeakPolarHBondContact O-CB 3.26Å; E48-S52 PolarHBondContact O-N 3.08Å; E49-S52 PolarHBondContact O-N 3.01Å; E49-S52 PolarHBondContact O-OG 2.95Å; S52-N54 VanDerWaalsContact C-N 3.34Å; S52-N54 PolarHBondContact O-N 3Å; S52-Q55 WeakPolarHBondContact O-CB 3.48Å; S52-Q55 PolarHBondContact O-N 3.3Å; S52-V56 WeakPolarHBondContact O-CG2 3.43Å; S52-V56 PolarHBondContact O-N 3.07Å; S52-V56 VanDerWaalsContact O-N 3.1Å |
| 53 | L | 80.1 | Confident | 79.9 | Confident | 113 Ų | 113 | 118.7 Ų | 118.7 | 59% | 0.592 | 57% | 0.574 | S | S | * | * | H | α-helix | trans | -66.8 | -38.5 | 178.5 | -173 | 62.6 | 0 | 0 | 0 | 111.1 | E49 I50 Q55 V56 A57 | E49-L53 WeakPolarHBondContact O-CB 3.49Å; E49-L53 PolarHBondContact O-N 3.27Å; I50-L53 PolarHBondContact O-N 3.43Å; L53-Q55 VanDerWaalsContact C-N 3.34Å; L53-Q55 PolarHBondContact O-N 3.48Å; L53-V56 PolarHBondContact O-N 3.27Å; L53-A57 WeakPolarHBondContact O-CB 3.48Å; L53-A57 PolarHBondContact O-N 3.46Å |
| 54 | N | 74.8 | Confident | 79.2 | Confident | 76 Ų | 76 | 116.8 Ų | 116.8 | 41% | 0.406 | 57% | 0.573 | S | S | . | * | H | α-helix | trans | -64.1 | -35.2 | 173.8 | -80.8 | -36.4 | 0 | 0 | 0 | 112.4 | I50 D51 S52 R58 | I50-N54 WeakPolarHBondContact CG2-ND2 3.45Å; I50-N54 VanDerWaalsContact O-CB 3.28Å; I50-N54 WeakPolarHBondContact O-CB 3.41Å; I50-N54 VanDerWaalsContact O-CG 3.24Å; I50-N54 PolarHBondContact O-N 2.82Å; I50-N54 PolarHBondContact O-ND2 3.02Å; I50-N54 VanDerWaalsContact O-ND2 3.13Å; D51-N54 PolarHBondContact O-N 3.46Å; S52-N54 VanDerWaalsContact C-N 3.34Å; S52-N54 PolarHBondContact O-N 3Å; N54-R58 WeakPolarHBondContact O-CB 3.44Å; N54-R58 WeakPolarHBondContact O-CG 3.36Å; N54-R58 PolarHBondContact O-N 3.33Å |
| 55 | Q | 75.8 | Confident | 78.5 | Confident | 131 Ų | 131 | 115.8 Ų | 115.8 | 61% | 0.612 | 57% | 0.573 | S | S | * | * | H | α-helix | trans | -66.5 | -43.2 | 172.9 | -75.4 | 178.4 | 30.7 | 0 | 0 | 111.9 | D51 S52 L53 A57 R58 H59 | D51-Q55 WeakPolarHBondContact O-CG 3.37Å; D51-Q55 PolarHBondContact O-N 3.12Å; S52-Q55 WeakPolarHBondContact O-CB 3.48Å; S52-Q55 PolarHBondContact O-N 3.3Å; L53-Q55 VanDerWaalsContact C-N 3.34Å; L53-Q55 PolarHBondContact O-N 3.48Å; Q55-A57 VanDerWaalsContact C-N 3.35Å; Q55-A57 PolarHBondContact O-N 3.33Å; Q55-R58 WeakPolarHBondContact O-CB 3.44Å; Q55-R58 PolarHBondContact O-N 3.36Å; Q55-H59 PolarHBondContact O-N 2.95Å |
| 56 | V | 71.6 | Confident | 78 | Confident | 103 Ų | 103 | 113.3 Ų | 113.3 | 62% | 0.624 | 57% | 0.566 | S | S | * | * | H | α-helix | trans | -63.4 | -41.2 | 175.4 | 177.3 | 0 | 0 | 0 | 0 | 111.2 | S52 L53 R58 H59 | S52-V56 WeakPolarHBondContact O-CG2 3.43Å; S52-V56 PolarHBondContact O-N 3.07Å; S52-V56 VanDerWaalsContact O-N 3.1Å; L53-V56 PolarHBondContact O-N 3.27Å; V56-R58 VanDerWaalsContact C-N 3.31Å; V56-R58 PolarHBondContact O-N 2.99Å; V56-H59 WeakPolarHBondContact O-CB 3.39Å; V56-H59 PolarHBondContact O-N 3.11Å |
| 57 | A | 63.5 | Low | 77.7 | Confident | 79 Ų | 79 | 110.5 Ų | 110.5 | 65% | 0.653 | 56% | 0.561 | S | S | * | * | H | α-helix | trans | -69.1 | -26.1 | 175.8 | 0 | 0 | 0 | 0 | 0 | 113.5 | L53 Q55 H59 | L53-A57 WeakPolarHBondContact O-CB 3.48Å; L53-A57 PolarHBondContact O-N 3.46Å; Q55-A57 VanDerWaalsContact C-N 3.35Å; Q55-A57 PolarHBondContact O-N 3.33Å; A57-H59 VanDerWaalsContact C-N 3.31Å |
| 58 | R | 63.3 | Low | 77.6 | Confident | 196 Ų | 196 | 106.9 Ų | 106.9 | 74% | 0.74 | 55% | 0.55 | S | S | * | * | H | α-helix | trans | -75.3 | -16 | 174.1 | -81.1 | 173.5 | -179 | -177.5 | 3.9 | 113.5 | N54 Q55 V56 R60 | N54-R58 WeakPolarHBondContact O-CB 3.44Å; N54-R58 WeakPolarHBondContact O-CG 3.36Å; N54-R58 PolarHBondContact O-N 3.33Å; Q55-R58 WeakPolarHBondContact O-CB 3.44Å; Q55-R58 PolarHBondContact O-N 3.36Å; V56-R58 VanDerWaalsContact C-N 3.31Å; V56-R58 PolarHBondContact O-N 2.99Å; R58-R60 PolarHBondContact O-N 3.03Å |
| 59 | H | 58 | Low | 77.4 | Confident | 146 Ų | 146 | 104.1 Ų | 104.1 | 68% | 0.676 | 54% | 0.539 | S | S | * | . | trans | -57.5 | 118.2 | 163.9 | -82.9 | -81 | 0 | 0 | 0 | 107 | Q55 V56 A57 P61 | Q55-H59 PolarHBondContact O-N 2.95Å; V56-H59 WeakPolarHBondContact O-CB 3.39Å; V56-H59 PolarHBondContact O-N 3.11Å; A57-H59 VanDerWaalsContact C-N 3.31Å; H59-P61 WeakPolarHBondContact O-CD 3.41Å | ||
| 60 | R | 65.8 | Low | 77.5 | Confident | 199 Ų | 199 | 104.3 Ų | 104.3 | 75% | 0.751 | 54% | 0.54 | S | S | * | . | trans | -98.5 | 42.9 | -177.1 | -102.2 | -174.1 | 178.6 | 177.1 | 0.3 | 112.5 | R58 R62 S63 S64 | R58-R60 PolarHBondContact O-N 3.03Å; R60-R62 PolarHBondContact O-N 3.02Å; R60-S63 WeakPolarHBondContact CB-OG 3.26Å; R60-S63 PolarHBondContact O-N 3.15Å; R60-S63 PolarHBondContact O-OG 3.22Å; R60-S64 PolarHBondContact O-N 3.42Å | ||
| 61 | P | 62.5 | Low | 78 | Confident | 91 Ų | 91 | 106.4 Ų | 106.4 | 59% | 0.591 | 55% | 0.548 | S | S | * | . | H | α-helix | trans | -64.9 | -31 | -177.1 | 29.5 | -32.3 | 0 | 0 | 0 | 110.8 | H59 S64 L65 | H59-P61 WeakPolarHBondContact O-CD 3.41Å; P61-S64 PolarHBondContact O-N 3.43Å; P61-L65 WeakPolarHBondContact O-CB 3.38Å; P61-L65 PolarHBondContact O-N 3.19Å |
| 62 | R | 72.1 | Confident | 78.6 | Confident | 204 Ų | 204 | 108.6 Ų | 108.6 | 77% | 0.77 | 56% | 0.556 | S | S | * | * | H | α-helix | trans | -66.9 | -41.5 | 178.3 | -168.1 | 176.4 | 174.5 | 90.3 | 0.1 | 112.9 | R60 V66 | R60-R62 PolarHBondContact O-N 3.02Å; R62-V66 WeakPolarHBondContact O-CB 3.5Å; R62-V66 WeakPolarHBondContact O-CG2 3.38Å; R62-V66 PolarHBondContact O-N 3.05Å |
| 63 | S | 78.1 | Confident | 79 | Confident | 61 Ų | 61 | 108.8 Ų | 108.8 | 43% | 0.427 | 55% | 0.552 | S | S | . | * | H | α-helix | trans | -72 | -36.6 | 178.5 | 68.7 | 0 | 0 | 0 | 0 | 111.9 | R60 L67 | R60-S63 WeakPolarHBondContact CB-OG 3.26Å; R60-S63 PolarHBondContact O-N 3.15Å; R60-S63 PolarHBondContact O-OG 3.22Å; S63-L67 WeakPolarHBondContact O-CB 3.47Å; S63-L67 PolarHBondContact O-N 3.43Å |
| 64 | S | 79.8 | Confident | 79.8 | Confident | 83 Ų | 83 | 111 Ų | 111 | 58% | 0.58 | 55% | 0.552 | S | S | * | * | H | α-helix | trans | -65.3 | -43.4 | 175.3 | -167.3 | 0 | 0 | 0 | 0 | 111.6 | R60 P61 L67 G68 | R60-S64 PolarHBondContact O-N 3.42Å; P61-S64 PolarHBondContact O-N 3.43Å; S64-L67 PolarHBondContact O-N 2.94Å; S64-G68 PolarHBondContact O-N 3.35Å |
| 65 | L | 82 | Confident | 80.9 | Confident | 111 Ų | 111 | 113.2 Ų | 113.2 | 58% | 0.581 | 56% | 0.56 | S | S | * | * | H | α-helix | trans | -64.1 | -45.2 | 175.9 | 179.2 | 63 | 0 | 0 | 0 | 111.5 | P61 L67 G68 I69 | P61-L65 WeakPolarHBondContact O-CB 3.38Å; P61-L65 PolarHBondContact O-N 3.19Å; L65-L67 VanDerWaalsContact C-N 3.3Å; L65-L67 PolarHBondContact O-N 3.32Å; L65-G68 PolarHBondContact O-N 2.96Å; L65-I69 HydrophobicContact CD1-CD1 4.05Å; L65-I69 HydrophobicContact CD1-CG1 4.28Å; L65-I69 HydrophobicContact CG-CD1 3.84Å; L65-I69 HydrophobicContact CG-CG1 4.47Å; L65-I69 WeakPolarHBondContact O-CB 3.36Å; L65-I69 VanDerWaalsContact O-CG1 3.27Å; L65-I69 WeakPolarHBondContact O-CG1 3.45Å; L65-I69 PolarHBondContact O-N 2.93Å |
| 66 | V | 86.4 | Confident | 81.9 | Confident | 65 Ų | 65 | 110.8 Ų | 110.8 | 39% | 0.394 | 55% | 0.551 | S | S | . | * | H | α-helix | trans | -60.7 | -40.9 | 176.6 | 168.4 | 0 | 0 | 0 | 0 | 111.2 | R62 I69 Q70 | R62-V66 WeakPolarHBondContact O-CB 3.5Å; R62-V66 WeakPolarHBondContact O-CG2 3.38Å; R62-V66 PolarHBondContact O-N 3.05Å; V66-I69 PolarHBondContact O-N 2.9Å; V66-Q70 WeakPolarHBondContact O-CG 3.48Å; V66-Q70 PolarHBondContact O-N 3.05Å |
| 67 | L | 87.3 | Confident | 83.1 | Confident | 93 Ų | 93 | 113.6 Ų | 113.6 | 49% | 0.487 | 55% | 0.55 | S | S | . | . | H | α-helix | trans | -65.8 | -42.1 | 176.2 | -173.2 | 66.3 | 0 | 0 | 0 | 111.8 | S63 S64 L65 Q70 Q71 | S63-L67 WeakPolarHBondContact O-CB 3.47Å; S63-L67 PolarHBondContact O-N 3.43Å; S64-L67 PolarHBondContact O-N 2.94Å; L65-L67 VanDerWaalsContact C-N 3.3Å; L65-L67 PolarHBondContact O-N 3.32Å; L67-Q70 PolarHBondContact O-N 2.9Å; L67-Q71 WeakPolarHBondContact O-CG 3.31Å; L67-Q71 PolarHBondContact O-N 3.1Å |
| 68 | G | 89.6 | Confident | 84.7 | Confident | 23 Ų | 23 | 114.8 Ų | 114.8 | 24% | 0.237 | 54% | 0.542 | C | S | . | . | H | α-helix | trans | -59.2 | -48.7 | 174 | 0 | 0 | 0 | 0 | 0 | 112 | S64 L65 Q70 Q71 E72 | S64-G68 PolarHBondContact O-N 3.35Å; L65-G68 PolarHBondContact O-N 2.96Å; G68-Q70 VanDerWaalsContact C-N 3.29Å; G68-Q70 PolarHBondContact O-N 3.36Å; G68-Q71 WeakPolarHBondContact O-CB 3.29Å; G68-Q71 PolarHBondContact O-N 3.22Å; G68-Q71 VanDerWaalsContact O-N 3.1Å; G68-E72 WeakPolarHBondContact O-CG 3.38Å; G68-E72 PolarHBondContact O-N 3.06Å |
| 69 | I | 89.3 | Confident | 86.4 | Confident | 75 Ų | 75 | 109.4 Ų | 109.4 | 39% | 0.385 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -59.7 | -38.7 | 175.9 | -69.1 | 167.7 | 0 | 0 | 0 | 111.3 | L65 V66 N73 | L65-I69 HydrophobicContact CD1-CD1 4.05Å; L65-I69 HydrophobicContact CD1-CG1 4.28Å; L65-I69 HydrophobicContact CG-CD1 3.84Å; L65-I69 HydrophobicContact CG-CG1 4.47Å; L65-I69 WeakPolarHBondContact O-CB 3.36Å; L65-I69 VanDerWaalsContact O-CG1 3.27Å; L65-I69 WeakPolarHBondContact O-CG1 3.45Å; L65-I69 PolarHBondContact O-N 2.93Å; V66-I69 PolarHBondContact O-N 2.9Å; I69-N73 VanDerWaalsContact CG2-ND2 3.31Å; I69-N73 WeakPolarHBondContact CG2-ND2 3.36Å; I69-N73 VanDerWaalsContact O-CB 3.29Å; I69-N73 WeakPolarHBondContact O-CB 3.36Å; I69-N73 VanDerWaalsContact O-CG 3.24Å; I69-N73 PolarHBondContact O-N 3.02Å; I69-N73 PolarHBondContact O-ND2 3.42Å |
| 70 | Q | 93.4 | Very high | 88.3 | Confident | 120 Ų | 120 | 108.3 Ų | 108.3 | 56% | 0.561 | 52% | 0.523 | S | S | * | . | H | α-helix | trans | -66.2 | -38.8 | 176.4 | -78.6 | -178.8 | -11.6 | 0 | 0 | 112.5 | V66 L67 G68 R74 | V66-Q70 WeakPolarHBondContact O-CG 3.48Å; V66-Q70 PolarHBondContact O-N 3.05Å; L67-Q70 PolarHBondContact O-N 2.9Å; G68-Q70 VanDerWaalsContact C-N 3.29Å; G68-Q70 PolarHBondContact O-N 3.36Å; Q70-R74 PolarHBondContact O-N 2.93Å; Q70-R74 VanDerWaalsContact O-N 3.12Å |
| 71 | Q | 95.1 | Very high | 89.8 | Confident | 128 Ų | 128 | 103.4 Ų | 103.4 | 60% | 0.598 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -67 | -46.9 | 175.7 | -72.5 | 177.8 | -7.3 | 0 | 0 | 111.5 | L67 G68 N73 R74 Q75 | L67-Q71 WeakPolarHBondContact O-CG 3.31Å; L67-Q71 PolarHBondContact O-N 3.1Å; G68-Q71 WeakPolarHBondContact O-CB 3.29Å; G68-Q71 PolarHBondContact O-N 3.22Å; G68-Q71 VanDerWaalsContact O-N 3.1Å; Q71-N73 PolarHBondContact O-N 3.28Å; Q71-R74 WeakPolarHBondContact O-CB 3.29Å; Q71-R74 PolarHBondContact O-N 3.49Å; Q71-R74 VanDerWaalsContact O-N 3.12Å; Q71-Q75 PolarHBondContact O-N 3.44Å |
| 72 | E | 95.2 | Very high | 91.5 | Very high | 120 Ų | 120 | 104 Ų | 104 | 56% | 0.561 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -59.3 | -45.6 | 176.2 | -72.5 | 174.7 | -170.9 | 0 | 0 | 111.5 | G68 R74 Q75 I76 | G68-E72 WeakPolarHBondContact O-CG 3.38Å; G68-E72 PolarHBondContact O-N 3.06Å; E72-R74 VanDerWaalsContact C-N 3.25Å; E72-R74 PolarHBondContact O-N 3.12Å; E72-Q75 PolarHBondContact O-N 3.12Å; E72-Q75 VanDerWaalsContact O-N 3.11Å; E72-I76 VanDerWaalsContact O-CG1 3.31Å; E72-I76 WeakPolarHBondContact O-CG1 3.24Å; E72-I76 PolarHBondContact O-N 2.92Å |
| 73 | N | 96 | Very high | 92.8 | Very high | 67 Ų | 67 | 98.3 Ų | 98.3 | 36% | 0.358 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -61.2 | -34 | 176.4 | -80.2 | -46.6 | 0 | 0 | 0 | 113 | I69 Q71 R77 | I69-N73 VanDerWaalsContact CG2-ND2 3.31Å; I69-N73 WeakPolarHBondContact CG2-ND2 3.36Å; I69-N73 VanDerWaalsContact O-CB 3.29Å; I69-N73 WeakPolarHBondContact O-CB 3.36Å; I69-N73 VanDerWaalsContact O-CG 3.24Å; I69-N73 PolarHBondContact O-N 3.02Å; I69-N73 PolarHBondContact O-ND2 3.42Å; Q71-N73 PolarHBondContact O-N 3.28Å; N73-R77 WeakPolarHBondContact O-CG 3.5Å; N73-R77 PolarHBondContact O-N 2.86Å |
| 74 | R | 95.9 | Very high | 93.7 | Very high | 161 Ų | 161 | 101.7 Ų | 101.7 | 61% | 0.608 | 50% | 0.495 | S | S | * | . | H | α-helix | trans | -66 | -47.2 | 173.9 | 180 | -178.2 | 173.8 | 167.9 | 3.2 | 110.6 | Q70 Q71 E72 I76 R77 E78 | Q70-R74 PolarHBondContact O-N 2.93Å; Q70-R74 VanDerWaalsContact O-N 3.12Å; Q71-R74 WeakPolarHBondContact O-CB 3.29Å; Q71-R74 PolarHBondContact O-N 3.49Å; Q71-R74 VanDerWaalsContact O-N 3.12Å; E72-R74 VanDerWaalsContact C-N 3.25Å; E72-R74 PolarHBondContact O-N 3.12Å; R74-I76 VanDerWaalsContact C-N 3.32Å; R74-I76 PolarHBondContact O-N 3.25Å; R74-R77 PolarHBondContact O-N 3.01Å; R74-R77 VanDerWaalsContact O-N 3.15Å; R74-E78 WeakPolarHBondContact CG-OE1 3.36Å; R74-E78 IonicContact CZ-OE1 2.94Å; R74-E78 IonicContact NE-OE1 2.88Å; R74-E78 PolarHBondContact NE-OE1 3.38Å; R74-E78 IonicContact NH2-OE1 3.68Å; R74-E78 WeakPolarHBondContact O-CG 3.35Å; R74-E78 PolarHBondContact O-N 3.12Å |
| 75 | Q | 97.3 | Very high | 94.6 | Very high | 121 Ų | 121 | 102.8 Ų | 102.8 | 57% | 0.565 | 49% | 0.491 | S | S | * | . | H | α-helix | trans | -62 | -39.8 | 178.7 | -169.3 | 174.8 | 9.3 | 0 | 0 | 112 | Q71 E72 R77 E78 L79 | Q71-Q75 PolarHBondContact O-N 3.44Å; E72-Q75 PolarHBondContact O-N 3.12Å; E72-Q75 VanDerWaalsContact O-N 3.11Å; Q75-R77 VanDerWaalsContact C-N 3.33Å; Q75-R77 PolarHBondContact O-N 3.28Å; Q75-E78 PolarHBondContact O-N 2.95Å; Q75-L79 HydrophobicContact CG-CD1 4.44Å; Q75-L79 WeakPolarHBondContact O-CG 3.47Å; Q75-L79 PolarHBondContact O-N 2.86Å |
| 76 | I | 97.2 | Very high | 95.4 | Very high | 81 Ų | 81 | 102.4 Ų | 102.4 | 42% | 0.415 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -59.1 | -44.4 | 174.5 | -69.3 | 165.8 | 0 | 0 | 0 | 110.7 | E72 R74 L79 Q80 | E72-I76 VanDerWaalsContact O-CG1 3.31Å; E72-I76 WeakPolarHBondContact O-CG1 3.24Å; E72-I76 PolarHBondContact O-N 2.92Å; R74-I76 VanDerWaalsContact C-N 3.32Å; R74-I76 PolarHBondContact O-N 3.25Å; I76-L79 PolarHBondContact O-N 3.35Å; I76-Q80 HydrophobicContact CG2-CG 4.38Å; I76-Q80 WeakPolarHBondContact O-CB 3.31Å; I76-Q80 VanDerWaalsContact O-CG 3.24Å; I76-Q80 WeakPolarHBondContact O-CG 3.48Å; I76-Q80 PolarHBondContact O-N 2.98Å |
| 77 | R | 97.4 | Very high | 95.9 | Very high | 162 Ų | 162 | 107.6 Ų | 107.6 | 61% | 0.611 | 50% | 0.501 | S | S | * | . | H | α-helix | trans | -65.3 | -39.9 | 177.9 | -70.2 | -179.3 | -155.1 | 121.1 | 2.2 | 112.5 | N73 R74 Q75 Q80 Q81 | N73-R77 WeakPolarHBondContact O-CG 3.5Å; N73-R77 PolarHBondContact O-N 2.86Å; R74-R77 PolarHBondContact O-N 3.01Å; R74-R77 VanDerWaalsContact O-N 3.15Å; Q75-R77 VanDerWaalsContact C-N 3.33Å; Q75-R77 PolarHBondContact O-N 3.28Å; R77-Q80 PolarHBondContact O-N 2.95Å; R77-Q81 WeakPolarHBondContact O-CB 3.35Å; R77-Q81 PolarHBondContact O-N 3.22Å |
| 78 | E | 97.7 | Very high | 96.4 | Very high | 103 Ų | 103 | 106 Ų | 106 | 48% | 0.481 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -62.2 | -47.2 | 176.8 | -71.6 | 170.5 | -173.5 | 0 | 0 | 110.5 | R74 Q75 Q80 Q81 E82 | R74-E78 WeakPolarHBondContact CG-OE1 3.36Å; R74-E78 IonicContact CZ-OE1 2.94Å; R74-E78 IonicContact NE-OE1 2.88Å; R74-E78 PolarHBondContact NE-OE1 3.38Å; R74-E78 IonicContact NH2-OE1 3.68Å; R74-E78 WeakPolarHBondContact O-CG 3.35Å; R74-E78 PolarHBondContact O-N 3.12Å; Q75-E78 PolarHBondContact O-N 2.95Å; E78-Q80 VanDerWaalsContact C-N 3.35Å; E78-Q80 PolarHBondContact O-N 2.9Å; E78-Q81 PolarHBondContact O-N 2.93Å; E78-E82 PolarHBondContact O-N 2.97Å |
| 79 | L | 98 | Very high | 96.8 | Very high | 83 Ų | 83 | 107 Ų | 107 | 44% | 0.435 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -63.3 | -37.7 | 175.1 | -73.7 | 171.1 | 0 | 0 | 0 | 112.9 | Q75 I76 Q81 N83 | Q75-L79 HydrophobicContact CG-CD1 4.44Å; Q75-L79 WeakPolarHBondContact O-CG 3.47Å; Q75-L79 PolarHBondContact O-N 2.86Å; I76-L79 PolarHBondContact O-N 3.35Å; L79-Q81 VanDerWaalsContact C-N 3.34Å; L79-N83 WeakPolarHBondContact O-CB 3.27Å; L79-N83 PolarHBondContact O-N 3.47Å; L79-N83 PolarHBondContact O-ND2 2.95Å |
| 80 | Q | 97.8 | Very high | 97.3 | Very high | 124 Ų | 124 | 108.3 Ų | 108.3 | 58% | 0.579 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -65.8 | -39.2 | 175.9 | -77.2 | 174.8 | -15.5 | 0 | 0 | 111.8 | I76 R77 E78 K84 | I76-Q80 HydrophobicContact CG2-CG 4.38Å; I76-Q80 WeakPolarHBondContact O-CB 3.31Å; I76-Q80 VanDerWaalsContact O-CG 3.24Å; I76-Q80 WeakPolarHBondContact O-CG 3.48Å; I76-Q80 PolarHBondContact O-N 2.98Å; R77-Q80 PolarHBondContact O-N 2.95Å; E78-Q80 VanDerWaalsContact C-N 3.35Å; E78-Q80 PolarHBondContact O-N 2.9Å; Q80-K84 PolarHBondContact O-N 3.08Å |
| 81 | Q | 98.1 | Very high | 97.5 | Very high | 96 Ų | 96 | 108.1 Ų | 108.1 | 45% | 0.449 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -66.9 | -45 | 175.9 | -179.3 | 59.7 | 26.5 | 0 | 0 | 111.1 | R77 E78 L79 N83 K84 E85 | R77-Q81 WeakPolarHBondContact O-CB 3.35Å; R77-Q81 PolarHBondContact O-N 3.22Å; E78-Q81 PolarHBondContact O-N 2.93Å; L79-Q81 VanDerWaalsContact C-N 3.34Å; Q81-N83 PolarHBondContact O-N 3.38Å; Q81-K84 WeakPolarHBondContact O-CB 2.85Å; Q81-K84 PolarHBondContact O-N 3.23Å; Q81-K84 VanDerWaalsContact O-N 3.12Å; Q81-E85 PolarHBondContact NE2-OE1 2.99Å; Q81-E85 WeakPolarHBondContact O-CG 3.18Å; Q81-E85 PolarHBondContact O-N 3.25Å |
| 82 | E | 98.1 | Very high | 97.6 | Very high | 104 Ų | 104 | 108.2 Ų | 108.2 | 49% | 0.486 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -60 | -45.1 | 175.2 | -174.7 | -178.4 | 178.1 | 0 | 0 | 111.4 | E78 K84 E85 L86 | E78-E82 PolarHBondContact O-N 2.97Å; E82-K84 VanDerWaalsContact C-N 3.25Å; E82-K84 PolarHBondContact O-N 3.22Å; E82-E85 PolarHBondContact O-N 3.4Å; E82-E85 VanDerWaalsContact O-N 3.15Å; E82-L86 HydrophobicContact CG-CD1 4.15Å; E82-L86 HydrophobicContact CG-CG 4.43Å; E82-L86 WeakPolarHBondContact O-CB 3.34Å; E82-L86 WeakPolarHBondContact O-CG 3.14Å; E82-L86 PolarHBondContact O-N 2.94Å |
| 83 | N | 98.1 | Very high | 97.8 | Very high | 83 Ų | 83 | 108.1 Ų | 108.1 | 44% | 0.444 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -59.6 | -37.5 | 175.5 | -88 | -73.3 | 0 | 0 | 0 | 112.5 | L79 Q81 R87 | L79-N83 WeakPolarHBondContact O-CB 3.27Å; L79-N83 PolarHBondContact O-N 3.47Å; L79-N83 PolarHBondContact O-ND2 2.95Å; Q81-N83 PolarHBondContact O-N 3.38Å; N83-R87 VanDerWaalsContact O-CG 3.26Å; N83-R87 WeakPolarHBondContact O-CG 3.2Å; N83-R87 PolarHBondContact O-N 3.25Å; N83-R87 VanDerWaalsContact O-N 3.08Å |
| 84 | K | 98.2 | Very high | 97.8 | Very high | 132 Ų | 132 | 109.8 Ų | 109.8 | 57% | 0.574 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -65.4 | -45.3 | 175.9 | -174.3 | -177.8 | 176.9 | -175.9 | 0 | 110.8 | Q80 Q81 E82 R87 T88 | Q80-K84 PolarHBondContact O-N 3.08Å; Q81-K84 WeakPolarHBondContact O-CB 2.85Å; Q81-K84 PolarHBondContact O-N 3.23Å; Q81-K84 VanDerWaalsContact O-N 3.12Å; E82-K84 VanDerWaalsContact C-N 3.25Å; E82-K84 PolarHBondContact O-N 3.22Å; K84-R87 PolarHBondContact O-N 3.32Å; K84-T88 PolarHBondContact O-N 2.86Å; K84-T88 PolarHBondContact O-OG1 3.21Å |
| 85 | E | 98.1 | Very high | 97.9 | Very high | 107 Ų | 107 | 105.6 Ų | 105.6 | 50% | 0.5 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -63.7 | -41.7 | 178.5 | -72.6 | 171.6 | -166.1 | 0 | 0 | 112.3 | Q81 E82 R87 T88 S89 | Q81-E85 PolarHBondContact NE2-OE1 2.99Å; Q81-E85 WeakPolarHBondContact O-CG 3.18Å; Q81-E85 PolarHBondContact O-N 3.25Å; E82-E85 PolarHBondContact O-N 3.4Å; E82-E85 VanDerWaalsContact O-N 3.15Å; E85-R87 VanDerWaalsContact C-N 3.35Å; E85-R87 PolarHBondContact O-N 2.86Å; E85-T88 WeakPolarHBondContact CA-OG1 3.48Å; E85-T88 PolarHBondContact O-N 2.89Å; E85-T88 PolarHBondContact O-OG1 3.28Å; E85-S89 WeakPolarHBondContact O-CB 3.34Å; E85-S89 PolarHBondContact O-N 3.37Å |
| 86 | L | 98.4 | Very high | 98 | Very high | 103 Ų | 103 | 102.1 Ų | 102.1 | 54% | 0.539 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -62.1 | -41.7 | 175 | -71.5 | 173 | 0 | 0 | 0 | 111.8 | E82 S89 L90 | E82-L86 HydrophobicContact CG-CD1 4.15Å; E82-L86 HydrophobicContact CG-CG 4.43Å; E82-L86 WeakPolarHBondContact O-CB 3.34Å; E82-L86 WeakPolarHBondContact O-CG 3.14Å; E82-L86 PolarHBondContact O-N 2.94Å; L86-S89 PolarHBondContact O-N 3.42Å; L86-L90 WeakPolarHBondContact O-CB 3.46Å; L86-L90 PolarHBondContact O-N 3.02Å |
| 87 | R | 98.3 | Very high | 98 | Very high | 174 Ų | 174 | 103.2 Ų | 103.2 | 66% | 0.657 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -63.2 | -46.7 | 175.7 | -74.4 | 173.7 | -175.6 | -167.4 | 1.1 | 111.7 | N83 K84 E85 S89 L90 E91 | N83-R87 VanDerWaalsContact O-CG 3.26Å; N83-R87 WeakPolarHBondContact O-CG 3.2Å; N83-R87 PolarHBondContact O-N 3.25Å; N83-R87 VanDerWaalsContact O-N 3.08Å; K84-R87 PolarHBondContact O-N 3.32Å; E85-R87 VanDerWaalsContact C-N 3.35Å; E85-R87 PolarHBondContact O-N 2.86Å; R87-S89 VanDerWaalsContact C-N 3.34Å; R87-S89 PolarHBondContact O-N 3.32Å; R87-L90 WeakPolarHBondContact O-CB 3.44Å; R87-L90 PolarHBondContact O-N 3.28Å; R87-E91 WeakPolarHBondContact O-CG 3.33Å; R87-E91 PolarHBondContact O-N 3.34Å |
| 88 | T | 97.9 | Very high | 97.9 | Very high | 59 Ų | 59 | 101.8 Ų | 101.8 | 36% | 0.362 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -62.3 | -41.9 | 177.5 | 48.8 | 0 | 0 | 0 | 0 | 111.7 | K84 E85 L90 E91 E92 | K84-T88 PolarHBondContact O-N 2.86Å; K84-T88 PolarHBondContact O-OG1 3.21Å; E85-T88 WeakPolarHBondContact CA-OG1 3.48Å; E85-T88 PolarHBondContact O-N 2.89Å; E85-T88 PolarHBondContact O-OG1 3.28Å; T88-L90 VanDerWaalsContact C-N 3.31Å; T88-L90 PolarHBondContact O-N 3.08Å; T88-E91 PolarHBondContact O-N 3.5Å; T88-E92 WeakPolarHBondContact O-CG 3.49Å; T88-E92 PolarHBondContact O-N 2.95Å |
| 89 | S | 98.3 | Very high | 97.9 | Very high | 44 Ų | 44 | 102.1 Ų | 102.1 | 31% | 0.308 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -63.4 | -37.6 | 176.6 | -175.8 | 0 | 0 | 0 | 0 | 112.1 | E85 L86 R87 H93 | E85-S89 WeakPolarHBondContact O-CB 3.34Å; E85-S89 PolarHBondContact O-N 3.37Å; L86-S89 PolarHBondContact O-N 3.42Å; R87-S89 VanDerWaalsContact C-N 3.34Å; R87-S89 PolarHBondContact O-N 3.32Å; S89-H93 WeakPolarHBondContact O-CB 3.49Å; S89-H93 PolarHBondContact O-N 3.25Å; S89-H93 PolarHBondContact O-ND1 3.03Å |
| 90 | L | 98.4 | Very high | 97.9 | Very high | 102 Ų | 102 | 103.2 Ų | 103.2 | 53% | 0.534 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -65.5 | -44.8 | 176.8 | -170.1 | 110.3 | 0 | 0 | 0 | 111.3 | L86 R87 T88 H93 Q94 | L86-L90 WeakPolarHBondContact O-CB 3.46Å; L86-L90 PolarHBondContact O-N 3.02Å; R87-L90 WeakPolarHBondContact O-CB 3.44Å; R87-L90 PolarHBondContact O-N 3.28Å; T88-L90 VanDerWaalsContact C-N 3.31Å; T88-L90 PolarHBondContact O-N 3.08Å; L90-H93 PolarHBondContact O-N 3.04Å; L90-Q94 WeakPolarHBondContact O-CG 3.42Å; L90-Q94 PolarHBondContact O-N 3.46Å |
| 91 | E | 97.9 | Very high | 97.8 | Very high | 116 Ų | 116 | 101.3 Ų | 101.3 | 54% | 0.542 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -61.5 | -42.6 | 176.6 | -72.9 | 171.3 | -168.9 | 0 | 0 | 111.8 | R87 T88 Q94 S95 | R87-E91 WeakPolarHBondContact O-CG 3.33Å; R87-E91 PolarHBondContact O-N 3.34Å; T88-E91 PolarHBondContact O-N 3.5Å; E91-Q94 PolarHBondContact O-N 3.46Å; E91-S95 WeakPolarHBondContact O-CB 3.32Å; E91-S95 PolarHBondContact O-N 3.45Å; E91-S95 PolarHBondContact O-OG 3.45Å |
| 92 | E | 97.9 | Very high | 97.5 | Very high | 131 Ų | 131 | 99.7 Ų | 99.7 | 61% | 0.612 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -63.5 | -43.2 | 175.8 | -73.8 | 177.1 | 179.8 | 0 | 0 | 111.8 | T88 S95 A96 | T88-E92 WeakPolarHBondContact O-CG 3.49Å; T88-E92 PolarHBondContact O-N 2.95Å; E92-S95 PolarHBondContact O-N 3.47Å; E92-A96 WeakPolarHBondContact O-CB 3.41Å; E92-A96 PolarHBondContact O-N 3.01Å |
| 93 | H | 98.3 | Very high | 97.4 | Very high | 117 Ų | 117 | 99.7 Ų | 99.7 | 54% | 0.542 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -65 | -41 | 176.4 | -72.8 | 2.2 | 0 | 0 | 0 | 112.4 | S89 L90 A96 L97 | S89-H93 WeakPolarHBondContact O-CB 3.49Å; S89-H93 PolarHBondContact O-N 3.25Å; S89-H93 PolarHBondContact O-ND1 3.03Å; L90-H93 PolarHBondContact O-N 3.04Å; H93-A96 PolarHBondContact O-N 3.4Å; H93-L97 WeakPolarHBondContact O-CB 3.28Å; H93-L97 WeakPolarHBondContact O-CG 3.42Å; H93-L97 PolarHBondContact O-N 3.29Å |
| 94 | Q | 97.7 | Very high | 97.3 | Very high | 103 Ų | 103 | 102.4 Ų | 102.4 | 48% | 0.481 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -60.6 | -47.8 | 173.9 | -75.7 | 175.8 | -11.8 | 0 | 0 | 111 | L90 E91 A96 L97 E98 | L90-Q94 WeakPolarHBondContact O-CG 3.42Å; L90-Q94 PolarHBondContact O-N 3.46Å; E91-Q94 PolarHBondContact O-N 3.46Å; Q94-A96 VanDerWaalsContact C-N 3.33Å; Q94-A96 PolarHBondContact O-N 3.1Å; Q94-L97 PolarHBondContact O-N 3.2Å; Q94-E98 WeakPolarHBondContact O-CG 3.5Å; Q94-E98 PolarHBondContact O-N 3.43Å |
| 95 | S | 97.5 | Very high | 96.9 | Very high | 73 Ų | 73 | 103.2 Ų | 103.2 | 51% | 0.51 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -59.9 | -42.5 | 177.5 | -58.9 | 0 | 0 | 0 | 0 | 112.2 | E91 E92 E98 L99 | E91-S95 WeakPolarHBondContact O-CB 3.32Å; E91-S95 PolarHBondContact O-N 3.45Å; E91-S95 PolarHBondContact O-OG 3.45Å; E92-S95 PolarHBondContact O-N 3.47Å; S95-E98 PolarHBondContact O-N 3.13Å; S95-L99 PolarHBondContact O-N 3.34Å; S95-L99 VanDerWaalsContact O-N 3.08Å |
| 96 | A | 98.4 | Very high | 96.4 | Very high | 47 Ų | 47 | 101.6 Ų | 101.6 | 39% | 0.388 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -63.5 | -43.6 | 176.2 | 0 | 0 | 0 | 0 | 0 | 112 | E92 H93 Q94 L99 I100 | E92-A96 WeakPolarHBondContact O-CB 3.41Å; E92-A96 PolarHBondContact O-N 3.01Å; H93-A96 PolarHBondContact O-N 3.4Å; Q94-A96 VanDerWaalsContact C-N 3.33Å; Q94-A96 PolarHBondContact O-N 3.1Å; A96-L99 PolarHBondContact O-N 3.13Å; A96-I100 VanDerWaalsContact O-CG1 3.29Å; A96-I100 WeakPolarHBondContact O-CG1 3.42Å; A96-I100 PolarHBondContact O-N 2.86Å |
| 97 | L | 97.9 | Very high | 96.1 | Very high | 105 Ų | 105 | 101.9 Ų | 101.9 | 55% | 0.55 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -64.4 | -42 | 176.6 | -77.4 | 170.9 | 0 | 0 | 0 | 112.1 | H93 Q94 L99 I100 M101 | H93-L97 WeakPolarHBondContact O-CB 3.28Å; H93-L97 WeakPolarHBondContact O-CG 3.42Å; H93-L97 PolarHBondContact O-N 3.29Å; Q94-L97 PolarHBondContact O-N 3.2Å; L97-L99 VanDerWaalsContact C-N 3.31Å; L97-L99 PolarHBondContact O-N 3.49Å; L97-I100 PolarHBondContact O-N 3.2Å; L97-M101 WeakPolarHBondContact O-CB 3.37Å; L97-M101 VanDerWaalsContact O-CG 3.24Å; L97-M101 WeakPolarHBondContact O-CG 3.37Å; L97-M101 PolarHBondContact O-N 3.48Å |
| 98 | E | 95.4 | Very high | 95.5 | Very high | 132 Ų | 132 | 96.8 Ų | 96.8 | 62% | 0.617 | 48% | 0.484 | S | S | * | . | H | α-helix | trans | -59.4 | -43.1 | 175.7 | -75.9 | -179.6 | -179.7 | 0 | 0 | 111.8 | Q94 S95 M101 T102 | Q94-E98 WeakPolarHBondContact O-CG 3.5Å; Q94-E98 PolarHBondContact O-N 3.43Å; S95-E98 PolarHBondContact O-N 3.13Å; E98-M101 PolarHBondContact O-N 3.2Å; E98-T102 WeakPolarHBondContact O-CB 3.42Å; E98-T102 PolarHBondContact O-N 2.87Å; E98-T102 PolarHBondContact O-OG1 3.2Å |
| 99 | L | 97.3 | Very high | 94.8 | Very high | 110 Ų | 110 | 99.7 Ų | 99.7 | 58% | 0.576 | 49% | 0.492 | S | S | * | . | H | α-helix | trans | -62.8 | -47.7 | 175.7 | -178.3 | 63 | 0 | 0 | 0 | 111.5 | S95 A96 L97 M101 T102 K103 | S95-L99 PolarHBondContact O-N 3.34Å; S95-L99 VanDerWaalsContact O-N 3.08Å; A96-L99 PolarHBondContact O-N 3.13Å; L97-L99 VanDerWaalsContact C-N 3.31Å; L97-L99 PolarHBondContact O-N 3.49Å; L99-M101 PolarHBondContact O-N 3.39Å; L99-T102 PolarHBondContact O-N 2.95Å; L99-K103 WeakPolarHBondContact O-CG 3.49Å; L99-K103 PolarHBondContact O-N 2.94Å |
| 100 | I | 97.9 | Very high | 94.1 | Very high | 106 Ų | 106 | 105.2 Ų | 105.2 | 54% | 0.544 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -59.7 | -47.7 | 178 | -69.8 | 166.2 | 0 | 0 | 0 | 110.4 | A96 L97 T102 K103 Y104 | A96-I100 VanDerWaalsContact O-CG1 3.29Å; A96-I100 WeakPolarHBondContact O-CG1 3.42Å; A96-I100 PolarHBondContact O-N 2.86Å; L97-I100 PolarHBondContact O-N 3.2Å; I100-T102 VanDerWaalsContact C-N 3.3Å; I100-T102 PolarHBondContact O-N 2.85Å; I100-K103 PolarHBondContact O-N 2.98Å; I100-Y104 WeakPolarHBondContact O-CB 3.43Å; I100-Y104 PolarHBondContact O-N 3.21Å |
| 101 | M | 95.6 | Very high | 93.5 | Very high | 83 Ų | 83 | 105.6 Ų | 105.6 | 41% | 0.409 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -63.8 | -36.7 | 179.6 | -72.2 | -62.9 | -69.9 | 0 | 0 | 111.7 | L97 E98 L99 Y104 R105 | L97-M101 WeakPolarHBondContact O-CB 3.37Å; L97-M101 VanDerWaalsContact O-CG 3.24Å; L97-M101 WeakPolarHBondContact O-CG 3.37Å; L97-M101 PolarHBondContact O-N 3.48Å; E98-M101 PolarHBondContact O-N 3.2Å; L99-M101 PolarHBondContact O-N 3.39Å; M101-Y104 PolarHBondContact O-N 3.14Å; M101-R105 WeakPolarHBondContact O-CB 3.24Å; M101-R105 VanDerWaalsContact O-CG 3.24Å; M101-R105 WeakPolarHBondContact O-CG 3.38Å; M101-R105 PolarHBondContact O-N 3.03Å |
| 102 | T | 92.6 | Very high | 92.5 | Very high | 62 Ų | 62 | 102.5 Ų | 102.5 | 38% | 0.38 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -63.7 | -47.8 | 173.5 | -58.3 | 0 | 0 | 0 | 0 | 111.1 | E98 L99 I100 Y104 R105 E106 | E98-T102 WeakPolarHBondContact O-CB 3.42Å; E98-T102 PolarHBondContact O-N 2.87Å; E98-T102 PolarHBondContact O-OG1 3.2Å; L99-T102 PolarHBondContact O-N 2.95Å; I100-T102 VanDerWaalsContact C-N 3.3Å; I100-T102 PolarHBondContact O-N 2.85Å; T102-Y104 VanDerWaalsContact C-N 3.32Å; T102-Y104 PolarHBondContact O-N 3.47Å; T102-R105 PolarHBondContact O-N 2.71Å; T102-E106 WeakPolarHBondContact O-CG 3.48Å; T102-E106 PolarHBondContact O-N 2.88Å |
| 103 | K | 96.1 | Very high | 91.4 | Very high | 105 Ų | 105 | 100.9 Ų | 100.9 | 46% | 0.457 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -63.7 | -36.8 | 176.2 | -68.5 | -45.8 | -174.2 | -166.9 | 0 | 113.3 | L99 I100 E106 Q107 | L99-K103 WeakPolarHBondContact O-CG 3.49Å; L99-K103 PolarHBondContact O-N 2.94Å; I100-K103 PolarHBondContact O-N 2.98Å; K103-E106 VanDerWaalsContact CD-OE2 3.26Å; K103-E106 WeakPolarHBondContact CD-OE2 3.48Å; K103-E106 VanDerWaalsContact NZ-CD 3.29Å; K103-E106 IonicContact NZ-OE1 2.82Å; K103-E106 PolarHBondContact NZ-OE1 3.32Å; K103-E106 IonicContact NZ-OE2 3.63Å; K103-E106 PolarHBondContact NZ-OE2 3.34Å; K103-E106 PolarHBondContact O-N 3.29Å; K103-Q107 WeakPolarHBondContact O-CB 3.46Å; K103-Q107 PolarHBondContact O-N 3.48Å |
| 104 | Y | 95.5 | Very high | 90.5 | Very high | 140 Ų | 140 | 99.5 Ų | 99.5 | 55% | 0.549 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -62.7 | -49.4 | 173.8 | -179.7 | -102.1 | 0 | 0 | 0 | 111.4 | I100 M101 T102 E106 Q107 V108 | I100-Y104 WeakPolarHBondContact O-CB 3.43Å; I100-Y104 PolarHBondContact O-N 3.21Å; M101-Y104 PolarHBondContact O-N 3.14Å; T102-Y104 VanDerWaalsContact C-N 3.32Å; T102-Y104 PolarHBondContact O-N 3.47Å; Y104-E106 VanDerWaalsContact C-N 3.35Å; Y104-E106 PolarHBondContact O-N 2.78Å; Y104-Q107 PolarHBondContact O-N 3.25Å; Y104-Q107 VanDerWaalsContact O-N 3.16Å; Y104-V108 HydrophobicContact CD1-CG2 4.28Å; Y104-V108 HydrophobicContact CE1-CG2 3.87Å; Y104-V108 HydrophobicContact CE2-CG2 4.13Å; Y104-V108 WeakPolarHBondContact O-CG2 3.41Å; Y104-V108 PolarHBondContact O-N 3.49Å |
| 105 | R | 90.6 | Very high | 89.3 | Confident | 148 Ų | 148 | 98.9 Ų | 98.9 | 56% | 0.558 | 51% | 0.505 | S | S | * | . | H | α-helix | trans | -58.8 | -44 | 175.8 | -70.9 | 174.6 | -166.7 | 117.5 | -4 | 111.8 | M101 T102 Q107 V108 F109 | M101-R105 WeakPolarHBondContact O-CB 3.24Å; M101-R105 VanDerWaalsContact O-CG 3.24Å; M101-R105 WeakPolarHBondContact O-CG 3.38Å; M101-R105 PolarHBondContact O-N 3.03Å; T102-R105 PolarHBondContact O-N 2.71Å; R105-Q107 VanDerWaalsContact C-N 3.34Å; R105-Q107 PolarHBondContact O-N 2.91Å; R105-V108 PolarHBondContact O-N 3.37Å; R105-F109 WeakPolarHBondContact O-CB 3.43Å; R105-F109 PolarHBondContact O-N 2.89Å |
| 106 | E | 87.5 | Confident | 87.4 | Confident | 74 Ų | 74 | 98.3 Ų | 98.3 | 35% | 0.346 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -59.6 | -41.1 | 175.1 | -75 | 175 | -162.9 | 0 | 0 | 112.5 | T102 K103 Y104 R110 | T102-E106 WeakPolarHBondContact O-CG 3.48Å; T102-E106 PolarHBondContact O-N 2.88Å; K103-E106 VanDerWaalsContact CD-OE2 3.26Å; K103-E106 WeakPolarHBondContact CD-OE2 3.48Å; K103-E106 VanDerWaalsContact NZ-CD 3.29Å; K103-E106 IonicContact NZ-OE1 2.82Å; K103-E106 PolarHBondContact NZ-OE1 3.32Å; K103-E106 IonicContact NZ-OE2 3.63Å; K103-E106 PolarHBondContact NZ-OE2 3.34Å; K103-E106 PolarHBondContact O-N 3.29Å; Y104-E106 VanDerWaalsContact C-N 3.35Å; Y104-E106 PolarHBondContact O-N 2.78Å; E106-R110 WeakPolarHBondContact O-CB 3.03Å; E106-R110 WeakPolarHBondContact O-CG 3.43Å; E106-R110 PolarHBondContact O-N 3.45Å; E106-R110 PolarHBondContact O-NE 3.35Å |
| 107 | Q | 90.6 | Very high | 85.4 | Confident | 109 Ų | 109 | 107.7 Ų | 107.7 | 51% | 0.509 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -68.8 | -46.4 | 179.2 | -178.9 | 178 | -0 | 0 | 0 | 111.5 | K103 Y104 R105 F109 R110 L111 | K103-Q107 WeakPolarHBondContact O-CB 3.46Å; K103-Q107 PolarHBondContact O-N 3.48Å; Y104-Q107 PolarHBondContact O-N 3.25Å; Y104-Q107 VanDerWaalsContact O-N 3.16Å; R105-Q107 VanDerWaalsContact C-N 3.34Å; R105-Q107 PolarHBondContact O-N 2.91Å; Q107-F109 VanDerWaalsContact C-N 3.28Å; Q107-F109 PolarHBondContact O-N 3.34Å; Q107-R110 PolarHBondContact O-N 2.94Å; Q107-L111 HydrophobicContact CG-CD1 4.18Å; Q107-L111 WeakPolarHBondContact O-CG 3.27Å; Q107-L111 PolarHBondContact O-N 3.24Å |
| 108 | V | 86.4 | Confident | 83.2 | Confident | 66 Ų | 66 | 111.9 Ų | 111.9 | 40% | 0.4 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -58.9 | -44 | 176.1 | 171.8 | 0 | 0 | 0 | 0 | 110.2 | Y104 R105 L111 L112 | Y104-V108 HydrophobicContact CD1-CG2 4.28Å; Y104-V108 HydrophobicContact CE1-CG2 3.87Å; Y104-V108 HydrophobicContact CE2-CG2 4.13Å; Y104-V108 WeakPolarHBondContact O-CG2 3.41Å; Y104-V108 PolarHBondContact O-N 3.49Å; R105-V108 PolarHBondContact O-N 3.37Å; V108-L111 PolarHBondContact O-N 3.44Å; V108-L112 WeakPolarHBondContact O-CB 3.48Å; V108-L112 PolarHBondContact O-N 3.18Å |
| 109 | F | 82.6 | Confident | 81.4 | Confident | 120 Ų | 120 | 109.7 Ų | 109.7 | 53% | 0.526 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -61.1 | -46.2 | 176.4 | -176.3 | -95.5 | 0 | 0 | 0 | 112.3 | R105 Q107 L111 L112 M113 | R105-F109 WeakPolarHBondContact O-CB 3.43Å; R105-F109 PolarHBondContact O-N 2.89Å; Q107-F109 VanDerWaalsContact C-N 3.28Å; Q107-F109 PolarHBondContact O-N 3.34Å; F109-L111 PolarHBondContact O-N 2.93Å; F109-L112 WeakPolarHBondContact O-CB 3.36Å; F109-L112 PolarHBondContact O-N 3.1Å; F109-M113 HydrophobicContact CD1-CG 4.16Å; F109-M113 HydrophobicContact CD2-CE 4.26Å; F109-M113 HydrophobicContact CE1-CE 4.09Å; F109-M113 HydrophobicContact CE1-CG 3.81Å; F109-M113 HydrophobicContact CE2-CE 3.36Å; F109-M113 HydrophobicContact CE2-CG 4.45Å; F109-M113 HydrophobicContact CZ-CE 3.27Å; F109-M113 HydrophobicContact CZ-CG 3.99Å; F109-M113 HydrophobicContact CZ-SD 4.41Å; F109-M113 WeakPolarHBondContact O-CG 3.43Å; F109-M113 PolarHBondContact O-N 3.45Å |
| 110 | R | 84.2 | Confident | 80 | Confident | 160 Ų | 160 | 108.9 Ų | 108.9 | 60% | 0.604 | 53% | 0.529 | S | S | * | . | H | α-helix | trans | -60 | -43.8 | 176 | -82.6 | -177.5 | -78.2 | 158.9 | -8.7 | 112.5 | E106 Q107 M113 A114 | E106-R110 WeakPolarHBondContact O-CB 3.03Å; E106-R110 WeakPolarHBondContact O-CG 3.43Å; E106-R110 PolarHBondContact O-N 3.45Å; E106-R110 PolarHBondContact O-NE 3.35Å; Q107-R110 PolarHBondContact O-N 2.94Å; R110-M113 PolarHBondContact O-N 3.15Å; R110-A114 WeakPolarHBondContact O-CB 3.46Å; R110-A114 PolarHBondContact O-N 3.42Å |
| 111 | L | 84.7 | Confident | 78.7 | Confident | 110 Ų | 110 | 106.6 Ų | 106.6 | 58% | 0.576 | 53% | 0.526 | S | S | * | . | H | α-helix | trans | -64.3 | -41.6 | 176.3 | -74.3 | 169.5 | 0 | 0 | 0 | 111.7 | Q107 V108 F109 A114 S115 | Q107-L111 HydrophobicContact CG-CD1 4.18Å; Q107-L111 WeakPolarHBondContact O-CG 3.27Å; Q107-L111 PolarHBondContact O-N 3.24Å; V108-L111 PolarHBondContact O-N 3.44Å; F109-L111 PolarHBondContact O-N 2.93Å; L111-A114 PolarHBondContact O-N 3.08Å; L111-S115 VanDerWaalsContact O-CB 3.3Å; L111-S115 WeakPolarHBondContact O-CB 3.28Å; L111-S115 PolarHBondContact O-N 3.26Å; L111-S115 PolarHBondContact O-OG 3.14Å |
| 112 | L | 77.6 | Confident | 77.5 | Confident | 52 Ų | 52 | 105.5 Ų | 105.5 | 27% | 0.272 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -60.7 | -47.7 | 176.7 | -166.8 | 80.8 | 0 | 0 | 0 | 111 | V108 F109 A114 S115 K116 L126 | V108-L112 WeakPolarHBondContact O-CB 3.48Å; V108-L112 PolarHBondContact O-N 3.18Å; F109-L112 WeakPolarHBondContact O-CB 3.36Å; F109-L112 PolarHBondContact O-N 3.1Å; L112-A114 VanDerWaalsContact C-N 3.34Å; L112-A114 PolarHBondContact O-N 2.91Å; L112-S115 PolarHBondContact O-N 3.08Å; L112-S115 VanDerWaalsContact O-N 3.15Å; L112-S115 PolarHBondContact O-OG 3.47Å; L112-K116 HydrophobicContact CD1-CD 4.29Å; L112-K116 HydrophobicContact CG-CD 4.2Å; L112-K116 WeakPolarHBondContact O-CB 3.41Å; L112-K116 PolarHBondContact O-N 3.33Å; L112-L126 HydrophobicContact CD2-CD1 4.23Å |
| 113 | M | 75.8 | Confident | 76.5 | Confident | 97 Ų | 97 | 105.3 Ų | 105.3 | 48% | 0.478 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -65.5 | -34.5 | 177.9 | -69.5 | -59.1 | 170.9 | 0 | 0 | 112.8 | F109 R110 | F109-M113 HydrophobicContact CD1-CG 4.16Å; F109-M113 HydrophobicContact CD2-CE 4.26Å; F109-M113 HydrophobicContact CE1-CE 4.09Å; F109-M113 HydrophobicContact CE1-CG 3.81Å; F109-M113 HydrophobicContact CE2-CE 3.36Å; F109-M113 HydrophobicContact CE2-CG 4.45Å; F109-M113 HydrophobicContact CZ-CE 3.27Å; F109-M113 HydrophobicContact CZ-CG 3.99Å; F109-M113 HydrophobicContact CZ-SD 4.41Å; F109-M113 WeakPolarHBondContact O-CG 3.43Å; F109-M113 PolarHBondContact O-N 3.45Å; R110-M113 PolarHBondContact O-N 3.15Å |
| 114 | A | 79.3 | Confident | 75.5 | Confident | 88 Ų | 88 | 104.2 Ų | 104.2 | 73% | 0.727 | 52% | 0.522 | S | S | * | . | H | α-helix | trans | -71.4 | -30.1 | 172.9 | 0 | 0 | 0 | 0 | 0 | 112.7 | R110 L111 L112 | R110-A114 WeakPolarHBondContact O-CB 3.46Å; R110-A114 PolarHBondContact O-N 3.42Å; L111-A114 PolarHBondContact O-N 3.08Å; L112-A114 VanDerWaalsContact C-N 3.34Å; L112-A114 PolarHBondContact O-N 2.91Å |
| 115 | S | 71.4 | Confident | 74.7 | Confident | 90 Ų | 90 | 102.8 Ų | 102.8 | 63% | 0.629 | 52% | 0.521 | S | S | * | . | H | α-helix | trans | -86.8 | -24.7 | -178.3 | 77.3 | 0 | 0 | 0 | 0 | 114.3 | L111 L112 | L111-S115 VanDerWaalsContact O-CB 3.3Å; L111-S115 WeakPolarHBondContact O-CB 3.28Å; L111-S115 PolarHBondContact O-N 3.26Å; L111-S115 PolarHBondContact O-OG 3.14Å; L112-S115 PolarHBondContact O-N 3.08Å; L112-S115 VanDerWaalsContact O-N 3.15Å; L112-S115 PolarHBondContact O-OG 3.47Å |
| 116 | K | 58.2 | Low | 74.1 | Confident | 61 Ų | 61 | 99.7 Ų | 99.7 | 27% | 0.265 | 52% | 0.515 | S | S | . | . | trans | -103.9 | 115.4 | -175.9 | -73.7 | -168.6 | 177.7 | 176.9 | 0 | 111.8 | L112 I122 | L112-K116 HydrophobicContact CD1-CD 4.29Å; L112-K116 HydrophobicContact CG-CD 4.2Å; L112-K116 WeakPolarHBondContact O-CB 3.41Å; L112-K116 PolarHBondContact O-N 3.33Å; K116-I122 VanDerWaalsContact NZ-CB 3.28Å | ||
| 117 | R | 55.5 | Low | 73.6 | Confident | 243 Ų | 243 | 102.9 Ų | 102.9 | 92% | 0.917 | 53% | 0.527 | S | S | * | . | S | Bend | trans | -58.4 | 128.4 | 138.7 | -66 | -173.3 | 176.2 | -167.2 | -1.1 | 106.7 | D119 | R117-D119 PolarHBondContact O-N 2.93Å; R117-D119 VanDerWaalsContact O-N 3.14Å |
| 118 | E | 51.7 | Low | 73.1 | Confident | 193 Ų | 193 | 103.9 Ų | 103.9 | 90% | 0.902 | 53% | 0.532 | S | S | * | . | trans | -47 | 111 | -169.9 | -63.2 | 170.9 | 162.6 | 0 | 0 | 113 | ||||
| 119 | D | 58.7 | Low | 72.8 | Confident | 87 Ų | 87 | 105.3 Ų | 105.3 | 47% | 0.465 | 53% | 0.534 | S | S | . | . | trans | -110.8 | 101 | 163 | -162.2 | -10.2 | 0 | 0 | 0 | 108.2 | R117 A121 I122 | R117-D119 PolarHBondContact O-N 2.93Å; R117-D119 VanDerWaalsContact O-N 3.14Å; D119-A121 PolarHBondContact O-N 3.46Å; D119-A121 VanDerWaalsContact O-N 3.15Å; D119-I122 HydrophobicContact CB-CD1 4.36Å; D119-I122 PolarHBondContact O-N 3.37Å | ||
| 120 | P | 67.3 | Low | 72.7 | Confident | 93 Ų | 93 | 105 Ų | 105 | 60% | 0.604 | 53% | 0.534 | S | S | * | . | H | α-helix | trans | -61.6 | -24.7 | -169.2 | 21.3 | -31.4 | 0 | 0 | 0 | 113.5 | I122 V123 T124 | P120-I122 VanDerWaalsContact C-N 3.33Å; P120-I122 PolarHBondContact O-N 3.19Å; P120-V123 PolarHBondContact O-N 3.43Å; P120-T124 PolarHBondContact O-N 2.96Å; P120-T124 PolarHBondContact O-OG1 2.92Å; P120-T124 VanDerWaalsContact O-OG1 3.13Å |
| 121 | A | 71.1 | Confident | 72.9 | Confident | 58 Ų | 58 | 101 Ų | 101 | 48% | 0.479 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -63.9 | -35.2 | -179.3 | 0 | 0 | 0 | 0 | 0 | 113.3 | D119 T124 Q125 | D119-A121 PolarHBondContact O-N 3.46Å; D119-A121 VanDerWaalsContact O-N 3.15Å; A121-T124 WeakPolarHBondContact CA-OG1 3.38Å; A121-T124 PolarHBondContact O-OG1 3.01Å; A121-Q125 PolarHBondContact O-N 3.27Å |
| 122 | I | 70.1 | Confident | 73.1 | Confident | 59 Ų | 59 | 100.1 Ų | 100.1 | 30% | 0.303 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -78.8 | -28.9 | -177.1 | -53.3 | 169.8 | 0 | 0 | 0 | 110.9 | K116 D119 P120 L126 | K116-I122 VanDerWaalsContact NZ-CB 3.28Å; D119-I122 HydrophobicContact CB-CD1 4.36Å; D119-I122 PolarHBondContact O-N 3.37Å; P120-I122 VanDerWaalsContact C-N 3.33Å; P120-I122 PolarHBondContact O-N 3.19Å; I122-L126 HydrophobicContact CG2-CD1 4.25Å; I122-L126 WeakPolarHBondContact O-CG 3.38Å; I122-L126 PolarHBondContact O-N 3.01Å; I122-L126 VanDerWaalsContact O-N 3.16Å |
| 123 | V | 71.4 | Confident | 73.5 | Confident | 59 Ų | 59 | 103.7 Ų | 103.7 | 36% | 0.358 | 54% | 0.543 | S | S | . | . | H | α-helix | trans | -70.2 | -40.5 | 176 | 177.8 | 0 | 0 | 0 | 0 | 110.9 | P120 K127 | P120-V123 PolarHBondContact O-N 3.43Å; V123-K127 WeakPolarHBondContact O-CG 3.45Å; V123-K127 PolarHBondContact O-N 3.02Å |
| 124 | T | 76 | Confident | 73.9 | Confident | 81 Ų | 81 | 103.8 Ų | 103.8 | 50% | 0.497 | 54% | 0.543 | S | S | . | . | H | α-helix | trans | -65.3 | -42.4 | 175.6 | 38.8 | 0 | 0 | 0 | 0 | 112 | P120 A121 L126 K127 E128 | P120-T124 PolarHBondContact O-N 2.96Å; P120-T124 PolarHBondContact O-OG1 2.92Å; P120-T124 VanDerWaalsContact O-OG1 3.13Å; A121-T124 WeakPolarHBondContact CA-OG1 3.38Å; A121-T124 PolarHBondContact O-OG1 3.01Å; T124-L126 PolarHBondContact O-N 2.96Å; T124-K127 PolarHBondContact O-N 3.35Å; T124-E128 PolarHBondContact O-N 3.01Å |
| 125 | Q | 78.6 | Confident | 74.4 | Confident | 111 Ų | 111 | 104.2 Ų | 104.2 | 52% | 0.519 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -65.6 | -40.4 | -179.8 | -164.8 | 175.3 | 19.8 | 0 | 0 | 112.7 | A121 K127 E128 Q129 | A121-Q125 PolarHBondContact O-N 3.27Å; Q125-K127 VanDerWaalsContact C-N 3.34Å; Q125-K127 PolarHBondContact O-N 3.35Å; Q125-E128 PolarHBondContact O-N 3.45Å; Q125-Q129 WeakPolarHBondContact O-CG 3.24Å; Q125-Q129 PolarHBondContact O-N 3.38Å |
| 126 | L | 77.1 | Confident | 75.4 | Confident | 82 Ų | 82 | 102.7 Ų | 102.7 | 43% | 0.429 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -65.1 | -36.8 | 174.9 | -80.8 | 165.9 | 0 | 0 | 0 | 112.5 | L112 I122 T124 H130 | L112-L126 HydrophobicContact CD2-CD1 4.23Å; I122-L126 HydrophobicContact CG2-CD1 4.25Å; I122-L126 WeakPolarHBondContact O-CG 3.38Å; I122-L126 PolarHBondContact O-N 3.01Å; I122-L126 VanDerWaalsContact O-N 3.16Å; T124-L126 PolarHBondContact O-N 2.96Å; L126-H130 WeakPolarHBondContact O-CB 3.33Å; L126-H130 PolarHBondContact O-N 3.43Å |
| 127 | K | 76.6 | Confident | 77 | Confident | 142 Ų | 142 | 106 Ų | 106 | 62% | 0.617 | 54% | 0.539 | S | S | * | . | H | α-helix | trans | -66.6 | -43.8 | 175.6 | -75.9 | 179.7 | 177.8 | -176.4 | 0 | 111.5 | V123 T124 Q125 H130 T131 | V123-K127 WeakPolarHBondContact O-CG 3.45Å; V123-K127 PolarHBondContact O-N 3.02Å; T124-K127 PolarHBondContact O-N 3.35Å; Q125-K127 VanDerWaalsContact C-N 3.34Å; Q125-K127 PolarHBondContact O-N 3.35Å; K127-H130 PolarHBondContact O-N 3.48Å; K127-T131 PolarHBondContact O-N 3.41Å; K127-T131 PolarHBondContact O-OG1 3.48Å |
| 128 | E | 81.9 | Confident | 78.7 | Confident | 130 Ų | 130 | 97.9 Ų | 97.9 | 61% | 0.607 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -60.9 | -44.4 | 176.1 | -83.1 | 179.6 | 154.5 | 0 | 0 | 112.2 | T124 Q125 T131 T132 | T124-E128 PolarHBondContact O-N 3.01Å; Q125-E128 PolarHBondContact O-N 3.45Å; E128-T131 VanDerWaalsContact CA-OG1 3.26Å; E128-T131 WeakPolarHBondContact CA-OG1 3.36Å; E128-T131 PolarHBondContact O-N 2.89Å; E128-T131 PolarHBondContact O-OG1 2.95Å; E128-T132 WeakPolarHBondContact O-CG2 3.33Å; E128-T132 PolarHBondContact O-N 3.32Å; E128-T132 PolarHBondContact O-OG1 2.73Å |
| 129 | Q | 79.1 | Confident | 80.7 | Confident | 95 Ų | 95 | 92.6 Ų | 92.6 | 44% | 0.444 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -59.9 | -47 | 174.9 | -74.3 | 177.5 | -12.5 | 0 | 0 | 111.7 | Q125 T131 T132 E133 | Q125-Q129 WeakPolarHBondContact O-CG 3.24Å; Q125-Q129 PolarHBondContact O-N 3.38Å; Q129-T131 VanDerWaalsContact C-N 3.34Å; Q129-T131 PolarHBondContact O-N 3.24Å; Q129-T132 WeakPolarHBondContact CA-OG1 3.39Å; Q129-T132 PolarHBondContact O-N 2.81Å; Q129-T132 PolarHBondContact O-OG1 2.87Å; Q129-E133 WeakPolarHBondContact O-CG 3.33Å; Q129-E133 PolarHBondContact O-N 3.35Å |
| 130 | H | 81.5 | Confident | 82.4 | Confident | 114 Ų | 114 | 94.5 Ų | 94.5 | 53% | 0.528 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -62.6 | -40.5 | 177.2 | -174.1 | -64.8 | 0 | 0 | 0 | 112.2 | L126 K127 M134 | L126-H130 WeakPolarHBondContact O-CB 3.33Å; L126-H130 PolarHBondContact O-N 3.43Å; K127-H130 PolarHBondContact O-N 3.48Å; H130-M134 VanDerWaalsContact O-CB 3.25Å; H130-M134 WeakPolarHBondContact O-CB 3.48Å; H130-M134 PolarHBondContact O-N 2.96Å |
| 131 | T | 86.7 | Confident | 83.8 | Confident | 76 Ų | 76 | 95.3 Ų | 95.3 | 47% | 0.466 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -67 | -36.8 | 177.8 | 43.7 | 0 | 0 | 0 | 0 | 112.7 | K127 E128 Q129 Q135 | K127-T131 PolarHBondContact O-N 3.41Å; K127-T131 PolarHBondContact O-OG1 3.48Å; E128-T131 VanDerWaalsContact CA-OG1 3.26Å; E128-T131 WeakPolarHBondContact CA-OG1 3.36Å; E128-T131 PolarHBondContact O-N 2.89Å; E128-T131 PolarHBondContact O-OG1 2.95Å; Q129-T131 VanDerWaalsContact C-N 3.34Å; Q129-T131 PolarHBondContact O-N 3.24Å; T131-Q135 WeakPolarHBondContact O-CB 3.48Å; T131-Q135 PolarHBondContact O-N 3.17Å |
| 132 | T | 89.8 | Confident | 84.8 | Confident | 92 Ų | 92 | 96.9 Ų | 96.9 | 56% | 0.564 | 49% | 0.493 | S | S | * | . | H | α-helix | trans | -71.5 | -42 | 179 | 45.6 | 0 | 0 | 0 | 0 | 111.7 | E128 Q129 Q135 A136 | E128-T132 WeakPolarHBondContact O-CG2 3.33Å; E128-T132 PolarHBondContact O-N 3.32Å; E128-T132 PolarHBondContact O-OG1 2.73Å; Q129-T132 WeakPolarHBondContact CA-OG1 3.39Å; Q129-T132 PolarHBondContact O-N 2.81Å; Q129-T132 PolarHBondContact O-OG1 2.87Å; T132-Q135 PolarHBondContact O-N 3.44Å; T132-A136 PolarHBondContact O-N 3.1Å |
| 133 | E | 84.9 | Confident | 86 | Confident | 127 Ų | 127 | 99.8 Ų | 99.8 | 59% | 0.593 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -61.5 | -43.7 | 172.6 | -72.6 | 178.8 | 177.1 | 0 | 0 | 111.9 | Q129 Q135 A136 H137 | Q129-E133 WeakPolarHBondContact O-CG 3.33Å; Q129-E133 PolarHBondContact O-N 3.35Å; E133-Q135 VanDerWaalsContact C-N 3.33Å; E133-Q135 PolarHBondContact O-N 3.44Å; E133-A136 PolarHBondContact O-N 3.44Å; E133-H137 PolarHBondContact O-CD2 3.5Å; E133-H137 PolarHBondContact O-N 3.3Å |
| 134 | M | 84.9 | Confident | 87.1 | Confident | 98 Ų | 98 | 103 Ų | 103 | 48% | 0.483 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -64.9 | -38.2 | 177.9 | -168.4 | 155.2 | 63.7 | 0 | 0 | 111.9 | H130 H137 I138 | H130-M134 VanDerWaalsContact O-CB 3.25Å; H130-M134 WeakPolarHBondContact O-CB 3.48Å; H130-M134 PolarHBondContact O-N 2.96Å; M134-H137 PolarHBondContact O-N 3.13Å; M134-I138 HydrophobicContact CG-CD1 4.49Å; M134-I138 WeakPolarHBondContact O-CG1 3.43Å; M134-I138 PolarHBondContact O-N 3.42Å |
| 135 | Q | 90.3 | Very high | 88 | Confident | 97 Ų | 97 | 100.6 Ų | 100.6 | 45% | 0.453 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -63.8 | -43.7 | 174.1 | -171.3 | 60.2 | 46 | 0 | 0 | 111.6 | T131 T132 E133 H137 I138 D139 | T131-Q135 WeakPolarHBondContact O-CB 3.48Å; T131-Q135 PolarHBondContact O-N 3.17Å; T132-Q135 PolarHBondContact O-N 3.44Å; E133-Q135 VanDerWaalsContact C-N 3.33Å; E133-Q135 PolarHBondContact O-N 3.44Å; Q135-H137 VanDerWaalsContact C-N 3.28Å; Q135-H137 PolarHBondContact O-N 3.03Å; Q135-I138 WeakPolarHBondContact O-CB 3.25Å; Q135-I138 PolarHBondContact O-N 2.92Å; Q135-I138 VanDerWaalsContact O-N 3.12Å; Q135-D139 PolarHBondContact NE2-OD1 3.38Å; Q135-D139 VanDerWaalsContact O-CG 3.22Å; Q135-D139 PolarHBondContact O-N 2.86Å |
| 136 | A | 92.4 | Very high | 88.8 | Confident | 58 Ų | 58 | 98.5 Ų | 98.5 | 48% | 0.479 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -60.8 | -36.9 | 177 | 0 | 0 | 0 | 0 | 0 | 112.5 | T132 E133 D139 K140 | T132-A136 PolarHBondContact O-N 3.1Å; E133-A136 PolarHBondContact O-N 3.44Å; A136-D139 PolarHBondContact O-N 3.45Å; A136-K140 PolarHBondContact O-N 2.96Å |
| 137 | H | 90.8 | Very high | 89.8 | Confident | 130 Ų | 130 | 99.1 Ų | 99.1 | 60% | 0.602 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -67.2 | -41.3 | 173.5 | -74.8 | -54.2 | 0 | 0 | 0 | 112.8 | E133 M134 Q135 D139 K140 I141 | E133-H137 PolarHBondContact O-CD2 3.5Å; E133-H137 PolarHBondContact O-N 3.3Å; M134-H137 PolarHBondContact O-N 3.13Å; Q135-H137 VanDerWaalsContact C-N 3.28Å; Q135-H137 PolarHBondContact O-N 3.03Å; H137-D139 VanDerWaalsContact C-N 3.31Å; H137-D139 PolarHBondContact O-N 3.48Å; H137-K140 WeakPolarHBondContact O-CB 3.31Å; H137-K140 PolarHBondContact O-N 3.04Å; H137-I141 WeakPolarHBondContact O-CG1 3.44Å; H137-I141 PolarHBondContact O-N 2.9Å |
| 138 | I | 91.6 | Very high | 90.6 | Very high | 74 Ų | 74 | 98.6 Ų | 98.6 | 38% | 0.379 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -60 | -44.8 | 174.7 | -70.9 | 166.2 | 0 | 0 | 0 | 110.3 | M134 Q135 K140 I141 N142 | M134-I138 HydrophobicContact CG-CD1 4.49Å; M134-I138 WeakPolarHBondContact O-CG1 3.43Å; M134-I138 PolarHBondContact O-N 3.42Å; Q135-I138 WeakPolarHBondContact O-CB 3.25Å; Q135-I138 PolarHBondContact O-N 2.92Å; Q135-I138 VanDerWaalsContact O-N 3.12Å; I138-K140 VanDerWaalsContact C-N 3.32Å; I138-K140 PolarHBondContact O-N 3.31Å; I138-I141 PolarHBondContact O-N 3.02Å; I138-N142 PolarHBondContact O-N 2.94Å; I138-N142 PolarHBondContact O-ND2 2.86Å |
| 139 | D | 93.8 | Very high | 91.3 | Very high | 82 Ų | 82 | 99.2 Ų | 99.2 | 44% | 0.439 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -62.8 | -40.2 | 179.4 | -63.2 | -19.4 | 0 | 0 | 0 | 111.3 | Q135 A136 H137 N142 E143 | Q135-D139 PolarHBondContact NE2-OD1 3.38Å; Q135-D139 VanDerWaalsContact O-CG 3.22Å; Q135-D139 PolarHBondContact O-N 2.86Å; A136-D139 PolarHBondContact O-N 3.45Å; H137-D139 VanDerWaalsContact C-N 3.31Å; H137-D139 PolarHBondContact O-N 3.48Å; D139-N142 PolarHBondContact O-N 3.1Å; D139-E143 PolarHBondContact O-N 3.03Å |
| 140 | K | 95.3 | Very high | 92 | Very high | 127 Ų | 127 | 100.4 Ų | 100.4 | 55% | 0.552 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -61.2 | -43.6 | 174.4 | -163 | 84 | 178.9 | 179.1 | 0 | 112.5 | A136 H137 I138 N142 E143 M144 | A136-K140 PolarHBondContact O-N 2.96Å; H137-K140 WeakPolarHBondContact O-CB 3.31Å; H137-K140 PolarHBondContact O-N 3.04Å; I138-K140 VanDerWaalsContact C-N 3.32Å; I138-K140 PolarHBondContact O-N 3.31Å; K140-N142 VanDerWaalsContact C-N 3.32Å; K140-E143 PolarHBondContact O-N 3.42Å; K140-M144 PolarHBondContact O-N 2.97Å |
| 141 | I | 95.1 | Very high | 92.6 | Very high | 109 Ų | 109 | 97.2 Ų | 97.2 | 56% | 0.559 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -64.6 | -41.1 | 177.6 | -68.9 | 166.8 | 0 | 0 | 0 | 110.1 | H137 I138 E143 M144 A145 | H137-I141 WeakPolarHBondContact O-CG1 3.44Å; H137-I141 PolarHBondContact O-N 2.9Å; I138-I141 PolarHBondContact O-N 3.02Å; I141-E143 VanDerWaalsContact C-N 3.35Å; I141-M144 PolarHBondContact O-N 2.86Å; I141-A145 WeakPolarHBondContact O-CB 3.41Å; I141-A145 PolarHBondContact O-N 2.88Å |
| 142 | N | 93 | Very high | 92.9 | Very high | 91 Ų | 91 | 97.4 Ų | 97.4 | 49% | 0.487 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -63.8 | -40.6 | 176.8 | -72.7 | -32.7 | 0 | 0 | 0 | 112.1 | I138 D139 K140 A145 S146 | I138-N142 PolarHBondContact O-N 2.94Å; I138-N142 PolarHBondContact O-ND2 2.86Å; D139-N142 PolarHBondContact O-N 3.1Å; K140-N142 VanDerWaalsContact C-N 3.32Å; N142-A145 PolarHBondContact O-N 2.94Å; N142-S146 PolarHBondContact O-N 3.5Å |
| 143 | E | 95.9 | Very high | 93.1 | Very high | 120 Ų | 120 | 98.2 Ų | 98.2 | 56% | 0.561 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -61.4 | -49.9 | 173.8 | -169.9 | -174.5 | -177.7 | 0 | 0 | 111 | D139 K140 I141 A145 S146 V147 | D139-E143 PolarHBondContact O-N 3.03Å; K140-E143 PolarHBondContact O-N 3.42Å; I141-E143 VanDerWaalsContact C-N 3.35Å; E143-A145 VanDerWaalsContact C-N 3.33Å; E143-A145 PolarHBondContact O-N 3.17Å; E143-S146 VanDerWaalsContact O-CB 3.29Å; E143-S146 WeakPolarHBondContact O-CB 3.37Å; E143-S146 PolarHBondContact O-N 3.21Å; E143-S146 VanDerWaalsContact O-N 3.08Å; E143-V147 WeakPolarHBondContact O-CG2 3.37Å; E143-V147 PolarHBondContact O-N 3.27Å |
| 144 | M | 94.8 | Very high | 93.6 | Very high | 126 Ų | 126 | 95.3 Ų | 95.3 | 62% | 0.621 | 49% | 0.492 | S | S | * | . | H | α-helix | trans | -57.5 | -44.6 | 175.8 | -81.1 | 177.6 | 40.5 | 0 | 0 | 112.3 | K140 I141 S146 V147 M148 | K140-M144 PolarHBondContact O-N 2.97Å; I141-M144 PolarHBondContact O-N 2.86Å; M144-S146 VanDerWaalsContact C-N 3.26Å; M144-S146 PolarHBondContact O-N 3.47Å; M144-V147 PolarHBondContact O-N 2.95Å; M144-M148 WeakPolarHBondContact O-CB 3.47Å; M144-M148 PolarHBondContact O-N 3.5Å |
| 145 | A | 94.4 | Very high | 94 | Very high | 32 Ų | 32 | 95.2 Ų | 95.2 | 26% | 0.264 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -62.6 | -35.5 | 177.6 | 0 | 0 | 0 | 0 | 0 | 111.7 | I141 N142 E143 R149 | I141-A145 WeakPolarHBondContact O-CB 3.41Å; I141-A145 PolarHBondContact O-N 2.88Å; N142-A145 PolarHBondContact O-N 2.94Å; E143-A145 VanDerWaalsContact C-N 3.33Å; E143-A145 PolarHBondContact O-N 3.17Å; A145-R149 WeakPolarHBondContact O-CB 3.39Å; A145-R149 WeakPolarHBondContact O-CG 3.32Å; A145-R149 PolarHBondContact O-N 2.89Å; A145-R149 PolarHBondContact O-NH1 2.85Å |
| 146 | S | 95.9 | Very high | 94.1 | Very high | 66 Ų | 66 | 96.4 Ų | 96.4 | 46% | 0.462 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -65.1 | -48.3 | 174.5 | -165.8 | 0 | 0 | 0 | 0 | 112 | N142 E143 M144 M148 R149 K150 | N142-S146 PolarHBondContact O-N 3.5Å; E143-S146 VanDerWaalsContact O-CB 3.29Å; E143-S146 WeakPolarHBondContact O-CB 3.37Å; E143-S146 PolarHBondContact O-N 3.21Å; E143-S146 VanDerWaalsContact O-N 3.08Å; M144-S146 VanDerWaalsContact C-N 3.26Å; M144-S146 PolarHBondContact O-N 3.47Å; S146-M148 VanDerWaalsContact C-N 3.34Å; S146-M148 PolarHBondContact O-N 3.44Å; S146-R149 PolarHBondContact O-N 3.04Å; S146-K150 PolarHBondContact O-N 2.92Å |
| 147 | V | 96.9 | Very high | 94 | Very high | 95 Ų | 95 | 95.3 Ų | 95.3 | 58% | 0.576 | 49% | 0.494 | S | S | * | . | H | α-helix | trans | -61 | -44.2 | 177.3 | 174.7 | 0 | 0 | 0 | 0 | 111 | E143 M144 K150 A151 | E143-V147 WeakPolarHBondContact O-CG2 3.37Å; E143-V147 PolarHBondContact O-N 3.27Å; M144-V147 PolarHBondContact O-N 2.95Å; V147-K150 PolarHBondContact O-N 2.94Å; V147-A151 PolarHBondContact O-N 2.97Å |
| 148 | M | 94.6 | Very high | 94.1 | Very high | 132 Ų | 132 | 96.4 Ų | 96.4 | 65% | 0.65 | 49% | 0.492 | S | S | * | . | H | α-helix | trans | -65.4 | -41.6 | -179.1 | -164.9 | 173.8 | 178.1 | 0 | 0 | 112 | M144 S146 K150 A151 I152 | M144-M148 WeakPolarHBondContact O-CB 3.47Å; M144-M148 PolarHBondContact O-N 3.5Å; S146-M148 VanDerWaalsContact C-N 3.34Å; S146-M148 PolarHBondContact O-N 3.44Å; M148-K150 VanDerWaalsContact C-N 3.33Å; M148-K150 PolarHBondContact O-N 2.91Å; M148-A151 PolarHBondContact O-N 2.97Å; M148-I152 WeakPolarHBondContact O-CG1 3.43Å; M148-I152 PolarHBondContact O-N 2.95Å; M148-I152 VanDerWaalsContact O-N 3.08Å |
| 149 | R | 95.1 | Very high | 94.2 | Very high | 142 Ų | 142 | 96.6 Ų | 96.6 | 54% | 0.536 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -59.7 | -43.7 | 172 | -77.5 | -172.9 | -62.2 | -90.5 | 0.8 | 111.8 | A145 S146 A151 I152 E153 | A145-R149 WeakPolarHBondContact O-CB 3.39Å; A145-R149 WeakPolarHBondContact O-CG 3.32Å; A145-R149 PolarHBondContact O-N 2.89Å; A145-R149 PolarHBondContact O-NH1 2.85Å; S146-R149 PolarHBondContact O-N 3.04Å; R149-A151 VanDerWaalsContact C-N 3.33Å; R149-A151 PolarHBondContact O-N 3.45Å; R149-I152 PolarHBondContact O-N 3.47Å; R149-E153 PolarHBondContact O-N 3.42Å |
| 150 | K | 95.2 | Very high | 94.1 | Very high | 120 Ų | 120 | 96 Ų | 96 | 52% | 0.522 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -65.2 | -37.7 | 179.6 | -169.2 | 69.1 | -153.6 | 158 | 0 | 112.5 | S146 V147 M148 E153 V154 | S146-K150 PolarHBondContact O-N 2.92Å; V147-K150 PolarHBondContact O-N 2.94Å; M148-K150 VanDerWaalsContact C-N 3.33Å; M148-K150 PolarHBondContact O-N 2.91Å; K150-E153 IonicContact NZ-OE2 2.78Å; K150-E153 PolarHBondContact NZ-OE2 3.49Å; K150-E153 PolarHBondContact O-N 2.86Å; K150-V154 VanDerWaalsContact O-CG2 3.32Å; K150-V154 WeakPolarHBondContact O-CG2 3.23Å; K150-V154 PolarHBondContact O-N 3.34Å; K150-V154 VanDerWaalsContact O-N 3.14Å |
| 151 | A | 93.9 | Very high | 94 | Very high | 48 Ų | 48 | 96.3 Ų | 96.3 | 40% | 0.397 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -61.9 | -46 | 174.5 | 0 | 0 | 0 | 0 | 0 | 111.3 | V147 M148 R149 E153 V154 D155 | V147-A151 PolarHBondContact O-N 2.97Å; M148-A151 PolarHBondContact O-N 2.97Å; R149-A151 VanDerWaalsContact C-N 3.33Å; R149-A151 PolarHBondContact O-N 3.45Å; A151-E153 PolarHBondContact O-N 3.13Å; A151-V154 PolarHBondContact O-N 3.3Å; A151-D155 PolarHBondContact O-N 2.85Å |
| 152 | I | 93.2 | Very high | 94 | Very high | 79 Ų | 79 | 96 Ų | 96 | 41% | 0.405 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -58.8 | -48.3 | 177.1 | -66.3 | 164.1 | 0 | 0 | 0 | 111.1 | M148 R149 V154 D155 E156 | M148-I152 WeakPolarHBondContact O-CG1 3.43Å; M148-I152 PolarHBondContact O-N 2.95Å; M148-I152 VanDerWaalsContact O-N 3.08Å; R149-I152 PolarHBondContact O-N 3.47Å; I152-V154 VanDerWaalsContact C-N 3.28Å; I152-V154 PolarHBondContact O-N 3.46Å; I152-D155 PolarHBondContact O-N 2.86Å; I152-E156 HydrophobicContact CG2-CG 4.24Å; I152-E156 WeakPolarHBondContact O-CB 3.26Å; I152-E156 WeakPolarHBondContact O-CG 3.31Å; I152-E156 PolarHBondContact O-N 3.32Å |
| 153 | E | 93.9 | Very high | 94 | Very high | 110 Ų | 110 | 96.5 Ų | 96.5 | 51% | 0.514 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -57.8 | -40.5 | 177.9 | -74 | 175.3 | -174.2 | 0 | 0 | 112.8 | R149 K150 A151 G157 | R149-E153 PolarHBondContact O-N 3.42Å; K150-E153 IonicContact NZ-OE2 2.78Å; K150-E153 PolarHBondContact NZ-OE2 3.49Å; K150-E153 PolarHBondContact O-N 2.86Å; A151-E153 PolarHBondContact O-N 3.13Å; E153-G157 PolarHBondContact O-N 3.38Å; E153-G157 VanDerWaalsContact O-N 3.15Å |
| 154 | V | 94.6 | Very high | 94 | Very high | 66 Ų | 66 | 96.5 Ų | 96.5 | 40% | 0.4 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -68.9 | -41 | 179 | 170.2 | 0 | 0 | 0 | 0 | 110.8 | K150 A151 I152 G157 R158 | K150-V154 VanDerWaalsContact O-CG2 3.32Å; K150-V154 WeakPolarHBondContact O-CG2 3.23Å; K150-V154 PolarHBondContact O-N 3.34Å; K150-V154 VanDerWaalsContact O-N 3.14Å; A151-V154 PolarHBondContact O-N 3.3Å; I152-V154 VanDerWaalsContact C-N 3.28Å; I152-V154 PolarHBondContact O-N 3.46Å; V154-G157 PolarHBondContact O-N 3.14Å; V154-R158 WeakPolarHBondContact O-CG 3.43Å; V154-R158 PolarHBondContact O-N 3.36Å |
| 155 | D | 93.3 | Very high | 94.1 | Very high | 95 Ų | 95 | 96.7 Ų | 96.7 | 51% | 0.508 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -68.3 | -43.4 | 179.1 | -73.1 | -15.6 | 0 | 0 | 0 | 111.5 | A151 I152 G157 R158 V159 | A151-D155 PolarHBondContact O-N 2.85Å; I152-D155 PolarHBondContact O-N 2.86Å; D155-G157 VanDerWaalsContact C-N 3.3Å; D155-G157 PolarHBondContact O-N 3.34Å; D155-R158 PolarHBondContact O-N 2.92Å; D155-V159 WeakPolarHBondContact O-CG2 3.44Å; D155-V159 PolarHBondContact O-N 3.32Å |
| 156 | E | 93.1 | Very high | 94.2 | Very high | 123 Ų | 123 | 99.5 Ų | 99.5 | 58% | 0.575 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -59.1 | -40.7 | 174.4 | -74.3 | -179.1 | 169.1 | 0 | 0 | 111.9 | I152 V159 C160 | I152-E156 HydrophobicContact CG2-CG 4.24Å; I152-E156 WeakPolarHBondContact O-CB 3.26Å; I152-E156 WeakPolarHBondContact O-CG 3.31Å; I152-E156 PolarHBondContact O-N 3.32Å; E156-V159 PolarHBondContact O-N 2.96Å; E156-C160 PolarHBondContact O-N 3.36Å; E156-C160 VanDerWaalsContact O-N 3.08Å; E156-C160 PolarHBondContact O-SG 3.4Å; E156-C160 VanDerWaalsContact O-SG 3.42Å |
| 157 | G | 90.6 | Very high | 94.2 | Very high | 35 Ų | 35 | 101.8 Ų | 101.8 | 36% | 0.361 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -59.8 | -45.5 | 174.7 | 0 | 0 | 0 | 0 | 0 | 112.8 | E153 V154 D155 C160 E161 | E153-G157 PolarHBondContact O-N 3.38Å; E153-G157 VanDerWaalsContact O-N 3.15Å; V154-G157 PolarHBondContact O-N 3.14Å; D155-G157 VanDerWaalsContact C-N 3.3Å; D155-G157 PolarHBondContact O-N 3.34Å; G157-C160 PolarHBondContact O-N 2.83Å; G157-E161 WeakPolarHBondContact O-CG 3.45Å; G157-E161 PolarHBondContact O-N 3.16Å; G157-E161 VanDerWaalsContact O-N 3.1Å |
| 158 | R | 91.7 | Very high | 94.2 | Very high | 152 Ų | 152 | 102.3 Ų | 102.3 | 57% | 0.574 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -63.9 | -40.9 | 177.1 | -70.2 | 176.2 | -172.7 | -97.6 | 1.9 | 112.3 | V154 D155 C160 E161 D162 | V154-R158 WeakPolarHBondContact O-CG 3.43Å; V154-R158 PolarHBondContact O-N 3.36Å; D155-R158 PolarHBondContact O-N 2.92Å; R158-C160 VanDerWaalsContact C-N 3.31Å; R158-C160 PolarHBondContact O-N 2.9Å; R158-E161 PolarHBondContact O-N 3.43Å; R158-D162 PolarHBondContact O-N 3.39Å |
| 159 | V | 93.4 | Very high | 94.3 | Very high | 79 Ų | 79 | 99.7 Ų | 99.7 | 48% | 0.479 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -60.4 | -42.9 | 177.2 | 171.3 | 0 | 0 | 0 | 0 | 110.8 | D155 E156 D162 E163 | D155-V159 WeakPolarHBondContact O-CG2 3.44Å; D155-V159 PolarHBondContact O-N 3.32Å; E156-V159 PolarHBondContact O-N 2.96Å; V159-D162 PolarHBondContact O-N 2.91Å; V159-E163 WeakPolarHBondContact O-CG 3.48Å; V159-E163 PolarHBondContact O-N 3.46Å |
| 160 | C | 91.7 | Very high | 94.4 | Very high | 70 Ų | 70 | 98.9 Ų | 98.9 | 47% | 0.473 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -61.3 | -45.7 | 174.8 | -71 | 0 | 0 | 0 | 0 | 112.3 | E156 G157 R158 D162 E163 E164 | E156-C160 PolarHBondContact O-N 3.36Å; E156-C160 VanDerWaalsContact O-N 3.08Å; E156-C160 PolarHBondContact O-SG 3.4Å; E156-C160 VanDerWaalsContact O-SG 3.42Å; G157-C160 PolarHBondContact O-N 2.83Å; R158-C160 VanDerWaalsContact C-N 3.31Å; R158-C160 PolarHBondContact O-N 2.9Å; C160-D162 VanDerWaalsContact C-N 3.33Å; C160-D162 PolarHBondContact O-N 3.25Å; C160-E163 PolarHBondContact O-N 3.5Å; C160-E164 WeakPolarHBondContact O-CG 3.38Å; C160-E164 PolarHBondContact O-N 2.85Å |
| 161 | E | 94.5 | Very high | 94.4 | Very high | 132 Ų | 132 | 99.4 Ų | 99.4 | 62% | 0.617 | 50% | 0.5 | S | S | * | . | H | α-helix | trans | -59.5 | -43.2 | 176.9 | -70.6 | 175.4 | 179.7 | 0 | 0 | 112 | G157 R158 E164 R165 | G157-E161 WeakPolarHBondContact O-CG 3.45Å; G157-E161 PolarHBondContact O-N 3.16Å; G157-E161 VanDerWaalsContact O-N 3.1Å; R158-E161 PolarHBondContact O-N 3.43Å; E161-E164 PolarHBondContact O-N 3.38Å; E161-R165 WeakPolarHBondContact O-CB 3.48Å; E161-R165 PolarHBondContact O-N 3.38Å |
| 162 | D | 93.7 | Very high | 94.6 | Very high | 103 Ų | 103 | 102.5 Ų | 102.5 | 55% | 0.551 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -65.8 | -43.5 | 177.4 | -75.3 | -20.6 | 0 | 0 | 0 | 111.5 | R158 V159 C160 E164 R165 I166 | R158-D162 PolarHBondContact O-N 3.39Å; V159-D162 PolarHBondContact O-N 2.91Å; C160-D162 VanDerWaalsContact C-N 3.33Å; C160-D162 PolarHBondContact O-N 3.25Å; D162-E164 PolarHBondContact O-N 3.19Å; D162-R165 PolarHBondContact O-N 3.01Å; D162-I166 VanDerWaalsContact O-CG1 3.27Å; D162-I166 WeakPolarHBondContact O-CG1 3.43Å; D162-I166 PolarHBondContact O-N 3.45Å |
| 163 | E | 94.8 | Very high | 94.7 | Very high | 101 Ų | 101 | 102.5 Ų | 102.5 | 47% | 0.472 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -60.9 | -42.5 | 175.2 | -80.1 | -167.3 | -177.2 | 0 | 0 | 112.4 | V159 C160 R165 I166 K167 | V159-E163 WeakPolarHBondContact O-CG 3.48Å; V159-E163 PolarHBondContact O-N 3.46Å; C160-E163 PolarHBondContact O-N 3.5Å; E163-R165 VanDerWaalsContact C-N 3.34Å; E163-I166 PolarHBondContact O-N 3.09Å; E163-K167 WeakPolarHBondContact O-CG 3.49Å; E163-K167 PolarHBondContact O-N 3.38Å; E163-K167 IonicContact OE2-NZ 3.77Å |
| 164 | E | 94.7 | Very high | 94.9 | Very high | 121 Ų | 121 | 100 Ų | 100 | 57% | 0.565 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -62.5 | -43.2 | 175.1 | -74.7 | -176.8 | 179.8 | 0 | 0 | 111.3 | C160 E161 D162 I166 K167 Q168 | C160-E164 WeakPolarHBondContact O-CG 3.38Å; C160-E164 PolarHBondContact O-N 2.85Å; E161-E164 PolarHBondContact O-N 3.38Å; D162-E164 PolarHBondContact O-N 3.19Å; E164-I166 VanDerWaalsContact C-N 3.35Å; E164-I166 PolarHBondContact O-N 3.4Å; E164-K167 PolarHBondContact O-N 3.44Å; E164-Q168 WeakPolarHBondContact O-CG 3.45Å; E164-Q168 PolarHBondContact O-N 2.93Å |
| 165 | R | 96.4 | Very high | 94.9 | Very high | 129 Ų | 129 | 98.4 Ų | 98.4 | 49% | 0.487 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -62.8 | -41.9 | 177.5 | -169.9 | 72.1 | -175.2 | 109.4 | 4.7 | 111.7 | E161 D162 E163 Q168 L169 | E161-R165 WeakPolarHBondContact O-CB 3.48Å; E161-R165 PolarHBondContact O-N 3.38Å; D162-R165 PolarHBondContact O-N 3.01Å; E163-R165 VanDerWaalsContact C-N 3.34Å; R165-Q168 PolarHBondContact O-N 2.83Å; R165-L169 HydrophobicContact CG-CD1 4.34Å; R165-L169 WeakPolarHBondContact O-CG 3.43Å; R165-L169 PolarHBondContact O-N 3.45Å |
| 166 | I | 96.5 | Very high | 95 | Very high | 92 Ų | 92 | 98.7 Ų | 98.7 | 47% | 0.472 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -61 | -51.2 | 175.9 | -70.9 | 166.4 | 0 | 0 | 0 | 110 | D162 E163 E164 Q168 L169 E170 | D162-I166 VanDerWaalsContact O-CG1 3.27Å; D162-I166 WeakPolarHBondContact O-CG1 3.43Å; D162-I166 PolarHBondContact O-N 3.45Å; E163-I166 PolarHBondContact O-N 3.09Å; E164-I166 VanDerWaalsContact C-N 3.35Å; E164-I166 PolarHBondContact O-N 3.4Å; I166-Q168 VanDerWaalsContact C-N 3.29Å; I166-Q168 PolarHBondContact O-N 3.41Å; I166-L169 PolarHBondContact O-N 2.88Å; I166-L169 VanDerWaalsContact O-N 3.1Å; I166-E170 HydrophobicContact CG2-CG 4.26Å; I166-E170 WeakPolarHBondContact O-CG 3.48Å; I166-E170 PolarHBondContact O-N 2.87Å |
| 167 | K | 96.5 | Very high | 95.1 | Very high | 114 Ų | 114 | 101.2 Ų | 101.2 | 50% | 0.496 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -58.5 | -40.6 | 179.1 | -72.4 | 170.4 | -172.3 | 158.1 | 0 | 112.2 | E163 E164 E170 L171 | E163-K167 WeakPolarHBondContact O-CG 3.49Å; E163-K167 PolarHBondContact O-N 3.38Å; E163-K167 IonicContact OE2-NZ 3.77Å; E164-K167 PolarHBondContact O-N 3.44Å; K167-E170 PolarHBondContact O-N 3.41Å; K167-L171 WeakPolarHBondContact O-CG 3.44Å; K167-L171 PolarHBondContact O-N 3.15Å |
| 168 | Q | 96.8 | Very high | 95.3 | Very high | 105 Ų | 105 | 105.3 Ų | 105.3 | 49% | 0.491 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -60.8 | -47.3 | 174.8 | -74 | 172.9 | 9.5 | 0 | 0 | 111.9 | E164 R165 I166 E170 L171 E172 | E164-Q168 WeakPolarHBondContact O-CG 3.45Å; E164-Q168 PolarHBondContact O-N 2.93Å; R165-Q168 PolarHBondContact O-N 2.83Å; I166-Q168 VanDerWaalsContact C-N 3.29Å; I166-Q168 PolarHBondContact O-N 3.41Å; Q168-E170 VanDerWaalsContact C-N 3.34Å; Q168-E170 PolarHBondContact O-N 2.95Å; Q168-L171 PolarHBondContact O-N 2.86Å; Q168-E172 WeakPolarHBondContact O-CB 3.36Å; Q168-E172 PolarHBondContact O-N 3.04Å |
| 169 | L | 97.1 | Very high | 95.3 | Very high | 77 Ų | 77 | 103.6 Ų | 103.6 | 40% | 0.403 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -65.6 | -36.6 | 178.9 | -71.5 | 170.7 | 0 | 0 | 0 | 112.2 | R165 I166 E172 N173 | R165-L169 HydrophobicContact CG-CD1 4.34Å; R165-L169 WeakPolarHBondContact O-CG 3.43Å; R165-L169 PolarHBondContact O-N 3.45Å; I166-L169 PolarHBondContact O-N 2.88Å; I166-L169 VanDerWaalsContact O-N 3.1Å; L169-E172 PolarHBondContact O-N 2.87Å; L169-N173 WeakPolarHBondContact O-CB 3.47Å; L169-N173 PolarHBondContact O-N 3.34Å |
| 170 | E | 96.8 | Very high | 95.2 | Very high | 125 Ų | 125 | 104.8 Ų | 104.8 | 58% | 0.584 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -64 | -44.8 | 175.2 | -74.1 | 179.7 | 157.8 | 0 | 0 | 111.8 | I166 K167 Q168 N173 S174 | I166-E170 HydrophobicContact CG2-CG 4.26Å; I166-E170 WeakPolarHBondContact O-CG 3.48Å; I166-E170 PolarHBondContact O-N 2.87Å; K167-E170 PolarHBondContact O-N 3.41Å; Q168-E170 VanDerWaalsContact C-N 3.34Å; Q168-E170 PolarHBondContact O-N 2.95Å; E170-N173 PolarHBondContact O-N 3.24Å; E170-S174 WeakPolarHBondContact O-CB 3.48Å; E170-S174 PolarHBondContact O-N 2.92Å |
| 171 | L | 96.3 | Very high | 95.2 | Very high | 131 Ų | 131 | 102.8 Ų | 102.8 | 69% | 0.686 | 51% | 0.51 | S | S | * | . | H | α-helix | trans | -61.9 | -45.2 | 174.8 | -73.4 | 172.2 | 0 | 0 | 0 | 111.5 | K167 Q168 N173 S174 G175 | K167-L171 WeakPolarHBondContact O-CG 3.44Å; K167-L171 PolarHBondContact O-N 3.15Å; Q168-L171 PolarHBondContact O-N 2.86Å; L171-N173 PolarHBondContact O-N 3.01Å; L171-S174 PolarHBondContact O-N 3.25Å; L171-G175 PolarHBondContact O-N 2.93Å |
| 172 | E | 97.1 | Very high | 95 | Very high | 113 Ų | 113 | 101.4 Ų | 101.4 | 53% | 0.528 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -60.9 | -44.7 | 176.2 | -172.1 | -180 | 176.8 | 0 | 0 | 111.1 | Q168 L169 S174 G175 L176 | Q168-E172 WeakPolarHBondContact O-CB 3.36Å; Q168-E172 PolarHBondContact O-N 3.04Å; L169-E172 PolarHBondContact O-N 2.87Å; E172-S174 PolarHBondContact O-N 3.33Å; E172-G175 PolarHBondContact O-N 3.5Å; E172-L176 HydrophobicContact CG-CD1 4.15Å; E172-L176 HydrophobicContact CG-CG 4.48Å; E172-L176 WeakPolarHBondContact O-CB 3.48Å; E172-L176 VanDerWaalsContact O-CG 3.26Å; E172-L176 WeakPolarHBondContact O-CG 3.47Å; E172-L176 PolarHBondContact O-N 3.41Å |
| 173 | N | 95.9 | Very high | 94.7 | Very high | 80 Ų | 80 | 100.1 Ų | 100.1 | 43% | 0.428 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -64.1 | -40.4 | 178.1 | -148.3 | -79 | 0 | 0 | 0 | 111.9 | L169 E170 L171 L176 R177 | L169-N173 WeakPolarHBondContact O-CB 3.47Å; L169-N173 PolarHBondContact O-N 3.34Å; E170-N173 PolarHBondContact O-N 3.24Å; L171-N173 PolarHBondContact O-N 3.01Å; N173-L176 PolarHBondContact O-N 2.92Å; N173-R177 WeakPolarHBondContact O-CB 3.41Å; N173-R177 VanDerWaalsContact O-CG 3.23Å; N173-R177 WeakPolarHBondContact O-CG 3.35Å; N173-R177 PolarHBondContact O-N 3.46Å; N173-R177 PolarHBondContact OD1-NE 2.93Å |
| 174 | S | 96.6 | Very high | 94.3 | Very high | 57 Ų | 57 | 103.7 Ų | 103.7 | 40% | 0.399 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -60.5 | -49.8 | 174.3 | -166.4 | 0 | 0 | 0 | 0 | 110.8 | E170 L171 E172 L176 R177 E178 | E170-S174 WeakPolarHBondContact O-CB 3.48Å; E170-S174 PolarHBondContact O-N 2.92Å; L171-S174 PolarHBondContact O-N 3.25Å; E172-S174 PolarHBondContact O-N 3.33Å; S174-L176 PolarHBondContact O-N 3.4Å; S174-R177 WeakPolarHBondContact O-CB 3.3Å; S174-R177 PolarHBondContact O-N 3.34Å; S174-R177 VanDerWaalsContact O-N 3.13Å; S174-E178 WeakPolarHBondContact O-CG 3.42Å; S174-E178 PolarHBondContact O-N 3.12Å; S174-E178 PolarHBondContact OG-OE1 2.85Å |
| 175 | G | 95.2 | Very high | 93.9 | Very high | 33 Ų | 33 | 104.2 Ų | 104.2 | 34% | 0.34 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -61.1 | -41.7 | 178.3 | 0 | 0 | 0 | 0 | 0 | 112.9 | L171 E172 R177 E178 L179 | L171-G175 PolarHBondContact O-N 2.93Å; E172-G175 PolarHBondContact O-N 3.5Å; G175-R177 VanDerWaalsContact C-N 3.33Å; G175-R177 PolarHBondContact O-N 2.97Å; G175-E178 PolarHBondContact O-N 2.92Å; G175-L179 WeakPolarHBondContact O-CB 3.28Å; G175-L179 PolarHBondContact O-N 2.98Å |
| 176 | L | 96.2 | Very high | 93.1 | Very high | 101 Ų | 101 | 100.3 Ų | 100.3 | 53% | 0.529 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -63.3 | -38.2 | 175 | -71.8 | 172.9 | 0 | 0 | 0 | 112.1 | E172 N173 S174 L180 | E172-L176 HydrophobicContact CG-CD1 4.15Å; E172-L176 HydrophobicContact CG-CG 4.48Å; E172-L176 WeakPolarHBondContact O-CB 3.48Å; E172-L176 VanDerWaalsContact O-CG 3.26Å; E172-L176 WeakPolarHBondContact O-CG 3.47Å; E172-L176 PolarHBondContact O-N 3.41Å; N173-L176 PolarHBondContact O-N 2.92Å; S174-L176 PolarHBondContact O-N 3.4Å; L176-L180 VanDerWaalsContact O-CB 3.31Å; L176-L180 WeakPolarHBondContact O-CB 3.37Å; L176-L180 PolarHBondContact O-N 3.28Å |
| 177 | R | 94.3 | Very high | 92.3 | Very high | 176 Ų | 176 | 102.4 Ų | 102.4 | 66% | 0.664 | 52% | 0.518 | S | S | * | . | H | α-helix | trans | -68.7 | -40.9 | 175.5 | -74.5 | 171.7 | -177.9 | -119.4 | 1.9 | 112.2 | N173 S174 G175 L180 G181 | N173-R177 WeakPolarHBondContact O-CB 3.41Å; N173-R177 VanDerWaalsContact O-CG 3.23Å; N173-R177 WeakPolarHBondContact O-CG 3.35Å; N173-R177 PolarHBondContact O-N 3.46Å; N173-R177 PolarHBondContact OD1-NE 2.93Å; S174-R177 WeakPolarHBondContact O-CB 3.3Å; S174-R177 PolarHBondContact O-N 3.34Å; S174-R177 VanDerWaalsContact O-N 3.13Å; G175-R177 VanDerWaalsContact C-N 3.33Å; G175-R177 PolarHBondContact O-N 2.97Å; R177-L180 PolarHBondContact O-N 2.94Å; R177-G181 PolarHBondContact O-N 3.47Å |
| 178 | E | 94.8 | Very high | 91.4 | Very high | 121 Ų | 121 | 102.3 Ų | 102.3 | 57% | 0.565 | 52% | 0.522 | S | S | * | . | H | α-helix | trans | -61.9 | -47.2 | 173.9 | -74.5 | 170.5 | -152.8 | 0 | 0 | 110.7 | S174 G175 L180 G181 I182 | S174-E178 WeakPolarHBondContact O-CG 3.42Å; S174-E178 PolarHBondContact O-N 3.12Å; S174-E178 PolarHBondContact OG-OE1 2.85Å; G175-E178 PolarHBondContact O-N 2.92Å; E178-L180 VanDerWaalsContact C-N 3.31Å; E178-L180 PolarHBondContact O-N 3.42Å; E178-G181 CarbonylContact O-C 3.58Å; E178-G181 WeakPolarHBondContact O-CA 3.27Å; E178-G181 PolarHBondContact O-N 3.25Å; E178-I182 WeakPolarHBondContact O-CG1 3.34Å; E178-I182 PolarHBondContact O-N 3.37Å |
| 179 | L | 93.1 | Very high | 90.5 | Very high | 116 Ų | 116 | 101.1 Ų | 101.1 | 61% | 0.607 | 52% | 0.522 | S | S | * | . | H | α-helix | trans | -61.8 | -39.8 | 177.6 | -163.5 | 70.3 | 0 | 0 | 0 | 111.7 | G175 G181 S183 | G175-L179 WeakPolarHBondContact O-CB 3.28Å; G175-L179 PolarHBondContact O-N 2.98Å; L179-G181 VanDerWaalsContact C-N 3.35Å; L179-S183 VanDerWaalsContact O-CB 3.3Å; L179-S183 WeakPolarHBondContact O-CB 3.48Å; L179-S183 PolarHBondContact O-N 3.41Å |
| 180 | L | 90.8 | Very high | 89.3 | Confident | 104 Ų | 104 | 102.4 Ų | 102.4 | 55% | 0.545 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -64.3 | -39.5 | 172.5 | -177.1 | 67.3 | 0 | 0 | 0 | 111.9 | L176 R177 E178 S183 R184 | L176-L180 VanDerWaalsContact O-CB 3.31Å; L176-L180 WeakPolarHBondContact O-CB 3.37Å; L176-L180 PolarHBondContact O-N 3.28Å; R177-L180 PolarHBondContact O-N 2.94Å; E178-L180 VanDerWaalsContact C-N 3.31Å; E178-L180 PolarHBondContact O-N 3.42Å; L180-S183 PolarHBondContact O-N 2.78Å; L180-R184 WeakPolarHBondContact O-CB 3.39Å; L180-R184 WeakPolarHBondContact O-CG 3.33Å; L180-R184 PolarHBondContact O-N 3.46Å |
| 181 | G | 91.3 | Very high | 88 | Confident | 27 Ų | 27 | 102.7 Ų | 102.7 | 28% | 0.278 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -61 | -51.6 | 174.8 | 0 | 0 | 0 | 0 | 0 | 111.7 | R177 E178 L179 S183 R184 E185 | R177-G181 PolarHBondContact O-N 3.47Å; E178-G181 CarbonylContact O-C 3.58Å; E178-G181 WeakPolarHBondContact O-CA 3.27Å; E178-G181 PolarHBondContact O-N 3.25Å; L179-G181 VanDerWaalsContact C-N 3.35Å; G181-S183 VanDerWaalsContact C-N 3.32Å; G181-S183 PolarHBondContact O-N 2.85Å; G181-R184 WeakPolarHBondContact O-CB 3.49Å; G181-R184 PolarHBondContact O-N 3.42Å; G181-R184 VanDerWaalsContact O-N 3.15Å; G181-E185 WeakPolarHBondContact O-CG 3.26Å; G181-E185 PolarHBondContact O-N 2.97Å |
| 182 | I | 91.1 | Very high | 86.5 | Confident | 103 Ų | 103 | 106 Ų | 106 | 53% | 0.528 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -59.4 | -43.7 | 175.9 | -64.5 | 165.2 | 0 | 0 | 0 | 110.5 | E178 R184 E185 A186 | E178-I182 WeakPolarHBondContact O-CG1 3.34Å; E178-I182 PolarHBondContact O-N 3.37Å; I182-R184 VanDerWaalsContact C-N 3.33Å; I182-R184 PolarHBondContact O-N 2.91Å; I182-E185 PolarHBondContact O-N 3.36Å; I182-A186 VanDerWaalsContact O-CB 3.26Å; I182-A186 WeakPolarHBondContact O-CB 3.4Å; I182-A186 PolarHBondContact O-N 3.18Å |
| 183 | S | 87.6 | Confident | 84.6 | Confident | 76 Ų | 76 | 105.9 Ų | 105.9 | 53% | 0.531 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -62.1 | -40.2 | 177.2 | 179.5 | 0 | 0 | 0 | 0 | 112.1 | L179 L180 G181 F187 | L179-S183 VanDerWaalsContact O-CB 3.3Å; L179-S183 WeakPolarHBondContact O-CB 3.48Å; L179-S183 PolarHBondContact O-N 3.41Å; L180-S183 PolarHBondContact O-N 2.78Å; G181-S183 VanDerWaalsContact C-N 3.32Å; G181-S183 PolarHBondContact O-N 2.85Å; S183-F187 VanDerWaalsContact O-CB 3.27Å; S183-F187 WeakPolarHBondContact O-CB 3.42Å; S183-F187 PolarHBondContact O-N 2.89Å |
| 184 | R | 86.5 | Confident | 82.7 | Confident | 177 Ų | 177 | 108.1 Ų | 108.1 | 67% | 0.668 | 54% | 0.538 | S | S | * | . | H | α-helix | trans | -64.9 | -44.3 | 173.1 | -81.7 | -179.7 | 165.9 | -147 | -1.5 | 112.2 | L180 G181 I182 F187 L188 | L180-R184 WeakPolarHBondContact O-CB 3.39Å; L180-R184 WeakPolarHBondContact O-CG 3.33Å; L180-R184 PolarHBondContact O-N 3.46Å; G181-R184 WeakPolarHBondContact O-CB 3.49Å; G181-R184 PolarHBondContact O-N 3.42Å; G181-R184 VanDerWaalsContact O-N 3.15Å; I182-R184 VanDerWaalsContact C-N 3.33Å; I182-R184 PolarHBondContact O-N 2.91Å; R184-F187 PolarHBondContact O-N 3.16Å; R184-L188 WeakPolarHBondContact O-CB 3.35Å; R184-L188 VanDerWaalsContact O-CG 3.28Å; R184-L188 WeakPolarHBondContact O-CG 3.39Å; R184-L188 PolarHBondContact O-N 3.45Å |
| 185 | E | 84.7 | Confident | 80.7 | Confident | 132 Ų | 132 | 107.8 Ų | 107.8 | 62% | 0.617 | 54% | 0.539 | S | S | * | . | H | α-helix | trans | -64.6 | -46 | 177.9 | -74.6 | 177.9 | -176.3 | 0 | 0 | 111.4 | G181 I182 F187 L188 V189 | G181-E185 WeakPolarHBondContact O-CG 3.26Å; G181-E185 PolarHBondContact O-N 2.97Å; I182-E185 PolarHBondContact O-N 3.36Å; E185-F187 VanDerWaalsContact C-N 3.33Å; E185-F187 PolarHBondContact O-N 2.93Å; E185-L188 WeakPolarHBondContact O-CB 3.44Å; E185-L188 PolarHBondContact O-N 2.95Å; E185-L188 VanDerWaalsContact O-N 3.12Å; E185-V189 WeakPolarHBondContact O-CG2 3.29Å; E185-V189 PolarHBondContact O-N 3.03Å |
| 186 | A | 80.6 | Confident | 78.5 | Confident | 47 Ų | 47 | 109.8 Ų | 109.8 | 39% | 0.388 | 55% | 0.548 | S | S | . | . | H | α-helix | trans | -59.4 | -43.1 | 174.7 | 0 | 0 | 0 | 0 | 0 | 111.6 | I182 L188 V189 L190 | I182-A186 VanDerWaalsContact O-CB 3.26Å; I182-A186 WeakPolarHBondContact O-CB 3.4Å; I182-A186 PolarHBondContact O-N 3.18Å; A186-L188 VanDerWaalsContact C-N 3.34Å; A186-L188 PolarHBondContact O-N 3.3Å; A186-V189 PolarHBondContact O-N 3.45Å; A186-L190 WeakPolarHBondContact O-CG 3.28Å; A186-L190 PolarHBondContact O-N 3.4Å |
| 187 | F | 80.1 | Confident | 76.1 | Confident | 135 Ų | 135 | 111.2 Ų | 111.2 | 59% | 0.592 | 55% | 0.552 | S | S | * | * | H | α-helix | trans | -63.2 | -39 | 174.5 | -174.8 | -95.4 | 0 | 0 | 0 | 112.4 | S183 R184 E185 K191 | S183-F187 VanDerWaalsContact O-CB 3.27Å; S183-F187 WeakPolarHBondContact O-CB 3.42Å; S183-F187 PolarHBondContact O-N 2.89Å; R184-F187 PolarHBondContact O-N 3.16Å; E185-F187 VanDerWaalsContact C-N 3.33Å; E185-F187 PolarHBondContact O-N 2.93Å; F187-K191 HydrophobicContact CE1-CD 4.47Å; F187-K191 WeakPolarHBondContact O-CB 3.5Å; F187-K191 PolarHBondContact O-N 3.41Å |
| 188 | L | 76.9 | Confident | 73.6 | Confident | 112 Ų | 112 | 108.1 Ų | 108.1 | 59% | 0.586 | 55% | 0.549 | S | S | * | . | H | α-helix | trans | -68.5 | -37 | 175.8 | -74.3 | 171.3 | 0 | 0 | 0 | 112.6 | R184 E185 A186 K191 R192 | R184-L188 WeakPolarHBondContact O-CB 3.35Å; R184-L188 VanDerWaalsContact O-CG 3.28Å; R184-L188 WeakPolarHBondContact O-CG 3.39Å; R184-L188 PolarHBondContact O-N 3.45Å; E185-L188 WeakPolarHBondContact O-CB 3.44Å; E185-L188 PolarHBondContact O-N 2.95Å; E185-L188 VanDerWaalsContact O-N 3.12Å; A186-L188 VanDerWaalsContact C-N 3.34Å; A186-L188 PolarHBondContact O-N 3.3Å; L188-K191 PolarHBondContact O-N 3.3Å; L188-R192 WeakPolarHBondContact O-CB 3.32Å; L188-R192 PolarHBondContact O-N 3.06Å |
| 189 | V | 77.3 | Confident | 71.1 | Confident | 80 Ų | 80 | 108.1 Ų | 108.1 | 49% | 0.485 | 56% | 0.557 | S | S | . | * | H | α-helix | trans | -64.9 | -49 | 175.1 | 171 | 0 | 0 | 0 | 0 | 110.2 | E185 A186 K191 R192 E193 | E185-V189 WeakPolarHBondContact O-CG2 3.29Å; E185-V189 PolarHBondContact O-N 3.03Å; A186-V189 PolarHBondContact O-N 3.45Å; V189-K191 VanDerWaalsContact C-N 3.32Å; V189-K191 PolarHBondContact O-N 2.83Å; V189-R192 CarbonylContact O-C 3.57Å; V189-R192 WeakPolarHBondContact O-CA 3.4Å; V189-R192 WeakPolarHBondContact O-CB 3.26Å; V189-R192 PolarHBondContact O-N 3.39Å; V189-E193 PolarHBondContact O-N 3.32Å |
| 190 | L | 73.3 | Confident | 68.8 | Low | 105 Ų | 105 | 106.8 Ų | 106.8 | 55% | 0.55 | 56% | 0.558 | S | S | . | * | H | α-helix | trans | -59.2 | -41.9 | 175.7 | -72.6 | 170.2 | 0 | 0 | 0 | 112 | A186 R192 E193 E194 | A186-L190 WeakPolarHBondContact O-CG 3.28Å; A186-L190 PolarHBondContact O-N 3.4Å; L190-R192 VanDerWaalsContact C-N 3.29Å; L190-R192 PolarHBondContact O-N 3.39Å; L190-E193 PolarHBondContact O-N 3.37Å; L190-E194 WeakPolarHBondContact O-CB 3.5Å; L190-E194 PolarHBondContact O-N 3.49Å |
| 191 | K | 69.4 | Low | 66.6 | Low | 131 Ų | 131 | 108.4 Ų | 108.4 | 57% | 0.57 | 57% | 0.566 | S | S | * | * | H | α-helix | trans | -66 | -30.9 | 176.1 | -164.1 | 176.8 | -176.3 | 179.9 | 0 | 112.7 | F187 L188 V189 A195 | F187-K191 HydrophobicContact CE1-CD 4.47Å; F187-K191 WeakPolarHBondContact O-CB 3.5Å; F187-K191 PolarHBondContact O-N 3.41Å; L188-K191 PolarHBondContact O-N 3.3Å; V189-K191 VanDerWaalsContact C-N 3.32Å; V189-K191 PolarHBondContact O-N 2.83Å; K191-A195 VanDerWaalsContact O-CB 3.3Å; K191-A195 WeakPolarHBondContact O-CB 3.3Å; K191-A195 PolarHBondContact O-N 2.82Å |
| 192 | R | 64.9 | Low | 64.1 | Low | 200 Ų | 200 | 111.8 Ų | 111.8 | 76% | 0.755 | 59% | 0.586 | S | S | * | * | H | α-helix | trans | -77 | -36.4 | 175.1 | -179.6 | 179.4 | -85.6 | -179.6 | -5.2 | 111.6 | L188 V189 L190 A195 S196 | L188-R192 WeakPolarHBondContact O-CB 3.32Å; L188-R192 PolarHBondContact O-N 3.06Å; V189-R192 CarbonylContact O-C 3.57Å; V189-R192 WeakPolarHBondContact O-CA 3.4Å; V189-R192 WeakPolarHBondContact O-CB 3.26Å; V189-R192 PolarHBondContact O-N 3.39Å; L190-R192 VanDerWaalsContact C-N 3.29Å; L190-R192 PolarHBondContact O-N 3.39Å; R192-A195 PolarHBondContact O-N 3.43Å; R192-S196 VanDerWaalsContact O-CB 3.26Å; R192-S196 WeakPolarHBondContact O-CB 3.5Å; R192-S196 PolarHBondContact O-N 2.95Å |
| 193 | E | 57.3 | Low | 62 | Low | 111 Ų | 111 | 112.8 Ų | 112.8 | 52% | 0.519 | 60% | 0.599 | S | S | . | * | H | α-helix | trans | -67.2 | -44.3 | 172.8 | -75.6 | 179.9 | 164.5 | 0 | 0 | 111 | V189 L190 A195 S196 E197 | V189-E193 PolarHBondContact O-N 3.32Å; L190-E193 PolarHBondContact O-N 3.37Å; E193-A195 VanDerWaalsContact C-N 3.33Å; E193-A195 PolarHBondContact O-N 3.41Å; E193-S196 CarbonylContact O-C 3.55Å; E193-S196 PolarHBondContact O-N 3.03Å; E193-E197 WeakPolarHBondContact O-CB 3.48Å; E193-E197 PolarHBondContact O-N 2.85Å |
| 194 | E | 54.9 | Low | 60 | Low | 126 Ų | 126 | 116.7 Ų | 116.7 | 59% | 0.589 | 61% | 0.613 | S | S | * | * | H | α-helix | trans | -60 | -41.4 | 170.3 | -77.1 | -169.2 | 168.3 | 0 | 0 | 111.6 | L190 S196 N198 | L190-E194 WeakPolarHBondContact O-CB 3.5Å; L190-E194 PolarHBondContact O-N 3.49Å; E194-S196 VanDerWaalsContact C-N 3.3Å; E194-S196 PolarHBondContact O-N 2.84Å; E194-N198 WeakPolarHBondContact O-CB 3.33Å; E194-N198 PolarHBondContact O-N 3.04Å; E194-N198 PolarHBondContact O-ND2 3.18Å; E194-N198 PolarHBondContact O-OD1 3.1Å |
| 195 | A | 54.4 | Low | 57.7 | Low | 51 Ų | 51 | 115.9 Ų | 115.9 | 42% | 0.421 | 62% | 0.621 | S | S | . | * | H | α-helix | trans | -66.3 | -31 | 174.2 | 0 | 0 | 0 | 0 | 0 | 112.8 | K191 R192 E193 T199 | K191-A195 VanDerWaalsContact O-CB 3.3Å; K191-A195 WeakPolarHBondContact O-CB 3.3Å; K191-A195 PolarHBondContact O-N 2.82Å; R192-A195 PolarHBondContact O-N 3.43Å; E193-A195 VanDerWaalsContact C-N 3.33Å; E193-A195 PolarHBondContact O-N 3.41Å; A195-T199 WeakPolarHBondContact O-CB 3.39Å; A195-T199 PolarHBondContact O-N 2.61Å; A195-T199 PolarHBondContact O-OG1 3.34Å |
| 196 | S | 50.1 | Low | 55.9 | Low | 75 Ų | 75 | 116 Ų | 116 | 52% | 0.524 | 63% | 0.631 | S | S | . | * | H | α-helix | trans | -80 | -36.4 | 179 | -168.1 | 0 | 0 | 0 | 0 | 112.5 | R192 E193 E194 T199 S200 | R192-S196 VanDerWaalsContact O-CB 3.26Å; R192-S196 WeakPolarHBondContact O-CB 3.5Å; R192-S196 PolarHBondContact O-N 2.95Å; E193-S196 CarbonylContact O-C 3.55Å; E193-S196 PolarHBondContact O-N 3.03Å; E194-S196 VanDerWaalsContact C-N 3.3Å; E194-S196 PolarHBondContact O-N 2.84Å; S196-T199 PolarHBondContact O-N 2.95Å; S196-S200 PolarHBondContact O-N 2.76Å; S196-S200 VanDerWaalsContact O-N 3.1Å; S196-S200 PolarHBondContact O-OG 3.43Å |
| 197 | E | 44.9 | Very low | 54.1 | Low | 130 Ų | 130 | 119.4 Ų | 119.4 | 61% | 0.607 | 65% | 0.652 | S | S | * | * | H | α-helix | trans | -68.6 | -38.8 | 169.6 | -73.3 | -168.6 | 161.7 | 0 | 0 | 110.7 | E193 T199 S200 L201 | E193-E197 WeakPolarHBondContact O-CB 3.48Å; E193-E197 PolarHBondContact O-N 2.85Å; E197-T199 VanDerWaalsContact C-N 3.29Å; E197-T199 PolarHBondContact O-N 3.41Å; E197-S200 WeakPolarHBondContact CA-OG 3.11Å; E197-S200 PolarHBondContact O-N 2.77Å; E197-S200 PolarHBondContact O-OG 3.05Å; E197-L201 PolarHBondContact O-N 2.98Å |
| 198 | N | 41.5 | Very low | 52.5 | Low | 112 Ų | 112 | 117.2 Ų | 117.2 | 60% | 0.599 | 66% | 0.659 | S | S | * | * | H | α-helix | trans | -70.2 | -23.6 | 172.3 | -65.1 | -18.2 | 0 | 0 | 0 | 112.8 | E194 | E194-N198 WeakPolarHBondContact O-CB 3.33Å; E194-N198 PolarHBondContact O-N 3.04Å; E194-N198 PolarHBondContact O-ND2 3.18Å; E194-N198 PolarHBondContact O-OD1 3.1Å |
| 199 | T | 42.1 | Very low | 50.6 | Low | 120 Ų | 120 | 119.6 Ų | 119.6 | 74% | 0.736 | 67% | 0.672 | S | S | * | * | H | α-helix | trans | -80.3 | -22.1 | 172.7 | -58.3 | 0 | 0 | 0 | 0 | 112.1 | A195 S196 E197 | A195-T199 WeakPolarHBondContact O-CB 3.39Å; A195-T199 PolarHBondContact O-N 2.61Å; A195-T199 PolarHBondContact O-OG1 3.34Å; S196-T199 PolarHBondContact O-N 2.95Å; E197-T199 VanDerWaalsContact C-N 3.29Å; E197-T199 PolarHBondContact O-N 3.41Å |
| 200 | S | 45.4 | Very low | 49 | Very low | 89 Ų | 89 | 122.4 Ų | 122.4 | 62% | 0.622 | 69% | 0.689 | S | S | * | * | H | α-helix | trans | -95.7 | -10.2 | 176.6 | 39.4 | 0 | 0 | 0 | 0 | 113.6 | S196 E197 | S196-S200 PolarHBondContact O-N 2.76Å; S196-S200 VanDerWaalsContact O-N 3.1Å; S196-S200 PolarHBondContact O-OG 3.43Å; E197-S200 WeakPolarHBondContact CA-OG 3.11Å; E197-S200 PolarHBondContact O-N 2.77Å; E197-S200 PolarHBondContact O-OG 3.05Å |
| 201 | L | 44.6 | Very low | 47.2 | Very low | 138 Ų | 138 | 122.6 Ų | 122.6 | 72% | 0.723 | 70% | 0.699 | S | S | * | * | S | Bend | trans | -120 | 81.2 | 169.5 | -64.6 | 176.3 | 0 | 0 | 0 | 112.1 | E197 | E197-L201 PolarHBondContact O-N 2.98Š|
| 202 | S | 37.6 | Very low | 46 | Very low | 98 Ų | 98 | 124.5 Ų | 124.5 | 69% | 0.685 | 71% | 0.714 | S | S | * | * | trans | 88.6 | 134.9 | 154.2 | -43.7 | 0 | 0 | 0 | 0 | 118.6 | L204 | S202-L204 PolarHBondContact O-N 3.2Š| ||
| 203 | P | 47.8 | Very low | 44.8 | Very low | 124 Ų | 124 | 126.3 Ų | 126.3 | 81% | 0.805 | 72% | 0.721 | S | S | * | * | trans | -85.3 | 103.3 | 171 | 33.7 | -26.1 | 0 | 0 | 0 | 108.8 | ||||
| 204 | L | 45.9 | Very low | 44.1 | Very low | 158 Ų | 158 | 131.1 Ų | 131.1 | 83% | 0.827 | 74% | 0.74 | S | S | * | * | trans | -165.1 | 143.9 | 157.6 | -133.3 | 79.9 | 0 | 0 | 0 | 109.5 | S202 | S202-L204 PolarHBondContact O-N 3.2Š| ||
| 205 | L | 37.3 | Very low | 43.3 | Very low | 159 Ų | 159 | 134.3 Ų | 134.3 | 83% | 0.832 | 78% | 0.777 | S | S | * | * | trans | 89 | 68.5 | 175.7 | -46 | -180 | 0 | 0 | 0 | 114.8 | ||||
| 206 | T | 47.4 | Very low | 42.7 | Very low | 135 Ų | 135 | 138.5 Ų | 138.5 | 83% | 0.828 | 79% | 0.794 | S | S | * | * | trans | -59.7 | 138.6 | 151.3 | 36.9 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 207 | S | 43.2 | Very low | 42.3 | Very low | 118 Ų | 118 | 141.8 Ų | 141.8 | 83% | 0.825 | 81% | 0.809 | S | S | * | * | trans | 69.5 | 82.4 | 151.1 | 67.5 | 0 | 0 | 0 | 0 | 118.6 | ||||
| 208 | A | 45.8 | Very low | 42.2 | Very low | 90 Ų | 90 | 142.4 Ų | 142.4 | 74% | 0.744 | 82% | 0.82 | S | S | * | * | S | Bend | trans | -137.8 | 129.5 | 138.9 | 0 | 0 | 0 | 0 | 0 | 109.6 | ||
| 209 | D | 36.8 | Very low | 42.2 | Very low | 161 Ų | 161 | 144.2 Ų | 144.2 | 86% | 0.861 | 83% | 0.833 | S | S | * | * | trans | 73.1 | 66.2 | 157.7 | -57.4 | -35.8 | 0 | 0 | 0 | 119.8 | ||||
| 210 | V | 43.9 | Very low | 42.3 | Very low | 140 Ų | 140 | 145.8 Ų | 145.8 | 85% | 0.848 | 84% | 0.839 | S | S | * | * | trans | -85.7 | 115.2 | 143.6 | 173.6 | 0 | 0 | 0 | 0 | 108.4 | ||||
| 211 | S | 36.8 | Very low | 42 | Very low | 108 Ų | 108 | 149.5 Ų | 149.5 | 76% | 0.755 | 85% | 0.853 | S | S | * | * | trans | 116.5 | 77.4 | 155.7 | -52.6 | 0 | 0 | 0 | 0 | 116.5 | ||||
| 212 | L | 44 | Very low | 41.9 | Very low | 171 Ų | 171 | 150.4 Ų | 150.4 | 90% | 0.895 | 86% | 0.863 | S | S | * | * | trans | -114.8 | 139.9 | 135.2 | -87.9 | 166.5 | 0 | 0 | 0 | 108.7 | ||||
| 213 | R | 39.4 | Very low | 42.2 | Very low | 239 Ų | 239 | 154.4 Ų | 154.4 | 90% | 0.902 | 88% | 0.876 | S | S | * | * | trans | 95.6 | 74.1 | 170.6 | -53.4 | -175.1 | -171.3 | -163.4 | 2 | 117.2 | ||||
| 214 | K | 42.5 | Very low | 41.7 | Very low | 211 Ų | 211 | 156.9 Ų | 156.9 | 92% | 0.917 | 88% | 0.882 | S | S | * | * | -114.9 | 104.9 | 121.7 | -90.3 | -175.4 | 176.7 | 178.1 | 0 | 108.8 | |||||
| 215 | S | 37.6 | Very low | 41.3 | Very low | 193 Ų | 193 | 156.8 Ų | 156.8 | 100% | 1.35 | 89% | 0.887 | S | S | * | * | trans | -173.1 | 0 | 146.3 | -74.6 | 0 | 0 | 0 | 0 | 106.7 |
Retrieved 215 of 215 residues in 41 ms
(Link to these results)