| 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 | 53.1 | Low | 76.6 | Confident | 188 Ų | 188 | 116.5 Ų | 116.5 | 93% | 0.926 | 59% | 0.589 | S | S | * | * | 0 | -32 | 0 | -73.5 | -164 | -167.8 | 0 | 0 | 113.7 | W3 I4 L5 | M1-W3 PolarHBondContact O-N 3Å; M1-I4 PolarHBondContact O-N 2.82Å; M1-L5 PolarHBondContact O-N 2.9Å | |||
| 2 | S | 69.1 | Low | 77.3 | Confident | 98 Ų | 98 | 115.4 Ų | 115.4 | 69% | 0.685 | 58% | 0.58 | S | S | * | * | H | α-helix | trans | -60.6 | -37.2 | -179.1 | 51.5 | 0 | 0 | 0 | 0 | 114.7 | I4 L5 N6 | S2-I4 VanDerWaalsContact C-N 3.34Å; S2-I4 PolarHBondContact O-N 2.86Å; S2-L5 PolarHBondContact O-N 3.42Å; S2-N6 PolarHBondContact O-N 2.97Å |
| 3 | W | 74.2 | Confident | 77.7 | Confident | 156 Ų | 156 | 113.9 Ų | 113.9 | 59% | 0.591 | 58% | 0.575 | S | S | * | * | H | α-helix | trans | -65.7 | -36 | 178.5 | 72.3 | -84.7 | 0 | 0 | 0 | 112.8 | M1 N6 L7 | M1-W3 PolarHBondContact O-N 3Å; W3-N6 PolarHBondContact O-N 3.18Å; W3-L7 HydrophobicContact CE3-CD1 3.49Å; W3-L7 VanDerWaalsContact CE3-CD1 3.49Å; W3-L7 HydrophobicContact CZ3-CD1 3.78Å; W3-L7 WeakPolarHBondContact O-CB 3.25Å; W3-L7 PolarHBondContact O-N 2.87Å |
| 4 | I | 72.8 | Confident | 78.2 | Confident | 96 Ų | 96 | 113.9 Ų | 113.9 | 49% | 0.492 | 58% | 0.576 | S | S | . | * | H | α-helix | trans | -67.1 | -40.7 | 176.5 | -65.6 | 171.7 | 0 | 0 | 0 | 110.7 | M1 S2 L7 K8 | M1-I4 PolarHBondContact O-N 2.82Å; S2-I4 VanDerWaalsContact C-N 3.34Å; S2-I4 PolarHBondContact O-N 2.86Å; I4-L7 PolarHBondContact O-N 3.4Å; I4-K8 WeakPolarHBondContact O-CB 3.49Å; I4-K8 PolarHBondContact O-N 3.44Å |
| 5 | L | 76.8 | Confident | 78.7 | Confident | 120 Ų | 120 | 113.7 Ų | 113.7 | 63% | 0.628 | 58% | 0.576 | S | S | * | * | H | α-helix | trans | -65.2 | -40.8 | 175.5 | -73.4 | 167.7 | 0 | 0 | 0 | 111.7 | M1 S2 K8 E9 | M1-L5 PolarHBondContact O-N 2.9Å; S2-L5 PolarHBondContact O-N 3.42Å; L5-K8 PolarHBondContact O-N 3.19Å; L5-E9 WeakPolarHBondContact O-CB 3.31Å; L5-E9 PolarHBondContact O-N 3.43Å |
| 6 | N | 79.9 | Confident | 78.9 | Confident | 81 Ų | 81 | 112.8 Ų | 112.8 | 43% | 0.433 | 57% | 0.573 | S | S | . | * | H | α-helix | trans | -67.2 | -39.8 | 176.7 | -167.8 | -25.8 | 0 | 0 | 0 | 112.1 | S2 W3 K8 E9 K10 | S2-N6 PolarHBondContact O-N 2.97Å; W3-N6 PolarHBondContact O-N 3.18Å; N6-K8 VanDerWaalsContact C-N 3.35Å; N6-E9 PolarHBondContact O-N 3.37Å; N6-K10 WeakPolarHBondContact O-CB 3.39Å; N6-K10 WeakPolarHBondContact O-CG 3.47Å; N6-K10 PolarHBondContact O-N 2.9Å; N6-K10 WeakPolarHBondContact OD1-CE 3.24Å |
| 7 | L | 79.3 | Confident | 79.1 | Confident | 103 Ų | 103 | 113.5 Ų | 113.5 | 54% | 0.539 | 57% | 0.574 | S | S | . | * | H | α-helix | trans | -63.4 | -40.5 | 173.1 | -103.8 | 137.2 | 0 | 0 | 0 | 112.1 | W3 I4 K10 A11 | W3-L7 HydrophobicContact CE3-CD1 3.49Å; W3-L7 VanDerWaalsContact CE3-CD1 3.49Å; W3-L7 HydrophobicContact CZ3-CD1 3.78Å; W3-L7 WeakPolarHBondContact O-CB 3.25Å; W3-L7 PolarHBondContact O-N 2.87Å; I4-L7 PolarHBondContact O-N 3.4Å; L7-K10 PolarHBondContact O-N 3.31Å; L7-A11 WeakPolarHBondContact O-CB 3.43Å; L7-A11 PolarHBondContact O-N 2.85Å |
| 8 | K | 85.5 | Confident | 79.2 | Confident | 124 Ų | 124 | 112.6 Ų | 112.6 | 54% | 0.539 | 57% | 0.569 | S | S | . | * | H | α-helix | trans | -62.8 | -47.4 | 175.5 | -174.4 | -178.7 | 169.1 | -173.8 | 0 | 111.3 | I4 L5 N6 K10 A11 E12 | I4-K8 WeakPolarHBondContact O-CB 3.49Å; I4-K8 PolarHBondContact O-N 3.44Å; L5-K8 PolarHBondContact O-N 3.19Å; N6-K8 VanDerWaalsContact C-N 3.35Å; K8-K10 PolarHBondContact O-N 3.25Å; K8-A11 PolarHBondContact O-N 3Å; K8-E12 WeakPolarHBondContact CE-OE1 3.4Å; K8-E12 IonicContact NZ-OE1 3.15Å; K8-E12 WeakPolarHBondContact O-CG 3.31Å; K8-E12 PolarHBondContact O-N 3.42Å |
| 9 | E | 83.2 | Confident | 79.1 | Confident | 118 Ų | 118 | 111.8 Ų | 111.8 | 55% | 0.551 | 57% | 0.567 | S | S | * | * | H | α-helix | trans | -61.6 | -40.9 | 177.7 | -175.7 | 178.6 | -168.9 | 0 | 0 | 112.1 | L5 N6 N13 | L5-E9 WeakPolarHBondContact O-CB 3.31Å; L5-E9 PolarHBondContact O-N 3.43Å; N6-E9 PolarHBondContact O-N 3.37Å; E9-N13 WeakPolarHBondContact O-CB 3.48Å; E9-N13 PolarHBondContact O-N 3.42Å; E9-N13 PolarHBondContact O-ND2 2.98Å; E9-N13 VanDerWaalsContact O-ND2 3.09Å |
| 10 | K | 85.9 | Confident | 79.1 | Confident | 139 Ų | 139 | 111.7 Ų | 111.7 | 60% | 0.604 | 57% | 0.568 | S | S | * | * | H | α-helix | trans | -66.4 | -37.8 | 174.7 | -76.6 | -177.8 | 178.6 | -175.4 | 0 | 113 | N6 L7 K8 L14 | N6-K10 WeakPolarHBondContact O-CB 3.39Å; N6-K10 WeakPolarHBondContact O-CG 3.47Å; N6-K10 PolarHBondContact O-N 2.9Å; N6-K10 WeakPolarHBondContact OD1-CE 3.24Å; L7-K10 PolarHBondContact O-N 3.31Å; K8-K10 PolarHBondContact O-N 3.25Å; K10-L14 WeakPolarHBondContact O-CB 3.43Å; K10-L14 PolarHBondContact O-N 3.07Å |
| 11 | A | 83.4 | Confident | 79.1 | Confident | 59 Ų | 59 | 110.1 Ų | 110.1 | 49% | 0.488 | 56% | 0.564 | S | S | . | * | H | α-helix | trans | -68.5 | -40.3 | 177.8 | 0 | 0 | 0 | 0 | 0 | 111.8 | L7 K8 L14 L15 | L7-A11 WeakPolarHBondContact O-CB 3.43Å; L7-A11 PolarHBondContact O-N 2.85Å; K8-A11 PolarHBondContact O-N 3Å; A11-L14 PolarHBondContact O-N 3.13Å; A11-L15 PolarHBondContact O-N 3.39Å; A11-L15 VanDerWaalsContact O-N 3.1Å |
| 12 | E | 84.4 | Confident | 80 | Confident | 103 Ų | 103 | 103.1 Ų | 103.1 | 48% | 0.481 | 54% | 0.536 | S | S | . | . | H | α-helix | trans | -63.2 | -46.8 | 174.4 | -73.4 | 173.8 | 171.8 | 0 | 0 | 110.8 | K8 L14 L15 D16 | K8-E12 WeakPolarHBondContact CE-OE1 3.4Å; K8-E12 IonicContact NZ-OE1 3.15Å; K8-E12 WeakPolarHBondContact O-CG 3.31Å; K8-E12 PolarHBondContact O-N 3.42Å; E12-L14 VanDerWaalsContact C-N 3.31Å; E12-L14 PolarHBondContact O-N 3.39Å; E12-L15 WeakPolarHBondContact O-CB 3.26Å; E12-L15 PolarHBondContact O-N 3.01Å; E12-L15 VanDerWaalsContact O-N 3.14Å; E12-D16 PolarHBondContact O-N 3.39Å |
| 13 | N | 83.2 | Confident | 80.2 | Confident | 96 Ų | 96 | 100.4 Ų | 100.4 | 51% | 0.513 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -62.2 | -34.4 | 176.1 | -75.4 | -37.1 | 0 | 0 | 0 | 113.7 | E9 H17 | E9-N13 WeakPolarHBondContact O-CB 3.48Å; E9-N13 PolarHBondContact O-N 3.42Å; E9-N13 PolarHBondContact O-ND2 2.98Å; E9-N13 VanDerWaalsContact O-ND2 3.09Å; N13-H17 PolarHBondContact O-N 2.97Å; N13-H17 VanDerWaalsContact O-N 3.15Å |
| 14 | L | 84.5 | Confident | 80.1 | Confident | 114 Ų | 114 | 97.2 Ų | 97.2 | 60% | 0.597 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -69.4 | -37.7 | 176.6 | -162.7 | 94.8 | 0 | 0 | 0 | 111.1 | K10 A11 E12 H17 I18 | K10-L14 WeakPolarHBondContact O-CB 3.43Å; K10-L14 PolarHBondContact O-N 3.07Å; A11-L14 PolarHBondContact O-N 3.13Å; E12-L14 VanDerWaalsContact C-N 3.31Å; E12-L14 PolarHBondContact O-N 3.39Å; L14-H17 PolarHBondContact O-N 3.23Å; L14-I18 HydrophobicContact CD2-CD1 4.26Å; L14-I18 HydrophobicContact CG-CD1 4.44Å; L14-I18 WeakPolarHBondContact O-CG1 3.2Å; L14-I18 PolarHBondContact O-N 2.88Å; L14-I18 VanDerWaalsContact O-N 3.07Å |
| 15 | L | 84.8 | Confident | 79.8 | Confident | 110 Ų | 110 | 95.8 Ų | 95.8 | 58% | 0.576 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -64.9 | -46.5 | 177.8 | -141.1 | 85 | 0 | 0 | 0 | 110.7 | A11 E12 H17 I18 D19 | A11-L15 PolarHBondContact O-N 3.39Å; A11-L15 VanDerWaalsContact O-N 3.1Å; E12-L15 WeakPolarHBondContact O-CB 3.26Å; E12-L15 PolarHBondContact O-N 3.01Å; E12-L15 VanDerWaalsContact O-N 3.14Å; L15-H17 VanDerWaalsContact C-N 3.26Å; L15-H17 PolarHBondContact O-N 3.11Å; L15-I18 PolarHBondContact O-N 2.92Å; L15-I18 VanDerWaalsContact O-N 3.15Å; L15-D19 PolarHBondContact O-N 3.41Å |
| 16 | D | 82.2 | Confident | 79.1 | Confident | 99 Ų | 99 | 97.1 Ų | 97.1 | 53% | 0.529 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -59.8 | -38.3 | 176.6 | -72.2 | -15.4 | 0 | 0 | 0 | 111.5 | E12 D19 D20 | E12-D16 PolarHBondContact O-N 3.39Å; D16-D19 PolarHBondContact O-N 2.92Å; D16-D20 PolarHBondContact O-N 2.87Å |
| 17 | H | 82.9 | Confident | 78.1 | Confident | 126 Ų | 126 | 100.5 Ų | 100.5 | 58% | 0.583 | 54% | 0.54 | S | S | * | . | H | α-helix | trans | -68.7 | -36.4 | 177.4 | -162.4 | 59.2 | 0 | 0 | 0 | 113 | N13 L14 L15 V21 | N13-H17 PolarHBondContact O-N 2.97Å; N13-H17 VanDerWaalsContact O-N 3.15Å; L14-H17 PolarHBondContact O-N 3.23Å; L15-H17 VanDerWaalsContact C-N 3.26Å; L15-H17 PolarHBondContact O-N 3.11Å; H17-V21 VanDerWaalsContact O-CG2 3.27Å; H17-V21 WeakPolarHBondContact O-CG2 3.28Å; H17-V21 PolarHBondContact O-N 3.28Å |
| 18 | I | 80.3 | Confident | 76.9 | Confident | 96 Ų | 96 | 103.7 Ų | 103.7 | 49% | 0.492 | 55% | 0.549 | S | S | . | . | H | α-helix | trans | -67.5 | -41.4 | 175.6 | -70 | 167.1 | 0 | 0 | 0 | 110.3 | L14 L15 V21 A22 | L14-I18 HydrophobicContact CD2-CD1 4.26Å; L14-I18 HydrophobicContact CG-CD1 4.44Å; L14-I18 WeakPolarHBondContact O-CG1 3.2Å; L14-I18 PolarHBondContact O-N 2.88Å; L14-I18 VanDerWaalsContact O-N 3.07Å; L15-I18 PolarHBondContact O-N 2.92Å; L15-I18 VanDerWaalsContact O-N 3.15Å; I18-V21 PolarHBondContact O-N 3.45Å; I18-A22 VanDerWaalsContact O-CB 3.32Å; I18-A22 WeakPolarHBondContact O-CB 3.42Å; I18-A22 PolarHBondContact O-N 3.34Å |
| 19 | D | 78.4 | Confident | 75 | Confident | 98 Ų | 98 | 103.4 Ų | 103.4 | 52% | 0.524 | 56% | 0.56 | S | S | . | * | H | α-helix | trans | -65.5 | -38.9 | 177.5 | -80.3 | -13.2 | 0 | 0 | 0 | 111.8 | L15 D16 A22 A23 | L15-D19 PolarHBondContact O-N 3.41Å; D16-D19 PolarHBondContact O-N 2.92Å; D19-A22 PolarHBondContact O-N 3.32Å; D19-A23 VanDerWaalsContact O-CB 3.22Å; D19-A23 WeakPolarHBondContact O-CB 3.48Å; D19-A23 PolarHBondContact O-N 3.28Å |
| 20 | D | 78.9 | Confident | 73.2 | Confident | 109 Ų | 109 | 105.4 Ų | 105.4 | 58% | 0.583 | 58% | 0.58 | S | S | * | * | H | α-helix | trans | -64.4 | -41.9 | 173.8 | -92.1 | -7.8 | 0 | 0 | 0 | 112.6 | D16 A23 T24 | D16-D20 PolarHBondContact O-N 2.87Å; D20-A23 PolarHBondContact O-N 3.49Å; D20-T24 WeakPolarHBondContact O-CB 3.33Å; D20-T24 PolarHBondContact O-N 2.91Å; D20-T24 PolarHBondContact O-OG1 3.05Å |
| 21 | V | 78.1 | Confident | 71 | Confident | 80 Ų | 80 | 101.1 Ų | 101.1 | 49% | 0.485 | 58% | 0.575 | S | S | . | * | H | α-helix | trans | -67.4 | -39.9 | 176.6 | 172.3 | 0 | 0 | 0 | 0 | 110.9 | H17 I18 T24 A25 | H17-V21 VanDerWaalsContact O-CG2 3.27Å; H17-V21 WeakPolarHBondContact O-CG2 3.28Å; H17-V21 PolarHBondContact O-N 3.28Å; I18-V21 PolarHBondContact O-N 3.45Å; V21-T24 WeakPolarHBondContact CA-OG1 3.3Å; V21-T24 PolarHBondContact O-N 2.96Å; V21-T24 PolarHBondContact O-OG1 3.4Å; V21-T24 VanDerWaalsContact O-OG1 3.11Å; V21-A25 VanDerWaalsContact O-CB 3.28Å; V21-A25 WeakPolarHBondContact O-CB 3.42Å; V21-A25 PolarHBondContact O-N 2.88Å |
| 22 | A | 71.4 | Confident | 68.7 | Low | 41 Ų | 41 | 105.6 Ų | 105.6 | 34% | 0.339 | 59% | 0.591 | S | S | . | * | H | α-helix | trans | -66.5 | -42.5 | 175.3 | 0 | 0 | 0 | 0 | 0 | 111.4 | I18 D19 A25 L26 | I18-A22 VanDerWaalsContact O-CB 3.32Å; I18-A22 WeakPolarHBondContact O-CB 3.42Å; I18-A22 PolarHBondContact O-N 3.34Å; D19-A22 PolarHBondContact O-N 3.32Å; A22-A25 PolarHBondContact O-N 2.82Å; A22-L26 VanDerWaalsContact O-CB 3.31Å; A22-L26 WeakPolarHBondContact O-CB 3.47Å; A22-L26 WeakPolarHBondContact O-CD1 3.42Å; A22-L26 VanDerWaalsContact O-CG 3.23Å; A22-L26 WeakPolarHBondContact O-CG 3.26Å; A22-L26 PolarHBondContact O-N 3.16Å |
| 23 | A | 74.3 | Confident | 66.5 | Low | 41 Ų | 41 | 107.5 Ų | 107.5 | 34% | 0.339 | 61% | 0.61 | S | S | . | * | H | α-helix | trans | -63.7 | -41.1 | 176.8 | 0 | 0 | 0 | 0 | 0 | 111.8 | D19 D20 L26 Q27 | D19-A23 VanDerWaalsContact O-CB 3.22Å; D19-A23 WeakPolarHBondContact O-CB 3.48Å; D19-A23 PolarHBondContact O-N 3.28Å; D20-A23 PolarHBondContact O-N 3.49Å; A23-L26 PolarHBondContact O-N 2.98Å; A23-Q27 WeakPolarHBondContact O-CB 3.44Å; A23-Q27 VanDerWaalsContact O-CG 3.24Å; A23-Q27 WeakPolarHBondContact O-CG 3.3Å; A23-Q27 PolarHBondContact O-N 3.47Å |
| 24 | T | 71.4 | Confident | 64.4 | Low | 88 Ų | 88 | 108 Ų | 108 | 54% | 0.54 | 62% | 0.621 | S | S | . | * | H | α-helix | trans | -71.7 | -35 | 176.3 | 40.5 | 0 | 0 | 0 | 0 | 113 | D20 V21 Q27 | D20-T24 WeakPolarHBondContact O-CB 3.33Å; D20-T24 PolarHBondContact O-N 2.91Å; D20-T24 PolarHBondContact O-OG1 3.05Å; V21-T24 WeakPolarHBondContact CA-OG1 3.3Å; V21-T24 PolarHBondContact O-N 2.96Å; V21-T24 PolarHBondContact O-OG1 3.4Å; V21-T24 VanDerWaalsContact O-OG1 3.11Å; T24-Q27 PolarHBondContact O-N 3.26Å |
| 25 | A | 67.6 | Low | 62.2 | Low | 66 Ų | 66 | 111 Ų | 111 | 55% | 0.545 | 63% | 0.63 | S | S | . | * | H | α-helix | trans | -67 | -37.6 | 173.4 | 0 | 0 | 0 | 0 | 0 | 112.2 | V21 A22 | V21-A25 VanDerWaalsContact O-CB 3.28Å; V21-A25 WeakPolarHBondContact O-CB 3.42Å; V21-A25 PolarHBondContact O-N 2.88Å; A22-A25 PolarHBondContact O-N 2.82Å |
| 26 | L | 60.5 | Low | 60 | Low | 149 Ų | 149 | 114.7 Ų | 114.7 | 78% | 0.78 | 64% | 0.641 | S | S | * | * | H | α-helix | trans | -79.7 | -17.4 | 178.6 | -70.1 | 168.6 | 0 | 0 | 0 | 113.8 | A22 A23 K28 | A22-L26 VanDerWaalsContact O-CB 3.31Å; A22-L26 WeakPolarHBondContact O-CB 3.47Å; A22-L26 WeakPolarHBondContact O-CD1 3.42Å; A22-L26 VanDerWaalsContact O-CG 3.23Å; A22-L26 WeakPolarHBondContact O-CG 3.26Å; A22-L26 PolarHBondContact O-N 3.16Å; A23-L26 PolarHBondContact O-N 2.98Å; L26-K28 VanDerWaalsContact C-N 3.32Å |
| 27 | Q | 60.5 | Low | 57.9 | Low | 152 Ų | 152 | 117.5 Ų | 117.5 | 71% | 0.71 | 66% | 0.656 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -82.2 | -1.1 | 175.1 | -82.3 | 178.1 | 13.3 | 0 | 0 | 114.3 | A23 T24 P29 | A23-Q27 WeakPolarHBondContact O-CB 3.44Å; A23-Q27 VanDerWaalsContact O-CG 3.24Å; A23-Q27 WeakPolarHBondContact O-CG 3.3Å; A23-Q27 PolarHBondContact O-N 3.47Å; T24-Q27 PolarHBondContact O-N 3.26Å; Q27-P29 WeakPolarHBondContact O-CD 3.42Å |
| 28 | K | 52.7 | Low | 55.6 | Low | 169 Ų | 169 | 118.9 Ų | 118.9 | 74% | 0.735 | 67% | 0.668 | S | S | * | * | S | Bend | trans | -66.7 | 120.3 | 168.3 | -77.9 | -174 | 178.6 | 176.9 | 0 | 109 | L26 V30 | L26-K28 VanDerWaalsContact C-N 3.32Å; K28-V30 PolarHBondContact O-N 3.17Å; K28-V30 VanDerWaalsContact O-N 3.13Å |
| 29 | P | 47.2 | Very low | 53.5 | Low | 118 Ų | 118 | 117.2 Ų | 117.2 | 77% | 0.766 | 68% | 0.675 | S | S | * | * | trans | -65.1 | 119.6 | -173 | 24.6 | -31.5 | 0 | 0 | 0 | 109.9 | Q27 G31 | Q27-P29 WeakPolarHBondContact O-CD 3.42Å; P29-G31 PolarHBondContact O-N 3.39Å | ||
| 30 | V | 43.7 | Very low | 51.8 | Low | 160 Ų | 160 | 123.6 Ų | 123.6 | 97% | 0.97 | 69% | 0.691 | S | S | * | * | trans | -65 | 87 | 156.7 | -174.2 | 0 | 0 | 0 | 0 | 106 | K28 | K28-V30 PolarHBondContact O-N 3.17Å; K28-V30 VanDerWaalsContact O-N 3.13Å | ||
| 31 | G | 41.3 | Very low | 49.9 | Very low | 49 Ų | 49 | 125.8 Ų | 125.8 | 51% | 0.505 | 70% | 0.703 | S | S | . | * | trans | -164.2 | 111.2 | -171.9 | 0 | 0 | 0 | 0 | 0 | 113.3 | P29 | P29-G31 PolarHBondContact O-N 3.39Š| ||
| 32 | N | 34.7 | Very low | 48 | Very low | 154 Ų | 154 | 128.1 Ų | 128.1 | 82% | 0.824 | 71% | 0.713 | S | S | * | * | trans | 89.1 | 73.5 | 154.9 | -51.2 | -6.3 | 0 | 0 | 0 | 117.2 | ||||
| 33 | T | 37.8 | Very low | 46.6 | Very low | 143 Ų | 143 | 134.3 Ų | 134.3 | 88% | 0.877 | 73% | 0.734 | S | S | * | * | trans | -104.2 | 74.6 | 139.1 | 50.3 | 0 | 0 | 0 | 0 | 108.4 | F35 | T33-F35 PolarHBondContact O-N 2.88Å; T33-F35 VanDerWaalsContact O-N 3.16Å | ||
| 34 | S | 38.8 | Very low | 44.5 | Very low | 106 Ų | 106 | 142.6 Ų | 142.6 | 74% | 0.741 | 76% | 0.757 | S | S | * | * | trans | -68.5 | 108 | 166.1 | 51.9 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 35 | F | 38.7 | Very low | 42.8 | Very low | 177 Ų | 177 | 143.3 Ų | 143.3 | 78% | 0.776 | 77% | 0.772 | S | S | * | * | trans | -19.6 | 128.4 | 144.6 | -90 | -110.5 | 0 | 0 | 0 | 114.5 | T33 | T33-F35 PolarHBondContact O-N 2.88Å; T33-F35 VanDerWaalsContact O-N 3.16Å | ||
| 36 | F | 37.7 | Very low | 41.1 | Very low | 188 Ų | 188 | 144.9 Ų | 144.9 | 83% | 0.825 | 78% | 0.775 | S | S | * | * | trans | 55.1 | 115.6 | 162.2 | -66.4 | -93 | 0 | 0 | 0 | 117.8 | ||||
| 37 | D | 38.2 | Very low | 40.1 | Very low | 158 Ų | 158 | 145.9 Ų | 145.9 | 85% | 0.845 | 78% | 0.78 | S | S | * | * | -168.4 | 147.6 | 103.2 | -151.3 | -1.6 | 0 | 0 | 0 | 110.5 | |||||
| 38 | D | 35.3 | Very low | 38.9 | Very low | 154 Ų | 154 | 145.9 Ų | 145.9 | 82% | 0.824 | 79% | 0.785 | S | S | * | * | trans | -60.1 | 155.7 | 173.6 | -164.9 | 1.4 | 0 | 0 | 0 | 111.4 | ||||
| 39 | G | 36.5 | Very low | 38.4 | Very low | 62 Ų | 62 | 145.9 Ų | 145.9 | 64% | 0.639 | 79% | 0.793 | S | S | * | * | trans | 131.9 | 94.2 | 169.3 | 0 | 0 | 0 | 0 | 0 | 115 | D41 | G39-D41 PolarHBondContact O-N 3.39Š| ||
| 40 | R | 41.7 | Very low | 37.8 | Very low | 231 Ų | 231 | 143.3 Ų | 143.3 | 87% | 0.872 | 79% | 0.788 | S | S | * | * | trans | -16.7 | 123.2 | 144 | -60.3 | 167.7 | -175.2 | 177.2 | 0.6 | 112.8 | ||||
| 41 | D | 39.4 | Very low | 37.3 | Very low | 155 Ų | 155 | 141.8 Ų | 141.8 | 83% | 0.829 | 78% | 0.781 | S | S | * | * | -174.5 | 147 | 115.8 | -93.3 | -18.7 | 0 | 0 | 0 | 111.5 | G39 | G39-D41 PolarHBondContact O-N 3.39Š| |||
| 42 | D | 39.2 | Very low | 37 | Very low | 130 Ų | 130 | 146.2 Ų | 146.2 | 70% | 0.695 | 80% | 0.798 | S | S | * | * | trans | -62.7 | 169 | -172.5 | -72.6 | -56.3 | 0 | 0 | 0 | 115.3 | ||||
| 43 | H | 40.5 | Very low | 36.9 | Very low | 170 Ų | 170 | 146.1 Ų | 146.1 | 79% | 0.787 | 80% | 0.798 | S | S | * | * | trans | 104.8 | 92 | 149.6 | -49 | -54.4 | 0 | 0 | 0 | 118.2 | ||||
| 44 | R | 31.5 | Very low | 36.7 | Very low | 216 Ų | 216 | 146.9 Ų | 146.9 | 82% | 0.815 | 80% | 0.795 | S | S | * | * | 59.4 | 97.8 | 113.8 | -161.7 | -180 | -179.3 | -134.1 | -0.4 | 116.9 | |||||
| 45 | A | 35.1 | Very low | 36.4 | Very low | 102 Ų | 102 | 149.4 Ų | 149.4 | 84% | 0.843 | 80% | 0.799 | S | S | * | * | trans | -116.3 | 94.9 | 153 | 0 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 46 | T | 32.8 | Very low | 36 | Very low | 100 Ų | 100 | 144.7 Ų | 144.7 | 61% | 0.613 | 79% | 0.793 | S | S | * | * | trans | -72.1 | 124.2 | 160.4 | 26.3 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 47 | L | 39.3 | Very low | 35.9 | Very low | 170 Ų | 170 | 145.7 Ų | 145.7 | 89% | 0.89 | 80% | 0.797 | S | S | * | * | trans | -124.4 | 117.5 | 157.9 | -80.3 | 172.3 | 0 | 0 | 0 | 109.7 | ||||
| 48 | N | 35.3 | Very low | 35.7 | Very low | 151 Ų | 151 | 143.4 Ų | 143.4 | 81% | 0.807 | 79% | 0.794 | S | S | * | * | trans | -64.8 | 133.1 | 170.1 | -72.9 | -31.7 | 0 | 0 | 0 | 110.3 | ||||
| 49 | N | 41.7 | Very low | 35.5 | Very low | 169 Ų | 169 | 144.2 Ų | 144.2 | 90% | 0.904 | 80% | 0.798 | S | S | * | * | trans | -160.2 | 131.4 | 137.7 | -91.9 | -20.9 | 0 | 0 | 0 | 109.2 | ||||
| 50 | G | 35.4 | Very low | 35.4 | Very low | 65 Ų | 65 | 147.1 Ų | 147.1 | 67% | 0.67 | 80% | 0.803 | S | S | * | * | trans | -73.6 | -165.9 | -161.9 | 0 | 0 | 0 | 0 | 0 | 117.3 | ||||
| 51 | P | 31.9 | Very low | 35.2 | Very low | 127 Ų | 127 | 143.3 Ų | 143.3 | 83% | 0.825 | 80% | 0.799 | S | S | * | * | P | Polyproline II helix | trans | -83.6 | 128.7 | -146.9 | 33.2 | -33.5 | 0 | 0 | 0 | 112.2 | ||
| 52 | V | 36 | Very low | 35 | Very low | 143 Ų | 143 | 144 Ų | 144 | 87% | 0.867 | 80% | 0.802 | S | S | * | * | P | Polyproline II helix | trans | -101.2 | 119.8 | 164.6 | -178.6 | 0 | 0 | 0 | 0 | 108.2 | ||
| 53 | N | 32.6 | Very low | 34.7 | Very low | 151 Ų | 151 | 145.4 Ų | 145.4 | 81% | 0.807 | 80% | 0.804 | S | S | * | * | P | Polyproline II helix | trans | -49.7 | 127.8 | -172.2 | -80 | -37.4 | 0 | 0 | 0 | 114.6 | ||
| 54 | I | 32.3 | Very low | 34.4 | Very low | 159 Ų | 159 | 143 Ų | 143 | 82% | 0.815 | 80% | 0.804 | S | S | * | * | P | Polyproline II helix | trans | -77.4 | 124.1 | 156.8 | -59.4 | 164.5 | 0 | 0 | 0 | 107.5 | ||
| 55 | L | 32.9 | Very low | 34.7 | Very low | 159 Ų | 159 | 139 Ų | 139 | 83% | 0.832 | 80% | 0.803 | S | S | * | * | trans | -169.4 | 97.7 | 151.9 | -99.3 | 143 | 0 | 0 | 0 | 106.8 | ||||
| 56 | A | 31.1 | Very low | 34.7 | Very low | 78 Ų | 78 | 139.1 Ų | 139.1 | 65% | 0.645 | 80% | 0.795 | S | S | * | * | 85.3 | 110.1 | 88.5 | 0 | 0 | 0 | 0 | 0 | 112.2 | |||||
| 57 | K | 35.4 | Very low | 34.7 | Very low | 209 Ų | 209 | 143 Ų | 143 | 91% | 0.909 | 81% | 0.811 | S | S | * | * | trans | 175.5 | 100.6 | 144.9 | -98.8 | 164.4 | -174.6 | -174.4 | 0 | 110 | ||||
| 58 | S | 35 | Very low | 34.9 | Very low | 111 Ų | 111 | 141.3 Ų | 141.3 | 78% | 0.776 | 81% | 0.807 | S | S | * | * | trans | -173.4 | 92.6 | 139.3 | 34.7 | 0 | 0 | 0 | 0 | 109.3 | V60 | S58-V60 PolarHBondContact O-N 3.4Å; S58-V60 VanDerWaalsContact O-N 3.13Å | ||
| 59 | D | 29.1 | Very low | 34.7 | Very low | 170 Ų | 170 | 141.6 Ų | 141.6 | 91% | 0.909 | 81% | 0.809 | S | S | * | * | trans | -52.7 | 109.1 | 154.8 | -71.4 | -51.4 | 0 | 0 | 0 | 108.8 | ||||
| 60 | V | 36 | Very low | 34.6 | Very low | 124 Ų | 124 | 141.5 Ų | 141.5 | 75% | 0.752 | 81% | 0.808 | S | S | * | * | trans | -124.3 | 101.7 | 158.7 | -178.9 | 0 | 0 | 0 | 0 | 107.2 | S58 L62 | S58-V60 PolarHBondContact O-N 3.4Å; S58-V60 VanDerWaalsContact O-N 3.13Å; V60-L62 PolarHBondContact O-N 2.96Å; V60-L62 VanDerWaalsContact O-N 3.11Å | ||
| 61 | L | 37.3 | Very low | 34.5 | Very low | 151 Ų | 151 | 142.2 Ų | 142.2 | 79% | 0.791 | 82% | 0.815 | S | S | * | * | trans | -54.2 | 108.5 | 170.8 | -70 | 160.2 | 0 | 0 | 0 | 109.6 | H63 | L61-H63 PolarHBondContact O-N 2.89Å; L61-H63 VanDerWaalsContact O-N 3.11Å | ||
| 62 | L | 33.8 | Very low | 34.6 | Very low | 169 Ų | 169 | 139.8 Ų | 139.8 | 89% | 0.885 | 81% | 0.814 | S | S | * | * | trans | -67.5 | 99 | 161.9 | -80.2 | 157.4 | 0 | 0 | 0 | 108.2 | V60 P64 | V60-L62 PolarHBondContact O-N 2.96Å; V60-L62 VanDerWaalsContact O-N 3.11Å; L62-P64 WeakPolarHBondContact O-CD 3.28Å | ||
| 63 | H | 34.3 | Very low | 34.3 | Very low | 160 Ų | 160 | 138 Ų | 138 | 74% | 0.741 | 81% | 0.808 | S | S | * | * | trans | -81.7 | 120.8 | 162.4 | -93 | -43.2 | 0 | 0 | 0 | 109.6 | L61 V65 | L61-H63 PolarHBondContact O-N 2.89Å; L61-H63 VanDerWaalsContact O-N 3.11Å; H63-V65 PolarHBondContact O-N 2.97Å | ||
| 64 | P | 34.4 | Very low | 34.5 | Very low | 120 Ų | 120 | 140 Ų | 140 | 78% | 0.779 | 81% | 0.812 | S | S | * | * | trans | -78.9 | 117.5 | 173.2 | 31.3 | -28.2 | 0 | 0 | 0 | 108.1 | L62 | L62-P64 WeakPolarHBondContact O-CD 3.28Š| ||
| 65 | V | 37.5 | Very low | 34.5 | Very low | 131 Ų | 131 | 142.4 Ų | 142.4 | 79% | 0.794 | 82% | 0.816 | S | S | * | * | trans | -109.3 | 133.8 | 170.3 | -179.5 | 0 | 0 | 0 | 0 | 109.1 | H63 | H63-V65 PolarHBondContact O-N 2.97Š| ||
| 66 | P | 35.3 | Very low | 34.9 | Very low | 105 Ų | 105 | 140.2 Ų | 140.2 | 68% | 0.682 | 81% | 0.814 | S | S | * | * | trans | -79.7 | 145.4 | -166.4 | -3.9 | 23.1 | 0 | 0 | 0 | 111.9 | V68 | P66-V68 PolarHBondContact O-N 2.88Š| ||
| 67 | L | 33.2 | Very low | 35.2 | Very low | 181 Ų | 181 | 148.2 Ų | 148.2 | 95% | 0.948 | 83% | 0.828 | S | S | * | * | trans | -53.3 | 117.4 | 163.4 | -79.1 | 144 | 0 | 0 | 0 | 110.5 | ||||
| 68 | V | 43.5 | Very low | 35.3 | Very low | 134 Ų | 134 | 145.3 Ų | 145.3 | 81% | 0.812 | 82% | 0.82 | S | S | * | * | trans | -129.9 | 104.6 | 162 | -127.5 | 0 | 0 | 0 | 0 | 107.7 | P66 | P66-V68 PolarHBondContact O-N 2.88Š| ||
| 69 | N | 31.2 | Very low | 35.5 | Very low | 158 Ų | 158 | 145.7 Ų | 145.7 | 85% | 0.845 | 82% | 0.82 | S | S | * | * | trans | -70.5 | 127.9 | 161.1 | -105.2 | -18 | 0 | 0 | 0 | 107.5 | ||||
| 70 | D | 38.6 | Very low | 35.9 | Very low | 166 Ų | 166 | 142.9 Ų | 142.9 | 89% | 0.888 | 81% | 0.809 | S | S | * | * | trans | -156.3 | 137.4 | 142 | -104.2 | -26.4 | 0 | 0 | 0 | 111.2 | ||||
| 71 | G | 32.4 | Very low | 36 | Very low | 80 Ų | 80 | 143 Ų | 143 | 83% | 0.825 | 81% | 0.805 | S | S | * | * | trans | -70.5 | 153.9 | -171.3 | 0 | 0 | 0 | 0 | 0 | 114.5 | ||||
| 72 | G | 34.3 | Very low | 36.2 | Very low | 76 Ų | 76 | 143.7 Ų | 143.7 | 78% | 0.784 | 81% | 0.807 | S | S | * | * | trans | -171.6 | 102.1 | 170.5 | 0 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 73 | S | 29.5 | Very low | 36.5 | Very low | 107 Ų | 107 | 139.5 Ų | 139.5 | 75% | 0.748 | 80% | 0.797 | S | S | * | * | trans | -67.1 | 133.7 | 171.8 | 66.5 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 74 | H | 38.4 | Very low | 36.7 | Very low | 192 Ų | 192 | 138.6 Ų | 138.6 | 89% | 0.889 | 80% | 0.797 | S | S | * | * | trans | -145.7 | 126.6 | 149.4 | -86.5 | -66.7 | 0 | 0 | 0 | 111.9 | ||||
| 75 | K | 31.2 | Very low | 36.9 | Very low | 210 Ų | 210 | 139.7 Ų | 139.7 | 91% | 0.913 | 80% | 0.797 | S | S | * | * | trans | -83.5 | 132.5 | 173.8 | -66.4 | 172 | 174.4 | 176.7 | 0 | 109.9 | ||||
| 76 | S | 41.5 | Very low | 37.1 | Very low | 112 Ų | 112 | 142.1 Ų | 142.1 | 78% | 0.783 | 80% | 0.802 | S | S | * | * | trans | -163.3 | 99.6 | 152.9 | 45.9 | 0 | 0 | 0 | 0 | 108.6 | ||||
| 77 | R | 37.9 | Very low | 37.2 | Very low | 247 Ų | 247 | 142.7 Ų | 142.7 | 93% | 0.932 | 81% | 0.808 | S | S | * | * | 70.9 | 94.6 | 88 | -161.4 | 174.1 | 175.8 | 168.6 | -1.8 | 113 | |||||
| 78 | I | 37.3 | Very low | 37 | Very low | 147 Ų | 147 | 141.5 Ų | 141.5 | 75% | 0.754 | 80% | 0.803 | S | S | * | * | trans | -75.4 | 156.6 | 171.6 | -56.7 | 162.7 | 0 | 0 | 0 | 110.3 | V80 | I78-V80 HydrophobicContact CG2-CG2 4.4Å; I78-V80 VanDerWaalsContact CG2-N 3.31Å | ||
| 79 | P | 39.1 | Very low | 36.9 | Very low | 119 Ų | 119 | 140.9 Ų | 140.9 | 77% | 0.773 | 80% | 0.804 | S | S | * | * | -137 | 122.9 | 117.2 | 32 | -16.6 | 0 | 0 | 0 | 111.8 | |||||
| 80 | V | 37.3 | Very low | 37.2 | Very low | 112 Ų | 112 | 144.5 Ų | 144.5 | 68% | 0.679 | 81% | 0.806 | S | S | * | * | 58.1 | 98.1 | 92.2 | -177.4 | 0 | 0 | 0 | 0 | 113.7 | I78 | I78-V80 HydrophobicContact CG2-CG2 4.4Å; I78-V80 VanDerWaalsContact CG2-N 3.31Å | |||
| 81 | N | 38.6 | Very low | 37 | Very low | 125 Ų | 125 | 142.3 Ų | 142.3 | 67% | 0.668 | 80% | 0.803 | S | S | * | * | 176.8 | 131.9 | 104.9 | -112 | -10.6 | 0 | 0 | 0 | 113.9 | |||||
| 82 | M | 42.2 | Very low | 37.4 | Very low | 166 Ų | 166 | 145.5 Ų | 145.5 | 82% | 0.818 | 80% | 0.8 | S | S | * | * | trans | 60 | 133 | 139.9 | -60 | -174.6 | -170.8 | 0 | 0 | 118.9 | ||||
| 83 | A | 38 | Very low | 37.3 | Very low | 82 Ų | 82 | 150.3 Ų | 150.3 | 68% | 0.678 | 80% | 0.802 | S | S | * | * | cis | -163.2 | 172.1 | 16.2 | 0 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 84 | D | 39.4 | Very low | 37.8 | Very low | 140 Ų | 140 | 150.5 Ų | 150.5 | 75% | 0.749 | 80% | 0.804 | S | S | * | * | trans | 87.1 | 103.3 | 156.8 | -60.8 | -17.2 | 0 | 0 | 0 | 120.4 | ||||
| 85 | N | 37.8 | Very low | 37.6 | Very low | 144 Ų | 144 | 150.2 Ų | 150.2 | 77% | 0.77 | 80% | 0.8 | S | S | * | * | trans | 69 | 98.2 | 134.5 | -65.5 | -15.6 | 0 | 0 | 0 | 118.4 | ||||
| 86 | M | 42.1 | Very low | 37.9 | Very low | 182 Ų | 182 | 144.2 Ų | 144.2 | 90% | 0.897 | 78% | 0.784 | S | S | * | * | 166.7 | 119.5 | 106.7 | -81.3 | -94 | -107.6 | 0 | 0 | 111 | |||||
| 87 | S | 37.1 | Very low | 37.6 | Very low | 117 Ų | 117 | 147.5 Ų | 147.5 | 82% | 0.818 | 79% | 0.787 | S | S | * | * | trans | 21.9 | 131.3 | 156.8 | -68.3 | 0 | 0 | 0 | 0 | 123 | ||||
| 88 | D | 30.5 | Very low | 37.4 | Very low | 156 Ų | 156 | 140.7 Ų | 140.7 | 83% | 0.834 | 78% | 0.777 | S | S | * | * | trans | -41.4 | 133.4 | 168.3 | -69.7 | -51.4 | 0 | 0 | 0 | 116 | ||||
| 89 | S | 40 | Very low | 37.5 | Very low | 120 Ų | 120 | 145.1 Ų | 145.1 | 84% | 0.839 | 78% | 0.784 | S | S | * | * | trans | -142.7 | 114.1 | 143.4 | -76.5 | 0 | 0 | 0 | 0 | 109.1 | S91 | S89-S91 PolarHBondContact O-N 3.43Š| ||
| 90 | R | 38 | Very low | 37.1 | Very low | 234 Ų | 234 | 147.2 Ų | 147.2 | 88% | 0.883 | 79% | 0.789 | S | S | * | * | trans | -58.2 | 114.3 | -178.6 | -71.1 | 169.1 | 162 | -175.2 | -6.4 | 111 | I92 | R90-I92 PolarHBondContact O-N 2.96Š| ||
| 91 | S | 34 | Very low | 36.9 | Very low | 120 Ų | 120 | 147.2 Ų | 147.2 | 84% | 0.839 | 79% | 0.794 | S | S | * | * | trans | -72.8 | 115 | 160.4 | -67.6 | 0 | 0 | 0 | 0 | 109.6 | S89 | S89-S91 PolarHBondContact O-N 3.43Š| ||
| 92 | I | 42.2 | Very low | 36.7 | Very low | 147 Ų | 147 | 146.6 Ų | 146.6 | 75% | 0.754 | 80% | 0.799 | S | S | * | * | trans | -96.3 | 99 | 165.1 | -56.9 | 172.5 | 0 | 0 | 0 | 106.4 | R90 | R90-I92 PolarHBondContact O-N 2.96Š| ||
| 93 | E | 30.6 | Very low | 36 | Very low | 178 Ų | 178 | 147.6 Ų | 147.6 | 83% | 0.832 | 81% | 0.805 | S | S | * | * | trans | -70.6 | 131.9 | 156.4 | -75.8 | -176.9 | 153.5 | 0 | 0 | 108.1 | ||||
| 94 | S | 40 | Very low | 35.6 | Very low | 111 Ų | 111 | 147 Ų | 147 | 78% | 0.776 | 81% | 0.806 | S | S | * | * | trans | -140.5 | 115 | 160.9 | -74.2 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 95 | K | 34.9 | Very low | 35.2 | Very low | 185 Ų | 185 | 147.1 Ų | 147.1 | 80% | 0.804 | 81% | 0.807 | S | S | * | * | trans | -75.2 | 146.6 | 175.9 | -79.7 | 173.1 | 172.2 | 169.8 | 0 | 111 | ||||
| 96 | S | 36.7 | Very low | 34.8 | Very low | 84 Ų | 84 | 144.5 Ų | 144.5 | 59% | 0.587 | 81% | 0.813 | S | S | * | * | trans | 68 | 123.2 | 134.8 | 69.9 | 0 | 0 | 0 | 0 | 120 | ||||
| 97 | H | 36.8 | Very low | 34.4 | Very low | 182 Ų | 182 | 145.6 Ų | 145.6 | 84% | 0.843 | 81% | 0.809 | S | S | * | * | -177.7 | 147.5 | 87.8 | -87.2 | -44.7 | 0 | 0 | 0 | 112 | |||||
| 98 | S | 33.5 | Very low | 34.3 | Very low | 104 Ų | 104 | 147.9 Ų | 147.9 | 73% | 0.727 | 81% | 0.811 | S | S | * | * | trans | -74 | 151 | 172.3 | 64.3 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 99 | R | 39.2 | Very low | 34.4 | Very low | 239 Ų | 239 | 148.9 Ų | 148.9 | 90% | 0.902 | 81% | 0.811 | S | S | * | * | -179.8 | 130.2 | 120 | -101.4 | 170.5 | 168.8 | 178.3 | -2.9 | 112.8 | |||||
| 100 | N | 30 | Very low | 34.4 | Very low | 163 Ų | 163 | 146.5 Ų | 146.5 | 87% | 0.872 | 79% | 0.791 | S | S | * | * | trans | -29.9 | 138.2 | 158.9 | -61.6 | -10.7 | 0 | 0 | 0 | 115.2 | ||||
| 101 | S | 32.6 | Very low | 34.3 | Very low | 113 Ų | 113 | 143.2 Ų | 143.2 | 79% | 0.79 | 79% | 0.791 | S | S | * | * | trans | 171 | 101.4 | 138.5 | -179.7 | 0 | 0 | 0 | 0 | 106 | ||||
| 102 | S | 34.2 | Very low | 34.7 | Very low | 111 Ų | 111 | 141.6 Ų | 141.6 | 78% | 0.776 | 79% | 0.793 | S | S | * | * | 114.9 | 137.4 | 84.7 | 177.4 | 0 | 0 | 0 | 0 | 107.7 | |||||
| 103 | M | 29.1 | Very low | 34.8 | Very low | 188 Ų | 188 | 136.9 Ų | 136.9 | 93% | 0.926 | 77% | 0.773 | S | S | * | * | trans | -54.7 | 136 | -173.3 | -59 | 177.1 | 73.7 | 0 | 0 | 112.8 | ||||
| 104 | G | 29.4 | Very low | 35.3 | Very low | 68 Ų | 68 | 132.8 Ų | 132.8 | 70% | 0.701 | 76% | 0.762 | S | S | * | * | trans | 162.8 | 102.9 | 168.6 | 0 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 105 | N | 30.8 | Very low | 35.6 | Very low | 144 Ų | 144 | 131.3 Ų | 131.3 | 77% | 0.77 | 76% | 0.757 | S | S | * | * | trans | 36.3 | 109.6 | 166.8 | -66.1 | 1.4 | 0 | 0 | 0 | 117.6 | Y107 | N105-Y107 WeakPolarHBondContact O-CD2 3.44Å; N105-Y107 WeakPolarHBondContact O-CE2 3.4Å; N105-Y107 PolarHBondContact O-N 3.1Å | ||
| 106 | G | 28.8 | Very low | 36 | Very low | 88 Ų | 88 | 125.4 Ų | 125.4 | 91% | 0.907 | 74% | 0.736 | S | S | * | * | trans | -55.7 | 113.6 | -174.8 | 0 | 0 | 0 | 0 | 0 | 114.8 | ||||
| 107 | Y | 34.3 | Very low | 36.2 | Very low | 205 Ų | 205 | 125.3 Ų | 125.3 | 80% | 0.804 | 73% | 0.732 | S | S | * | * | trans | -102.6 | 118 | 163 | -67.1 | -85.5 | 0 | 0 | 0 | 108.3 | N105 Q109 | N105-Y107 WeakPolarHBondContact O-CD2 3.44Å; N105-Y107 WeakPolarHBondContact O-CE2 3.4Å; N105-Y107 PolarHBondContact O-N 3.1Å; Y107-Q109 PolarHBondContact O-N 3.23Å | ||
| 108 | L | 33.9 | Very low | 36.4 | Very low | 166 Ų | 166 | 119 Ų | 119 | 87% | 0.869 | 71% | 0.712 | S | S | * | * | trans | -79.1 | 90.5 | 166.7 | -104 | 146.6 | 0 | 0 | 0 | 107.7 | V110 | L108-V110 PolarHBondContact O-N 2.86Š| ||
| 109 | Q | 32.8 | Very low | 37 | Very low | 176 Ų | 176 | 121.2 Ų | 121.2 | 82% | 0.822 | 71% | 0.712 | S | S | * | * | trans | -69.9 | 113.3 | 162.2 | -115.9 | 174.7 | 5.2 | 0 | 0 | 107.4 | Y107 | Y107-Q109 PolarHBondContact O-N 3.23Š| ||
| 110 | V | 40.6 | Very low | 37 | Very low | 71 Ų | 71 | 112.8 Ų | 112.8 | 43% | 0.43 | 70% | 0.699 | S | S | . | * | trans | -98.8 | 119.7 | 166 | -179.7 | 0 | 0 | 0 | 0 | 105.9 | L108 G112 | L108-V110 PolarHBondContact O-N 2.86Å; V110-G112 PolarHBondContact O-N 2.63Å | ||
| 111 | D | 36.5 | Very low | 37.5 | Very low | 164 Ų | 164 | 109.9 Ų | 109.9 | 88% | 0.877 | 69% | 0.692 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -45.6 | 123.2 | 179.9 | -76.1 | -37.1 | 0 | 0 | 0 | 111.5 | ||
| 112 | G | 40.9 | Very low | 37.9 | Very low | 86 Ų | 86 | 112 Ų | 112 | 89% | 0.887 | 70% | 0.7 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 92.4 | -3.9 | 163 | 0 | 0 | 0 | 0 | 0 | 118.7 | V110 | V110-G112 PolarHBondContact O-N 2.63Š|
| 113 | S | 45.1 | Very low | 38.5 | Very low | 48 Ų | 48 | 109.6 Ų | 109.6 | 34% | 0.336 | 69% | 0.693 | S | S | . | * | S | Bend | trans | -106.6 | 137.7 | 174.3 | -76.9 | 0 | 0 | 0 | 0 | 111.9 | A115 E168 | S113-A115 PolarHBondContact O-N 3.42Å; S113-E168 PolarHBondContact OG-OE1 3.01Å; S113-E168 VanDerWaalsContact OG-OE1 3.1Å |
| 114 | P | 41.9 | Very low | 39.4 | Very low | 93 Ų | 93 | 106.9 Ų | 106.9 | 60% | 0.604 | 68% | 0.682 | S | S | * | * | trans | -59.3 | 124.4 | 177.1 | 24.1 | -32 | 0 | 0 | 0 | 110 | V116 | P114-V116 PolarHBondContact O-N 3.13Š| ||
| 115 | A | 45.3 | Very low | 40.4 | Very low | 80 Ų | 80 | 112.4 Ų | 112.4 | 66% | 0.661 | 69% | 0.69 | S | S | * | * | trans | -69.3 | 95.8 | 174.9 | 0 | 0 | 0 | 0 | 0 | 109.3 | S113 | S113-A115 PolarHBondContact O-N 3.42Š| ||
| 116 | V | 42.9 | Very low | 41.1 | Very low | 60 Ų | 60 | 110.9 Ų | 110.9 | 36% | 0.364 | 68% | 0.681 | S | S | . | * | trans | -87.7 | 116.1 | 173.5 | -169.6 | 0 | 0 | 0 | 0 | 109.1 | P114 I161 | P114-V116 PolarHBondContact O-N 3.13Å; V116-I161 HydrophobicContact CB-CG2 3.62Å; V116-I161 HydrophobicContact CG1-CB 4.28Å; V116-I161 HydrophobicContact CG1-CD1 3.32Å; V116-I161 HydrophobicContact CG1-CG1 3.75Å; V116-I161 HydrophobicContact CG1-CG2 3.58Å; V116-I161 HydrophobicContact CG2-CG2 4.22Å | ||
| 117 | V | 41.1 | Very low | 42 | Very low | 83 Ų | 83 | 107.5 Ų | 107.5 | 50% | 0.503 | 65% | 0.647 | S | S | . | * | trans | -111.8 | 115.7 | 179.2 | -178.4 | 0 | 0 | 0 | 0 | 109.4 | M119 | V117-M119 HydrophobicContact CG1-CG 3.95Š| ||
| 118 | A | 42.3 | Very low | 42.4 | Very low | 50 Ų | 50 | 100 Ų | 100 | 41% | 0.413 | 62% | 0.624 | S | S | . | * | trans | -93.9 | 105.3 | 171 | 0 | 0 | 0 | 0 | 0 | 109.7 | Q158 | A118-Q158 HydrophobicContact CB-CB 4.44Å; A118-Q158 HydrophobicContact CB-CG 3.58Å | ||
| 119 | M | 44.1 | Very low | 42.9 | Very low | 150 Ų | 150 | 92.2 Ų | 92.2 | 74% | 0.739 | 58% | 0.583 | S | S | * | * | trans | -102.7 | 108.6 | 169.1 | -68.9 | -144.1 | -52.5 | 0 | 0 | 110 | V117 | V117-M119 HydrophobicContact CG1-CG 3.95Š| ||
| 120 | G | 40.5 | Very low | 43.6 | Very low | 61 Ų | 61 | 86.7 Ų | 86.7 | 63% | 0.629 | 56% | 0.562 | S | S | * | * | trans | -95.9 | 117.8 | 169.7 | 0 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 121 | S | 39.4 | Very low | 43.8 | Very low | 102 Ų | 102 | 85.6 Ų | 85.6 | 71% | 0.713 | 55% | 0.553 | S | S | * | * | trans | -85.3 | 130.1 | 165.5 | -177.7 | 0 | 0 | 0 | 0 | 109.3 | G123 | S121-G123 PolarHBondContact O-N 2.91Š| ||
| 122 | T | 42.2 | Very low | 44.2 | Very low | 157 Ų | 157 | 80.8 Ų | 80.8 | 96% | 0.963 | 54% | 0.536 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -78.3 | 22.6 | -177.8 | 47.8 | 0 | 0 | 0 | 0 | 114 | ||
| 123 | G | 47.1 | Very low | 44.3 | Very low | 61 Ų | 61 | 84.2 Ų | 84.2 | 63% | 0.629 | 53% | 0.527 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -110.7 | -21.6 | -167.9 | 0 | 0 | 0 | 0 | 0 | 117.3 | S121 | S121-G123 PolarHBondContact O-N 2.91Š|
| 124 | D | 46.4 | Very low | 44.2 | Very low | 131 Ų | 131 | 89.5 Ų | 89.5 | 70% | 0.701 | 55% | 0.546 | S | S | * | . | S | Bend | trans | -124.2 | 146 | -171.1 | -77.9 | -40.7 | 0 | 0 | 0 | 112.1 | N126 | D124-N126 PolarHBondContact O-N 3.42Š|
| 125 | Q | 51.7 | Low | 44.4 | Very low | 185 Ų | 185 | 91 Ų | 91 | 86% | 0.864 | 54% | 0.543 | S | S | * | . | S | Bend | trans | -63.8 | -6.6 | 177.9 | -65.8 | -177.9 | 0.7 | 0 | 0 | 113.3 | ||
| 126 | N | 46.1 | Very low | 44.3 | Very low | 111 Ų | 111 | 91.2 Ų | 91.2 | 59% | 0.594 | 55% | 0.545 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -115.5 | 124.7 | 174.8 | -66.4 | -19.5 | 0 | 0 | 0 | 109.6 | D124 | D124-N126 PolarHBondContact O-N 3.42Å |
| 127 | G | 46.8 | Very low | 44.6 | Very low | 17 Ų | 17 | 98 Ų | 98 | 18% | 0.175 | 57% | 0.572 | C | S | . | * | E | Extended strand (participates in β ladder) | trans | -81.6 | 124.8 | 172.7 | 0 | 0 | 0 | 0 | 0 | 109.8 | ||
| 128 | S | 42.6 | Very low | 44.8 | Very low | 47 Ų | 47 | 100.4 Ų | 100.4 | 33% | 0.329 | 58% | 0.582 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -88.3 | 132.1 | 172.1 | -179 | 0 | 0 | 0 | 0 | 110.1 | ||
| 129 | V | 43.8 | Very low | 44.5 | Very low | 3 Ų | 3 | 101 Ų | 101 | 2% | 0.018 | 59% | 0.594 | C | S | . | * | E | Extended strand (participates in β ladder) | trans | -116.4 | 111.1 | 169.1 | -178.4 | 0 | 0 | 0 | 0 | 107.2 | I131 L149 A154 Q158 | V129-I131 HydrophobicContact CG1-CG1 4.06Å; V129-L149 HydrophobicContact CB-CD1 4.47Å; V129-L149 HydrophobicContact CG2-CD1 4.39Å; V129-A154 HydrophobicContact CG2-CB 3.53Å; V129-Q158 HydrophobicContact CG2-CG 4.45Å |
| 130 | V | 48.8 | Very low | 44.3 | Very low | 61 Ų | 61 | 100.7 Ų | 100.7 | 37% | 0.37 | 60% | 0.595 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -89.6 | 110.4 | 174.9 | -177.6 | 0 | 0 | 0 | 0 | 108.1 | ||
| 131 | I | 44.1 | Very low | 44.3 | Very low | 48 Ų | 48 | 104.8 Ų | 104.8 | 25% | 0.246 | 60% | 0.602 | C | S | . | * | E | Extended strand (participates in β ladder) | trans | -96.4 | 98.5 | 170.9 | -52 | 177.4 | 0 | 0 | 0 | 107.2 | V129 F133 | V129-I131 HydrophobicContact CG1-CG1 4.06Å; I131-F133 HydrophobicContact CB-CE2 4.35Å; I131-F133 HydrophobicContact CG2-CD2 4.1Å; I131-F133 HydrophobicContact CG2-CE1 4.11Å; I131-F133 HydrophobicContact CG2-CE2 3.47Å; I131-F133 VanDerWaalsContact CG2-CE2 3.47Å; I131-F133 HydrophobicContact CG2-CZ 3.48Å; I131-F133 VanDerWaalsContact CG2-CZ 3.48Å |
| 132 | A | 45.8 | Very low | 44.2 | Very low | 62 Ų | 62 | 109.8 Ų | 109.8 | 51% | 0.512 | 61% | 0.605 | S | S | . | * | trans | -89.9 | 118.8 | 171.4 | 0 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 133 | F | 42.4 | Very low | 44.2 | Very low | 159 Ų | 159 | 109.4 Ų | 109.4 | 70% | 0.697 | 60% | 0.597 | S | S | * | * | trans | -94.6 | 113.3 | 166.2 | -61.2 | -82.6 | 0 | 0 | 0 | 108.1 | I131 K135 | I131-F133 HydrophobicContact CB-CE2 4.35Å; I131-F133 HydrophobicContact CG2-CD2 4.1Å; I131-F133 HydrophobicContact CG2-CE1 4.11Å; I131-F133 HydrophobicContact CG2-CE2 3.47Å; I131-F133 VanDerWaalsContact CG2-CE2 3.47Å; I131-F133 HydrophobicContact CG2-CZ 3.48Å; I131-F133 VanDerWaalsContact CG2-CZ 3.48Å; F133-K135 PolarHBondContact O-N 3.02Å | ||
| 134 | E | 44 | Very low | 43.9 | Very low | 159 Ų | 159 | 110 Ų | 110 | 74% | 0.743 | 60% | 0.596 | S | S | * | * | trans | -88.2 | 106.5 | 175.1 | -160.3 | 157.1 | -140.2 | 0 | 0 | 110.5 | R142 | E134-R142 IonicContact OE1-NH2 3.91Š| ||
| 135 | K | 45.3 | Very low | 43.8 | Very low | 125 Ų | 125 | 106.2 Ų | 106.2 | 54% | 0.543 | 58% | 0.583 | S | S | . | * | trans | 20.6 | 118 | 158.9 | -101.5 | -177.6 | 172.4 | -177.7 | 0 | 119.5 | F133 L140 | F133-K135 PolarHBondContact O-N 3.02Å; K135-L140 WeakPolarHBondContact CE-O 3.35Å | ||
| 136 | A | 42.9 | Very low | 43.4 | Very low | 84 Ų | 84 | 102.9 Ų | 102.9 | 69% | 0.694 | 57% | 0.571 | S | S | * | * | trans | -60.5 | 147.1 | 140.3 | 0 | 0 | 0 | 0 | 0 | 109.6 | D138 | A136-D138 PolarHBondContact O-N 3.29Š| ||
| 137 | E | 50.1 | Low | 43.5 | Very low | 201 Ų | 201 | 101 Ų | 101 | 94% | 0.939 | 56% | 0.563 | S | S | * | * | S | Bend | trans | -54.2 | -12.5 | -173.5 | -69.3 | -172 | 138.4 | 0 | 0 | 115.3 | G139 | E137-G139 PolarHBondContact O-N 3.06Š|
| 138 | D | 45.2 | Very low | 43.6 | Very low | 134 Ų | 134 | 104.4 Ų | 104.4 | 72% | 0.717 | 58% | 0.584 | S | S | * | * | S | Bend | trans | -95.1 | 89.9 | 178.2 | -70.9 | -32.2 | 0 | 0 | 0 | 112 | A136 L140 | A136-D138 PolarHBondContact O-N 3.29Å; D138-L140 PolarHBondContact O-N 3.39Å |
| 139 | G | 36.3 | Very low | 44.1 | Very low | 64 Ų | 64 | 103.1 Ų | 103.1 | 66% | 0.66 | 57% | 0.573 | S | S | * | * | trans | 54 | -4.5 | 138.2 | 0 | 0 | 0 | 0 | 0 | 122.1 | E137 | E137-G139 PolarHBondContact O-N 3.06Š| ||
| 140 | L | 40 | Very low | 44.7 | Very low | 143 Ų | 143 | 106.3 Ų | 106.3 | 75% | 0.749 | 59% | 0.594 | S | S | * | * | trans | -88.9 | 132.6 | -169.3 | -91.8 | 140.5 | 0 | 0 | 0 | 111.5 | K135 D138 | K135-L140 WeakPolarHBondContact CE-O 3.35Å; D138-L140 PolarHBondContact O-N 3.39Å | ||
| 141 | D | 39.5 | Very low | 45.4 | Very low | 147 Ų | 147 | 106.5 Ų | 106.5 | 79% | 0.786 | 59% | 0.593 | S | S | * | * | trans | -51.5 | 140.8 | -176.4 | -74.7 | -44.1 | 0 | 0 | 0 | 112.8 | L143 | D141-L143 PolarHBondContact O-N 2.86Š| ||
| 142 | R | 38.3 | Very low | 46.7 | Very low | 206 Ų | 206 | 109.1 Ų | 109.1 | 78% | 0.777 | 61% | 0.611 | S | S | * | * | trans | -59.5 | 96.7 | 172.3 | -74.1 | 177.9 | 165 | -175.5 | -6.6 | 109.3 | E134 A144 | E134-R142 IonicContact OE1-NH2 3.91Å; R142-A144 VanDerWaalsContact C-N 3.26Å; R142-A144 PolarHBondContact O-N 3.21Å | ||
| 143 | L | 40.8 | Very low | 47.8 | Very low | 150 Ų | 150 | 110.8 Ų | 110.8 | 79% | 0.785 | 61% | 0.608 | S | S | * | * | trans | -76.2 | 83.5 | 161.7 | -97.2 | 146.4 | 0 | 0 | 0 | 108 | D141 A145 | D141-L143 PolarHBondContact O-N 2.86Å; L143-A145 VanDerWaalsContact C-N 3.28Å; L143-A145 PolarHBondContact O-N 2.82Å; L143-A145 VanDerWaalsContact O-N 3.11Å | ||
| 144 | A | 41.5 | Very low | 48.9 | Very low | 74 Ų | 74 | 103.3 Ų | 103.3 | 61% | 0.612 | 58% | 0.576 | S | S | * | * | trans | -73.3 | 90.1 | 159.2 | 0 | 0 | 0 | 0 | 0 | 107 | R142 D146 | R142-A144 VanDerWaalsContact C-N 3.26Å; R142-A144 PolarHBondContact O-N 3.21Å; A144-D146 PolarHBondContact O-N 2.9Å | ||
| 145 | A | 44.2 | Very low | 50.3 | Low | 51 Ų | 51 | 101 Ų | 101 | 42% | 0.421 | 56% | 0.564 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -78.8 | 99 | 168.7 | 0 | 0 | 0 | 0 | 0 | 107.7 | L143 V147 | L143-A145 VanDerWaalsContact C-N 3.28Å; L143-A145 PolarHBondContact O-N 2.82Å; L143-A145 VanDerWaalsContact O-N 3.11Å; A145-V147 VanDerWaalsContact C-N 3.29Å; A145-V147 HydrophobicContact CB-CG2 4.21Å; A145-V147 PolarHBondContact O-N 3.37Å |
| 146 | D | 43.2 | Very low | 51.9 | Low | 115 Ų | 115 | 99.4 Ų | 99.4 | 62% | 0.615 | 56% | 0.561 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -67.8 | 92.1 | 163.7 | -93.5 | -16.4 | 0 | 0 | 0 | 107.9 | A144 S148 | A144-D146 PolarHBondContact O-N 2.9Å; D146-S148 PolarHBondContact O-N 3.35Å |
| 147 | V | 48.6 | Very low | 53.5 | Low | 71 Ų | 71 | 99.4 Ų | 99.4 | 43% | 0.43 | 55% | 0.546 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -90.3 | 99.1 | 170.1 | -170.5 | 0 | 0 | 0 | 0 | 107.1 | A145 L149 | A145-V147 VanDerWaalsContact C-N 3.29Å; A145-V147 HydrophobicContact CB-CG2 4.21Å; A145-V147 PolarHBondContact O-N 3.37Å; V147-L149 VanDerWaalsContact C-N 3.34Å; V147-L149 HydrophobicContact CG1-CD2 3.95Å; V147-L149 HydrophobicContact CG1-CG 3.89Å; V147-L149 PolarHBondContact O-N 3.23Å |
| 148 | S | 48.9 | Very low | 54.8 | Low | 89 Ų | 89 | 92.2 Ų | 92.2 | 62% | 0.622 | 51% | 0.512 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -71.8 | 93.1 | 168 | -64.4 | 0 | 0 | 0 | 0 | 108.6 | D146 | D146-S148 PolarHBondContact O-N 3.35Å |
| 149 | L | 52 | Low | 56.5 | Low | 20 Ų | 20 | 89.1 Ų | 89.1 | 11% | 0.105 | 50% | 0.495 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -80 | 142.7 | 172.9 | -70.4 | 164.2 | 0 | 0 | 0 | 109.2 | V129 V147 N151 E153 A154 H157 | V129-L149 HydrophobicContact CB-CD1 4.47Å; V129-L149 HydrophobicContact CG2-CD1 4.39Å; V147-L149 VanDerWaalsContact C-N 3.34Å; V147-L149 HydrophobicContact CG1-CD2 3.95Å; V147-L149 HydrophobicContact CG1-CG 3.89Å; V147-L149 PolarHBondContact O-N 3.23Å; L149-N151 PolarHBondContact O-N 3.18Å; L149-E153 HydrophobicContact CB-CB 3.96Å; L149-E153 HydrophobicContact CD2-CB 4.06Å; L149-E153 WeakPolarHBondContact CD2-OE2 3.46Å; L149-E153 HydrophobicContact CG-CB 4.44Å; L149-A154 HydrophobicContact CB-CB 3.97Å; L149-H157 HydrophobicContact CD1-CB 4.23Å; L149-H157 WeakPolarHBondContact CD1-CD2 3.38Å |
| 150 | P | 56.9 | Low | 58.6 | Low | 69 Ų | 69 | 88.6 Ų | 88.6 | 45% | 0.448 | 49% | 0.485 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -47.2 | 140.3 | 163.9 | -22.4 | 30.6 | 0 | 0 | 0 | 109.5 | V152 E153 A154 | P150-V152 CarbonylContact O-C 3.52Å; P150-V152 PolarHBondContact O-N 3.02Å; P150-E153 VanDerWaalsContact CD-OE2 3.31Å; P150-E153 WeakPolarHBondContact CD-OE2 3.38Å; P150-E153 HydrophobicContact CG-CG 4.45Å; P150-E153 PolarHBondContact O-N 3Å; P150-A154 PolarHBondContact O-N 3.18Å |
| 151 | N | 64.7 | Low | 60.6 | Low | 66 Ų | 66 | 83.9 Ų | 83.9 | 35% | 0.353 | 46% | 0.46 | S | S | . | . | H | α-helix | trans | -48.1 | -31.3 | -172.2 | -171.8 | 1.4 | 0 | 0 | 0 | 114 | L149 K155 | L149-N151 PolarHBondContact O-N 3.18Å; N151-K155 WeakPolarHBondContact O-CB 3.39Å; N151-K155 VanDerWaalsContact O-CG 3.25Å; N151-K155 WeakPolarHBondContact O-CG 3.38Å; N151-K155 PolarHBondContact O-N 3.21Å; N151-K155 VanDerWaalsContact OD1-CE 3.24Å; N151-K155 WeakPolarHBondContact OD1-CE 3.07Å |
| 152 | V | 71.3 | Confident | 62.7 | Low | 103 Ų | 103 | 82.1 Ų | 82.1 | 62% | 0.624 | 45% | 0.45 | S | S | * | . | H | α-helix | trans | -69 | -51.1 | 174.4 | -175.7 | 0 | 0 | 0 | 0 | 111.9 | P150 A154 K155 D156 | P150-V152 CarbonylContact O-C 3.52Å; P150-V152 PolarHBondContact O-N 3.02Å; V152-A154 VanDerWaalsContact C-N 3.33Å; V152-A154 PolarHBondContact O-N 3Å; V152-K155 WeakPolarHBondContact O-CB 3.36Å; V152-K155 PolarHBondContact O-N 3.44Å; V152-D156 PolarHBondContact O-N 3.29Å |
| 153 | E | 68.7 | Low | 65.1 | Low | 96 Ų | 96 | 80.3 Ų | 80.3 | 45% | 0.449 | 44% | 0.443 | S | S | . | . | H | α-helix | trans | -64.9 | -36.1 | 178.9 | -68.2 | 178.2 | -167.6 | 0 | 0 | 112.2 | L149 P150 D156 H157 | L149-E153 HydrophobicContact CB-CB 3.96Å; L149-E153 HydrophobicContact CD2-CB 4.06Å; L149-E153 WeakPolarHBondContact CD2-OE2 3.46Å; L149-E153 HydrophobicContact CG-CB 4.44Å; P150-E153 VanDerWaalsContact CD-OE2 3.31Å; P150-E153 WeakPolarHBondContact CD-OE2 3.38Å; P150-E153 HydrophobicContact CG-CG 4.45Å; P150-E153 PolarHBondContact O-N 3Å; E153-D156 PolarHBondContact O-N 3.47Å; E153-H157 PolarHBondContact O-N 3.36Å; E153-H157 PolarHBondContact O-ND1 3.38Å |
| 154 | A | 65.1 | Low | 67.3 | Low | 2 Ų | 2 | 77.9 Ų | 77.9 | 2% | 0.017 | 43% | 0.43 | C | S | . | . | H | α-helix | trans | -59.1 | -47.5 | 172.5 | 0 | 0 | 0 | 0 | 0 | 111.4 | V129 L149 P150 V152 H157 Q158 | V129-A154 HydrophobicContact CG2-CB 3.53Å; L149-A154 HydrophobicContact CB-CB 3.97Å; P150-A154 PolarHBondContact O-N 3.18Å; V152-A154 VanDerWaalsContact C-N 3.33Å; V152-A154 PolarHBondContact O-N 3Å; A154-H157 PolarHBondContact O-N 3.48Å; A154-Q158 VanDerWaalsContact O-CG 3.31Å; A154-Q158 WeakPolarHBondContact O-CG 3.05Å; A154-Q158 PolarHBondContact O-N 2.94Å |
| 155 | K | 73.9 | Confident | 69.3 | Low | 112 Ų | 112 | 78.3 Ų | 78.3 | 49% | 0.487 | 42% | 0.416 | S | S | . | . | H | α-helix | trans | -64 | -41.6 | 175.7 | -75.8 | 173.3 | 178.3 | 176.6 | 0 | 111.7 | N151 V152 H157 Q158 I159 | N151-K155 WeakPolarHBondContact O-CB 3.39Å; N151-K155 VanDerWaalsContact O-CG 3.25Å; N151-K155 WeakPolarHBondContact O-CG 3.38Å; N151-K155 PolarHBondContact O-N 3.21Å; N151-K155 VanDerWaalsContact OD1-CE 3.24Å; N151-K155 WeakPolarHBondContact OD1-CE 3.07Å; V152-K155 WeakPolarHBondContact O-CB 3.36Å; V152-K155 PolarHBondContact O-N 3.44Å; K155-H157 VanDerWaalsContact C-N 3.32Å; K155-H157 PolarHBondContact O-N 2.8Å; K155-Q158 PolarHBondContact O-N 2.92Å; K155-I159 WeakPolarHBondContact O-CB 3.25Å; K155-I159 WeakPolarHBondContact O-CD1 3.22Å; K155-I159 WeakPolarHBondContact O-CG1 3.48Å; K155-I159 PolarHBondContact O-N 3.49Å |
| 156 | D | 78.6 | Confident | 71.5 | Confident | 91 Ų | 91 | 80.1 Ų | 80.1 | 49% | 0.487 | 42% | 0.418 | S | S | . | . | H | α-helix | trans | -63.1 | -38.5 | 177.3 | -72.2 | -22.8 | 0 | 0 | 0 | 111.8 | V152 E153 I159 A160 | V152-D156 PolarHBondContact O-N 3.29Å; E153-D156 PolarHBondContact O-N 3.47Å; D156-I159 PolarHBondContact O-N 2.99Å; D156-A160 WeakPolarHBondContact O-CB 3.4Å; D156-A160 PolarHBondContact O-N 2.91Å |
| 157 | H | 75.3 | Confident | 73.7 | Confident | 83 Ų | 83 | 80.6 Ų | 80.6 | 38% | 0.384 | 42% | 0.416 | S | S | . | . | H | α-helix | trans | -65 | -45.7 | 172.8 | -82.9 | 31.2 | 0 | 0 | 0 | 112.2 | L149 E153 A154 K155 I159 A160 I161 | L149-H157 HydrophobicContact CD1-CB 4.23Å; L149-H157 WeakPolarHBondContact CD1-CD2 3.38Å; E153-H157 PolarHBondContact O-N 3.36Å; E153-H157 PolarHBondContact O-ND1 3.38Å; A154-H157 PolarHBondContact O-N 3.48Å; K155-H157 VanDerWaalsContact C-N 3.32Å; K155-H157 PolarHBondContact O-N 2.8Å; H157-I159 VanDerWaalsContact C-N 3.29Å; H157-I159 PolarHBondContact O-N 3.44Å; H157-A160 WeakPolarHBondContact O-CB 3.48Å; H157-A160 PolarHBondContact O-N 3.48Å; H157-A160 VanDerWaalsContact O-N 3.13Å; H157-I161 WeakPolarHBondContact O-CD1 3.34Å; H157-I161 VanDerWaalsContact O-CG1 3.3Å; H157-I161 WeakPolarHBondContact O-CG1 3.24Å; H157-I161 PolarHBondContact O-N 2.92Å |
| 158 | Q | 77.8 | Confident | 75.6 | Confident | 50 Ų | 50 | 80.1 Ų | 80.1 | 23% | 0.234 | 41% | 0.41 | C | S | . | . | H | α-helix | trans | -58.6 | -42.5 | 174.6 | -68.6 | 179.7 | -1.3 | 0 | 0 | 111.6 | A118 V129 A154 K155 I161 L162 | A118-Q158 HydrophobicContact CB-CB 4.44Å; A118-Q158 HydrophobicContact CB-CG 3.58Å; V129-Q158 HydrophobicContact CG2-CG 4.45Å; A154-Q158 VanDerWaalsContact O-CG 3.31Å; A154-Q158 WeakPolarHBondContact O-CG 3.05Å; A154-Q158 PolarHBondContact O-N 2.94Å; K155-Q158 PolarHBondContact O-N 2.92Å; Q158-I161 PolarHBondContact O-N 3.04Å; Q158-L162 WeakPolarHBondContact O-CB 3.44Å; Q158-L162 VanDerWaalsContact O-CG 3.28Å; Q158-L162 WeakPolarHBondContact O-CG 3.44Å; Q158-L162 PolarHBondContact O-N 3.34Å |
| 159 | I | 81.2 | Confident | 77.6 | Confident | 69 Ų | 69 | 80.2 Ų | 80.2 | 35% | 0.354 | 40% | 0.403 | S | S | . | . | H | α-helix | trans | -62.6 | -42.6 | 175.2 | -69.8 | 164.4 | 0 | 0 | 0 | 110.7 | K155 D156 H157 L162 R163 | K155-I159 WeakPolarHBondContact O-CB 3.25Å; K155-I159 WeakPolarHBondContact O-CD1 3.22Å; K155-I159 WeakPolarHBondContact O-CG1 3.48Å; K155-I159 PolarHBondContact O-N 3.49Å; D156-I159 PolarHBondContact O-N 2.99Å; H157-I159 VanDerWaalsContact C-N 3.29Å; H157-I159 PolarHBondContact O-N 3.44Å; I159-L162 PolarHBondContact O-N 3.4Å; I159-R163 HydrophobicContact CG2-CG 4.42Å; I159-R163 WeakPolarHBondContact O-CB 3.35Å; I159-R163 VanDerWaalsContact O-CG 3.26Å; I159-R163 WeakPolarHBondContact O-CG 3.5Å; I159-R163 PolarHBondContact O-N 2.87Å |
| 160 | A | 81.2 | Confident | 79.6 | Confident | 54 Ų | 54 | 85 Ų | 85 | 45% | 0.446 | 42% | 0.424 | S | S | . | . | H | α-helix | trans | -62.8 | -43.4 | 177.4 | 0 | 0 | 0 | 0 | 0 | 112.2 | D156 H157 R163 L164 | D156-A160 WeakPolarHBondContact O-CB 3.4Å; D156-A160 PolarHBondContact O-N 2.91Å; H157-A160 WeakPolarHBondContact O-CB 3.48Å; H157-A160 PolarHBondContact O-N 3.48Å; H157-A160 VanDerWaalsContact O-N 3.13Å; A160-R163 PolarHBondContact O-N 3.3Å; A160-L164 PolarHBondContact O-N 3.06Å |
| 161 | I | 81.4 | Confident | 81.3 | Confident | 43 Ų | 43 | 84.5 Ų | 84.5 | 22% | 0.221 | 42% | 0.423 | C | S | . | . | H | α-helix | trans | -62.6 | -46.8 | 175.8 | -67.6 | 154.1 | 0 | 0 | 0 | 110.7 | V116 H157 Q158 R163 L164 R165 | V116-I161 HydrophobicContact CB-CG2 3.62Å; V116-I161 HydrophobicContact CG1-CB 4.28Å; V116-I161 HydrophobicContact CG1-CD1 3.32Å; V116-I161 HydrophobicContact CG1-CG1 3.75Å; V116-I161 HydrophobicContact CG1-CG2 3.58Å; V116-I161 HydrophobicContact CG2-CG2 4.22Å; H157-I161 WeakPolarHBondContact O-CD1 3.34Å; H157-I161 VanDerWaalsContact O-CG1 3.3Å; H157-I161 WeakPolarHBondContact O-CG1 3.24Å; H157-I161 PolarHBondContact O-N 2.92Å; Q158-I161 PolarHBondContact O-N 3.04Å; I161-R163 VanDerWaalsContact C-N 3.33Å; I161-R163 PolarHBondContact O-N 3.33Å; I161-L164 PolarHBondContact O-N 2.73Å; I161-R165 PolarHBondContact O-N 3.43Å |
| 162 | L | 82.8 | Confident | 82.5 | Confident | 110 Ų | 110 | 84.9 Ų | 84.9 | 58% | 0.576 | 43% | 0.43 | S | S | * | . | H | α-helix | trans | -62.6 | -39.6 | 177.5 | -73 | 171.9 | 0 | 0 | 0 | 111.7 | Q158 I159 R165 I166 | Q158-L162 WeakPolarHBondContact O-CB 3.44Å; Q158-L162 VanDerWaalsContact O-CG 3.28Å; Q158-L162 WeakPolarHBondContact O-CG 3.44Å; Q158-L162 PolarHBondContact O-N 3.34Å; I159-L162 PolarHBondContact O-N 3.4Å; L162-R165 PolarHBondContact O-N 2.93Å; L162-I166 VanDerWaalsContact O-CG1 3.26Å; L162-I166 WeakPolarHBondContact O-CG1 3.31Å; L162-I166 PolarHBondContact O-N 2.69Å |
| 163 | R | 88.1 | Confident | 83.6 | Confident | 168 Ų | 168 | 84.6 Ų | 84.6 | 63% | 0.634 | 43% | 0.425 | S | S | * | . | H | α-helix | trans | -62.1 | -44.5 | 174.3 | -76.6 | 174.3 | 179.9 | 176.8 | 2.4 | 111.9 | I159 A160 I161 R165 I166 Q167 | I159-R163 HydrophobicContact CG2-CG 4.42Å; I159-R163 WeakPolarHBondContact O-CB 3.35Å; I159-R163 VanDerWaalsContact O-CG 3.26Å; I159-R163 WeakPolarHBondContact O-CG 3.5Å; I159-R163 PolarHBondContact O-N 2.87Å; A160-R163 PolarHBondContact O-N 3.3Å; I161-R163 VanDerWaalsContact C-N 3.33Å; I161-R163 PolarHBondContact O-N 3.33Å; R163-R165 VanDerWaalsContact C-N 3.31Å; R163-R165 PolarHBondContact O-N 2.99Å; R163-I166 PolarHBondContact O-N 3.11Å; R163-Q167 WeakPolarHBondContact O-CG 3.39Å; R163-Q167 PolarHBondContact O-N 3.4Å |
| 164 | L | 87.6 | Confident | 84.7 | Confident | 99 Ų | 99 | 83.6 Ų | 83.6 | 52% | 0.518 | 43% | 0.429 | S | S | . | . | H | α-helix | trans | -62.5 | -41.4 | 176.5 | -168.4 | 129 | 0 | 0 | 0 | 110.9 | A160 I161 I166 Q167 E168 | A160-L164 PolarHBondContact O-N 3.06Å; I161-L164 PolarHBondContact O-N 2.73Å; L164-I166 PolarHBondContact O-N 3.07Å; L164-Q167 PolarHBondContact O-N 2.85Å; L164-E168 HydrophobicContact CD2-CG 4.49Å; L164-E168 WeakPolarHBondContact O-CG 3.23Å; L164-E168 PolarHBondContact O-N 3.27Å |
| 165 | R | 83.4 | Confident | 86 | Confident | 84 Ų | 84 | 90.2 Ų | 90.2 | 32% | 0.317 | 46% | 0.457 | S | S | . | . | H | α-helix | trans | -65 | -38.8 | 175.7 | -174.4 | 55 | 176 | 173.7 | -0.8 | 112.9 | I161 L162 R163 E168 L169 | I161-R165 PolarHBondContact O-N 3.43Å; L162-R165 PolarHBondContact O-N 2.93Å; R163-R165 VanDerWaalsContact C-N 3.31Å; R163-R165 PolarHBondContact O-N 2.99Å; R165-E168 WeakPolarHBondContact CD-OE2 3.46Å; R165-E168 IonicContact CZ-OE2 2.77Å; R165-E168 IonicContact NH1-OE2 3.15Å; R165-E168 PolarHBondContact NH1-OE2 2.93Å; R165-E168 PolarHBondContact O-N 3.48Å; R165-L169 HydrophobicContact CG-CD1 4.18Å; R165-L169 WeakPolarHBondContact O-CB 3.39Å; R165-L169 VanDerWaalsContact O-CG 3.28Å; R165-L169 WeakPolarHBondContact O-CG 3.36Å; R165-L169 PolarHBondContact O-N 3.15Å |
| 166 | I | 90.4 | Very high | 86.7 | Confident | 88 Ų | 88 | 87.6 Ų | 87.6 | 45% | 0.451 | 45% | 0.453 | S | S | . | . | H | α-helix | trans | -61.6 | -47.2 | 174 | -72.1 | 164.9 | 0 | 0 | 0 | 109.9 | L162 R163 L164 E168 L169 E170 | L162-I166 VanDerWaalsContact O-CG1 3.26Å; L162-I166 WeakPolarHBondContact O-CG1 3.31Å; L162-I166 PolarHBondContact O-N 2.69Å; R163-I166 PolarHBondContact O-N 3.11Å; L164-I166 PolarHBondContact O-N 3.07Å; I166-E168 VanDerWaalsContact C-N 3.35Å; I166-E168 PolarHBondContact O-N 3.34Å; I166-L169 PolarHBondContact O-N 3.45Å; I166-L169 VanDerWaalsContact O-N 3.17Å; I166-E170 HydrophobicContact CG2-CG 4.2Å; I166-E170 WeakPolarHBondContact CG2-OE1 3.49Å; I166-E170 WeakPolarHBondContact O-CB 3.28Å; I166-E170 VanDerWaalsContact O-CG 3.3Å; I166-E170 WeakPolarHBondContact O-CG 3.32Å; I166-E170 PolarHBondContact O-N 2.99Å |
| 167 | Q | 90.5 | Very high | 87.4 | Confident | 125 Ų | 125 | 87.4 Ų | 87.4 | 58% | 0.584 | 45% | 0.449 | S | S | * | . | H | α-helix | trans | -60.8 | -40.3 | 177.5 | -72.3 | 177.1 | -21.9 | 0 | 0 | 112.8 | R163 L164 S171 | R163-Q167 WeakPolarHBondContact O-CG 3.39Å; R163-Q167 PolarHBondContact O-N 3.4Å; L164-Q167 PolarHBondContact O-N 2.85Å; Q167-S171 WeakPolarHBondContact O-CB 3.42Å; Q167-S171 PolarHBondContact O-N 2.99Å |
| 168 | E | 88.3 | Confident | 88.2 | Confident | 62 Ų | 62 | 86.1 Ų | 86.1 | 29% | 0.29 | 45% | 0.453 | S | S | . | . | H | α-helix | trans | -62.4 | -45.4 | 173.6 | -73.9 | -179.2 | 163.7 | 0 | 0 | 112.1 | S113 L164 R165 I166 S171 S172 | S113-E168 PolarHBondContact OG-OE1 3.01Å; S113-E168 VanDerWaalsContact OG-OE1 3.1Å; L164-E168 HydrophobicContact CD2-CG 4.49Å; L164-E168 WeakPolarHBondContact O-CG 3.23Å; L164-E168 PolarHBondContact O-N 3.27Å; R165-E168 WeakPolarHBondContact CD-OE2 3.46Å; R165-E168 IonicContact CZ-OE2 2.77Å; R165-E168 IonicContact NH1-OE2 3.15Å; R165-E168 PolarHBondContact NH1-OE2 2.93Å; R165-E168 PolarHBondContact O-N 3.48Å; I166-E168 VanDerWaalsContact C-N 3.35Å; I166-E168 PolarHBondContact O-N 3.34Å; E168-S171 PolarHBondContact O-N 3.22Å; E168-S172 WeakPolarHBondContact O-CB 3.48Å; E168-S172 PolarHBondContact O-N 3.42Å |
| 169 | L | 91.3 | Very high | 88.9 | Confident | 91 Ų | 91 | 89.9 Ų | 89.9 | 48% | 0.476 | 47% | 0.474 | S | S | . | . | H | α-helix | trans | -66.7 | -39.7 | 179.2 | -72.8 | 173.3 | 0 | 0 | 0 | 111.7 | R165 I166 S172 L173 | R165-L169 HydrophobicContact CG-CD1 4.18Å; R165-L169 WeakPolarHBondContact O-CB 3.39Å; R165-L169 VanDerWaalsContact O-CG 3.28Å; R165-L169 WeakPolarHBondContact O-CG 3.36Å; R165-L169 PolarHBondContact O-N 3.15Å; I166-L169 PolarHBondContact O-N 3.45Å; I166-L169 VanDerWaalsContact O-N 3.17Å; L169-S172 PolarHBondContact O-N 3.16Å; L169-L173 VanDerWaalsContact O-CB 3.25Å; L169-L173 WeakPolarHBondContact O-CB 3.27Å; L169-L173 PolarHBondContact O-N 3.15Å |
| 170 | E | 93.9 | Very high | 89.3 | Confident | 119 Ų | 119 | 91 Ų | 91 | 56% | 0.556 | 48% | 0.479 | S | S | * | . | H | α-helix | trans | -63 | -43.9 | 174.2 | -74.3 | 173.6 | 165.4 | 0 | 0 | 111.4 | I166 L173 S174 | I166-E170 HydrophobicContact CG2-CG 4.2Å; I166-E170 WeakPolarHBondContact CG2-OE1 3.49Å; I166-E170 WeakPolarHBondContact O-CB 3.28Å; I166-E170 VanDerWaalsContact O-CG 3.3Å; I166-E170 WeakPolarHBondContact O-CG 3.32Å; I166-E170 PolarHBondContact O-N 2.99Å; E170-L173 PolarHBondContact O-N 2.89Å; E170-S174 WeakPolarHBondContact O-CB 3.48Å; E170-S174 PolarHBondContact O-N 3.36Å |
| 171 | S | 91.6 | Very high | 89.8 | Confident | 60 Ų | 60 | 96.4 Ų | 96.4 | 42% | 0.42 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -62.3 | -43.9 | 174.5 | -178.3 | 0 | 0 | 0 | 0 | 112.1 | Q167 E168 S174 K175 | Q167-S171 WeakPolarHBondContact O-CB 3.42Å; Q167-S171 PolarHBondContact O-N 2.99Å; E168-S171 PolarHBondContact O-N 3.22Å; S171-S174 PolarHBondContact O-N 3.42Å; S171-K175 WeakPolarHBondContact O-CG 3.49Å; S171-K175 PolarHBondContact O-N 3.15Å |
| 172 | S | 90.8 | Very high | 90.2 | Very high | 73 Ų | 73 | 97 Ų | 97 | 51% | 0.51 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -64.3 | -43 | 176.6 | -170.6 | 0 | 0 | 0 | 0 | 111.9 | E168 L169 K175 S176 | E168-S172 WeakPolarHBondContact O-CB 3.48Å; E168-S172 PolarHBondContact O-N 3.42Å; L169-S172 PolarHBondContact O-N 3.16Å; S172-K175 PolarHBondContact O-N 3.07Å; S172-S176 WeakPolarHBondContact O-CB 3.28Å; S172-S176 PolarHBondContact O-N 2.96Å |
| 173 | L | 93.4 | Very high | 90.6 | Very high | 98 Ų | 98 | 94.1 Ų | 94.1 | 51% | 0.513 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -61.8 | -45.3 | 175.4 | -178.4 | 64.3 | 0 | 0 | 0 | 111.2 | L169 E170 K175 S176 Q177 | L169-L173 VanDerWaalsContact O-CB 3.25Å; L169-L173 WeakPolarHBondContact O-CB 3.27Å; L169-L173 PolarHBondContact O-N 3.15Å; E170-L173 PolarHBondContact O-N 2.89Å; L173-K175 VanDerWaalsContact C-N 3.33Å; L173-K175 PolarHBondContact O-N 2.88Å; L173-S176 PolarHBondContact O-N 3.34Å; L173-Q177 HydrophobicContact CD1-CG 4.46Å; L173-Q177 WeakPolarHBondContact O-CG 3.45Å; L173-Q177 PolarHBondContact O-N 3.38Å |
| 174 | S | 91.7 | Very high | 90.8 | Very high | 75 Ų | 75 | 90.1 Ų | 90.1 | 52% | 0.524 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -59.3 | -42.5 | 176.2 | -177.2 | 0 | 0 | 0 | 0 | 111.9 | E170 S171 A178 | E170-S174 WeakPolarHBondContact O-CB 3.48Å; E170-S174 PolarHBondContact O-N 3.36Å; S171-S174 PolarHBondContact O-N 3.42Å; S174-A178 PolarHBondContact O-N 3.05Å |
| 175 | K | 92.4 | Very high | 90.9 | Very high | 141 Ų | 141 | 88.8 Ų | 88.8 | 61% | 0.613 | 48% | 0.476 | S | S | * | . | H | α-helix | trans | -64.7 | -43.5 | 175.4 | -71.8 | 174.3 | -175.8 | 177 | 0 | 111.7 | S171 S172 L173 A178 L179 | S171-K175 WeakPolarHBondContact O-CG 3.49Å; S171-K175 PolarHBondContact O-N 3.15Å; S172-K175 PolarHBondContact O-N 3.07Å; L173-K175 VanDerWaalsContact C-N 3.33Å; L173-K175 PolarHBondContact O-N 2.88Å; K175-A178 PolarHBondContact O-N 2.92Å; K175-L179 WeakPolarHBondContact O-CG 3.39Å; K175-L179 PolarHBondContact O-N 3.36Å |
| 176 | S | 89.6 | Confident | 91.4 | Very high | 57 Ų | 57 | 90.6 Ų | 90.6 | 40% | 0.399 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -62.2 | -43.9 | 177.4 | 178.8 | 0 | 0 | 0 | 0 | 111.9 | S172 L173 A178 L179 I180 | S172-S176 WeakPolarHBondContact O-CB 3.28Å; S172-S176 PolarHBondContact O-N 2.96Å; L173-S176 PolarHBondContact O-N 3.34Å; S176-A178 VanDerWaalsContact C-N 3.34Å; S176-A178 PolarHBondContact O-N 3.42Å; S176-L179 PolarHBondContact O-N 3.24Å; S176-I180 WeakPolarHBondContact O-CG1 3.49Å; S176-I180 PolarHBondContact O-N 3.25Å |
| 177 | Q | 93.3 | Very high | 91.5 | Very high | 86 Ų | 86 | 90.9 Ų | 90.9 | 40% | 0.402 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -62.8 | -38.8 | 175.6 | -72.9 | 177.5 | -9.4 | 0 | 0 | 112.4 | L173 I180 R181 | L173-Q177 HydrophobicContact CD1-CG 4.46Å; L173-Q177 WeakPolarHBondContact O-CG 3.45Å; L173-Q177 PolarHBondContact O-N 3.38Å; Q177-I180 PolarHBondContact O-N 3.41Å; Q177-R181 WeakPolarHBondContact O-CG 3.34Å; Q177-R181 PolarHBondContact O-N 3.49Å |
| 178 | A | 91.2 | Very high | 91.6 | Very high | 57 Ų | 57 | 91 Ų | 91 | 47% | 0.471 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -64.2 | -39.9 | 174.9 | 0 | 0 | 0 | 0 | 0 | 112.1 | S174 K175 S176 S182 | S174-A178 PolarHBondContact O-N 3.05Å; K175-A178 PolarHBondContact O-N 2.92Å; S176-A178 VanDerWaalsContact C-N 3.34Å; S176-A178 PolarHBondContact O-N 3.42Å; A178-S182 WeakPolarHBondContact O-CB 3.36Å; A178-S182 PolarHBondContact O-N 2.96Å |
| 179 | L | 91.8 | Very high | 91.8 | Very high | 128 Ų | 128 | 92.2 Ų | 92.2 | 67% | 0.67 | 50% | 0.499 | S | S | * | . | H | α-helix | trans | -65.4 | -40.9 | 174.7 | -70.8 | 173.2 | 0 | 0 | 0 | 112.2 | K175 S176 S182 A183 | K175-L179 WeakPolarHBondContact O-CG 3.39Å; K175-L179 PolarHBondContact O-N 3.36Å; S176-L179 PolarHBondContact O-N 3.24Å; L179-S182 WeakPolarHBondContact O-CB 3.45Å; L179-S182 PolarHBondContact O-N 3.29Å; L179-A183 PolarHBondContact O-N 3.23Å |
| 180 | I | 91.3 | Very high | 91.9 | Very high | 92 Ų | 92 | 91.4 Ų | 91.4 | 47% | 0.472 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -61.8 | -49.9 | 176.2 | -68.6 | 165.5 | 0 | 0 | 0 | 110.3 | S176 Q177 S182 A183 D184 | S176-I180 WeakPolarHBondContact O-CG1 3.49Å; S176-I180 PolarHBondContact O-N 3.25Å; Q177-I180 PolarHBondContact O-N 3.41Å; I180-S182 VanDerWaalsContact C-N 3.27Å; I180-S182 PolarHBondContact O-N 3.39Å; I180-A183 WeakPolarHBondContact O-CB 3.44Å; I180-A183 PolarHBondContact O-N 2.95Å; I180-D184 PolarHBondContact O-N 3.09Å |
| 181 | R | 90 | Very high | 91.9 | Very high | 168 Ų | 168 | 91 Ų | 91 | 63% | 0.634 | 50% | 0.495 | S | S | * | . | H | α-helix | trans | -58.3 | -40.2 | 176.9 | -69.8 | 176.2 | -170.8 | 156.4 | 4.5 | 112.1 | Q177 D184 T185 | Q177-R181 WeakPolarHBondContact O-CG 3.34Å; Q177-R181 PolarHBondContact O-N 3.49Å; R181-D184 PolarHBondContact O-N 2.99Å; R181-T185 WeakPolarHBondContact O-CG2 3.49Å; R181-T185 PolarHBondContact O-N 3.02Å; R181-T185 PolarHBondContact O-OG1 2.95Å |
| 182 | S | 91 | Very high | 92.1 | Very high | 56 Ų | 56 | 93.8 Ų | 93.8 | 39% | 0.392 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -61.4 | -45.7 | 174.7 | -175.4 | 0 | 0 | 0 | 0 | 111.5 | A178 L179 I180 D184 T185 Q186 | A178-S182 WeakPolarHBondContact O-CB 3.36Å; A178-S182 PolarHBondContact O-N 2.96Å; L179-S182 WeakPolarHBondContact O-CB 3.45Å; L179-S182 PolarHBondContact O-N 3.29Å; I180-S182 VanDerWaalsContact C-N 3.27Å; I180-S182 PolarHBondContact O-N 3.39Å; S182-D184 PolarHBondContact O-N 3.02Å; S182-T185 PolarHBondContact O-N 3.38Å; S182-T185 PolarHBondContact O-OG1 3.14Å; S182-Q186 WeakPolarHBondContact O-CG 3.46Å; S182-Q186 PolarHBondContact O-N 2.95Å |
| 183 | A | 91.3 | Very high | 92.3 | Very high | 50 Ų | 50 | 94.2 Ų | 94.2 | 41% | 0.413 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -63.7 | -39.6 | 177 | 0 | 0 | 0 | 0 | 0 | 112.6 | L179 I180 Q186 L187 | L179-A183 PolarHBondContact O-N 3.23Å; I180-A183 WeakPolarHBondContact O-CB 3.44Å; I180-A183 PolarHBondContact O-N 2.95Å; A183-Q186 WeakPolarHBondContact O-CB 3.49Å; A183-Q186 PolarHBondContact O-N 3.1Å; A183-L187 PolarHBondContact O-N 3.19Å |
| 184 | D | 91.1 | Very high | 92.3 | Very high | 84 Ų | 84 | 95.2 Ų | 95.2 | 45% | 0.449 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -61.8 | -46 | 175.8 | -68.2 | -25.8 | 0 | 0 | 0 | 110.9 | I180 R181 S182 Q186 L187 E188 | I180-D184 PolarHBondContact O-N 3.09Å; R181-D184 PolarHBondContact O-N 2.99Å; S182-D184 PolarHBondContact O-N 3.02Å; D184-Q186 VanDerWaalsContact C-N 3.3Å; D184-Q186 PolarHBondContact O-N 3.47Å; D184-L187 WeakPolarHBondContact O-CB 3.47Å; D184-L187 PolarHBondContact O-N 3.44Å; D184-L187 VanDerWaalsContact O-N 3.15Å; D184-E188 WeakPolarHBondContact O-CG 2.92Å; D184-E188 PolarHBondContact O-N 3.33Å |
| 185 | T | 91.5 | Very high | 92.5 | Very high | 70 Ų | 70 | 94.5 Ų | 94.5 | 43% | 0.429 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -63.4 | -34.9 | 175.3 | 60.7 | 0 | 0 | 0 | 0 | 112.7 | R181 S182 N189 | R181-T185 WeakPolarHBondContact O-CG2 3.49Å; R181-T185 PolarHBondContact O-N 3.02Å; R181-T185 PolarHBondContact O-OG1 2.95Å; S182-T185 PolarHBondContact O-N 3.38Å; S182-T185 PolarHBondContact O-OG1 3.14Å; T185-N189 WeakPolarHBondContact O-CB 3.23Å; T185-N189 PolarHBondContact O-N 2.91Å; T185-N189 PolarHBondContact O-ND2 3.33Å; T185-N189 VanDerWaalsContact O-ND2 3.16Å |
| 186 | Q | 92.9 | Very high | 92.7 | Very high | 122 Ų | 122 | 92.1 Ų | 92.1 | 57% | 0.57 | 49% | 0.488 | S | S | * | . | H | α-helix | trans | -67 | -40 | 174.4 | -73.8 | 179.9 | -4.9 | 0 | 0 | 111.6 | S182 A183 D184 N189 V190 | S182-Q186 WeakPolarHBondContact O-CG 3.46Å; S182-Q186 PolarHBondContact O-N 2.95Å; A183-Q186 WeakPolarHBondContact O-CB 3.49Å; A183-Q186 PolarHBondContact O-N 3.1Å; D184-Q186 VanDerWaalsContact C-N 3.3Å; D184-Q186 PolarHBondContact O-N 3.47Å; Q186-N189 PolarHBondContact O-N 3.13Å; Q186-V190 VanDerWaalsContact O-CG2 3.28Å; Q186-V190 WeakPolarHBondContact O-CG2 3.45Å; Q186-V190 PolarHBondContact O-N 2.96Å |
| 187 | L | 92.4 | Very high | 92.9 | Very high | 95 Ų | 95 | 97.2 Ų | 97.2 | 50% | 0.497 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -64.9 | -44.8 | 176.8 | -177.6 | 63 | 0 | 0 | 0 | 111.5 | A183 D184 N189 V190 Q191 | A183-L187 PolarHBondContact O-N 3.19Å; D184-L187 WeakPolarHBondContact O-CB 3.47Å; D184-L187 PolarHBondContact O-N 3.44Å; D184-L187 VanDerWaalsContact O-N 3.15Å; L187-N189 VanDerWaalsContact C-N 3.35Å; L187-N189 PolarHBondContact O-N 3.33Å; L187-V190 PolarHBondContact O-N 2.98Å; L187-Q191 WeakPolarHBondContact O-CG 3.49Å; L187-Q191 PolarHBondContact O-N 3.45Å |
| 188 | E | 92.2 | Very high | 93 | Very high | 128 Ų | 128 | 98.6 Ų | 98.6 | 60% | 0.598 | 51% | 0.505 | S | S | * | . | H | α-helix | trans | -58 | -46.7 | 174.4 | -73.2 | 178.5 | 176.5 | 0 | 0 | 111.2 | D184 V190 Q191 E192 | D184-E188 WeakPolarHBondContact O-CG 2.92Å; D184-E188 PolarHBondContact O-N 3.33Å; E188-V190 VanDerWaalsContact C-N 3.33Å; E188-V190 PolarHBondContact O-N 2.93Å; E188-Q191 PolarHBondContact O-N 3.46Å; E188-E192 PolarHBondContact O-N 2.94Å |
| 189 | N | 92.4 | Very high | 93.2 | Very high | 86 Ų | 86 | 100.8 Ų | 100.8 | 46% | 0.46 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -61.4 | -39.5 | 176.7 | -70.6 | -22.8 | 0 | 0 | 0 | 112.4 | T185 Q186 L187 E192 I193 | T185-N189 WeakPolarHBondContact O-CB 3.23Å; T185-N189 PolarHBondContact O-N 2.91Å; T185-N189 PolarHBondContact O-ND2 3.33Å; T185-N189 VanDerWaalsContact O-ND2 3.16Å; Q186-N189 PolarHBondContact O-N 3.13Å; L187-N189 VanDerWaalsContact C-N 3.35Å; L187-N189 PolarHBondContact O-N 3.33Å; N189-E192 PolarHBondContact O-N 2.96Å; N189-I193 WeakPolarHBondContact O-CB 3.48Å; N189-I193 WeakPolarHBondContact O-CD1 3.42Å; N189-I193 VanDerWaalsContact O-CG1 3.23Å; N189-I193 WeakPolarHBondContact O-CG1 3.48Å; N189-I193 PolarHBondContact O-N 3.1Å |
| 190 | V | 94.1 | Very high | 93.4 | Very high | 74 Ų | 74 | 99.1 Ų | 99.1 | 45% | 0.448 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -64.8 | -43.5 | 177 | 168.9 | 0 | 0 | 0 | 0 | 110.8 | Q186 L187 E188 E192 I193 E194 | Q186-V190 VanDerWaalsContact O-CG2 3.28Å; Q186-V190 WeakPolarHBondContact O-CG2 3.45Å; Q186-V190 PolarHBondContact O-N 2.96Å; L187-V190 PolarHBondContact O-N 2.98Å; E188-V190 VanDerWaalsContact C-N 3.33Å; E188-V190 PolarHBondContact O-N 2.93Å; V190-E192 VanDerWaalsContact C-N 3.35Å; V190-E192 PolarHBondContact O-N 3.27Å; V190-I193 PolarHBondContact O-N 2.95Å; V190-E194 WeakPolarHBondContact O-CG 3.46Å; V190-E194 PolarHBondContact O-N 2.93Å |
| 191 | Q | 94.3 | Very high | 93.6 | Very high | 110 Ų | 110 | 100.5 Ų | 100.5 | 51% | 0.514 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -63.5 | -40 | 176.7 | -70.4 | 175.9 | -3.2 | 0 | 0 | 111.9 | L187 E188 E194 S195 | L187-Q191 WeakPolarHBondContact O-CG 3.49Å; L187-Q191 PolarHBondContact O-N 3.45Å; E188-Q191 PolarHBondContact O-N 3.46Å; Q191-E194 PolarHBondContact O-N 3.41Å; Q191-S195 WeakPolarHBondContact O-CB 3.4Å; Q191-S195 PolarHBondContact O-N 3.21Å |
| 192 | E | 94.9 | Very high | 93.9 | Very high | 120 Ų | 120 | 96.6 Ų | 96.6 | 56% | 0.561 | 49% | 0.492 | S | S | * | . | H | α-helix | trans | -63.4 | -44.2 | 174.6 | -172.8 | 175.5 | -168.8 | 0 | 0 | 111.5 | E188 N189 V190 E194 S195 L196 | E188-E192 PolarHBondContact O-N 2.94Å; N189-E192 PolarHBondContact O-N 2.96Å; V190-E192 VanDerWaalsContact C-N 3.35Å; V190-E192 PolarHBondContact O-N 3.27Å; E192-E194 VanDerWaalsContact C-N 3.33Å; E192-E194 PolarHBondContact O-N 2.97Å; E192-S195 WeakPolarHBondContact O-CB 3.38Å; E192-S195 PolarHBondContact O-N 3.37Å; E192-L196 HydrophobicContact CG-CD1 4.19Å; E192-L196 WeakPolarHBondContact O-CB 3.26Å; E192-L196 WeakPolarHBondContact O-CG 3.43Å; E192-L196 PolarHBondContact O-N 3.29Å |
| 193 | I | 94.5 | Very high | 94.2 | Very high | 82 Ų | 82 | 99.6 Ų | 99.6 | 42% | 0.421 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -61.1 | -41.1 | 176 | -71.1 | 165.9 | 0 | 0 | 0 | 111.3 | N189 V190 L196 R197 | N189-I193 WeakPolarHBondContact O-CB 3.48Å; N189-I193 WeakPolarHBondContact O-CD1 3.42Å; N189-I193 VanDerWaalsContact O-CG1 3.23Å; N189-I193 WeakPolarHBondContact O-CG1 3.48Å; N189-I193 PolarHBondContact O-N 3.1Å; V190-I193 PolarHBondContact O-N 2.95Å; I193-L196 PolarHBondContact O-N 3.07Å; I193-R197 WeakPolarHBondContact O-CB 3.42Å; I193-R197 VanDerWaalsContact O-CG 3.26Å; I193-R197 WeakPolarHBondContact O-CG 3.38Å; I193-R197 PolarHBondContact O-N 3.04Å |
| 194 | E | 94.8 | Very high | 94.4 | Very high | 118 Ų | 118 | 102.9 Ų | 102.9 | 55% | 0.551 | 51% | 0.51 | S | S | * | . | H | α-helix | trans | -65.2 | -42.3 | 176.5 | -74.4 | -178.8 | 172.3 | 0 | 0 | 112 | V190 Q191 E192 R197 H198 | V190-E194 WeakPolarHBondContact O-CG 3.46Å; V190-E194 PolarHBondContact O-N 2.93Å; Q191-E194 PolarHBondContact O-N 3.41Å; E192-E194 VanDerWaalsContact C-N 3.33Å; E192-E194 PolarHBondContact O-N 2.97Å; E194-R197 PolarHBondContact O-N 3.43Å; E194-H198 PolarHBondContact O-N 3.49Å |
| 195 | S | 95.4 | Very high | 94.6 | Very high | 60 Ų | 60 | 101.8 Ų | 101.8 | 42% | 0.42 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -59.6 | -47.9 | 173.9 | -179.9 | 0 | 0 | 0 | 0 | 111.7 | Q191 E192 R197 H198 Q199 | Q191-S195 WeakPolarHBondContact O-CB 3.4Å; Q191-S195 PolarHBondContact O-N 3.21Å; E192-S195 WeakPolarHBondContact O-CB 3.38Å; E192-S195 PolarHBondContact O-N 3.37Å; S195-R197 VanDerWaalsContact C-N 3.35Å; S195-R197 PolarHBondContact O-N 2.9Å; S195-H198 WeakPolarHBondContact O-CB 3.35Å; S195-H198 PolarHBondContact O-N 3.23Å; S195-Q199 WeakPolarHBondContact O-CG 3.5Å; S195-Q199 PolarHBondContact O-N 3.41Å |
| 196 | L | 95.7 | Very high | 94.9 | Very high | 92 Ų | 92 | 101.8 Ų | 101.8 | 48% | 0.482 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -63 | -39.5 | 177.6 | -71.7 | 172.1 | 0 | 0 | 0 | 112.1 | E192 I193 H198 Q199 L200 | E192-L196 HydrophobicContact CG-CD1 4.19Å; E192-L196 WeakPolarHBondContact O-CB 3.26Å; E192-L196 WeakPolarHBondContact O-CG 3.43Å; E192-L196 PolarHBondContact O-N 3.29Å; I193-L196 PolarHBondContact O-N 3.07Å; L196-H198 VanDerWaalsContact C-N 3.33Å; L196-H198 PolarHBondContact O-N 3.38Å; L196-Q199 PolarHBondContact O-N 3.46Å; L196-L200 WeakPolarHBondContact O-CB 3.43Å; L196-L200 PolarHBondContact O-N 3.11Å |
| 197 | R | 95.8 | Very high | 95 | Very high | 164 Ų | 164 | 100.3 Ų | 100.3 | 62% | 0.619 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -62.4 | -41.1 | 174.5 | -78 | 173.5 | 177.7 | 173.4 | 1.9 | 111.8 | I193 E194 S195 L200 Q201 | I193-R197 WeakPolarHBondContact O-CB 3.42Å; I193-R197 VanDerWaalsContact O-CG 3.26Å; I193-R197 WeakPolarHBondContact O-CG 3.38Å; I193-R197 PolarHBondContact O-N 3.04Å; E194-R197 PolarHBondContact O-N 3.43Å; S195-R197 VanDerWaalsContact C-N 3.35Å; S195-R197 PolarHBondContact O-N 2.9Å; R197-L200 PolarHBondContact O-N 3.31Å; R197-Q201 WeakPolarHBondContact O-CG 3.44Å; R197-Q201 PolarHBondContact O-N 3.44Å |
| 198 | H | 94.4 | Very high | 95.1 | Very high | 114 Ų | 114 | 98.5 Ų | 98.5 | 53% | 0.528 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -64.9 | -44.5 | 176.5 | -175.4 | 55.9 | 0 | 0 | 0 | 111.8 | E194 S195 L196 L200 Q201 I202 | E194-H198 PolarHBondContact O-N 3.49Å; S195-H198 WeakPolarHBondContact O-CB 3.35Å; S195-H198 PolarHBondContact O-N 3.23Å; L196-H198 VanDerWaalsContact C-N 3.33Å; L196-H198 PolarHBondContact O-N 3.38Å; H198-L200 VanDerWaalsContact C-N 3.32Å; H198-L200 PolarHBondContact O-N 3.34Å; H198-Q201 PolarHBondContact O-N 3.47Å; H198-I202 WeakPolarHBondContact O-CG1 3.39Å; H198-I202 PolarHBondContact O-N 2.9Å; H198-I202 VanDerWaalsContact O-N 3.1Å |
| 199 | Q | 95.9 | Very high | 95.2 | Very high | 103 Ų | 103 | 99 Ų | 99 | 48% | 0.481 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -60.5 | -41.4 | 175.4 | -69.5 | 177.1 | 13.1 | 0 | 0 | 112.1 | S195 L196 I202 L203 | S195-Q199 WeakPolarHBondContact O-CG 3.5Å; S195-Q199 PolarHBondContact O-N 3.41Å; L196-Q199 PolarHBondContact O-N 3.46Å; Q199-I202 PolarHBondContact O-N 3.11Å; Q199-L203 WeakPolarHBondContact O-CG 3.37Å; Q199-L203 PolarHBondContact O-N 3.45Å |
| 200 | L | 95.7 | Very high | 95.3 | Very high | 94 Ų | 94 | 100.9 Ų | 100.9 | 49% | 0.492 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -61.8 | -44.1 | 176.9 | -174.1 | 146.9 | 0 | 0 | 0 | 111.7 | L196 R197 H198 I202 L203 E204 | L196-L200 WeakPolarHBondContact O-CB 3.43Å; L196-L200 PolarHBondContact O-N 3.11Å; R197-L200 PolarHBondContact O-N 3.31Å; H198-L200 VanDerWaalsContact C-N 3.32Å; H198-L200 PolarHBondContact O-N 3.34Å; L200-I202 VanDerWaalsContact C-N 3.32Å; L200-I202 PolarHBondContact O-N 2.96Å; L200-L203 PolarHBondContact O-N 3.28Å; L200-E204 VanDerWaalsContact CD2-CD 3.45Å; L200-E204 HydrophobicContact CD2-CG 4.1Å; L200-E204 WeakPolarHBondContact CD2-OE1 3.47Å; L200-E204 WeakPolarHBondContact O-CG 3.36Å; L200-E204 PolarHBondContact O-N 3.18Å |
| 201 | Q | 96 | Very high | 95.4 | Very high | 121 Ų | 121 | 105.4 Ų | 105.4 | 57% | 0.565 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -60.8 | -40.2 | 175.9 | -73.5 | 175.2 | -10.4 | 0 | 0 | 112.6 | R197 H198 E204 A205 | R197-Q201 WeakPolarHBondContact O-CG 3.44Å; R197-Q201 PolarHBondContact O-N 3.44Å; H198-Q201 PolarHBondContact O-N 3.47Å; Q201-E204 PolarHBondContact O-N 3.49Å; Q201-A205 PolarHBondContact O-N 3.5Å |
| 202 | I | 95.8 | Very high | 95.5 | Very high | 85 Ų | 85 | 106.3 Ų | 106.3 | 44% | 0.436 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -63.3 | -47.1 | 175.7 | -67.2 | 167.4 | 0 | 0 | 0 | 110.2 | H198 Q199 L200 E204 A205 V206 | H198-I202 WeakPolarHBondContact O-CG1 3.39Å; H198-I202 PolarHBondContact O-N 2.9Å; H198-I202 VanDerWaalsContact O-N 3.1Å; Q199-I202 PolarHBondContact O-N 3.11Å; L200-I202 VanDerWaalsContact C-N 3.32Å; L200-I202 PolarHBondContact O-N 2.96Å; I202-E204 VanDerWaalsContact C-N 3.34Å; I202-E204 PolarHBondContact O-N 3.41Å; I202-A205 WeakPolarHBondContact O-CB 3.39Å; I202-A205 PolarHBondContact O-N 3.27Å; I202-V206 HydrophobicContact CG2-CG2 4.45Å; I202-V206 WeakPolarHBondContact O-CG2 3.25Å; I202-V206 PolarHBondContact O-N 2.88Å |
| 203 | L | 96.8 | Very high | 95.6 | Very high | 120 Ų | 120 | 103 Ų | 103 | 63% | 0.628 | 52% | 0.516 | S | S | * | . | H | α-helix | trans | -62.8 | -39.6 | 179.4 | -73.3 | 171.6 | 0 | 0 | 0 | 112.3 | Q199 L200 A205 V206 L207 | Q199-L203 WeakPolarHBondContact O-CG 3.37Å; Q199-L203 PolarHBondContact O-N 3.45Å; L200-L203 PolarHBondContact O-N 3.28Å; L203-A205 VanDerWaalsContact C-N 3.33Å; L203-A205 PolarHBondContact O-N 3.49Å; L203-V206 PolarHBondContact O-N 3.05Å; L203-L207 VanDerWaalsContact O-CB 3.25Å; L203-L207 WeakPolarHBondContact O-CB 3.36Å; L203-L207 PolarHBondContact O-N 2.95Å |
| 204 | E | 96.3 | Very high | 95.6 | Very high | 119 Ų | 119 | 105.6 Ų | 105.6 | 56% | 0.556 | 52% | 0.524 | S | S | * | . | H | α-helix | trans | -62.8 | -39.7 | 174.3 | -74.5 | -179.3 | 157.8 | 0 | 0 | 112.1 | L200 Q201 I202 L207 S208 | L200-E204 VanDerWaalsContact CD2-CD 3.45Å; L200-E204 HydrophobicContact CD2-CG 4.1Å; L200-E204 WeakPolarHBondContact CD2-OE1 3.47Å; L200-E204 WeakPolarHBondContact O-CG 3.36Å; L200-E204 PolarHBondContact O-N 3.18Å; Q201-E204 PolarHBondContact O-N 3.49Å; I202-E204 VanDerWaalsContact C-N 3.34Å; I202-E204 PolarHBondContact O-N 3.41Å; E204-L207 PolarHBondContact O-N 3.49Å; E204-S208 WeakPolarHBondContact O-CB 3.46Å; E204-S208 PolarHBondContact O-N 3.41Å |
| 205 | A | 95.1 | Very high | 95.7 | Very high | 60 Ų | 60 | 104.9 Ų | 104.9 | 50% | 0.496 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -64.8 | -46.6 | 175.9 | 0 | 0 | 0 | 0 | 0 | 111.7 | Q201 I202 L203 L207 S208 E209 | Q201-A205 PolarHBondContact O-N 3.5Å; I202-A205 WeakPolarHBondContact O-CB 3.39Å; I202-A205 PolarHBondContact O-N 3.27Å; L203-A205 VanDerWaalsContact C-N 3.33Å; L203-A205 PolarHBondContact O-N 3.49Å; A205-L207 PolarHBondContact O-N 3.38Å; A205-S208 WeakPolarHBondContact O-CB 3.49Å; A205-S208 PolarHBondContact O-N 3.37Å; A205-E209 PolarHBondContact O-N 3.45Å |
| 206 | V | 96.5 | Very high | 95.7 | Very high | 71 Ų | 71 | 110.5 Ų | 110.5 | 43% | 0.43 | 53% | 0.534 | S | S | . | . | H | α-helix | trans | -61.1 | -45 | 176.3 | 172.8 | 0 | 0 | 0 | 0 | 110.8 | I202 L203 S208 E209 E210 | I202-V206 HydrophobicContact CG2-CG2 4.45Å; I202-V206 WeakPolarHBondContact O-CG2 3.25Å; I202-V206 PolarHBondContact O-N 2.88Å; L203-V206 PolarHBondContact O-N 3.05Å; V206-S208 VanDerWaalsContact C-N 3.3Å; V206-S208 PolarHBondContact O-N 3.03Å; V206-E209 PolarHBondContact O-N 2.84Å; V206-E209 VanDerWaalsContact O-N 3.16Å; V206-E210 HydrophobicContact CG1-CG 4.34Å; V206-E210 WeakPolarHBondContact O-CB 3.41Å; V206-E210 WeakPolarHBondContact O-CG 3.41Å; V206-E210 PolarHBondContact O-N 2.86Å |
| 207 | L | 95.3 | Very high | 95.7 | Very high | 91 Ų | 91 | 107.7 Ų | 107.7 | 48% | 0.476 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -64.2 | -35.8 | 178.7 | -177.4 | 145.2 | 0 | 0 | 0 | 112.1 | L203 E204 A205 R211 | L203-L207 VanDerWaalsContact O-CB 3.25Å; L203-L207 WeakPolarHBondContact O-CB 3.36Å; L203-L207 PolarHBondContact O-N 2.95Å; E204-L207 PolarHBondContact O-N 3.49Å; A205-L207 PolarHBondContact O-N 3.38Å; L207-R211 HydrophobicContact CD2-CG 4.47Å; L207-R211 VanDerWaalsContact CD2-NE 3.28Å; L207-R211 WeakPolarHBondContact O-CB 3.46Å; L207-R211 VanDerWaalsContact O-CG 3.24Å; L207-R211 WeakPolarHBondContact O-CG 3.32Å; L207-R211 PolarHBondContact O-N 3.38Å |
| 208 | S | 95.4 | Very high | 95.8 | Very high | 57 Ų | 57 | 104.1 Ų | 104.1 | 40% | 0.399 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -65.1 | -41 | 173.1 | -174.4 | 0 | 0 | 0 | 0 | 112 | E204 A205 V206 K212 | E204-S208 WeakPolarHBondContact O-CB 3.46Å; E204-S208 PolarHBondContact O-N 3.41Å; A205-S208 WeakPolarHBondContact O-CB 3.49Å; A205-S208 PolarHBondContact O-N 3.37Å; V206-S208 VanDerWaalsContact C-N 3.3Å; V206-S208 PolarHBondContact O-N 3.03Å; S208-K212 WeakPolarHBondContact O-CG 3.4Å; S208-K212 PolarHBondContact O-N 3.34Å |
| 209 | E | 94.7 | Very high | 95.9 | Very high | 138 Ų | 138 | 101.4 Ų | 101.4 | 65% | 0.645 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -67 | -47.3 | 176.5 | -171.7 | 171.3 | -171.2 | 0 | 0 | 112 | A205 V206 R211 K212 A213 | A205-E209 PolarHBondContact O-N 3.45Å; V206-E209 PolarHBondContact O-N 2.84Å; V206-E209 VanDerWaalsContact O-N 3.16Å; E209-R211 VanDerWaalsContact C-N 3.31Å; E209-R211 PolarHBondContact O-N 3.25Å; E209-K212 WeakPolarHBondContact O-CB 3.45Å; E209-K212 PolarHBondContact O-N 2.92Å; E209-K212 VanDerWaalsContact O-N 3.09Å; E209-A213 PolarHBondContact O-N 3.38Å |
| 210 | E | 94.7 | Very high | 95.9 | Very high | 126 Ų | 126 | 103.1 Ų | 103.1 | 59% | 0.589 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -59.4 | -40.3 | 176.1 | -76.7 | -65.5 | 155.1 | 0 | 0 | 112.1 | V206 K212 A213 F214 | V206-E210 HydrophobicContact CG1-CG 4.34Å; V206-E210 WeakPolarHBondContact O-CB 3.41Å; V206-E210 WeakPolarHBondContact O-CG 3.41Å; V206-E210 PolarHBondContact O-N 2.86Å; E210-K212 VanDerWaalsContact C-N 3.34Å; E210-K212 PolarHBondContact O-N 3.16Å; E210-A213 PolarHBondContact O-N 3Å; E210-F214 WeakPolarHBondContact O-CB 3.24Å; E210-F214 PolarHBondContact O-N 3.18Å |
| 211 | R | 96.2 | Very high | 95.9 | Very high | 168 Ų | 168 | 105.6 Ų | 105.6 | 63% | 0.634 | 52% | 0.522 | S | S | * | . | H | α-helix | trans | -62.6 | -40.4 | 174.5 | -78.3 | 178.8 | -179.3 | -156 | 4.4 | 112.4 | L207 E209 E215 | L207-R211 HydrophobicContact CD2-CG 4.47Å; L207-R211 VanDerWaalsContact CD2-NE 3.28Å; L207-R211 WeakPolarHBondContact O-CB 3.46Å; L207-R211 VanDerWaalsContact O-CG 3.24Å; L207-R211 WeakPolarHBondContact O-CG 3.32Å; L207-R211 PolarHBondContact O-N 3.38Å; E209-R211 VanDerWaalsContact C-N 3.31Å; E209-R211 PolarHBondContact O-N 3.25Å; R211-E215 PolarHBondContact O-N 3.09Å |
| 212 | K | 95.9 | Very high | 96 | Very high | 130 Ų | 130 | 104.3 Ų | 104.3 | 57% | 0.565 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -65.3 | -47.7 | 175.4 | -71.6 | 172.5 | -176.6 | 175.4 | 0 | 110.6 | S208 E209 E210 F214 E215 Y216 | S208-K212 WeakPolarHBondContact O-CG 3.4Å; S208-K212 PolarHBondContact O-N 3.34Å; E209-K212 WeakPolarHBondContact O-CB 3.45Å; E209-K212 PolarHBondContact O-N 2.92Å; E209-K212 VanDerWaalsContact O-N 3.09Å; E210-K212 VanDerWaalsContact C-N 3.34Å; E210-K212 PolarHBondContact O-N 3.16Å; K212-F214 VanDerWaalsContact C-N 3.28Å; K212-F214 PolarHBondContact O-N 2.99Å; K212-E215 PolarHBondContact O-N 3.3Å; K212-Y216 HydrophobicContact CB-CE2 4.36Å; K212-Y216 WeakPolarHBondContact O-CD2 3.04Å; K212-Y216 PolarHBondContact O-N 3.37Å |
| 213 | A | 95.9 | Very high | 96 | Very high | 51 Ų | 51 | 103 Ų | 103 | 42% | 0.421 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -57.9 | -41.8 | 177.4 | 0 | 0 | 0 | 0 | 0 | 111.8 | E209 E210 Y216 A217 | E209-A213 PolarHBondContact O-N 3.38Å; E210-A213 PolarHBondContact O-N 3Å; A213-Y216 PolarHBondContact O-N 2.89Å; A213-A217 WeakPolarHBondContact O-CB 3.44Å; A213-A217 PolarHBondContact O-N 2.96Å |
| 214 | F | 96.4 | Very high | 96 | Very high | 136 Ų | 136 | 104.1 Ų | 104.1 | 60% | 0.596 | 51% | 0.514 | S | S | * | . | H | α-helix | trans | -62.8 | -46.4 | 175.9 | -179.2 | -97.2 | 0 | 0 | 0 | 112.7 | E210 K212 Y216 A217 K218 | E210-F214 WeakPolarHBondContact O-CB 3.24Å; E210-F214 PolarHBondContact O-N 3.18Å; K212-F214 VanDerWaalsContact C-N 3.28Å; K212-F214 PolarHBondContact O-N 2.99Å; F214-Y216 VanDerWaalsContact C-N 3.32Å; F214-Y216 PolarHBondContact O-N 3.24Å; F214-A217 PolarHBondContact O-N 3.22Å; F214-K218 HydrophobicContact CE1-CD 4.23Å; F214-K218 VanDerWaalsContact O-CB 3.28Å; F214-K218 WeakPolarHBondContact O-CB 3.01Å; F214-K218 PolarHBondContact O-N 3.19Å |
| 215 | E | 96.5 | Very high | 95.9 | Very high | 102 Ų | 102 | 102.8 Ų | 102.8 | 48% | 0.477 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -65.3 | -35.5 | 177.6 | -73.7 | -61.3 | 146.1 | 0 | 0 | 112 | R211 K212 K218 A219 | R211-E215 PolarHBondContact O-N 3.09Å; K212-E215 PolarHBondContact O-N 3.3Å; E215-K218 IonicContact OE1-NZ 3.63Å; E215-K218 PolarHBondContact OE1-NZ 3.41Å; E215-K218 IonicContact OE2-NZ 2.88Å; E215-K218 PolarHBondContact OE2-NZ 2.94Å; E215-A219 WeakPolarHBondContact O-CB 3.28Å; E215-A219 PolarHBondContact O-N 2.89Å |
| 216 | Y | 95.8 | Very high | 96 | Very high | 178 Ų | 178 | 105 Ų | 105 | 70% | 0.698 | 51% | 0.509 | S | S | * | . | H | α-helix | trans | -63.1 | -48.8 | 171.6 | -75 | -60.6 | 0 | 0 | 0 | 112.1 | K212 A213 F214 K218 A219 E220 | K212-Y216 HydrophobicContact CB-CE2 4.36Å; K212-Y216 WeakPolarHBondContact O-CD2 3.04Å; K212-Y216 PolarHBondContact O-N 3.37Å; A213-Y216 PolarHBondContact O-N 2.89Å; F214-Y216 VanDerWaalsContact C-N 3.32Å; F214-Y216 PolarHBondContact O-N 3.24Å; Y216-K218 VanDerWaalsContact C-N 3.31Å; Y216-K218 PolarHBondContact O-N 2.86Å; Y216-A219 PolarHBondContact O-N 3.06Å; Y216-E220 PolarHBondContact O-N 3.45Å |
| 217 | A | 95.8 | Very high | 96 | Very high | 33 Ų | 33 | 106.1 Ų | 106.1 | 27% | 0.273 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -61.3 | -41 | 178.4 | 0 | 0 | 0 | 0 | 0 | 111.6 | A213 F214 E220 Y221 | A213-A217 WeakPolarHBondContact O-CB 3.44Å; A213-A217 PolarHBondContact O-N 2.96Å; F214-A217 PolarHBondContact O-N 3.22Å; A217-E220 WeakPolarHBondContact O-CB 3.48Å; A217-E220 PolarHBondContact O-N 3.45Å; A217-Y221 HydrophobicContact CB-CE2 4.33Å; A217-Y221 WeakPolarHBondContact O-CD2 3.46Å; A217-Y221 PolarHBondContact O-N 3.43Å |
| 218 | K | 96.6 | Very high | 96 | Very high | 89 Ų | 89 | 104.5 Ų | 104.5 | 39% | 0.387 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -61.2 | -43.9 | 174.8 | 176.7 | -178.8 | 161.2 | -154.4 | 0 | 111.9 | F214 E215 Y216 E220 Y221 L222 | F214-K218 HydrophobicContact CE1-CD 4.23Å; F214-K218 VanDerWaalsContact O-CB 3.28Å; F214-K218 WeakPolarHBondContact O-CB 3.01Å; F214-K218 PolarHBondContact O-N 3.19Å; E215-K218 IonicContact OE1-NZ 3.63Å; E215-K218 PolarHBondContact OE1-NZ 3.41Å; E215-K218 IonicContact OE2-NZ 2.88Å; E215-K218 PolarHBondContact OE2-NZ 2.94Å; Y216-K218 VanDerWaalsContact C-N 3.31Å; Y216-K218 PolarHBondContact O-N 2.86Å; K218-E220 VanDerWaalsContact C-N 3.34Å; K218-Y221 PolarHBondContact O-N 2.89Å; K218-L222 HydrophobicContact CG-CD1 4.25Å; K218-L222 WeakPolarHBondContact O-CB 3.28Å; K218-L222 VanDerWaalsContact O-CG 3.31Å; K218-L222 WeakPolarHBondContact O-CG 3.47Å; K218-L222 PolarHBondContact O-N 3.28Å |
| 219 | A | 96.2 | Very high | 96.1 | Very high | 58 Ų | 58 | 107 Ų | 107 | 48% | 0.479 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -62.9 | -41.2 | 175.5 | 0 | 0 | 0 | 0 | 0 | 111.8 | E215 Y216 L222 S223 | E215-A219 WeakPolarHBondContact O-CB 3.28Å; E215-A219 PolarHBondContact O-N 2.89Å; Y216-A219 PolarHBondContact O-N 3.06Å; A219-L222 PolarHBondContact O-N 2.96Å; A219-S223 WeakPolarHBondContact O-CB 3.49Å; A219-S223 PolarHBondContact O-N 3.25Å |
| 220 | E | 96.2 | Very high | 96.1 | Very high | 139 Ų | 139 | 107.6 Ų | 107.6 | 65% | 0.65 | 51% | 0.509 | S | S | * | . | H | α-helix | trans | -61.3 | -48.7 | 175.2 | -173.3 | -176 | 173.7 | 0 | 0 | 111.7 | Y216 A217 K218 L222 S223 R224 | Y216-E220 PolarHBondContact O-N 3.45Å; A217-E220 WeakPolarHBondContact O-CB 3.48Å; A217-E220 PolarHBondContact O-N 3.45Å; K218-E220 VanDerWaalsContact C-N 3.34Å; E220-L222 PolarHBondContact O-N 2.98Å; E220-S223 WeakPolarHBondContact O-CB 3.31Å; E220-S223 PolarHBondContact O-N 3.44Å; E220-R224 PolarHBondContact O-N 2.97Å |
| 221 | Y | 96.6 | Very high | 96.2 | Very high | 145 Ų | 145 | 107.5 Ų | 107.5 | 57% | 0.569 | 51% | 0.509 | S | S | * | . | H | α-helix | trans | -62.3 | -42.1 | 177.6 | -74.8 | -58 | 0 | 0 | 0 | 112.4 | A217 K218 R224 I225 | A217-Y221 HydrophobicContact CB-CE2 4.33Å; A217-Y221 WeakPolarHBondContact O-CD2 3.46Å; A217-Y221 PolarHBondContact O-N 3.43Å; K218-Y221 PolarHBondContact O-N 2.89Å; Y221-R224 PolarHBondContact O-N 3.26Å; Y221-I225 VanDerWaalsContact O-CG1 3.28Å; Y221-I225 WeakPolarHBondContact O-CG1 3.35Å; Y221-I225 PolarHBondContact O-N 2.9Å |
| 222 | L | 96.9 | Very high | 96.1 | Very high | 94 Ų | 94 | 103.7 Ų | 103.7 | 49% | 0.492 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -62.7 | -42.7 | 176.1 | -74.1 | 172.6 | 0 | 0 | 0 | 111.7 | K218 A219 E220 R224 I225 Q226 | K218-L222 HydrophobicContact CG-CD1 4.25Å; K218-L222 WeakPolarHBondContact O-CB 3.28Å; K218-L222 VanDerWaalsContact O-CG 3.31Å; K218-L222 WeakPolarHBondContact O-CG 3.47Å; K218-L222 PolarHBondContact O-N 3.28Å; A219-L222 PolarHBondContact O-N 2.96Å; E220-L222 PolarHBondContact O-N 2.98Å; L222-R224 VanDerWaalsContact C-N 3.31Å; L222-R224 PolarHBondContact O-N 2.77Å; L222-I225 PolarHBondContact O-N 2.85Å; L222-Q226 WeakPolarHBondContact O-CG 3.45Å; L222-Q226 PolarHBondContact O-N 2.83Å |
| 223 | S | 96.1 | Very high | 96.2 | Very high | 59 Ų | 59 | 101 Ų | 101 | 41% | 0.413 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -60.2 | -43.7 | 174.4 | -170.6 | 0 | 0 | 0 | 0 | 111.2 | A219 E220 I225 Q226 E227 | A219-S223 WeakPolarHBondContact O-CB 3.49Å; A219-S223 PolarHBondContact O-N 3.25Å; E220-S223 WeakPolarHBondContact O-CB 3.31Å; E220-S223 PolarHBondContact O-N 3.44Å; S223-I225 PolarHBondContact O-N 3.32Å; S223-Q226 PolarHBondContact O-N 3.37Å; S223-E227 PolarHBondContact O-N 3.35Å |
| 224 | R | 96.3 | Very high | 96.1 | Very high | 143 Ų | 143 | 101.2 Ų | 101.2 | 54% | 0.54 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -66.2 | -38.6 | 179.5 | -172.8 | 58.2 | 179.6 | 171.1 | 3.9 | 112.7 | E220 Y221 L222 Q226 E227 V228 | E220-R224 PolarHBondContact O-N 2.97Å; Y221-R224 PolarHBondContact O-N 3.26Å; L222-R224 VanDerWaalsContact C-N 3.31Å; L222-R224 PolarHBondContact O-N 2.77Å; R224-Q226 VanDerWaalsContact C-N 3.34Å; R224-E227 WeakPolarHBondContact CD-OE2 3.33Å; R224-E227 IonicContact CZ-OE2 3.71Å; R224-E227 IonicContact NH1-OE2 2.96Å; R224-E227 PolarHBondContact NH1-OE2 3.36Å; R224-E227 PolarHBondContact O-N 3.01Å; R224-V228 WeakPolarHBondContact O-CG2 3.39Å; R224-V228 PolarHBondContact O-N 3.49Å; R224-V228 VanDerWaalsContact O-N 3.08Å |
| 225 | I | 95.6 | Very high | 96.1 | Very high | 90 Ų | 90 | 98.2 Ų | 98.2 | 46% | 0.462 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -60.8 | -46.1 | 173.8 | -71.3 | 164.9 | 0 | 0 | 0 | 109.9 | Y221 L222 S223 E227 V228 E229 | Y221-I225 VanDerWaalsContact O-CG1 3.28Å; Y221-I225 WeakPolarHBondContact O-CG1 3.35Å; Y221-I225 PolarHBondContact O-N 2.9Å; L222-I225 PolarHBondContact O-N 2.85Å; S223-I225 PolarHBondContact O-N 3.32Å; I225-E227 VanDerWaalsContact C-N 3.31Å; I225-E227 PolarHBondContact O-N 3.2Å; I225-V228 PolarHBondContact O-N 3.36Å; I225-E229 HydrophobicContact CG2-CG 4.26Å; I225-E229 WeakPolarHBondContact O-CB 3.45Å; I225-E229 WeakPolarHBondContact O-CG 3.4Å; I225-E229 PolarHBondContact O-N 3.08Å |
| 226 | Q | 96.4 | Very high | 96.1 | Very high | 108 Ų | 108 | 98.8 Ų | 98.8 | 51% | 0.505 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -62.5 | -36 | 178.1 | -72 | 177.9 | -5.3 | 0 | 0 | 113.1 | L222 S223 R224 K230 | L222-Q226 WeakPolarHBondContact O-CG 3.45Å; L222-Q226 PolarHBondContact O-N 2.83Å; S223-Q226 PolarHBondContact O-N 3.37Å; R224-Q226 VanDerWaalsContact C-N 3.34Å; Q226-K230 VanDerWaalsContact O-CG 3.31Å; Q226-K230 WeakPolarHBondContact O-CG 3.35Å; Q226-K230 PolarHBondContact O-N 3.43Å |
| 227 | E | 96.5 | Very high | 96 | Very high | 93 Ų | 93 | 96.1 Ų | 96.1 | 44% | 0.435 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -63.1 | -47.5 | 173.4 | -74.1 | 175.4 | -179.8 | 0 | 0 | 111.7 | S223 R224 I225 E229 K230 E231 | S223-E227 PolarHBondContact O-N 3.35Å; R224-E227 WeakPolarHBondContact CD-OE2 3.33Å; R224-E227 IonicContact CZ-OE2 3.71Å; R224-E227 IonicContact NH1-OE2 2.96Å; R224-E227 PolarHBondContact NH1-OE2 3.36Å; R224-E227 PolarHBondContact O-N 3.01Å; I225-E227 VanDerWaalsContact C-N 3.31Å; I225-E227 PolarHBondContact O-N 3.2Å; E227-E229 VanDerWaalsContact C-N 3.32Å; E227-E229 PolarHBondContact O-N 3.26Å; E227-K230 PolarHBondContact O-N 3.04Å; E227-E231 PolarHBondContact O-N 2.93Å |
| 228 | V | 96.3 | Very high | 96 | Very high | 57 Ų | 57 | 101.6 Ų | 101.6 | 35% | 0.345 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -64.9 | -37.7 | 178 | 172.9 | 0 | 0 | 0 | 0 | 111.1 | R224 I225 E231 N232 | R224-V228 WeakPolarHBondContact O-CG2 3.39Å; R224-V228 PolarHBondContact O-N 3.49Å; R224-V228 VanDerWaalsContact O-N 3.08Å; I225-V228 PolarHBondContact O-N 3.36Å; V228-E231 PolarHBondContact O-N 3.46Å; V228-N232 WeakPolarHBondContact O-CB 3.49Å; V228-N232 PolarHBondContact O-N 3.33Å; V228-N232 PolarHBondContact O-ND2 3.22Å |
| 229 | E | 96.1 | Very high | 96 | Very high | 110 Ų | 110 | 102.1 Ų | 102.1 | 51% | 0.514 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -61.8 | -44.3 | 173.9 | -75.4 | 175.5 | 163.2 | 0 | 0 | 111.7 | I225 E227 N232 V233 | I225-E229 HydrophobicContact CG2-CG 4.26Å; I225-E229 WeakPolarHBondContact O-CB 3.45Å; I225-E229 WeakPolarHBondContact O-CG 3.4Å; I225-E229 PolarHBondContact O-N 3.08Å; E227-E229 VanDerWaalsContact C-N 3.32Å; E227-E229 PolarHBondContact O-N 3.26Å; E229-N232 PolarHBondContact O-N 2.88Å; E229-V233 WeakPolarHBondContact O-CG2 3.48Å; E229-V233 PolarHBondContact O-N 3.29Å |
| 230 | K | 96.1 | Very high | 95.9 | Very high | 150 Ų | 150 | 102.2 Ų | 102.2 | 65% | 0.652 | 51% | 0.514 | S | S | * | . | H | α-helix | trans | -62.9 | -42.6 | 175.3 | -73.7 | 172 | -176.4 | 174.2 | 0 | 112.1 | Q226 E227 V233 A234 | Q226-K230 VanDerWaalsContact O-CG 3.31Å; Q226-K230 WeakPolarHBondContact O-CG 3.35Å; Q226-K230 PolarHBondContact O-N 3.43Å; E227-K230 PolarHBondContact O-N 3.04Å; K230-V233 PolarHBondContact O-N 3.16Å; K230-A234 PolarHBondContact O-N 3.34Å |
| 231 | E | 96.1 | Very high | 95.8 | Very high | 124 Ų | 124 | 101 Ų | 101 | 58% | 0.579 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -62 | -45 | 175.8 | -173.6 | 176.1 | -173.7 | 0 | 0 | 111 | E227 V228 V233 A234 V235 | E227-E231 PolarHBondContact O-N 2.93Å; V228-E231 PolarHBondContact O-N 3.46Å; E231-V233 PolarHBondContact O-N 2.95Å; E231-A234 PolarHBondContact O-N 3.26Å; E231-V235 WeakPolarHBondContact O-CG2 3.28Å; E231-V235 PolarHBondContact O-N 3.47Å |
| 232 | N | 94.9 | Very high | 95.7 | Very high | 88 Ų | 88 | 97 Ų | 97 | 47% | 0.471 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -60.2 | -43.3 | 176.6 | -75.6 | -23 | 0 | 0 | 0 | 112.1 | V228 E229 V235 L236 | V228-N232 WeakPolarHBondContact O-CB 3.49Å; V228-N232 PolarHBondContact O-N 3.33Å; V228-N232 PolarHBondContact O-ND2 3.22Å; E229-N232 PolarHBondContact O-N 2.88Å; N232-V235 PolarHBondContact O-N 2.89Å; N232-L236 WeakPolarHBondContact O-CB 3.49Å; N232-L236 VanDerWaalsContact O-CG 3.28Å; N232-L236 WeakPolarHBondContact O-CG 3.34Å; N232-L236 PolarHBondContact O-N 2.88Å |
| 233 | V | 96.1 | Very high | 95.6 | Very high | 75 Ų | 75 | 96.9 Ų | 96.9 | 46% | 0.455 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -60.6 | -47 | 175.3 | 171.3 | 0 | 0 | 0 | 0 | 110.7 | E229 K230 E231 V235 L236 E237 | E229-V233 WeakPolarHBondContact O-CG2 3.48Å; E229-V233 PolarHBondContact O-N 3.29Å; K230-V233 PolarHBondContact O-N 3.16Å; E231-V233 PolarHBondContact O-N 2.95Å; V233-V235 VanDerWaalsContact C-N 3.32Å; V233-V235 PolarHBondContact O-N 3.37Å; V233-L236 PolarHBondContact O-N 3.39Å; V233-L236 VanDerWaalsContact O-N 3.16Å; V233-E237 HydrophobicContact CG1-CG 4.39Å; V233-E237 WeakPolarHBondContact O-CG 3.38Å; V233-E237 PolarHBondContact O-N 2.92Å |
| 234 | A | 95.3 | Very high | 95.4 | Very high | 54 Ų | 54 | 99.5 Ų | 99.5 | 45% | 0.446 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -61.9 | -38.6 | 178.5 | 0 | 0 | 0 | 0 | 0 | 112.7 | K230 E231 K238 | K230-A234 PolarHBondContact O-N 3.34Å; E231-A234 PolarHBondContact O-N 3.26Å; A234-K238 WeakPolarHBondContact O-CB 3.39Å; A234-K238 PolarHBondContact O-N 3.36Å |
| 235 | V | 95.5 | Very high | 95.3 | Very high | 74 Ų | 74 | 98.1 Ų | 98.1 | 45% | 0.448 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -65.1 | -43.7 | 174.4 | 171.7 | 0 | 0 | 0 | 0 | 111.1 | E231 N232 V233 K238 L239 | E231-V235 WeakPolarHBondContact O-CG2 3.28Å; E231-V235 PolarHBondContact O-N 3.47Å; N232-V235 PolarHBondContact O-N 2.89Å; V233-V235 VanDerWaalsContact C-N 3.32Å; V233-V235 PolarHBondContact O-N 3.37Å; V235-K238 PolarHBondContact O-N 3.35Å; V235-L239 HydrophobicContact CG1-CD1 4.05Å; V235-L239 HydrophobicContact CG1-CG 4.5Å; V235-L239 WeakPolarHBondContact O-CB 3.44Å; V235-L239 WeakPolarHBondContact O-CG 3.38Å; V235-L239 PolarHBondContact O-N 3.03Å |
| 236 | L | 95.8 | Very high | 95.1 | Very high | 113 Ų | 113 | 97.8 Ų | 97.8 | 59% | 0.592 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -64.2 | -41.3 | 177.8 | -73.1 | 171.9 | 0 | 0 | 0 | 112.2 | N232 V233 L239 A240 | N232-L236 WeakPolarHBondContact O-CB 3.49Å; N232-L236 VanDerWaalsContact O-CG 3.28Å; N232-L236 WeakPolarHBondContact O-CG 3.34Å; N232-L236 PolarHBondContact O-N 2.88Å; V233-L236 PolarHBondContact O-N 3.39Å; V233-L236 VanDerWaalsContact O-N 3.16Å; L236-L239 PolarHBondContact O-N 2.95Å; L236-A240 WeakPolarHBondContact O-CB 3.47Å; L236-A240 PolarHBondContact O-N 3.02Å |
| 237 | E | 95 | Very high | 94.8 | Very high | 122 Ų | 122 | 96.3 Ų | 96.3 | 57% | 0.57 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -61.9 | -43.9 | 174.7 | -73.1 | 176.3 | 171.2 | 0 | 0 | 111.5 | V233 L239 A240 L241 | V233-E237 HydrophobicContact CG1-CG 4.39Å; V233-E237 WeakPolarHBondContact O-CG 3.38Å; V233-E237 PolarHBondContact O-N 2.92Å; E237-L239 PolarHBondContact O-N 3.44Å; E237-A240 WeakPolarHBondContact O-CB 3.39Å; E237-A240 PolarHBondContact O-N 2.95Å; E237-L241 WeakPolarHBondContact O-CG 3.31Å; E237-L241 PolarHBondContact O-N 2.98Å |
| 238 | K | 96.1 | Very high | 94.5 | Very high | 149 Ų | 149 | 94.9 Ų | 94.9 | 65% | 0.648 | 50% | 0.495 | S | S | * | . | H | α-helix | trans | -63.8 | -39.8 | 175.2 | -171.7 | 178.3 | -179.5 | -179.3 | 0 | 112.2 | A234 V235 A240 L241 T242 | A234-K238 WeakPolarHBondContact O-CB 3.39Å; A234-K238 PolarHBondContact O-N 3.36Å; V235-K238 PolarHBondContact O-N 3.35Å; K238-A240 VanDerWaalsContact C-N 3.35Å; K238-L241 PolarHBondContact O-N 3.07Å; K238-T242 WeakPolarHBondContact O-CG2 3.48Å; K238-T242 PolarHBondContact O-N 3.44Å; K238-T242 PolarHBondContact O-OG1 3.23Å |
| 239 | L | 95.1 | Very high | 94.1 | Very high | 100 Ų | 100 | 97.6 Ų | 97.6 | 52% | 0.524 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -64.6 | -38.6 | 174.2 | -77.2 | 170.7 | 0 | 0 | 0 | 111.7 | V235 L236 E237 T242 N243 | V235-L239 HydrophobicContact CG1-CD1 4.05Å; V235-L239 HydrophobicContact CG1-CG 4.5Å; V235-L239 WeakPolarHBondContact O-CB 3.44Å; V235-L239 WeakPolarHBondContact O-CG 3.38Å; V235-L239 PolarHBondContact O-N 3.03Å; L236-L239 PolarHBondContact O-N 2.95Å; E237-L239 PolarHBondContact O-N 3.44Å; L239-T242 WeakPolarHBondContact CA-OG1 3.48Å; L239-T242 PolarHBondContact O-OG1 3.48Å; L239-T242 VanDerWaalsContact O-OG1 3.07Å; L239-N243 WeakPolarHBondContact O-CB 3.37Å; L239-N243 PolarHBondContact O-N 3.05Å |
| 240 | A | 95.2 | Very high | 93.7 | Very high | 60 Ų | 60 | 98.3 Ų | 98.3 | 50% | 0.496 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -63.7 | -44.4 | 175.6 | 0 | 0 | 0 | 0 | 0 | 111.9 | L236 E237 K238 N243 H244 | L236-A240 WeakPolarHBondContact O-CB 3.47Å; L236-A240 PolarHBondContact O-N 3.02Å; E237-A240 WeakPolarHBondContact O-CB 3.39Å; E237-A240 PolarHBondContact O-N 2.95Å; K238-A240 VanDerWaalsContact C-N 3.35Å; A240-N243 PolarHBondContact O-N 3.19Å; A240-H244 PolarHBondContact O-N 3.42Å |
| 241 | L | 94.9 | Very high | 93.1 | Very high | 113 Ų | 113 | 97.7 Ų | 97.7 | 59% | 0.592 | 50% | 0.499 | S | S | * | . | H | α-helix | trans | -61.8 | -51 | 176.2 | -71.4 | 173.4 | 0 | 0 | 0 | 112 | E237 K238 N243 H244 E245 | E237-L241 WeakPolarHBondContact O-CG 3.31Å; E237-L241 PolarHBondContact O-N 2.98Å; K238-L241 PolarHBondContact O-N 3.07Å; L241-N243 VanDerWaalsContact C-N 3.3Å; L241-N243 PolarHBondContact O-N 2.96Å; L241-H244 WeakPolarHBondContact O-CB 3.2Å; L241-H244 PolarHBondContact O-N 2.94Å; L241-H244 VanDerWaalsContact O-N 3.13Å; L241-E245 WeakPolarHBondContact O-CG 3.38Å; L241-E245 PolarHBondContact O-N 3Å |
| 242 | T | 94.6 | Very high | 92.5 | Very high | 62 Ų | 62 | 97.2 Ų | 97.2 | 38% | 0.38 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -63.7 | -33.7 | 179.2 | 51.4 | 0 | 0 | 0 | 0 | 112.7 | K238 L239 L246 | K238-T242 WeakPolarHBondContact O-CG2 3.48Å; K238-T242 PolarHBondContact O-N 3.44Å; K238-T242 PolarHBondContact O-OG1 3.23Å; L239-T242 WeakPolarHBondContact CA-OG1 3.48Å; L239-T242 PolarHBondContact O-OG1 3.48Å; L239-T242 VanDerWaalsContact O-OG1 3.07Å; T242-L246 WeakPolarHBondContact O-CB 3.42Å; T242-L246 PolarHBondContact O-N 3.01Å |
| 243 | N | 93.6 | Very high | 91.8 | Very high | 91 Ų | 91 | 98.5 Ų | 98.5 | 49% | 0.487 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -67.1 | -42.1 | 173 | -168.5 | -34.6 | 0 | 0 | 0 | 111.5 | L239 A240 L241 L246 N247 | L239-N243 WeakPolarHBondContact O-CB 3.37Å; L239-N243 PolarHBondContact O-N 3.05Å; A240-N243 PolarHBondContact O-N 3.19Å; L241-N243 VanDerWaalsContact C-N 3.3Å; L241-N243 PolarHBondContact O-N 2.96Å; N243-L246 PolarHBondContact O-N 2.98Å; N243-N247 PolarHBondContact O-N 3.43Å; N243-N247 PolarHBondContact O-ND2 2.94Å; N243-N247 PolarHBondContact OD1-ND2 3.13Å |
| 244 | H | 93 | Very high | 90.6 | Very high | 113 Ų | 113 | 97.2 Ų | 97.2 | 52% | 0.523 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -60.8 | -46.9 | 174.6 | -177.5 | 62 | 0 | 0 | 0 | 111.9 | A240 L241 L246 N247 E248 | A240-H244 PolarHBondContact O-N 3.42Å; L241-H244 WeakPolarHBondContact O-CB 3.2Å; L241-H244 PolarHBondContact O-N 2.94Å; L241-H244 VanDerWaalsContact O-N 3.13Å; H244-L246 VanDerWaalsContact C-N 3.35Å; H244-L246 PolarHBondContact O-N 2.94Å; H244-N247 PolarHBondContact O-N 3.34Å; H244-E248 PolarHBondContact O-N 3.22Å |
| 245 | E | 93.6 | Very high | 88.8 | Confident | 114 Ų | 114 | 101 Ų | 101 | 53% | 0.533 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -58.3 | -44.1 | 175.1 | -71.3 | 173 | -179.6 | 0 | 0 | 112.1 | L241 N247 E248 Q249 | L241-E245 WeakPolarHBondContact O-CG 3.38Å; L241-E245 PolarHBondContact O-N 3Å; E245-N247 VanDerWaalsContact C-N 3.34Å; E245-N247 PolarHBondContact O-N 2.93Å; E245-E248 PolarHBondContact O-N 2.87Å; E245-Q249 WeakPolarHBondContact O-CG 3.44Å; E245-Q249 PolarHBondContact O-N 3.19Å |
| 246 | L | 91.8 | Very high | 86.9 | Confident | 83 Ų | 83 | 101.7 Ų | 101.7 | 44% | 0.435 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -62.5 | -40.2 | 176.8 | -177.7 | 66.7 | 0 | 0 | 0 | 112 | T242 N243 H244 Q249 K250 | T242-L246 WeakPolarHBondContact O-CB 3.42Å; T242-L246 PolarHBondContact O-N 3.01Å; N243-L246 PolarHBondContact O-N 2.98Å; H244-L246 VanDerWaalsContact C-N 3.35Å; H244-L246 PolarHBondContact O-N 2.94Å; L246-Q249 PolarHBondContact O-N 3.34Å; L246-K250 WeakPolarHBondContact O-CG 3.42Å; L246-K250 PolarHBondContact O-N 3.46Å |
| 247 | N | 90.2 | Very high | 84.6 | Confident | 78 Ų | 78 | 107.4 Ų | 107.4 | 42% | 0.417 | 54% | 0.537 | S | S | . | . | H | α-helix | trans | -68.5 | -38.8 | 177.7 | -71.9 | -32.2 | 0 | 0 | 0 | 112 | N243 H244 E245 K250 R251 | N243-N247 PolarHBondContact O-N 3.43Å; N243-N247 PolarHBondContact O-ND2 2.94Å; N243-N247 PolarHBondContact OD1-ND2 3.13Å; H244-N247 PolarHBondContact O-N 3.34Å; E245-N247 VanDerWaalsContact C-N 3.34Å; E245-N247 PolarHBondContact O-N 2.93Å; N247-K250 PolarHBondContact O-N 3.43Å; N247-R251 PolarHBondContact O-N 3.46Å |
| 248 | E | 90.4 | Very high | 82.2 | Confident | 63 Ų | 63 | 111.4 Ų | 111.4 | 29% | 0.294 | 56% | 0.561 | S | S | . | * | H | α-helix | trans | -63.8 | -42.3 | 172.6 | -77.9 | -65 | 146.7 | 0 | 0 | 111.5 | H244 E245 K250 R251 L252 | H244-E248 PolarHBondContact O-N 3.22Å; E245-E248 PolarHBondContact O-N 2.87Å; E248-K250 PolarHBondContact O-N 2.93Å; E248-R251 WeakPolarHBondContact O-CB 3.38Å; E248-R251 PolarHBondContact O-N 3.32Å; E248-R251 IonicContact OE1-CZ 3.22Å; E248-R251 IonicContact OE1-NH1 3.78Å; E248-R251 PolarHBondContact OE1-NH1 3.18Å; E248-R251 IonicContact OE2-CZ 3.16Å; E248-R251 IonicContact OE2-NE 2.8Å; E248-R251 IonicContact OE2-NH1 3.63Å; E248-R251 PolarHBondContact OE2-NH1 2.89Å; E248-R251 VanDerWaalsContact OE2-NH1 3.16Å; E248-R251 IonicContact OE2-NH2 3.85Å; E248-R251 PolarHBondContact OE2-NH2 3.12Å; E248-R251 VanDerWaalsContact OE2-NH2 3.15Å; E248-L252 WeakPolarHBondContact O-CG 3.46Å; E248-L252 PolarHBondContact O-N 2.93Å |
| 249 | Q | 88.1 | Confident | 81.5 | Confident | 114 Ų | 114 | 109.5 Ų | 109.5 | 53% | 0.533 | 56% | 0.556 | S | S | . | * | H | α-helix | trans | -60.9 | -44.1 | 173.8 | -73.7 | 178.9 | 2.5 | 0 | 0 | 112.4 | E245 L246 R251 L252 L253 | E245-Q249 WeakPolarHBondContact O-CG 3.44Å; E245-Q249 PolarHBondContact O-N 3.19Å; L246-Q249 PolarHBondContact O-N 3.34Å; Q249-R251 VanDerWaalsContact C-N 3.3Å; Q249-R251 PolarHBondContact O-N 2.93Å; Q249-L252 PolarHBondContact O-N 3.47Å; Q249-L253 WeakPolarHBondContact O-CB 3.43Å; Q249-L253 WeakPolarHBondContact O-CG 3.15Å; Q249-L253 PolarHBondContact O-N 2.97Å |
| 250 | K | 86.4 | Confident | 80.8 | Confident | 125 Ų | 125 | 110 Ų | 110 | 54% | 0.543 | 56% | 0.558 | S | S | . | * | H | α-helix | trans | -60.2 | -40.5 | 174.2 | -77.2 | 177.7 | 179.7 | 176.5 | 0 | 111.7 | L246 N247 E248 G254 | L246-K250 WeakPolarHBondContact O-CG 3.42Å; L246-K250 PolarHBondContact O-N 3.46Å; N247-K250 PolarHBondContact O-N 3.43Å; E248-K250 PolarHBondContact O-N 2.93Å; K250-G254 PolarHBondContact O-N 3.3Å |
| 251 | R | 84.3 | Confident | 80 | Confident | 137 Ų | 137 | 112.8 Ų | 112.8 | 52% | 0.517 | 56% | 0.562 | S | S | . | * | H | α-helix | trans | -61.7 | -49.6 | 176.3 | -165.4 | -179.2 | 89.5 | -149.2 | -5.7 | 110.6 | N247 E248 Q249 L253 G254 F255 | N247-R251 PolarHBondContact O-N 3.46Å; E248-R251 WeakPolarHBondContact O-CB 3.38Å; E248-R251 PolarHBondContact O-N 3.32Å; E248-R251 IonicContact OE1-CZ 3.22Å; E248-R251 IonicContact OE1-NH1 3.78Å; E248-R251 PolarHBondContact OE1-NH1 3.18Å; E248-R251 IonicContact OE2-CZ 3.16Å; E248-R251 IonicContact OE2-NE 2.8Å; E248-R251 IonicContact OE2-NH1 3.63Å; E248-R251 PolarHBondContact OE2-NH1 2.89Å; E248-R251 VanDerWaalsContact OE2-NH1 3.16Å; E248-R251 IonicContact OE2-NH2 3.85Å; E248-R251 PolarHBondContact OE2-NH2 3.12Å; E248-R251 VanDerWaalsContact OE2-NH2 3.15Å; Q249-R251 VanDerWaalsContact C-N 3.3Å; Q249-R251 PolarHBondContact O-N 2.93Å; R251-L253 PolarHBondContact O-N 3.03Å; R251-G254 PolarHBondContact O-N 3.15Å; R251-F255 HydrophobicContact CG-CD2 3.9Å; R251-F255 HydrophobicContact CG-CE2 3.63Å; R251-F255 WeakPolarHBondContact O-CD2 3.48Å; R251-F255 PolarHBondContact O-N 3.44Å |
| 252 | L | 83.2 | Confident | 79.1 | Confident | 113 Ų | 113 | 112.8 Ų | 112.8 | 59% | 0.592 | 56% | 0.56 | S | S | * | * | H | α-helix | trans | -60.5 | -43.4 | 178.9 | -69.8 | 169.5 | 0 | 0 | 0 | 112.5 | E248 Q249 F255 S256 | E248-L252 WeakPolarHBondContact O-CG 3.46Å; E248-L252 PolarHBondContact O-N 2.93Å; Q249-L252 PolarHBondContact O-N 3.47Å; L252-F255 PolarHBondContact O-N 3.38Å; L252-S256 PolarHBondContact O-N 3.16Å |
| 253 | L | 79.4 | Confident | 78.1 | Confident | 115 Ų | 115 | 115.9 Ų | 115.9 | 60% | 0.602 | 57% | 0.571 | S | S | * | * | H | α-helix | trans | -67.5 | -36.9 | 176 | -72.5 | 169.5 | 0 | 0 | 0 | 112.3 | Q249 R251 F255 S256 | Q249-L253 WeakPolarHBondContact O-CB 3.43Å; Q249-L253 WeakPolarHBondContact O-CG 3.15Å; Q249-L253 PolarHBondContact O-N 2.97Å; R251-L253 PolarHBondContact O-N 3.03Å; L253-F255 VanDerWaalsContact C-N 3.28Å; L253-F255 PolarHBondContact O-N 3.33Å; L253-S256 WeakPolarHBondContact O-CB 3.37Å; L253-S256 PolarHBondContact O-N 3.19Å; L253-S256 VanDerWaalsContact O-N 3.12Å |
| 254 | G | 70.5 | Confident | 77.1 | Confident | 49 Ų | 49 | 117.6 Ų | 117.6 | 51% | 0.505 | 58% | 0.577 | S | S | . | * | H | α-helix | trans | -63.1 | -32.8 | 173.7 | 0 | 0 | 0 | 0 | 0 | 113.2 | K250 R251 | K250-G254 PolarHBondContact O-N 3.3Å; R251-G254 PolarHBondContact O-N 3.15Å |
| 255 | F | 58.9 | Low | 76 | Confident | 134 Ų | 134 | 117.9 Ų | 117.9 | 59% | 0.588 | 58% | 0.581 | S | S | * | * | H | α-helix | trans | -77.8 | -16.5 | 173 | -80.3 | -70.4 | 0 | 0 | 0 | 113.9 | R251 L252 L253 W257 | R251-F255 HydrophobicContact CG-CD2 3.9Å; R251-F255 HydrophobicContact CG-CE2 3.63Å; R251-F255 WeakPolarHBondContact O-CD2 3.48Å; R251-F255 PolarHBondContact O-N 3.44Å; L252-F255 PolarHBondContact O-N 3.38Å; L253-F255 VanDerWaalsContact C-N 3.28Å; L253-F255 PolarHBondContact O-N 3.33Å; F255-W257 PolarHBondContact O-N 2.8Å |
| 256 | S | 55.4 | Low | 74.6 | Confident | 87 Ų | 87 | 118.2 Ų | 118.2 | 61% | 0.608 | 58% | 0.584 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -75.8 | -5.9 | 178.1 | -175.6 | 0 | 0 | 0 | 0 | 114 | L252 L253 | L252-S256 PolarHBondContact O-N 3.16Å; L253-S256 WeakPolarHBondContact O-CB 3.37Å; L253-S256 PolarHBondContact O-N 3.19Å; L253-S256 VanDerWaalsContact O-N 3.12Å |
| 257 | W | 47.9 | Very low | 73.2 | Confident | 233 Ų | 233 | 121.2 Ų | 121.2 | 88% | 0.883 | 60% | 0.597 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -111.4 | 10.6 | -179.1 | -73.4 | 92.3 | 0 | 0 | 0 | 114 | F255 | F255-W257 PolarHBondContact O-N 2.8Š|
| 258 | L | 43.6 | Very low | 71.6 | Confident | 206 Ų | 206 | 125.1 Ų | 125.1 | 100% | 1.079 | 61% | 0.613 | S | S | * | * | trans | -113.1 | 0 | 168.6 | -81.6 | 163 | 0 | 0 | 0 | 109.5 |
Retrieved 258 of 258 residues in 556.8 ms
(Link to these results)