| 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 | 58.8 | Low | 65.2 | Low | 219 Ų | 219 | 138.8 Ų | 138.8 | 100% | 1.079 | 68% | 0.683 | S | S | * | * | 0 | -47.8 | 0 | -141.2 | 163.5 | -176.4 | 0 | 0 | 112.4 | K3 K4 | M1-K3 PolarHBondContact O-N 3.43Å; M1-K4 PolarHBondContact O-N 3.38Å; M1-K4 VanDerWaalsContact O-N 3.12Å | |||
| 2 | V | 62.9 | Low | 65.3 | Low | 121 Ų | 121 | 130.3 Ų | 130.3 | 73% | 0.733 | 66% | 0.658 | S | S | * | * | H | α-helix | trans | -55.7 | -41.7 | -179.1 | -174.7 | 0 | 0 | 0 | 0 | 114.6 | K4 L5 L6 | V2-K4 PolarHBondContact O-N 3.45Å; V2-L5 PolarHBondContact O-N 3.46Å; V2-L5 VanDerWaalsContact O-N 3.12Å; V2-L6 PolarHBondContact O-N 3.07Å; V2-L6 VanDerWaalsContact O-N 3.08Å |
| 3 | K | 62.9 | Low | 65.6 | Low | 190 Ų | 190 | 126.1 Ų | 126.1 | 83% | 0.826 | 64% | 0.642 | S | S | * | * | H | α-helix | trans | -60.8 | -29.9 | 177.9 | -69.1 | -176.7 | 175.1 | -176.7 | 0 | 113.8 | M1 F7 | M1-K3 PolarHBondContact O-N 3.43Å; K3-F7 PolarHBondContact O-N 3.28Å |
| 4 | K | 62.9 | Low | 66.3 | Low | 180 Ų | 180 | 121.9 Ų | 121.9 | 78% | 0.783 | 63% | 0.626 | S | S | * | * | H | α-helix | trans | -76.8 | -30.2 | 178.7 | -161.7 | 177.9 | -177.7 | -177.6 | 0 | 111.8 | M1 V2 H8 | M1-K4 PolarHBondContact O-N 3.38Å; M1-K4 VanDerWaalsContact O-N 3.12Å; V2-K4 PolarHBondContact O-N 3.45Å; K4-H8 PolarHBondContact O-N 3.49Å |
| 5 | L | 65.2 | Low | 67.3 | Low | 129 Ų | 129 | 120.4 Ų | 120.4 | 68% | 0.675 | 62% | 0.615 | S | S | * | * | H | α-helix | trans | -75.5 | -41.6 | 177.2 | -144.4 | 80 | 0 | 0 | 0 | 111.1 | V2 F7 H8 V9 | V2-L5 PolarHBondContact O-N 3.46Å; V2-L5 VanDerWaalsContact O-N 3.12Å; L5-F7 PolarHBondContact O-N 3.33Å; L5-H8 PolarHBondContact O-N 3.16Å; L5-V9 WeakPolarHBondContact O-CG2 3.29Å; L5-V9 PolarHBondContact O-N 3.18Å |
| 6 | L | 67.9 | Low | 68.1 | Low | 114 Ų | 114 | 121.2 Ų | 121.2 | 60% | 0.597 | 62% | 0.617 | S | S | * | * | H | α-helix | trans | -60.8 | -45.1 | 177 | -161.6 | 81 | 0 | 0 | 0 | 111.7 | V2 H8 V9 E10 | V2-L6 PolarHBondContact O-N 3.07Å; V2-L6 VanDerWaalsContact O-N 3.08Å; L6-H8 VanDerWaalsContact C-N 3.29Å; L6-H8 PolarHBondContact O-N 3.31Å; L6-V9 PolarHBondContact O-N 3.07Å; L6-E10 PolarHBondContact O-N 3.43Å |
| 7 | F | 70.1 | Confident | 68.8 | Low | 133 Ų | 133 | 121.7 Ų | 121.7 | 58% | 0.583 | 62% | 0.617 | S | S | * | * | H | α-helix | trans | -64.3 | -33.9 | 178.6 | -157.9 | -99.4 | 0 | 0 | 0 | 112.5 | K3 L5 L11 | K3-F7 PolarHBondContact O-N 3.28Å; L5-F7 PolarHBondContact O-N 3.33Å; F7-L11 HydrophobicContact CD1-CD1 3.57Å; F7-L11 HydrophobicContact CD1-CG 4.31Å; F7-L11 HydrophobicContact CE1-CD1 3.62Å; F7-L11 HydrophobicContact CE1-CG 4.26Å; F7-L11 WeakPolarHBondContact O-CB 3.43Å; F7-L11 WeakPolarHBondContact O-CD1 3.47Å; F7-L11 WeakPolarHBondContact O-CG 3.5Å; F7-L11 PolarHBondContact O-N 2.93Å |
| 8 | H | 65.3 | Low | 69.6 | Low | 143 Ų | 143 | 122.7 Ų | 122.7 | 66% | 0.662 | 62% | 0.619 | S | S | * | * | H | α-helix | trans | -75.2 | -33.9 | 178.3 | -155.5 | 11.9 | 0 | 0 | 0 | 112.4 | K4 L5 L6 G12 | K4-H8 PolarHBondContact O-N 3.49Å; L5-H8 PolarHBondContact O-N 3.16Å; L6-H8 VanDerWaalsContact C-N 3.29Å; L6-H8 PolarHBondContact O-N 3.31Å; H8-G12 PolarHBondContact O-N 3.46Å |
| 9 | V | 66.3 | Low | 70.4 | Confident | 92 Ų | 92 | 122.7 Ų | 122.7 | 56% | 0.558 | 61% | 0.614 | S | S | * | * | H | α-helix | trans | -68 | -44.6 | 172.2 | 174.1 | 0 | 0 | 0 | 0 | 110.6 | L5 L6 L11 G12 V13 | L5-V9 WeakPolarHBondContact O-CG2 3.29Å; L5-V9 PolarHBondContact O-N 3.18Å; L6-V9 PolarHBondContact O-N 3.07Å; V9-L11 PolarHBondContact O-N 3.2Å; V9-G12 PolarHBondContact O-N 2.82Å; V9-G12 VanDerWaalsContact O-N 3.14Å; V9-V13 HydrophobicContact CG1-CG2 4.38Å; V9-V13 VanDerWaalsContact O-CG2 3.3Å; V9-V13 WeakPolarHBondContact O-CG2 3.42Å; V9-V13 PolarHBondContact O-N 2.7Å |
| 10 | E | 66.1 | Low | 71 | Confident | 113 Ų | 113 | 121.4 Ų | 121.4 | 53% | 0.528 | 61% | 0.609 | S | S | . | * | H | α-helix | trans | -60.9 | -41.3 | 174.3 | -87.2 | 179.7 | 138.9 | 0 | 0 | 112.5 | L6 G12 V13 T14 | L6-E10 PolarHBondContact O-N 3.43Å; E10-G12 VanDerWaalsContact C-N 3.32Å; E10-G12 PolarHBondContact O-N 3.32Å; E10-V13 PolarHBondContact O-N 3.24Å; E10-T14 WeakPolarHBondContact O-CB 3.36Å; E10-T14 VanDerWaalsContact O-CG2 3.3Å; E10-T14 WeakPolarHBondContact O-CG2 3.39Å; E10-T14 PolarHBondContact O-N 3.22Å; E10-T14 PolarHBondContact O-OG1 3.48Å |
| 11 | L | 68.4 | Low | 71.8 | Confident | 93 Ų | 93 | 118.4 Ų | 118.4 | 49% | 0.487 | 60% | 0.603 | S | S | . | * | H | α-helix | trans | -62.7 | -38 | 173.5 | -83 | 164.4 | 0 | 0 | 0 | 112.5 | F7 V9 T14 H15 | F7-L11 HydrophobicContact CD1-CD1 3.57Å; F7-L11 HydrophobicContact CD1-CG 4.31Å; F7-L11 HydrophobicContact CE1-CD1 3.62Å; F7-L11 HydrophobicContact CE1-CG 4.26Å; F7-L11 WeakPolarHBondContact O-CB 3.43Å; F7-L11 WeakPolarHBondContact O-CD1 3.47Å; F7-L11 WeakPolarHBondContact O-CG 3.5Å; F7-L11 PolarHBondContact O-N 2.93Å; V9-L11 PolarHBondContact O-N 3.2Å; L11-T14 WeakPolarHBondContact CA-OG1 3.4Å; L11-T14 PolarHBondContact O-OG1 3.13Å; L11-H15 WeakPolarHBondContact O-CB 3.5Å; L11-H15 PolarHBondContact O-N 3.41Å |
| 12 | G | 66.4 | Low | 73.3 | Confident | 37 Ų | 37 | 112.6 Ų | 112.6 | 38% | 0.381 | 57% | 0.573 | S | S | . | * | H | α-helix | trans | -67.4 | -40.6 | 175.7 | 0 | 0 | 0 | 0 | 0 | 112.8 | H8 V9 E10 M16 | H8-G12 PolarHBondContact O-N 3.46Å; V9-G12 PolarHBondContact O-N 2.82Å; V9-G12 VanDerWaalsContact O-N 3.14Å; E10-G12 VanDerWaalsContact C-N 3.32Å; E10-G12 PolarHBondContact O-N 3.32Å; G12-M16 WeakPolarHBondContact O-CG 3.49Å; G12-M16 PolarHBondContact O-N 3.24Å; G12-M16 VanDerWaalsContact O-N 3.11Å |
| 13 | V | 69.3 | Low | 74.5 | Confident | 75 Ų | 75 | 113 Ų | 113 | 46% | 0.455 | 57% | 0.565 | S | S | . | * | H | α-helix | trans | -67.6 | -46.5 | 178.7 | 172.4 | 0 | 0 | 0 | 0 | 110.7 | V9 E10 H15 M16 E17 | V9-V13 HydrophobicContact CG1-CG2 4.38Å; V9-V13 VanDerWaalsContact O-CG2 3.3Å; V9-V13 WeakPolarHBondContact O-CG2 3.42Å; V9-V13 PolarHBondContact O-N 2.7Å; E10-V13 PolarHBondContact O-N 3.24Å; V13-H15 VanDerWaalsContact C-N 3.32Å; V13-H15 PolarHBondContact O-N 3.36Å; V13-M16 PolarHBondContact O-N 3.39Å; V13-M16 VanDerWaalsContact O-N 3.13Å; V13-E17 HydrophobicContact CG1-CG 4.43Å; V13-E17 WeakPolarHBondContact O-CG 3.38Å; V13-E17 PolarHBondContact O-N 2.94Å |
| 14 | T | 76.3 | Confident | 75.8 | Confident | 68 Ų | 68 | 111.6 Ų | 111.6 | 42% | 0.417 | 56% | 0.555 | S | S | . | * | H | α-helix | trans | -62.4 | -37.6 | 179 | 50.1 | 0 | 0 | 0 | 0 | 112.7 | E10 L11 E17 Q18 | E10-T14 WeakPolarHBondContact O-CB 3.36Å; E10-T14 VanDerWaalsContact O-CG2 3.3Å; E10-T14 WeakPolarHBondContact O-CG2 3.39Å; E10-T14 PolarHBondContact O-N 3.22Å; E10-T14 PolarHBondContact O-OG1 3.48Å; L11-T14 WeakPolarHBondContact CA-OG1 3.4Å; L11-T14 PolarHBondContact O-OG1 3.13Å; T14-E17 PolarHBondContact O-N 3.02Å; T14-Q18 WeakPolarHBondContact O-CG 3.44Å; T14-Q18 PolarHBondContact O-N 2.92Å; T14-Q18 VanDerWaalsContact O-N 3.13Å |
| 15 | H | 80.4 | Confident | 77 | Confident | 99 Ų | 99 | 105.9 Ų | 105.9 | 46% | 0.458 | 54% | 0.541 | S | S | . | . | H | α-helix | trans | -69 | -36.3 | 174.7 | 178.9 | -105.8 | 0 | 0 | 0 | 112.7 | L11 V13 K19 | L11-H15 WeakPolarHBondContact O-CB 3.5Å; L11-H15 PolarHBondContact O-N 3.41Å; V13-H15 VanDerWaalsContact C-N 3.32Å; V13-H15 PolarHBondContact O-N 3.36Å; H15-K19 PolarHBondContact O-N 3.02Å |
| 16 | M | 80 | Confident | 77.9 | Confident | 133 Ų | 133 | 107 Ų | 107 | 66% | 0.655 | 54% | 0.536 | S | S | * | . | H | α-helix | trans | -67.4 | -41.2 | 173.9 | -82 | -71.8 | -168.7 | 0 | 0 | 112.1 | G12 V13 K19 L20 | G12-M16 WeakPolarHBondContact O-CG 3.49Å; G12-M16 PolarHBondContact O-N 3.24Å; G12-M16 VanDerWaalsContact O-N 3.11Å; V13-M16 PolarHBondContact O-N 3.39Å; V13-M16 VanDerWaalsContact O-N 3.13Å; M16-K19 PolarHBondContact O-N 2.97Å; M16-L20 PolarHBondContact O-N 3.31Å |
| 17 | E | 79.5 | Confident | 78.6 | Confident | 130 Ų | 130 | 108.1 Ų | 108.1 | 61% | 0.607 | 53% | 0.532 | S | S | * | . | H | α-helix | trans | -65.2 | -38.7 | 178.3 | -71 | -164.4 | 148.8 | 0 | 0 | 112.5 | V13 T14 L20 A21 | V13-E17 HydrophobicContact CG1-CG 4.43Å; V13-E17 WeakPolarHBondContact O-CG 3.38Å; V13-E17 PolarHBondContact O-N 2.94Å; T14-E17 PolarHBondContact O-N 3.02Å; E17-L20 PolarHBondContact O-N 3.27Å; E17-A21 WeakPolarHBondContact O-CB 3.44Å; E17-A21 PolarHBondContact O-N 3.3Å |
| 18 | Q | 84 | Confident | 79 | Confident | 139 Ų | 139 | 108.8 Ų | 108.8 | 65% | 0.65 | 54% | 0.537 | S | S | * | . | H | α-helix | trans | -62.6 | -45.6 | 174 | -77.1 | 179.1 | -15.9 | 0 | 0 | 112.4 | T14 L20 A21 E22 | T14-Q18 WeakPolarHBondContact O-CG 3.44Å; T14-Q18 PolarHBondContact O-N 2.92Å; T14-Q18 VanDerWaalsContact O-N 3.13Å; Q18-L20 VanDerWaalsContact C-N 3.28Å; Q18-L20 PolarHBondContact O-N 2.9Å; Q18-A21 PolarHBondContact O-N 3.47Å; Q18-E22 PolarHBondContact O-N 3.43Å |
| 19 | K | 85.7 | Confident | 79.6 | Confident | 123 Ų | 123 | 105 Ų | 105 | 54% | 0.535 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -62.1 | -36.7 | 175.5 | -80.5 | -167.6 | 171.1 | -175.7 | 0 | 112.4 | H15 M16 F23 | H15-K19 PolarHBondContact O-N 3.02Å; M16-K19 PolarHBondContact O-N 2.97Å; K19-F23 WeakPolarHBondContact O-CB 3.42Å; K19-F23 PolarHBondContact O-N 3.25Å |
| 20 | L | 82.3 | Confident | 79.9 | Confident | 96 Ų | 96 | 105.8 Ų | 105.8 | 50% | 0.503 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -68.7 | -41 | 177.2 | -135.3 | 71.8 | 0 | 0 | 0 | 111.8 | M16 E17 Q18 F23 R24 | M16-L20 PolarHBondContact O-N 3.31Å; E17-L20 PolarHBondContact O-N 3.27Å; Q18-L20 VanDerWaalsContact C-N 3.28Å; Q18-L20 PolarHBondContact O-N 2.9Å; L20-F23 PolarHBondContact O-N 2.97Å; L20-R24 VanDerWaalsContact O-CG 3.28Å; L20-R24 WeakPolarHBondContact O-CG 3.47Å; L20-R24 PolarHBondContact O-N 2.94Å |
| 21 | A | 86.8 | Confident | 79.9 | Confident | 59 Ų | 59 | 108.7 Ų | 108.7 | 49% | 0.488 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -63.1 | -44.7 | 175.5 | 0 | 0 | 0 | 0 | 0 | 111.4 | E17 Q18 F23 R24 A25 | E17-A21 WeakPolarHBondContact O-CB 3.44Å; E17-A21 PolarHBondContact O-N 3.3Å; Q18-A21 PolarHBondContact O-N 3.47Å; A21-F23 PolarHBondContact O-N 3Å; A21-R24 PolarHBondContact O-N 3.48Å; A21-A25 WeakPolarHBondContact O-CB 3.44Å; A21-A25 PolarHBondContact O-N 2.93Å |
| 22 | E | 90.9 | Very high | 79.5 | Confident | 97 Ų | 97 | 107.2 Ų | 107.2 | 45% | 0.453 | 55% | 0.547 | S | S | . | . | H | α-helix | trans | -61.9 | -42.9 | 176.7 | -166 | -172.4 | 167.6 | 0 | 0 | 111.7 | Q18 R24 A25 R26 | Q18-E22 PolarHBondContact O-N 3.43Å; E22-R24 PolarHBondContact O-N 3.31Å; E22-A25 PolarHBondContact O-N 3.46Å; E22-R26 WeakPolarHBondContact O-CG 3.43Å; E22-R26 PolarHBondContact O-N 3.06Å; E22-R26 IonicContact OE1-CZ 3.24Å; E22-R26 IonicContact OE1-NE 3.93Å; E22-R26 PolarHBondContact OE1-NE 3.34Å; E22-R26 IonicContact OE1-NH2 2.7Å; E22-R26 PolarHBondContact OE1-NH2 3.48Å |
| 23 | F | 87.1 | Confident | 79 | Confident | 131 Ų | 131 | 113.4 Ų | 113.4 | 58% | 0.575 | 57% | 0.568 | S | S | * | * | H | α-helix | trans | -65 | -39.8 | 178 | -157.1 | -91.9 | 0 | 0 | 0 | 112.3 | K19 L20 A21 R27 | K19-F23 WeakPolarHBondContact O-CB 3.42Å; K19-F23 PolarHBondContact O-N 3.25Å; L20-F23 PolarHBondContact O-N 2.97Å; A21-F23 PolarHBondContact O-N 3Å; F23-R27 HydrophobicContact CD1-CG 4.2Å; F23-R27 HydrophobicContact CE1-CG 4.11Å; F23-R27 WeakPolarHBondContact O-CG 3.44Å; F23-R27 PolarHBondContact O-N 2.97Å |
| 24 | R | 91.4 | Very high | 78.5 | Confident | 160 Ų | 160 | 118.6 Ų | 118.6 | 60% | 0.604 | 58% | 0.584 | S | S | * | * | H | α-helix | trans | -64 | -43.4 | 174.3 | -71.9 | 172.3 | -170.5 | 175 | 3.5 | 111.4 | L20 A21 E22 R27 Q28 | L20-R24 VanDerWaalsContact O-CG 3.28Å; L20-R24 WeakPolarHBondContact O-CG 3.47Å; L20-R24 PolarHBondContact O-N 2.94Å; A21-R24 PolarHBondContact O-N 3.48Å; E22-R24 PolarHBondContact O-N 3.31Å; R24-R27 PolarHBondContact O-N 2.88Å; R24-Q28 WeakPolarHBondContact O-CG 3.38Å; R24-Q28 PolarHBondContact O-N 3.33Å |
| 25 | A | 86.9 | Confident | 76.9 | Confident | 59 Ų | 59 | 124.1 Ų | 124.1 | 49% | 0.488 | 60% | 0.602 | S | S | . | * | H | α-helix | trans | -62 | -45.6 | 177.8 | 0 | 0 | 0 | 0 | 0 | 111.9 | A21 E22 R27 Q28 A29 | A21-A25 WeakPolarHBondContact O-CB 3.44Å; A21-A25 PolarHBondContact O-N 2.93Å; E22-A25 PolarHBondContact O-N 3.46Å; A25-R27 PolarHBondContact O-N 3.4Å; A25-Q28 PolarHBondContact O-N 2.99Å; A25-A29 PolarHBondContact O-N 3.45Å |
| 26 | R | 84.4 | Confident | 75.1 | Confident | 153 Ų | 153 | 125.3 Ų | 125.3 | 58% | 0.577 | 62% | 0.619 | S | S | * | * | H | α-helix | trans | -59.4 | -44.9 | 175.1 | -71 | 178.3 | -176.2 | -141.4 | -2 | 112.1 | E22 Q28 A29 E30 | E22-R26 WeakPolarHBondContact O-CG 3.43Å; E22-R26 PolarHBondContact O-N 3.06Å; E22-R26 IonicContact OE1-CZ 3.24Å; E22-R26 IonicContact OE1-NE 3.93Å; E22-R26 PolarHBondContact OE1-NE 3.34Å; E22-R26 IonicContact OE1-NH2 2.7Å; E22-R26 PolarHBondContact OE1-NH2 3.48Å; R26-Q28 VanDerWaalsContact C-N 3.34Å; R26-Q28 PolarHBondContact O-N 3.4Å; R26-A29 PolarHBondContact O-N 3.38Å; R26-E30 WeakPolarHBondContact O-CG 3.3Å; R26-E30 PolarHBondContact O-N 2.91Å |
| 27 | R | 82.8 | Confident | 73.1 | Confident | 137 Ų | 137 | 127.5 Ų | 127.5 | 52% | 0.517 | 63% | 0.627 | S | S | . | * | H | α-helix | trans | -65.5 | -34.2 | 177.5 | -76.6 | -60.2 | -159.4 | -178.5 | 5.7 | 113.4 | F23 R24 A25 E30 K31 | F23-R27 HydrophobicContact CD1-CG 4.2Å; F23-R27 HydrophobicContact CE1-CG 4.11Å; F23-R27 WeakPolarHBondContact O-CG 3.44Å; F23-R27 PolarHBondContact O-N 2.97Å; R24-R27 PolarHBondContact O-N 2.88Å; A25-R27 PolarHBondContact O-N 3.4Å; R27-E30 WeakPolarHBondContact CD-OE2 3.44Å; R27-E30 IonicContact CZ-OE2 3.03Å; R27-E30 IonicContact NH1-OE2 3.46Å; R27-E30 PolarHBondContact NH1-OE2 3.36Å; R27-K31 WeakPolarHBondContact O-CB 3.37Å; R27-K31 WeakPolarHBondContact O-CG 3.46Å; R27-K31 PolarHBondContact O-N 3.32Å |
| 28 | Q | 79.3 | Confident | 71.2 | Confident | 147 Ų | 147 | 126.7 Ų | 126.7 | 69% | 0.687 | 63% | 0.633 | S | S | * | * | H | α-helix | trans | -72.8 | -36.9 | 176.1 | -71.9 | -168.8 | 8.7 | 0 | 0 | 112 | R24 A25 R26 K31 G32 | R24-Q28 WeakPolarHBondContact O-CG 3.38Å; R24-Q28 PolarHBondContact O-N 3.33Å; A25-Q28 PolarHBondContact O-N 2.99Å; R26-Q28 VanDerWaalsContact C-N 3.34Å; R26-Q28 PolarHBondContact O-N 3.4Å; Q28-K31 PolarHBondContact O-N 3.26Å; Q28-G32 PolarHBondContact O-N 3.49Å |
| 29 | A | 76.4 | Confident | 69.2 | Low | 64 Ų | 64 | 125.2 Ų | 125.2 | 53% | 0.529 | 65% | 0.645 | S | S | . | * | H | α-helix | trans | -64.4 | -41.6 | 171.7 | 0 | 0 | 0 | 0 | 0 | 112 | A25 R26 G32 M33 | A25-A29 PolarHBondContact O-N 3.45Å; R26-A29 PolarHBondContact O-N 3.38Å; A29-G32 PolarHBondContact O-N 3.24Å; A29-M33 WeakPolarHBondContact O-CB 3.3Å; A29-M33 PolarHBondContact O-N 3.12Å |
| 30 | E | 73.1 | Confident | 66.5 | Low | 109 Ų | 109 | 122.8 Ų | 122.8 | 51% | 0.509 | 66% | 0.655 | S | S | . | * | H | α-helix | trans | -64.5 | -39.3 | 174.6 | -76.4 | 179.3 | 174.4 | 0 | 0 | 112.9 | R26 R27 K34 | R26-E30 WeakPolarHBondContact O-CG 3.3Å; R26-E30 PolarHBondContact O-N 2.91Å; R27-E30 WeakPolarHBondContact CD-OE2 3.44Å; R27-E30 IonicContact CZ-OE2 3.03Å; R27-E30 IonicContact NH1-OE2 3.46Å; R27-E30 PolarHBondContact NH1-OE2 3.36Å; E30-K34 PolarHBondContact O-N 3.01Å |
| 31 | K | 65.6 | Low | 64.6 | Low | 173 Ų | 173 | 124.3 Ų | 124.3 | 75% | 0.752 | 67% | 0.671 | S | S | * | * | H | α-helix | trans | -70.7 | -33 | 175.4 | -79.3 | -176.7 | 175.9 | -173.5 | 0 | 112.4 | R27 Q28 | R27-K31 WeakPolarHBondContact O-CB 3.37Å; R27-K31 WeakPolarHBondContact O-CG 3.46Å; R27-K31 PolarHBondContact O-N 3.32Å; Q28-K31 PolarHBondContact O-N 3.26Å |
| 32 | G | 60 | Low | 62 | Low | 62 Ų | 62 | 130.6 Ų | 130.6 | 64% | 0.639 | 69% | 0.69 | S | S | * | * | H | α-helix | trans | -75.5 | -26.6 | 175.4 | 0 | 0 | 0 | 0 | 0 | 114 | Q28 A29 | Q28-G32 PolarHBondContact O-N 3.49Å; A29-G32 PolarHBondContact O-N 3.24Å |
| 33 | M | 57.7 | Low | 59.4 | Low | 168 Ų | 168 | 131.9 Ų | 131.9 | 83% | 0.828 | 71% | 0.707 | S | S | * | * | H | α-helix | trans | -81 | -14.6 | 177.5 | -153.2 | 85.1 | 88.6 | 0 | 0 | 113 | A29 | A29-M33 WeakPolarHBondContact O-CB 3.3Å; A29-M33 PolarHBondContact O-N 3.12Å |
| 34 | K | 58.4 | Low | 56.6 | Low | 183 Ų | 183 | 129.1 Ų | 129.1 | 80% | 0.796 | 72% | 0.715 | S | S | * | * | S | Bend | trans | -99.8 | 93.6 | 173 | -80.5 | -173.9 | 175.3 | -179.3 | 0 | 111.2 | E30 | E30-K34 PolarHBondContact O-N 3.01Š|
| 35 | K | 42.9 | Very low | 53.6 | Low | 184 Ų | 184 | 128.7 Ų | 128.7 | 80% | 0.8 | 73% | 0.725 | S | S | * | * | trans | 110 | 125.2 | 157.3 | -154.5 | 166.7 | -174.1 | 178.1 | 0 | 114.1 | ||||
| 36 | P | 42.4 | Very low | 50.9 | Low | 124 Ų | 124 | 134 Ų | 134 | 81% | 0.805 | 74% | 0.74 | S | S | * | * | cis | -122 | 126.1 | 41.2 | 35.2 | -18.6 | 0 | 0 | 0 | 115.7 | ||||
| 37 | E | 37.8 | Very low | 48.2 | Very low | 179 Ų | 179 | 138.7 Ų | 138.7 | 84% | 0.836 | 76% | 0.757 | S | S | * | * | P | Polyproline II helix | trans | -99.5 | 129.9 | 156.4 | -159.5 | 178.3 | 145 | 0 | 0 | 108.5 | ||
| 38 | P | 40 | Very low | 45.5 | Very low | 113 Ų | 113 | 136 Ų | 136 | 73% | 0.734 | 77% | 0.772 | S | S | * | * | P | Polyproline II helix | trans | -86.3 | 165.7 | -173.6 | 35.2 | -33.6 | 0 | 0 | 0 | 112.8 | ||
| 39 | A | 41 | Very low | 42.8 | Very low | 108 Ų | 108 | 133 Ų | 133 | 89% | 0.893 | 78% | 0.781 | S | S | * | * | P | Polyproline II helix | trans | -56.9 | 153.9 | -176.6 | 0 | 0 | 0 | 0 | 0 | 115.9 | ||
| 40 | G | 28.9 | Very low | 40.4 | Very low | 72 Ų | 72 | 133.5 Ų | 133.5 | 74% | 0.742 | 79% | 0.792 | S | S | * | * | trans | 178.8 | 158.8 | 149.5 | 0 | 0 | 0 | 0 | 0 | 112 | ||||
| 41 | P | 41.9 | Very low | 39 | Very low | 129 Ų | 129 | 134.3 Ų | 134.3 | 84% | 0.838 | 81% | 0.807 | S | S | * | * | cis | -128.2 | 150.1 | -17.9 | 31.9 | -13.6 | 0 | 0 | 0 | 113.7 | ||||
| 42 | Q | 33.4 | Very low | 37.2 | Very low | 191 Ų | 191 | 130.4 Ų | 130.4 | 89% | 0.893 | 81% | 0.807 | S | S | * | * | trans | -110.8 | 148.7 | 155.1 | -86.6 | -159.5 | 4.1 | 0 | 0 | 109.8 | ||||
| 43 | P | 35.8 | Very low | 35.9 | Very low | 123 Ų | 123 | 134.1 Ų | 134.1 | 80% | 0.799 | 82% | 0.817 | S | S | * | * | trans | -91.8 | 141 | -174.8 | 32.7 | -24.7 | 0 | 0 | 0 | 113.1 | ||||
| 44 | G | 28.2 | Very low | 34.8 | Very low | 73 Ų | 73 | 134.5 Ų | 134.5 | 75% | 0.753 | 82% | 0.817 | S | S | * | * | trans | 52.9 | 115.2 | 144.2 | 0 | 0 | 0 | 0 | 0 | 119.9 | ||||
| 45 | D | 29.1 | Very low | 33.9 | Very low | 151 Ų | 151 | 131.3 Ų | 131.3 | 81% | 0.807 | 82% | 0.815 | S | S | * | * | -166.7 | 161.6 | 102.7 | -121.3 | -33.6 | 0 | 0 | 0 | 113.6 | |||||
| 46 | Q | 29.3 | Very low | 33.1 | Very low | 172 Ų | 172 | 129.5 Ų | 129.5 | 80% | 0.804 | 81% | 0.814 | S | S | * | * | trans | -72 | 154.3 | -164.8 | -61 | 155 | 79.4 | 0 | 0 | 114.4 | ||||
| 47 | R | 27.7 | Very low | 32.4 | Very low | 250 Ų | 250 | 128.4 Ų | 128.4 | 94% | 0.943 | 81% | 0.809 | S | S | * | * | 148.2 | 122.1 | 110.2 | -164.8 | 167.1 | -156.2 | -176.7 | 4 | 113.9 | |||||
| 48 | G | 25.7 | Very low | 32.1 | Very low | 81 Ų | 81 | 124.2 Ų | 124.2 | 84% | 0.835 | 80% | 0.8 | S | S | * | * | trans | 91.3 | 103.6 | 135.6 | 0 | 0 | 0 | 0 | 0 | 118.5 | ||||
| 49 | G | 24.4 | Very low | 31.6 | Very low | 85 Ų | 85 | 127.9 Ų | 127.9 | 88% | 0.876 | 81% | 0.807 | S | S | * | * | trans | 178.1 | 117.8 | 158.2 | 0 | 0 | 0 | 0 | 0 | 113.7 | ||||
| 50 | G | 25.1 | Very low | 31.3 | Very low | 73 Ų | 73 | 131.1 Ų | 131.1 | 75% | 0.753 | 80% | 0.803 | S | S | * | * | trans | -159.2 | 172 | 157.5 | 0 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 51 | P | 44.3 | Very low | 32.3 | Very low | 127 Ų | 127 | 132.2 Ų | 132.2 | 83% | 0.825 | 80% | 0.797 | S | S | * | * | cis | -137.4 | 179.6 | -10.7 | 39.1 | -21.1 | 0 | 0 | 0 | 114.9 | ||||
| 52 | A | 26.7 | Very low | 31.6 | Very low | 90 Ų | 90 | 136.2 Ų | 136.2 | 74% | 0.744 | 80% | 0.801 | S | S | * | * | trans | 77.6 | 124.2 | 147.7 | 0 | 0 | 0 | 0 | 0 | 120.2 | ||||
| 53 | V | 33 | Very low | 31.7 | Very low | 141 Ų | 141 | 135.6 Ų | 135.6 | 86% | 0.855 | 80% | 0.799 | S | S | * | * | 177.9 | 130.2 | 98.1 | 163.5 | 0 | 0 | 0 | 0 | 109.6 | |||||
| 54 | Q | 34.8 | Very low | 32.1 | Very low | 176 Ų | 176 | 135 Ų | 135 | 82% | 0.822 | 79% | 0.794 | S | S | * | * | trans | -98.3 | 154.9 | 162.3 | -108 | -179.8 | -5.4 | 0 | 0 | 108.5 | ||||
| 55 | P | 39.2 | Very low | 32.4 | Very low | 116 Ų | 116 | 139.2 Ų | 139.2 | 75% | 0.753 | 79% | 0.794 | S | S | * | * | -146.1 | 141.2 | 87.2 | 31.5 | -11.2 | 0 | 0 | 0 | 113.2 | |||||
| 56 | D | 26.7 | Very low | 32.8 | Very low | 145 Ų | 145 | 137.7 Ų | 137.7 | 78% | 0.775 | 79% | 0.791 | S | S | * | * | 69.3 | 114.5 | 78.7 | -155.1 | 23 | 0 | 0 | 0 | 116.9 | |||||
| 57 | S | 27.8 | Very low | 33.4 | Very low | 101 Ų | 101 | 134.2 Ų | 134.2 | 71% | 0.706 | 79% | 0.785 | S | S | * | * | 157.4 | 112 | 123.5 | -168.3 | 0 | 0 | 0 | 0 | 114.7 | |||||
| 58 | S | 31.5 | Very low | 34.1 | Very low | 92 Ų | 92 | 130.9 Ų | 130.9 | 64% | 0.643 | 78% | 0.781 | S | S | * | * | trans | 0.9 | 142.6 | 147.2 | -52.5 | 0 | 0 | 0 | 0 | 122.8 | ||||
| 59 | H | 29 | Very low | 34.6 | Very low | 190 Ų | 190 | 132.2 Ų | 132.2 | 88% | 0.88 | 78% | 0.784 | S | S | * | * | 175.7 | 132.5 | 110.7 | -89.9 | -66.3 | 0 | 0 | 0 | 113.8 | |||||
| 60 | Q | 34.2 | Very low | 35.4 | Very low | 175 Ų | 175 | 132 Ų | 132 | 82% | 0.818 | 77% | 0.774 | S | S | * | * | trans | -101.5 | -173.1 | 164.6 | -134.8 | -153.3 | -2.6 | 0 | 0 | 108.3 | ||||
| 61 | P | 49.7 | Very low | 36.4 | Very low | 95 Ų | 95 | 134.6 Ų | 134.6 | 62% | 0.617 | 77% | 0.769 | S | S | * | * | cis | -126.2 | 160.7 | -48.3 | 32.5 | -17.1 | 0 | 0 | 0 | 112 | ||||
| 62 | K | 29.3 | Very low | 36.4 | Very low | 213 Ų | 213 | 133.9 Ų | 133.9 | 93% | 0.926 | 77% | 0.767 | S | S | * | * | trans | -159 | 116 | 150.6 | -72.8 | -160.6 | 179.9 | 172.1 | 0 | 112.9 | ||||
| 63 | E | 33.9 | Very low | 37.3 | Very low | 179 Ų | 179 | 134 Ų | 134 | 84% | 0.836 | 76% | 0.763 | S | S | * | * | trans | -92.9 | 160.9 | 143.7 | -115 | -160.1 | 145.3 | 0 | 0 | 107.1 | ||||
| 64 | P | 44.7 | Very low | 38.2 | Very low | 109 Ų | 109 | 130.6 Ų | 130.6 | 71% | 0.708 | 75% | 0.745 | S | S | * | * | -154.9 | 175.6 | 57.1 | 40 | -16.2 | 0 | 0 | 0 | 118.4 | |||||
| 65 | E | 35.2 | Very low | 39 | Very low | 162 Ų | 162 | 129.7 Ų | 129.7 | 76% | 0.757 | 74% | 0.741 | S | S | * | * | trans | 91.8 | 109.1 | 149.7 | -51 | -157.8 | 140.2 | 0 | 0 | 122.4 | ||||
| 66 | T | 36.3 | Very low | 39.6 | Very low | 119 Ų | 119 | 129.5 Ų | 129.5 | 73% | 0.73 | 73% | 0.733 | S | S | * | * | 75 | 124.1 | 113.7 | -55.9 | 0 | 0 | 0 | 0 | 120.5 | |||||
| 67 | S | 42.6 | Very low | 40.9 | Very low | 99 Ų | 99 | 131.6 Ų | 131.6 | 69% | 0.692 | 73% | 0.73 | S | S | * | * | trans | 91.5 | 102.7 | 163.9 | -54.8 | 0 | 0 | 0 | 0 | 116.5 | ||||
| 68 | Q | 41.4 | Very low | 42.5 | Very low | 180 Ų | 180 | 132 Ų | 132 | 84% | 0.841 | 73% | 0.725 | S | S | * | * | trans | 165.5 | 62.7 | 131.3 | -86.7 | 166.8 | 38 | 0 | 0 | 110.3 | ||||
| 69 | A | 36.5 | Very low | 43.8 | Very low | 109 Ų | 109 | 131.1 Ų | 131.1 | 90% | 0.901 | 72% | 0.718 | S | S | * | * | trans | -112.7 | 63.8 | 169.1 | 0 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 70 | A | 42.6 | Very low | 45.2 | Very low | 81 Ų | 81 | 130.3 Ų | 130.3 | 67% | 0.669 | 71% | 0.707 | S | S | * | * | S | Bend | trans | -156.1 | 4.7 | 174.5 | 0 | 0 | 0 | 0 | 0 | 116.1 | ||
| 71 | I | 44.7 | Very low | 46.5 | Very low | 128 Ų | 128 | 127 Ų | 127 | 66% | 0.656 | 70% | 0.695 | S | S | * | * | S | Bend | trans | -111.5 | -15.4 | -175 | -58.9 | 178.6 | 0 | 0 | 0 | 113.2 | ||
| 72 | S | 44.3 | Very low | 47.1 | Very low | 112 Ų | 112 | 130.6 Ų | 130.6 | 78% | 0.783 | 70% | 0.696 | S | S | * | * | S | Bend | trans | -94 | -2.8 | -171.2 | -51.6 | 0 | 0 | 0 | 0 | 116 | ||
| 73 | S | 46.4 | Very low | 48.6 | Very low | 93 Ų | 93 | 124.9 Ų | 124.9 | 65% | 0.65 | 68% | 0.675 | S | S | * | * | S | Bend | trans | -98.1 | -10.4 | -172.8 | 62 | 0 | 0 | 0 | 0 | 115.6 | ||
| 74 | S | 50.7 | Low | 50 | Low | 69 Ų | 69 | 122.2 Ų | 122.2 | 48% | 0.483 | 67% | 0.666 | S | S | . | * | S | Bend | trans | -91.2 | -36.9 | -178.6 | 27.6 | 0 | 0 | 0 | 0 | 112.7 | D76 R77 | S74-D76 PolarHBondContact O-N 2.99Å; S74-R77 PolarHBondContact O-N 3.26Å |
| 75 | Q | 51.8 | Low | 51 | Low | 157 Ų | 157 | 123.3 Ų | 123.3 | 73% | 0.734 | 67% | 0.666 | S | S | * | * | H | α-helix | trans | -70.5 | -28 | -172.8 | -131.7 | 173.7 | 3.5 | 0 | 0 | 114.3 | C79 | Q75-C79 PolarHBondContact O-N 3.21Å |
| 76 | D | 51.8 | Low | 52.4 | Low | 111 Ų | 111 | 118 Ų | 118 | 59% | 0.594 | 65% | 0.647 | S | S | * | * | H | α-helix | trans | -76.8 | -24.7 | -178.8 | -170.6 | 53.4 | 0 | 0 | 0 | 113.1 | S74 R80 | S74-D76 PolarHBondContact O-N 2.99Å; D76-R80 WeakPolarHBondContact O-CG 3.5Å |
| 77 | R | 55.3 | Low | 53.8 | Low | 189 Ų | 189 | 117.2 Ų | 117.2 | 71% | 0.713 | 64% | 0.642 | S | S | * | * | H | α-helix | trans | -78.1 | -43.6 | 176.7 | -70.2 | -174.3 | 173.7 | -170.6 | -1.7 | 111.8 | S74 C79 R80 D81 | S74-R77 PolarHBondContact O-N 3.26Å; R77-C79 PolarHBondContact O-N 3.45Å; R77-R80 PolarHBondContact O-N 3.34Å; R77-D81 PolarHBondContact O-N 2.9Å |
| 78 | D | 60.4 | Low | 54.9 | Low | 111 Ų | 111 | 116.7 Ų | 116.7 | 59% | 0.594 | 63% | 0.631 | S | S | * | * | H | α-helix | trans | -66.7 | -36.7 | -177.6 | -66.6 | -32 | 0 | 0 | 0 | 112.7 | R80 D81 W82 | D78-R80 VanDerWaalsContact C-N 3.35Å; D78-D81 PolarHBondContact O-N 3.45Å; D78-W82 PolarHBondContact O-N 3.14Å; D78-W82 VanDerWaalsContact O-N 3.07Å |
| 79 | C | 58.8 | Low | 56 | Low | 73 Ų | 73 | 109.7 Ų | 109.7 | 49% | 0.493 | 61% | 0.607 | S | S | . | * | H | α-helix | trans | -67.3 | -36.1 | 177.2 | -172.1 | 0 | 0 | 0 | 0 | 112.2 | Q75 R77 L83 | Q75-C79 PolarHBondContact O-N 3.21Å; R77-C79 PolarHBondContact O-N 3.45Å; C79-L83 WeakPolarHBondContact O-CB 3.43Å; C79-L83 WeakPolarHBondContact O-CG 3.49Å; C79-L83 PolarHBondContact O-N 3.48Å |
| 80 | R | 58 | Low | 57.5 | Low | 173 Ų | 173 | 114.4 Ų | 114.4 | 65% | 0.653 | 60% | 0.602 | S | S | * | * | H | α-helix | trans | -69.8 | -41.5 | 176.2 | -76.6 | -177.3 | 147.6 | -137.1 | -6 | 112 | D76 R77 D78 L83 L84 | D76-R80 WeakPolarHBondContact O-CG 3.5Å; R77-R80 PolarHBondContact O-N 3.34Å; D78-R80 VanDerWaalsContact C-N 3.35Å; R80-L83 PolarHBondContact O-N 2.93Å; R80-L84 VanDerWaalsContact O-CG 3.29Å; R80-L84 WeakPolarHBondContact O-CG 3.41Å; R80-L84 PolarHBondContact O-N 2.91Å |
| 81 | D | 62.5 | Low | 58.4 | Low | 106 Ų | 106 | 116.3 Ų | 116.3 | 57% | 0.567 | 59% | 0.592 | S | S | * | * | H | α-helix | trans | -67.3 | -40.1 | 178.4 | -81 | -20.5 | 0 | 0 | 0 | 112.1 | R77 D78 L83 L84 D85 | R77-D81 PolarHBondContact O-N 2.9Å; D78-D81 PolarHBondContact O-N 3.45Å; D81-L83 PolarHBondContact O-N 3.13Å; D81-L84 PolarHBondContact O-N 3.11Å; D81-D85 PolarHBondContact O-N 3.36Å; D81-D85 VanDerWaalsContact O-N 3.16Å |
| 82 | W | 62.8 | Low | 59.3 | Low | 170 Ų | 170 | 115.9 Ų | 115.9 | 64% | 0.644 | 59% | 0.585 | S | S | * | * | H | α-helix | trans | -65.1 | -36.9 | 175.4 | -179.7 | 78.9 | 0 | 0 | 0 | 113.5 | D78 L84 D85 S86 | D78-W82 PolarHBondContact O-N 3.14Å; D78-W82 VanDerWaalsContact O-N 3.07Å; W82-L84 VanDerWaalsContact C-N 3.35Å; W82-D85 PolarHBondContact O-N 3.01Å; W82-S86 PolarHBondContact NE1-OG 2.78Å; W82-S86 WeakPolarHBondContact O-CB 3.28Å; W82-S86 PolarHBondContact O-N 3.03Å; W82-S86 PolarHBondContact O-OG 3.36Å |
| 83 | L | 60.1 | Low | 60.4 | Low | 93 Ų | 93 | 112.8 Ų | 112.8 | 49% | 0.487 | 57% | 0.566 | S | S | . | * | H | α-helix | trans | -67.2 | -33.6 | 176.1 | -88.3 | 165.6 | 0 | 0 | 0 | 112.9 | C79 R80 D81 | C79-L83 WeakPolarHBondContact O-CB 3.43Å; C79-L83 WeakPolarHBondContact O-CG 3.49Å; C79-L83 PolarHBondContact O-N 3.48Å; R80-L83 PolarHBondContact O-N 2.93Å; D81-L83 PolarHBondContact O-N 3.13Å |
| 84 | L | 63.3 | Low | 61.5 | Low | 122 Ų | 122 | 110.9 Ų | 110.9 | 64% | 0.639 | 55% | 0.553 | S | S | * | * | I | π-helix | trans | -74.5 | -31.5 | 177 | -68.6 | 168.7 | 0 | 0 | 0 | 112 | R80 D81 W82 G89 | R80-L84 VanDerWaalsContact O-CG 3.29Å; R80-L84 WeakPolarHBondContact O-CG 3.41Å; R80-L84 PolarHBondContact O-N 2.91Å; D81-L84 PolarHBondContact O-N 3.11Å; W82-L84 VanDerWaalsContact C-N 3.35Å; L84-G89 WeakPolarHBondContact O-CA 3.07Å; L84-G89 PolarHBondContact O-N 2.78Å |
| 85 | D | 65.6 | Low | 62.4 | Low | 132 Ų | 132 | 114.7 Ų | 114.7 | 71% | 0.706 | 56% | 0.557 | S | S | * | * | I | π-helix | trans | -82.5 | -33.3 | -175.5 | -162.5 | 41.7 | 0 | 0 | 0 | 113.9 | D81 W82 | D81-D85 PolarHBondContact O-N 3.36Å; D81-D85 VanDerWaalsContact O-N 3.16Å; W82-D85 PolarHBondContact O-N 3.01Å |
| 86 | S | 65.2 | Low | 63.5 | Low | 51 Ų | 51 | 113.2 Ų | 113.2 | 36% | 0.357 | 55% | 0.55 | S | S | . | * | I | π-helix | trans | -83.4 | -29.8 | -155.9 | -63.8 | 0 | 0 | 0 | 0 | 117.4 | W82 | W82-S86 PolarHBondContact NE1-OG 2.78Å; W82-S86 WeakPolarHBondContact O-CB 3.28Å; W82-S86 PolarHBondContact O-N 3.03Å; W82-S86 PolarHBondContact O-OG 3.36Å |
| 87 | T | 65.6 | Low | 64.6 | Low | 103 Ų | 103 | 113.1 Ų | 113.1 | 63% | 0.632 | 55% | 0.549 | S | S | * | . | I | π-helix | trans | -157.4 | -38 | -177.9 | 52.1 | 0 | 0 | 0 | 0 | 113.4 | W91 | T87-W91 WeakPolarHBondContact O-CB 3.1Å; T87-W91 PolarHBondContact O-N 3.08Å; T87-W91 VanDerWaalsContact O-N 3.07Å |
| 88 | L | 65.1 | Low | 65.7 | Low | 88 Ų | 88 | 108 Ų | 108 | 46% | 0.461 | 54% | 0.539 | S | S | . | . | I | π-helix | trans | -70.9 | -45.5 | 179.5 | -69.5 | 167.1 | 0 | 0 | 0 | 111.2 | R90 W91 F92 | L88-R90 VanDerWaalsContact C-N 3.31Å; L88-R90 PolarHBondContact O-N 3.06Å; L88-W91 HydrophobicContact CD2-CE3 4.41Å; L88-W91 CarbonylContact O-C 3.58Å; L88-W91 PolarHBondContact O-N 3.07Å; L88-W91 VanDerWaalsContact O-N 3.08Å; L88-F92 HydrophobicContact CB-CD2 4.24Å; L88-F92 HydrophobicContact CB-CE2 4.2Å; L88-F92 HydrophobicContact CD2-CE2 4.28Å; L88-F92 WeakPolarHBondContact O-CD2 3.37Å; L88-F92 PolarHBondContact O-N 3.33Å |
| 89 | G | 65.6 | Low | 66.7 | Low | 33 Ų | 33 | 107.2 Ų | 107.2 | 34% | 0.34 | 53% | 0.534 | S | S | . | . | H | α-helix | trans | -57.2 | -43.4 | 176.2 | 0 | 0 | 0 | 0 | 0 | 112.5 | L84 W91 A93 | L84-G89 WeakPolarHBondContact O-CA 3.07Å; L84-G89 PolarHBondContact O-N 2.78Å; G89-W91 PolarHBondContact O-N 3.08Å; G89-A93 WeakPolarHBondContact O-CB 3.39Å; G89-A93 PolarHBondContact O-N 3.12Å |
| 90 | R | 66.7 | Low | 68 | Low | 208 Ų | 208 | 106.5 Ų | 106.5 | 79% | 0.785 | 53% | 0.53 | S | S | * | . | H | α-helix | trans | -68.5 | -31.1 | 175.6 | -166.7 | 170.6 | -179 | -118 | 1.2 | 113.2 | L88 S94 | L88-R90 VanDerWaalsContact C-N 3.31Å; L88-R90 PolarHBondContact O-N 3.06Å; R90-S94 VanDerWaalsContact O-CB 3.23Å; R90-S94 WeakPolarHBondContact O-CB 3.23Å; R90-S94 PolarHBondContact O-N 3.15Å; R90-S94 PolarHBondContact O-OG 2.9Å |
| 91 | W | 62.5 | Low | 69.5 | Low | 121 Ų | 121 | 102.8 Ų | 102.8 | 46% | 0.458 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -77.3 | -39.1 | 175.5 | 179 | 70 | 0 | 0 | 0 | 113.4 | T87 L88 G89 S94 R95 | T87-W91 WeakPolarHBondContact O-CB 3.1Å; T87-W91 PolarHBondContact O-N 3.08Å; T87-W91 VanDerWaalsContact O-N 3.07Å; L88-W91 HydrophobicContact CD2-CE3 4.41Å; L88-W91 CarbonylContact O-C 3.58Å; L88-W91 PolarHBondContact O-N 3.07Å; L88-W91 VanDerWaalsContact O-N 3.08Å; G89-W91 PolarHBondContact O-N 3.08Å; W91-S94 WeakPolarHBondContact CA-OG 3.46Å; W91-S94 PolarHBondContact O-N 2.77Å; W91-S94 PolarHBondContact O-OG 3.5Å; W91-R95 WeakPolarHBondContact O-CB 3.45Å; W91-R95 PolarHBondContact O-N 2.73Å |
| 92 | F | 63.8 | Low | 70.8 | Confident | 118 Ų | 118 | 102.2 Ų | 102.2 | 52% | 0.518 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -70.3 | -39.9 | 171.4 | -75.1 | -67.7 | 0 | 0 | 0 | 110.9 | L88 R95 Q96 | L88-F92 HydrophobicContact CB-CD2 4.24Å; L88-F92 HydrophobicContact CB-CE2 4.2Å; L88-F92 HydrophobicContact CD2-CE2 4.28Å; L88-F92 WeakPolarHBondContact O-CD2 3.37Å; L88-F92 PolarHBondContact O-N 3.33Å; F92-R95 PolarHBondContact O-N 3.46Å; F92-Q96 WeakPolarHBondContact O-CA 3.37Å; F92-Q96 WeakPolarHBondContact O-CB 3.22Å; F92-Q96 PolarHBondContact O-N 2.9Å |
| 93 | A | 67 | Low | 72.1 | Confident | 47 Ų | 47 | 99.6 Ų | 99.6 | 39% | 0.388 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -63.7 | -41.7 | 172.6 | 0 | 0 | 0 | 0 | 0 | 111.1 | G89 Q96 L97 | G89-A93 WeakPolarHBondContact O-CB 3.39Å; G89-A93 PolarHBondContact O-N 3.12Å; A93-Q96 PolarHBondContact O-N 2.93Å; A93-L97 VanDerWaalsContact O-CB 3.22Å; A93-L97 WeakPolarHBondContact O-CB 3.28Å; A93-L97 WeakPolarHBondContact O-CG 3.4Å; A93-L97 PolarHBondContact O-N 3.44Å |
| 94 | S | 68.3 | Low | 73.6 | Confident | 54 Ų | 54 | 100.3 Ų | 100.3 | 38% | 0.378 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -67.3 | -43.2 | 176.5 | 67.8 | 0 | 0 | 0 | 0 | 112.2 | R90 W91 L97 V98 | R90-S94 VanDerWaalsContact O-CB 3.23Å; R90-S94 WeakPolarHBondContact O-CB 3.23Å; R90-S94 PolarHBondContact O-N 3.15Å; R90-S94 PolarHBondContact O-OG 2.9Å; W91-S94 WeakPolarHBondContact CA-OG 3.46Å; W91-S94 PolarHBondContact O-N 2.77Å; W91-S94 PolarHBondContact O-OG 3.5Å; S94-L97 PolarHBondContact O-N 2.78Å; S94-V98 WeakPolarHBondContact O-CB 3.39Å; S94-V98 WeakPolarHBondContact O-CG2 3.01Å; S94-V98 PolarHBondContact O-N 3.41Å |
| 95 | R | 70.3 | Confident | 75.1 | Confident | 148 Ų | 148 | 100 Ų | 100 | 56% | 0.558 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -62.2 | -42.8 | 172.3 | -83.9 | -177.2 | 166 | -116.1 | -0.2 | 112.2 | W91 F92 V98 L99 | W91-R95 WeakPolarHBondContact O-CB 3.45Å; W91-R95 PolarHBondContact O-N 2.73Å; F92-R95 PolarHBondContact O-N 3.46Å; R95-V98 PolarHBondContact O-N 2.85Å; R95-L99 WeakPolarHBondContact O-CB 3Å; R95-L99 VanDerWaalsContact O-CG 3.28Å; R95-L99 WeakPolarHBondContact O-CG 3.09Å; R95-L99 PolarHBondContact O-N 2.89Å |
| 96 | Q | 74.8 | Confident | 76.4 | Confident | 127 Ų | 127 | 99.8 Ų | 99.8 | 59% | 0.593 | 51% | 0.51 | S | S | * | . | H | α-helix | trans | -67.1 | -39.8 | 179.3 | -177.1 | 66.2 | -1.1 | 0 | 0 | 111.2 | F92 A93 S100 | F92-Q96 WeakPolarHBondContact O-CA 3.37Å; F92-Q96 WeakPolarHBondContact O-CB 3.22Å; F92-Q96 PolarHBondContact O-N 2.9Å; A93-Q96 PolarHBondContact O-N 2.93Å; Q96-S100 WeakPolarHBondContact O-CA 3.22Å; Q96-S100 WeakPolarHBondContact O-CB 3.44Å; Q96-S100 PolarHBondContact O-N 3.34Å |
| 97 | L | 74.8 | Confident | 77.7 | Confident | 108 Ų | 108 | 101.6 Ų | 101.6 | 57% | 0.565 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -66.4 | -42.5 | 173.7 | -72.4 | 171.4 | 0 | 0 | 0 | 110.6 | A93 S94 S100 N101 | A93-L97 VanDerWaalsContact O-CB 3.22Å; A93-L97 WeakPolarHBondContact O-CB 3.28Å; A93-L97 WeakPolarHBondContact O-CG 3.4Å; A93-L97 PolarHBondContact O-N 3.44Å; S94-L97 PolarHBondContact O-N 2.78Å; L97-S100 PolarHBondContact O-N 3.34Å; L97-N101 WeakPolarHBondContact O-CB 3.43Å; L97-N101 PolarHBondContact O-N 3.44Å; L97-N101 PolarHBondContact O-ND2 3.2Å |
| 98 | V | 79.3 | Confident | 79.2 | Confident | 83 Ų | 83 | 101.4 Ų | 101.4 | 50% | 0.503 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -63 | -47.7 | 176.1 | 170.5 | 0 | 0 | 0 | 0 | 111.1 | S94 R95 S100 N101 I102 | S94-V98 WeakPolarHBondContact O-CB 3.39Å; S94-V98 WeakPolarHBondContact O-CG2 3.01Å; S94-V98 PolarHBondContact O-N 3.41Å; R95-V98 PolarHBondContact O-N 2.85Å; V98-S100 PolarHBondContact O-N 2.99Å; V98-N101 PolarHBondContact O-N 2.82Å; V98-I102 HydrophobicContact CG1-CD1 3.77Å; V98-I102 WeakPolarHBondContact O-CB 3.4Å; V98-I102 WeakPolarHBondContact O-CD1 3.47Å; V98-I102 WeakPolarHBondContact O-CG1 3.2Å; V98-I102 PolarHBondContact O-N 2.83Å |
| 99 | L | 81.6 | Confident | 80.6 | Confident | 93 Ų | 93 | 102.4 Ų | 102.4 | 49% | 0.487 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -63.1 | -41.6 | 175.7 | -69.9 | 172.1 | 0 | 0 | 0 | 111.7 | R95 I102 M103 | R95-L99 WeakPolarHBondContact O-CB 3Å; R95-L99 VanDerWaalsContact O-CG 3.28Å; R95-L99 WeakPolarHBondContact O-CG 3.09Å; R95-L99 PolarHBondContact O-N 2.89Å; L99-I102 PolarHBondContact O-N 3.25Å; L99-M103 WeakPolarHBondContact O-CB 2.83Å; L99-M103 VanDerWaalsContact O-CG 3.24Å; L99-M103 WeakPolarHBondContact O-CG 3.15Å; L99-M103 PolarHBondContact O-N 2.86Å |
| 100 | S | 84.7 | Confident | 82 | Confident | 59 Ų | 59 | 105.3 Ų | 105.3 | 41% | 0.413 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -63.4 | -43.2 | 176 | 179.6 | 0 | 0 | 0 | 0 | 111.6 | Q96 L97 V98 M103 L104 | Q96-S100 WeakPolarHBondContact O-CA 3.22Å; Q96-S100 WeakPolarHBondContact O-CB 3.44Å; Q96-S100 PolarHBondContact O-N 3.34Å; L97-S100 PolarHBondContact O-N 3.34Å; V98-S100 PolarHBondContact O-N 2.99Å; S100-M103 PolarHBondContact O-N 3.17Å; S100-L104 WeakPolarHBondContact O-CB 3.24Å; S100-L104 PolarHBondContact O-N 3.3Å |
| 101 | N | 89.2 | Confident | 83.4 | Confident | 95 Ų | 95 | 99 Ų | 99 | 51% | 0.508 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -64 | -41.8 | 175.5 | -75.6 | -42.2 | 0 | 0 | 0 | 111.6 | L97 V98 L104 L105 | L97-N101 WeakPolarHBondContact O-CB 3.43Å; L97-N101 PolarHBondContact O-N 3.44Å; L97-N101 PolarHBondContact O-ND2 3.2Å; V98-N101 PolarHBondContact O-N 2.82Å; N101-L104 PolarHBondContact O-N 3.47Å; N101-L105 VanDerWaalsContact O-CB 3.25Å; N101-L105 WeakPolarHBondContact O-CB 3.47Å; N101-L105 PolarHBondContact O-N 3.46Å |
| 102 | I | 90.6 | Very high | 85 | Confident | 94 Ų | 94 | 97.4 Ų | 97.4 | 48% | 0.482 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -65 | -44.9 | 176.6 | -68.8 | 163.6 | 0 | 0 | 0 | 110.7 | V98 L99 L105 K106 | V98-I102 HydrophobicContact CG1-CD1 3.77Å; V98-I102 WeakPolarHBondContact O-CB 3.4Å; V98-I102 WeakPolarHBondContact O-CD1 3.47Å; V98-I102 WeakPolarHBondContact O-CG1 3.2Å; V98-I102 PolarHBondContact O-N 2.83Å; L99-I102 PolarHBondContact O-N 3.25Å; I102-L105 PolarHBondContact O-N 2.71Å; I102-K106 WeakPolarHBondContact O-CB 3.5Å; I102-K106 PolarHBondContact O-N 2.8Å |
| 103 | M | 90.1 | Very high | 86.5 | Confident | 115 Ų | 115 | 95.1 Ų | 95.1 | 57% | 0.567 | 50% | 0.5 | S | S | * | . | H | α-helix | trans | -64 | -43.1 | 176.5 | -70.4 | -63.4 | 167.5 | 0 | 0 | 111.4 | L99 S100 K106 V107 | L99-M103 WeakPolarHBondContact O-CB 2.83Å; L99-M103 VanDerWaalsContact O-CG 3.24Å; L99-M103 WeakPolarHBondContact O-CG 3.15Å; L99-M103 PolarHBondContact O-N 2.86Å; S100-M103 PolarHBondContact O-N 3.17Å; M103-K106 PolarHBondContact O-N 2.77Å; M103-V107 WeakPolarHBondContact O-CG2 3.47Å; M103-V107 PolarHBondContact O-N 3.29Å |
| 104 | L | 91.8 | Very high | 87.8 | Confident | 108 Ų | 108 | 94.6 Ų | 94.6 | 57% | 0.565 | 49% | 0.491 | S | S | * | . | H | α-helix | trans | -62.5 | -43.4 | 176.4 | -176.5 | 136.7 | 0 | 0 | 0 | 111.5 | S100 N101 K106 V107 L108 | S100-L104 WeakPolarHBondContact O-CB 3.24Å; S100-L104 PolarHBondContact O-N 3.3Å; N101-L104 PolarHBondContact O-N 3.47Å; L104-K106 VanDerWaalsContact C-N 3.33Å; L104-K106 PolarHBondContact O-N 3.29Å; L104-V107 PolarHBondContact O-N 2.97Å; L104-L108 WeakPolarHBondContact O-CB 3.21Å; L104-L108 PolarHBondContact O-N 3.01Å |
| 105 | L | 94.6 | Very high | 88.9 | Confident | 115 Ų | 115 | 94 Ų | 94 | 60% | 0.602 | 49% | 0.494 | S | S | * | . | H | α-helix | trans | -60.8 | -43.2 | 174.9 | -179.1 | 63.8 | 0 | 0 | 0 | 111.3 | N101 I102 L108 L109 | N101-L105 VanDerWaalsContact O-CB 3.25Å; N101-L105 WeakPolarHBondContact O-CB 3.47Å; N101-L105 PolarHBondContact O-N 3.46Å; I102-L105 PolarHBondContact O-N 2.71Å; L105-L108 PolarHBondContact O-N 3.35Å; L105-L109 VanDerWaalsContact O-CB 3.28Å; L105-L109 WeakPolarHBondContact O-CB 3.22Å; L105-L109 PolarHBondContact O-N 3.35Å |
| 106 | K | 92.8 | Very high | 90.1 | Very high | 127 Ų | 127 | 91.9 Ų | 91.9 | 55% | 0.552 | 49% | 0.493 | S | S | * | . | H | α-helix | trans | -64.8 | -41.4 | 177.7 | -179.2 | 168 | 163.4 | 169.7 | 0 | 112 | I102 M103 L104 W110 | I102-K106 WeakPolarHBondContact O-CB 3.5Å; I102-K106 PolarHBondContact O-N 2.8Å; M103-K106 PolarHBondContact O-N 2.77Å; L104-K106 VanDerWaalsContact C-N 3.33Å; L104-K106 PolarHBondContact O-N 3.29Å; K106-W110 WeakPolarHBondContact O-CB 3.33Å; K106-W110 PolarHBondContact O-N 3.39Å |
| 107 | V | 93.4 | Very high | 91.1 | Very high | 90 Ų | 90 | 89 Ų | 89 | 55% | 0.545 | 48% | 0.479 | S | S | . | . | H | α-helix | trans | -66.4 | -44.6 | 175 | 171.8 | 0 | 0 | 0 | 0 | 111 | M103 L104 L109 W110 V111 | M103-V107 WeakPolarHBondContact O-CG2 3.47Å; M103-V107 PolarHBondContact O-N 3.29Å; L104-V107 PolarHBondContact O-N 2.97Å; V107-L109 PolarHBondContact O-N 3.49Å; V107-W110 WeakPolarHBondContact O-CB 3.39Å; V107-W110 PolarHBondContact O-N 3.38Å; V107-V111 HydrophobicContact CG1-CG2 4.49Å; V107-V111 WeakPolarHBondContact O-CG2 3.28Å; V107-V111 PolarHBondContact O-N 2.88Å |
| 108 | L | 96.1 | Very high | 92 | Very high | 98 Ų | 98 | 88.2 Ų | 88.2 | 51% | 0.513 | 48% | 0.478 | S | S | . | . | H | α-helix | trans | -61 | -46.9 | 177.6 | -176.1 | 68.8 | 0 | 0 | 0 | 111.1 | L104 L105 W110 V111 V112 | L104-L108 WeakPolarHBondContact O-CB 3.21Å; L104-L108 PolarHBondContact O-N 3.01Å; L105-L108 PolarHBondContact O-N 3.35Å; L108-W110 VanDerWaalsContact C-N 3.27Å; L108-W110 PolarHBondContact O-N 2.88Å; L108-V111 PolarHBondContact O-N 3.23Å; L108-V112 WeakPolarHBondContact O-CG2 2.88Å; L108-V112 PolarHBondContact O-N 3.39Å |
| 109 | L | 95.8 | Very high | 92.7 | Very high | 109 Ų | 109 | 92.2 Ų | 92.2 | 57% | 0.571 | 49% | 0.491 | S | S | * | . | H | α-helix | trans | -56.3 | -44.3 | 175.3 | 178.5 | 63.6 | 0 | 0 | 0 | 111 | L105 V107 V112 L113 | L105-L109 VanDerWaalsContact O-CB 3.28Å; L105-L109 WeakPolarHBondContact O-CB 3.22Å; L105-L109 PolarHBondContact O-N 3.35Å; V107-L109 PolarHBondContact O-N 3.49Å; L109-V112 PolarHBondContact O-N 3.27Å; L109-L113 WeakPolarHBondContact O-CB 3.29Å; L109-L113 PolarHBondContact O-N 2.76Å |
| 110 | W | 95.1 | Very high | 93.2 | Very high | 94 Ų | 94 | 92.3 Ų | 92.3 | 36% | 0.356 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -62.9 | -43.5 | 177.4 | -178.7 | 83.2 | 0 | 0 | 0 | 112.5 | K106 V107 L108 L113 L114 F126 F127 S130 | K106-W110 WeakPolarHBondContact O-CB 3.33Å; K106-W110 PolarHBondContact O-N 3.39Å; V107-W110 WeakPolarHBondContact O-CB 3.39Å; V107-W110 PolarHBondContact O-N 3.38Å; L108-W110 VanDerWaalsContact C-N 3.27Å; L108-W110 PolarHBondContact O-N 2.88Å; W110-L113 PolarHBondContact O-N 2.91Å; W110-L114 HydrophobicContact CH2-CD2 3.87Å; W110-L114 HydrophobicContact CZ3-CD2 4.01Å; W110-L114 WeakPolarHBondContact O-CB 3.25Å; W110-L114 PolarHBondContact O-N 2.66Å; W110-F126 AromaticContact NE1-CE1 3.82Å; W110-F126 AromaticContact NE1-CZ 3.93Å; W110-F127 HydrophobicContact CH2-CD2 4.26Å; W110-F127 HydrophobicContact CH2-CE2 4.43Å; W110-F127 HydrophobicContact CZ2-CD2 4.44Å; W110-S130 PolarHBondContact NE1-OG 3.29Å |
| 111 | V | 95.5 | Very high | 93.6 | Very high | 75 Ų | 75 | 98.2 Ų | 98.2 | 46% | 0.455 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -64 | -40.9 | 176.3 | 172.9 | 0 | 0 | 0 | 0 | 111.7 | V107 L108 L113 L114 G115 | V107-V111 HydrophobicContact CG1-CG2 4.49Å; V107-V111 WeakPolarHBondContact O-CG2 3.28Å; V107-V111 PolarHBondContact O-N 2.88Å; L108-V111 PolarHBondContact O-N 3.23Å; V111-L113 VanDerWaalsContact C-N 3.34Å; V111-L114 WeakPolarHBondContact O-CB 3.31Å; V111-L114 PolarHBondContact O-N 3.44Å; V111-G115 PolarHBondContact O-N 3.08Å |
| 112 | V | 96.3 | Very high | 93.7 | Very high | 89 Ų | 89 | 100.3 Ų | 100.3 | 54% | 0.539 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -61.9 | -44.3 | 175.5 | 169.9 | 0 | 0 | 0 | 0 | 110.7 | L108 L109 G115 L116 | L108-V112 WeakPolarHBondContact O-CG2 2.88Å; L108-V112 PolarHBondContact O-N 3.39Å; L109-V112 PolarHBondContact O-N 3.27Å; V112-G115 PolarHBondContact O-N 2.84Å; V112-L116 PolarHBondContact O-N 3.26Å |
| 113 | L | 94.6 | Very high | 93.8 | Very high | 69 Ų | 69 | 96.1 Ų | 96.1 | 36% | 0.361 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -62.3 | -45.2 | 176.6 | -134.1 | 69.6 | 0 | 0 | 0 | 111.1 | L109 W110 V111 G115 L116 F117 F126 | L109-L113 WeakPolarHBondContact O-CB 3.29Å; L109-L113 PolarHBondContact O-N 2.76Å; W110-L113 PolarHBondContact O-N 2.91Å; V111-L113 VanDerWaalsContact C-N 3.34Å; L113-G115 VanDerWaalsContact C-N 3.31Å; L113-G115 PolarHBondContact O-N 3.33Å; L113-L116 WeakPolarHBondContact O-CB 3.37Å; L113-L116 PolarHBondContact O-N 3.22Å; L113-F117 HydrophobicContact CD2-CE2 4.37Å; L113-F117 HydrophobicContact CG-CD2 4.34Å; L113-F117 HydrophobicContact CG-CE2 4.05Å; L113-F117 WeakPolarHBondContact O-CD2 3.4Å; L113-F117 PolarHBondContact O-N 3.15Å; L113-F126 HydrophobicContact CB-CE1 4.39Å; L113-F126 HydrophobicContact CB-CZ 3.91Å; L113-F126 HydrophobicContact CD2-CE2 3.86Å; L113-F126 HydrophobicContact CD2-CZ 3.86Å; L113-F126 HydrophobicContact CG-CE2 4.45Å; L113-F126 HydrophobicContact CG-CZ 4.27Å |
| 114 | L | 93.5 | Very high | 93.9 | Very high | 36 Ų | 36 | 96.6 Ų | 96.6 | 19% | 0.188 | 50% | 0.502 | C | S | . | . | H | α-helix | trans | -56.6 | -46.2 | 174.9 | -178.1 | 67.3 | 0 | 0 | 0 | 111.1 | W110 V111 L116 F117 V118 F126 F127 | W110-L114 HydrophobicContact CH2-CD2 3.87Å; W110-L114 HydrophobicContact CZ3-CD2 4.01Å; W110-L114 WeakPolarHBondContact O-CB 3.25Å; W110-L114 PolarHBondContact O-N 2.66Å; V111-L114 WeakPolarHBondContact O-CB 3.31Å; V111-L114 PolarHBondContact O-N 3.44Å; L114-L116 PolarHBondContact O-N 3.38Å; L114-F117 PolarHBondContact O-N 3.4Å; L114-V118 VanDerWaalsContact O-CG2 3.29Å; L114-V118 WeakPolarHBondContact O-CG2 3.49Å; L114-V118 PolarHBondContact O-N 2.82Å; L114-F126 HydrophobicContact CB-CD1 4.17Å; L114-F126 HydrophobicContact CB-CE1 3.9Å; L114-F126 HydrophobicContact CD1-CD1 3.63Å; L114-F126 HydrophobicContact CD1-CE1 4.12Å; L114-F127 HydrophobicContact CD1-CB 3.98Å; L114-F127 HydrophobicContact CD1-CD2 4.44Å |
| 115 | G | 93.2 | Very high | 94 | Very high | 43 Ų | 43 | 94.4 Ų | 94.4 | 44% | 0.443 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -60 | -44.1 | 176.3 | 0 | 0 | 0 | 0 | 0 | 113 | V111 V112 L113 F117 V118 E119 | V111-G115 PolarHBondContact O-N 3.08Å; V112-G115 PolarHBondContact O-N 2.84Å; L113-G115 VanDerWaalsContact C-N 3.31Å; L113-G115 PolarHBondContact O-N 3.33Å; G115-F117 VanDerWaalsContact C-N 3.34Å; G115-F117 PolarHBondContact O-N 3.47Å; G115-V118 PolarHBondContact O-N 3.44Å; G115-E119 PolarHBondContact O-N 2.9Å |
| 116 | L | 95.4 | Very high | 94 | Very high | 102 Ų | 102 | 90.7 Ų | 90.7 | 53% | 0.534 | 47% | 0.473 | S | S | . | . | H | α-helix | trans | -60.2 | -43 | 175.4 | -177.9 | 67.8 | 0 | 0 | 0 | 112 | V112 L113 L114 E119 L120 | V112-L116 PolarHBondContact O-N 3.26Å; L113-L116 WeakPolarHBondContact O-CB 3.37Å; L113-L116 PolarHBondContact O-N 3.22Å; L114-L116 PolarHBondContact O-N 3.38Å; L116-E119 PolarHBondContact O-N 2.85Å; L116-L120 HydrophobicContact CG-CD1 4.23Å; L116-L120 WeakPolarHBondContact O-CD1 3.46Å; L116-L120 WeakPolarHBondContact O-CG 3.33Å; L116-L120 PolarHBondContact O-N 3.35Å |
| 117 | F | 94.3 | Very high | 94.1 | Very high | 68 Ų | 68 | 89.3 Ų | 89.3 | 30% | 0.298 | 47% | 0.467 | S | S | . | . | H | α-helix | trans | -71.7 | -30.3 | 178.7 | -81.8 | -73.3 | 0 | 0 | 0 | 113.2 | L113 L114 G115 L120 E121 F122 G123 F126 | L113-F117 HydrophobicContact CD2-CE2 4.37Å; L113-F117 HydrophobicContact CG-CD2 4.34Å; L113-F117 HydrophobicContact CG-CE2 4.05Å; L113-F117 WeakPolarHBondContact O-CD2 3.4Å; L113-F117 PolarHBondContact O-N 3.15Å; L114-F117 PolarHBondContact O-N 3.4Å; G115-F117 VanDerWaalsContact C-N 3.34Å; G115-F117 PolarHBondContact O-N 3.47Å; F117-L120 HydrophobicContact CD1-CD1 4.37Å; F117-L120 PolarHBondContact O-N 2.73Å; F117-E121 PolarHBondContact O-N 3.42Å; F117-F122 HydrophobicContact CD1-CB 4.15Å; F117-F122 CarbonylContact O-C 3.28Å; F117-F122 VanDerWaalsContact O-C 3.28Å; F117-F122 WeakPolarHBondContact O-CA 3.39Å; F117-F122 PolarHBondContact O-N 3.24Å; F117-G123 PolarHBondContact O-N 3.19Å; F117-F126 HydrophobicContact CB-CB 4.08Å; F117-F126 HydrophobicContact CB-CG 4.33Å; F117-F126 HydrophobicContact CD2-CB 4.19Å; F117-F126 HydrophobicContact CD2-CD1 4.26Å; F117-F126 AromaticContact CD2-CD2 3.63Å; F117-F126 HydrophobicContact CD2-CD2 3.63Å; F117-F126 HydrophobicContact CD2-CE2 4.06Å; F117-F126 AromaticContact CD2-CG 3.74Å; F117-F126 HydrophobicContact CD2-CG 3.74Å; F117-F126 AromaticContact CE2-CD2 3.74Å; F117-F126 HydrophobicContact CE2-CD2 3.74Å; F117-F126 HydrophobicContact CE2-CE2 4Å; F117-F126 HydrophobicContact CE2-CG 4.33Å; F117-F126 HydrophobicContact CG-CB 4.04Å; F117-F126 HydrophobicContact CG-CD2 4.31Å; F117-F126 HydrophobicContact CG-CG 4.1Å; F117-F126 HydrophobicContact CZ-CD2 4.47Å |
| 118 | V | 94 | Very high | 94.2 | Very high | 91 Ų | 91 | 88.2 Ų | 88.2 | 55% | 0.552 | 46% | 0.458 | S | S | * | . | H | α-helix | trans | -63.2 | -43 | 172.6 | 168 | 0 | 0 | 0 | 0 | 110.9 | L114 G115 L120 E121 | L114-V118 VanDerWaalsContact O-CG2 3.29Å; L114-V118 WeakPolarHBondContact O-CG2 3.49Å; L114-V118 PolarHBondContact O-N 2.82Å; G115-V118 PolarHBondContact O-N 3.44Å; V118-L120 PolarHBondContact O-N 2.84Å; V118-E121 PolarHBondContact O-N 3.35Å; V118-E121 VanDerWaalsContact O-N 3.08Å |
| 119 | E | 93.3 | Very high | 94.2 | Very high | 167 Ų | 167 | 89.2 Ų | 89.2 | 78% | 0.78 | 46% | 0.462 | S | S | * | . | H | α-helix | trans | -62.9 | -32.7 | 176 | -167.2 | 66.8 | -164.2 | 0 | 0 | 112.2 | G115 L116 E121 | G115-E119 PolarHBondContact O-N 2.9Å; L116-E119 PolarHBondContact O-N 2.85Å; E119-E121 PolarHBondContact O-N 3.3Å |
| 120 | L | 92.4 | Very high | 94 | Very high | 95 Ų | 95 | 84.9 Ų | 84.9 | 50% | 0.497 | 44% | 0.441 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -79.2 | 5.9 | 176.4 | -69.1 | 161.7 | 0 | 0 | 0 | 113.5 | L116 F117 V118 F122 | L116-L120 HydrophobicContact CG-CD1 4.23Å; L116-L120 WeakPolarHBondContact O-CD1 3.46Å; L116-L120 WeakPolarHBondContact O-CG 3.33Å; L116-L120 PolarHBondContact O-N 3.35Å; F117-L120 HydrophobicContact CD1-CD1 4.37Å; F117-L120 PolarHBondContact O-N 2.73Å; V118-L120 PolarHBondContact O-N 2.84Å; L120-F122 HydrophobicContact CB-CD2 4.37Å; L120-F122 WeakPolarHBondContact O-CD2 3.28Å; L120-F122 PolarHBondContact O-N 2.91Å; L120-F122 VanDerWaalsContact O-N 3.08Å |
| 121 | E | 93.2 | Very high | 94 | Very high | 183 Ų | 183 | 84.7 Ų | 84.7 | 86% | 0.855 | 45% | 0.447 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 61.5 | 7.4 | -172.2 | -55 | -175.8 | 138.7 | 0 | 0 | 114.8 | F117 V118 E119 | F117-E121 PolarHBondContact O-N 3.42Å; V118-E121 PolarHBondContact O-N 3.35Å; V118-E121 VanDerWaalsContact O-N 3.08Å; E119-E121 PolarHBondContact O-N 3.3Å |
| 122 | F | 92.3 | Very high | 94 | Very high | 138 Ų | 138 | 87.4 Ų | 87.4 | 61% | 0.605 | 45% | 0.452 | S | S | * | . | trans | -106.2 | 16.6 | 179.8 | -74.1 | -74.8 | 0 | 0 | 0 | 113.6 | F117 L120 L124 P125 F126 | F117-F122 HydrophobicContact CD1-CB 4.15Å; F117-F122 CarbonylContact O-C 3.28Å; F117-F122 VanDerWaalsContact O-C 3.28Å; F117-F122 WeakPolarHBondContact O-CA 3.39Å; F117-F122 PolarHBondContact O-N 3.24Å; L120-F122 HydrophobicContact CB-CD2 4.37Å; L120-F122 WeakPolarHBondContact O-CD2 3.28Å; L120-F122 PolarHBondContact O-N 2.91Å; L120-F122 VanDerWaalsContact O-N 3.08Å; F122-L124 PolarHBondContact O-N 2.9Å; F122-P125 WeakPolarHBondContact O-CD 3.44Å; F122-F126 PolarHBondContact O-N 2.87Å | ||
| 123 | G | 92.3 | Very high | 93.8 | Very high | 7 Ų | 7 | 89.5 Ų | 89.5 | 7% | 0.072 | 45% | 0.452 | C | S | . | . | H | α-helix | trans | -64.1 | -38.7 | -176.4 | 0 | 0 | 0 | 0 | 0 | 113.7 | F117 F126 F127 | F117-G123 PolarHBondContact O-N 3.19Å; G123-F126 PolarHBondContact O-N 3.49Å; G123-F127 WeakPolarHBondContact O-CB 3.31Å; G123-F127 PolarHBondContact O-N 3.03Å |
| 124 | L | 92.8 | Very high | 93.6 | Very high | 125 Ų | 125 | 95.6 Ų | 95.6 | 65% | 0.654 | 47% | 0.47 | S | S | * | . | H | α-helix | trans | -66.8 | -48.3 | -177.6 | -179.9 | 130.4 | 0 | 0 | 0 | 112.7 | F122 F126 F127 I128 | F122-L124 PolarHBondContact O-N 2.9Å; L124-F126 VanDerWaalsContact C-N 3.34Å; L124-F126 PolarHBondContact O-N 3.41Å; L124-F127 PolarHBondContact O-N 2.95Å; L124-I128 HydrophobicContact CD2-CD1 3.6Å; L124-I128 HydrophobicContact CG-CD1 3.94Å; L124-I128 VanDerWaalsContact O-CG1 3.32Å; L124-I128 WeakPolarHBondContact O-CG1 3.45Å; L124-I128 PolarHBondContact O-N 3.33Å |
| 125 | P | 94.4 | Very high | 93.5 | Very high | 61 Ų | 61 | 98.2 Ų | 98.2 | 40% | 0.396 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -54.7 | -45.4 | 170.9 | -28.3 | 34.2 | 0 | 0 | 0 | 113.6 | F122 F127 I128 I129 | F122-P125 WeakPolarHBondContact O-CD 3.44Å; P125-F127 VanDerWaalsContact C-N 3.35Å; P125-F127 PolarHBondContact O-N 2.88Å; P125-I128 PolarHBondContact O-N 2.97Å; P125-I129 VanDerWaalsContact O-CG1 3.32Å; P125-I129 WeakPolarHBondContact O-CG1 3.41Å; P125-I129 PolarHBondContact O-N 3.05Å |
| 126 | F | 94.2 | Very high | 93.5 | Very high | 38 Ų | 38 | 102.7 Ų | 102.7 | 17% | 0.167 | 49% | 0.488 | C | S | . | . | H | α-helix | trans | -62.1 | -41.8 | 178.2 | 176.7 | -95 | 0 | 0 | 0 | 112.2 | W110 L113 L114 F117 F122 G123 L124 S130 | W110-F126 AromaticContact NE1-CE1 3.82Å; W110-F126 AromaticContact NE1-CZ 3.93Å; L113-F126 HydrophobicContact CB-CE1 4.39Å; L113-F126 HydrophobicContact CB-CZ 3.91Å; L113-F126 HydrophobicContact CD2-CE2 3.86Å; L113-F126 HydrophobicContact CD2-CZ 3.86Å; L113-F126 HydrophobicContact CG-CE2 4.45Å; L113-F126 HydrophobicContact CG-CZ 4.27Å; L114-F126 HydrophobicContact CB-CD1 4.17Å; L114-F126 HydrophobicContact CB-CE1 3.9Å; L114-F126 HydrophobicContact CD1-CD1 3.63Å; L114-F126 HydrophobicContact CD1-CE1 4.12Å; F117-F126 HydrophobicContact CB-CB 4.08Å; F117-F126 HydrophobicContact CB-CG 4.33Å; F117-F126 HydrophobicContact CD2-CB 4.19Å; F117-F126 HydrophobicContact CD2-CD1 4.26Å; F117-F126 AromaticContact CD2-CD2 3.63Å; F117-F126 HydrophobicContact CD2-CD2 3.63Å; F117-F126 HydrophobicContact CD2-CE2 4.06Å; F117-F126 AromaticContact CD2-CG 3.74Å; F117-F126 HydrophobicContact CD2-CG 3.74Å; F117-F126 AromaticContact CE2-CD2 3.74Å; F117-F126 HydrophobicContact CE2-CD2 3.74Å; F117-F126 HydrophobicContact CE2-CE2 4Å; F117-F126 HydrophobicContact CE2-CG 4.33Å; F117-F126 HydrophobicContact CG-CB 4.04Å; F117-F126 HydrophobicContact CG-CD2 4.31Å; F117-F126 HydrophobicContact CG-CG 4.1Å; F117-F126 HydrophobicContact CZ-CD2 4.47Å; F122-F126 PolarHBondContact O-N 2.87Å; G123-F126 PolarHBondContact O-N 3.49Å; L124-F126 VanDerWaalsContact C-N 3.34Å; L124-F126 PolarHBondContact O-N 3.41Å; F126-S130 VanDerWaalsContact O-CB 3.28Å; F126-S130 WeakPolarHBondContact O-CB 3.48Å; F126-S130 PolarHBondContact O-N 2.81Å; F126-S130 PolarHBondContact O-OG 3.45Å |
| 127 | F | 94.4 | Very high | 93.2 | Very high | 97 Ų | 97 | 103 Ų | 103 | 43% | 0.425 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -63.1 | -47.1 | 176 | 177.7 | -102.4 | 0 | 0 | 0 | 112.1 | W110 L114 G123 L124 P125 I129 S130 L131 | W110-F127 HydrophobicContact CH2-CD2 4.26Å; W110-F127 HydrophobicContact CH2-CE2 4.43Å; W110-F127 HydrophobicContact CZ2-CD2 4.44Å; L114-F127 HydrophobicContact CD1-CB 3.98Å; L114-F127 HydrophobicContact CD1-CD2 4.44Å; G123-F127 WeakPolarHBondContact O-CB 3.31Å; G123-F127 PolarHBondContact O-N 3.03Å; L124-F127 PolarHBondContact O-N 2.95Å; P125-F127 VanDerWaalsContact C-N 3.35Å; P125-F127 PolarHBondContact O-N 2.88Å; F127-I129 PolarHBondContact O-N 3.15Å; F127-S130 WeakPolarHBondContact O-CB 3.21Å; F127-S130 PolarHBondContact O-N 3.46Å; F127-L131 WeakPolarHBondContact O-CB 3.43Å; F127-L131 PolarHBondContact O-N 2.84Å |
| 128 | I | 96.1 | Very high | 92.8 | Very high | 68 Ų | 68 | 102.8 Ų | 102.8 | 35% | 0.349 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -61.3 | -47.1 | -179.7 | -69.6 | 168.8 | 0 | 0 | 0 | 110.7 | L124 P125 S130 L131 F132 | L124-I128 HydrophobicContact CD2-CD1 3.6Å; L124-I128 HydrophobicContact CG-CD1 3.94Å; L124-I128 VanDerWaalsContact O-CG1 3.32Å; L124-I128 WeakPolarHBondContact O-CG1 3.45Å; L124-I128 PolarHBondContact O-N 3.33Å; P125-I128 PolarHBondContact O-N 2.97Å; I128-S130 VanDerWaalsContact C-N 3.32Å; I128-S130 PolarHBondContact O-N 3.22Å; I128-L131 WeakPolarHBondContact O-CB 3.28Å; I128-L131 PolarHBondContact O-N 3.24Å; I128-F132 HydrophobicContact CG2-CD2 3.73Å; I128-F132 HydrophobicContact CG2-CE2 3.51Å; I128-F132 WeakPolarHBondContact O-CD2 3.49Å; I128-F132 PolarHBondContact O-N 3.44Å |
| 129 | I | 95.1 | Very high | 92.5 | Very high | 119 Ų | 119 | 104.7 Ų | 104.7 | 61% | 0.61 | 51% | 0.51 | S | S | * | . | H | α-helix | trans | -62.8 | -42 | 178 | -65.5 | 167.4 | 0 | 0 | 0 | 110.5 | P125 F127 L131 F132 Y133 | P125-I129 VanDerWaalsContact O-CG1 3.32Å; P125-I129 WeakPolarHBondContact O-CG1 3.41Å; P125-I129 PolarHBondContact O-N 3.05Å; F127-I129 PolarHBondContact O-N 3.15Å; I129-L131 VanDerWaalsContact C-N 3.33Å; I129-L131 PolarHBondContact O-N 2.95Å; I129-F132 PolarHBondContact O-N 3.29Å; I129-Y133 PolarHBondContact O-N 2.79Å |
| 130 | S | 92.5 | Very high | 92 | Very high | 17 Ų | 17 | 103.6 Ų | 103.6 | 12% | 0.119 | 50% | 0.499 | C | S | . | . | H | α-helix | trans | -62.4 | -39.3 | 175.6 | -63.6 | 0 | 0 | 0 | 0 | 112.5 | W110 F126 F127 I128 Y133 W134 | W110-S130 PolarHBondContact NE1-OG 3.29Å; F126-S130 VanDerWaalsContact O-CB 3.28Å; F126-S130 WeakPolarHBondContact O-CB 3.48Å; F126-S130 PolarHBondContact O-N 2.81Å; F126-S130 PolarHBondContact O-OG 3.45Å; F127-S130 WeakPolarHBondContact O-CB 3.21Å; F127-S130 PolarHBondContact O-N 3.46Å; I128-S130 VanDerWaalsContact C-N 3.32Å; I128-S130 PolarHBondContact O-N 3.22Å; S130-Y133 WeakPolarHBondContact O-CB 3.44Å; S130-Y133 PolarHBondContact O-N 3.31Å; S130-W134 PolarHBondContact O-N 3.36Å |
| 131 | L | 93.9 | Very high | 91 | Very high | 91 Ų | 91 | 102.5 Ų | 102.5 | 48% | 0.476 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -63.6 | -45.4 | 175.9 | 178.2 | 65.1 | 0 | 0 | 0 | 110.9 | F127 I128 I129 Y133 W134 L135 | F127-L131 WeakPolarHBondContact O-CB 3.43Å; F127-L131 PolarHBondContact O-N 2.84Å; I128-L131 WeakPolarHBondContact O-CB 3.28Å; I128-L131 PolarHBondContact O-N 3.24Å; I129-L131 VanDerWaalsContact C-N 3.33Å; I129-L131 PolarHBondContact O-N 2.95Å; L131-Y133 VanDerWaalsContact C-N 3.3Å; L131-Y133 PolarHBondContact O-N 2.96Å; L131-W134 PolarHBondContact O-N 2.9Å; L131-L135 VanDerWaalsContact O-CB 3.31Å; L131-L135 WeakPolarHBondContact O-CB 3.32Å; L131-L135 PolarHBondContact O-N 2.88Å |
| 132 | F | 95.3 | Very high | 89.9 | Confident | 132 Ų | 132 | 99.9 Ų | 99.9 | 58% | 0.579 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -61.4 | -39.5 | 174.4 | -81.2 | -63 | 0 | 0 | 0 | 112.2 | I128 I129 L135 Y136 | I128-F132 HydrophobicContact CG2-CD2 3.73Å; I128-F132 HydrophobicContact CG2-CE2 3.51Å; I128-F132 WeakPolarHBondContact O-CD2 3.49Å; I128-F132 PolarHBondContact O-N 3.44Å; I129-F132 PolarHBondContact O-N 3.29Å; F132-L135 PolarHBondContact O-N 3.31Å; F132-Y136 WeakPolarHBondContact O-CB 3.34Å; F132-Y136 PolarHBondContact O-N 2.91Å |
| 133 | Y | 92.6 | Very high | 89 | Confident | 133 Ų | 133 | 98.3 Ų | 98.3 | 52% | 0.522 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -60.7 | -46.1 | 174.5 | 175.8 | -102.2 | 0 | 0 | 0 | 111.4 | I129 S130 L131 Y136 E137 | I129-Y133 PolarHBondContact O-N 2.79Å; S130-Y133 WeakPolarHBondContact O-CB 3.44Å; S130-Y133 PolarHBondContact O-N 3.31Å; L131-Y133 VanDerWaalsContact C-N 3.3Å; L131-Y133 PolarHBondContact O-N 2.96Å; Y133-Y136 PolarHBondContact O-N 3.01Å; Y133-E137 WeakPolarHBondContact O-CB 3.39Å; Y133-E137 PolarHBondContact O-N 3.39Å |
| 134 | W | 91.4 | Very high | 87.8 | Confident | 197 Ų | 197 | 103.1 Ų | 103.1 | 75% | 0.746 | 52% | 0.522 | S | S | * | . | H | α-helix | trans | -68.9 | -38.4 | 179.6 | -162 | 11.8 | 0 | 0 | 0 | 112.6 | S130 L131 E137 G138 | S130-W134 PolarHBondContact O-N 3.36Å; L131-W134 PolarHBondContact O-N 2.9Å; W134-E137 PolarHBondContact O-N 3.34Å; W134-G138 PolarHBondContact O-N 3.19Å |
| 135 | L | 91.5 | Very high | 86.6 | Confident | 91 Ų | 91 | 105.4 Ų | 105.4 | 48% | 0.476 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -63 | -44.6 | 173.8 | -175.2 | 70.1 | 0 | 0 | 0 | 111 | L131 F132 G138 L139 | L131-L135 VanDerWaalsContact O-CB 3.31Å; L131-L135 WeakPolarHBondContact O-CB 3.32Å; L131-L135 PolarHBondContact O-N 2.88Å; F132-L135 PolarHBondContact O-N 3.31Å; L135-G138 PolarHBondContact O-N 3.37Å; L135-L139 HydrophobicContact CD1-CD1 3.6Å; L135-L139 HydrophobicContact CD1-CG 3.95Å; L135-L139 HydrophobicContact CD2-CD1 4.38Å; L135-L139 HydrophobicContact CG-CD1 3.74Å; L135-L139 HydrophobicContact CG-CG 4.26Å; L135-L139 VanDerWaalsContact O-CB 3.28Å; L135-L139 WeakPolarHBondContact O-CB 3.47Å; L135-L139 VanDerWaalsContact O-CG 3.31Å; L135-L139 WeakPolarHBondContact O-CG 3.2Å; L135-L139 PolarHBondContact O-N 2.9Å |
| 136 | Y | 91.4 | Very high | 85.4 | Confident | 136 Ų | 136 | 107.7 Ų | 107.7 | 53% | 0.533 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -59.3 | -52.4 | 175.4 | 177.7 | -99.2 | 0 | 0 | 0 | 109.8 | F132 Y133 G138 L139 R140 | F132-Y136 WeakPolarHBondContact O-CB 3.34Å; F132-Y136 PolarHBondContact O-N 2.91Å; Y133-Y136 PolarHBondContact O-N 3.01Å; Y136-G138 VanDerWaalsContact C-N 3.29Å; Y136-G138 PolarHBondContact O-N 2.97Å; Y136-L139 PolarHBondContact O-N 3.46Å; Y136-R140 HydrophobicContact CD1-CB 4.48Å; Y136-R140 HydrophobicContact CE1-CB 4.33Å; Y136-R140 HydrophobicContact CE1-CG 4.21Å; Y136-R140 HydrophobicContact CE2-CB 4.44Å; Y136-R140 HydrophobicContact CE2-CG 4.4Å; Y136-R140 WeakPolarHBondContact O-CA 3.24Å; Y136-R140 WeakPolarHBondContact O-CB 3.29Å; Y136-R140 PolarHBondContact O-N 2.9Å |
| 137 | E | 89.7 | Confident | 83.8 | Confident | 110 Ų | 110 | 112.6 Ų | 112.6 | 51% | 0.514 | 56% | 0.561 | S | S | . | * | H | α-helix | trans | -62.1 | -35.5 | 179.4 | -158 | 67.7 | -159.3 | 0 | 0 | 112.7 | Y133 W134 | Y133-E137 WeakPolarHBondContact O-CB 3.39Å; Y133-E137 PolarHBondContact O-N 3.39Å; W134-E137 PolarHBondContact O-N 3.34Å |
| 138 | G | 87 | Confident | 82.4 | Confident | 63 Ų | 63 | 110.3 Ų | 110.3 | 65% | 0.649 | 57% | 0.565 | S | S | * | * | H | α-helix | trans | -76.2 | -33 | 179.9 | 0 | 0 | 0 | 0 | 0 | 114.3 | W134 L135 Y136 | W134-G138 PolarHBondContact O-N 3.19Å; L135-G138 PolarHBondContact O-N 3.37Å; Y136-G138 VanDerWaalsContact C-N 3.29Å; Y136-G138 PolarHBondContact O-N 2.97Å |
| 139 | L | 85.8 | Confident | 81.1 | Confident | 130 Ų | 130 | 110.8 Ų | 110.8 | 68% | 0.681 | 57% | 0.566 | S | S | * | * | H | α-helix | trans | -93.6 | -20.6 | 178 | -63.8 | -177.8 | 0 | 0 | 0 | 112.8 | L135 Y136 S141 | L135-L139 HydrophobicContact CD1-CD1 3.6Å; L135-L139 HydrophobicContact CD1-CG 3.95Å; L135-L139 HydrophobicContact CD2-CD1 4.38Å; L135-L139 HydrophobicContact CG-CD1 3.74Å; L135-L139 HydrophobicContact CG-CG 4.26Å; L135-L139 VanDerWaalsContact O-CB 3.28Å; L135-L139 WeakPolarHBondContact O-CB 3.47Å; L135-L139 VanDerWaalsContact O-CG 3.31Å; L135-L139 WeakPolarHBondContact O-CG 3.2Å; L135-L139 PolarHBondContact O-N 2.9Å; Y136-L139 PolarHBondContact O-N 3.46Å; L139-S141 PolarHBondContact O-N 3.25Å |
| 140 | R | 83.6 | Confident | 79.5 | Confident | 145 Ų | 145 | 112.3 Ų | 112.3 | 55% | 0.547 | 57% | 0.574 | S | S | . | * | trans | -77.7 | 108.7 | 178.7 | -175.1 | 71 | -173 | 158.9 | 2.8 | 108.4 | Y136 P142 | Y136-R140 HydrophobicContact CD1-CB 4.48Å; Y136-R140 HydrophobicContact CE1-CB 4.33Å; Y136-R140 HydrophobicContact CE1-CG 4.21Å; Y136-R140 HydrophobicContact CE2-CB 4.44Å; Y136-R140 HydrophobicContact CE2-CG 4.4Å; Y136-R140 WeakPolarHBondContact O-CA 3.24Å; Y136-R140 WeakPolarHBondContact O-CB 3.29Å; Y136-R140 PolarHBondContact O-N 2.9Å; R140-P142 VanDerWaalsContact O-CD 3.29Å; R140-P142 WeakPolarHBondContact O-CD 3.33Å | ||
| 141 | S | 71.8 | Confident | 78.5 | Confident | 72 Ų | 72 | 113.7 Ų | 113.7 | 50% | 0.503 | 58% | 0.584 | S | S | . | * | trans | -67.5 | 119.6 | 159.7 | -52.7 | 0 | 0 | 0 | 0 | 107.7 | L139 E143 | L139-S141 PolarHBondContact O-N 3.25Å; S141-E143 PolarHBondContact O-N 3.39Å | ||
| 142 | P | 69.1 | Low | 77.5 | Confident | 128 Ų | 128 | 113.5 Ų | 113.5 | 83% | 0.831 | 60% | 0.596 | S | S | * | * | S | Bend | trans | -68.3 | -17.5 | -179.9 | 26.6 | -33.5 | 0 | 0 | 0 | 112.1 | R140 | R140-P142 VanDerWaalsContact O-CD 3.29Å; R140-P142 WeakPolarHBondContact O-CD 3.33Å |
| 143 | E | 74.1 | Confident | 76.1 | Confident | 104 Ų | 104 | 114.2 Ų | 114.2 | 49% | 0.486 | 60% | 0.596 | S | S | . | * | S | Bend | trans | -92.3 | 130.8 | 179.5 | -162.2 | 161.5 | -167.8 | 0 | 0 | 110.7 | S141 R145 K146 | S141-E143 PolarHBondContact O-N 3.39Å; E143-R145 PolarHBondContact O-N 3.25Å; E143-K146 WeakPolarHBondContact OE1-CE 3.16Å; E143-K146 IonicContact OE1-NZ 3.32Å; E143-K146 PolarHBondContact OE1-NZ 3.49Å; E143-K146 IonicContact OE2-NZ 2.71Å; E143-K146 PolarHBondContact OE2-NZ 2.97Å |
| 144 | P | 68.2 | Low | 75 | Confident | 108 Ų | 108 | 109.1 Ų | 109.1 | 70% | 0.701 | 58% | 0.58 | S | S | * | * | P | Polyproline II helix | trans | -57.8 | 134.4 | 166.1 | 23.8 | -30.9 | 0 | 0 | 0 | 108.8 | K146 | P144-K146 PolarHBondContact O-N 3.45Å; P144-K146 VanDerWaalsContact O-N 3.15Å |
| 145 | R | 66.8 | Low | 73.8 | Confident | 174 Ų | 174 | 105.5 Ų | 105.5 | 66% | 0.657 | 58% | 0.579 | S | S | * | * | P | Polyproline II helix | trans | -51.3 | 122.6 | -178.4 | -68.4 | -109.2 | -179 | 164 | -0.3 | 109.7 | E143 E149 | E143-R145 PolarHBondContact O-N 3.25Å; R145-E149 WeakPolarHBondContact CA-OE2 3.48Å; R145-E149 WeakPolarHBondContact CD-OE2 3.19Å |
| 146 | K | 68.8 | Low | 73 | Confident | 109 Ų | 109 | 109.1 Ų | 109.1 | 47% | 0.474 | 59% | 0.591 | S | S | . | * | P | Polyproline II helix | trans | -67 | 138.9 | 174.9 | -68.2 | 173.5 | -179.3 | 152.8 | 0 | 109.3 | E143 P144 G148 E149 | E143-K146 WeakPolarHBondContact OE1-CE 3.16Å; E143-K146 IonicContact OE1-NZ 3.32Å; E143-K146 PolarHBondContact OE1-NZ 3.49Å; E143-K146 IonicContact OE2-NZ 2.71Å; E143-K146 PolarHBondContact OE2-NZ 2.97Å; P144-K146 PolarHBondContact O-N 3.45Å; P144-K146 VanDerWaalsContact O-N 3.15Å; K146-G148 PolarHBondContact O-N 3.04Å; K146-E149 HydrophobicContact CB-CG 4.15Å; K146-E149 PolarHBondContact N-OE1 2.94Å; K146-E149 PolarHBondContact O-N 3.36Å |
| 147 | P | 61.3 | Low | 72.2 | Confident | 140 Ų | 140 | 103.9 Ų | 103.9 | 91% | 0.909 | 57% | 0.573 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -58.4 | 114 | 172 | 22.7 | -30.3 | 0 | 0 | 0 | 108.7 | ||
| 148 | G | 65 | Low | 71.3 | Confident | 49 Ų | 49 | 103.4 Ų | 103.4 | 51% | 0.505 | 58% | 0.579 | S | S | . | * | T | Hydrogen-bonded Turn | trans | 104.6 | 1.9 | -175.4 | 0 | 0 | 0 | 0 | 0 | 116 | K146 L150 | K146-G148 PolarHBondContact O-N 3.04Å; G148-L150 PolarHBondContact O-N 3.38Å |
| 149 | E | 67.7 | Low | 70.5 | Confident | 79 Ų | 79 | 106.2 Ų | 106.2 | 37% | 0.369 | 58% | 0.579 | S | S | . | * | trans | -60.5 | 126.3 | 167.4 | -92.9 | 171.5 | -158.7 | 0 | 0 | 110.3 | R145 K146 S151 | R145-E149 WeakPolarHBondContact CA-OE2 3.48Å; R145-E149 WeakPolarHBondContact CD-OE2 3.19Å; K146-E149 HydrophobicContact CB-CG 4.15Å; K146-E149 PolarHBondContact N-OE1 2.94Å; K146-E149 PolarHBondContact O-N 3.36Å; E149-S151 VanDerWaalsContact C-N 3.34Å; E149-S151 PolarHBondContact O-N 2.97Å | ||
| 150 | L | 61.8 | Low | 69.6 | Low | 150 Ų | 150 | 102.7 Ų | 102.7 | 79% | 0.785 | 57% | 0.565 | S | S | * | * | trans | -59.3 | 93.2 | -176.8 | -64 | 163.9 | 0 | 0 | 0 | 109.7 | G148 S154 | G148-L150 PolarHBondContact O-N 3.38Å; L150-S154 WeakPolarHBondContact CD2-OG 3.32Å | ||
| 151 | S | 71.1 | Confident | 69 | Low | 46 Ų | 46 | 101.9 Ų | 101.9 | 32% | 0.322 | 57% | 0.567 | S | S | . | * | trans | -67.3 | 156.9 | 164.8 | 73.4 | 0 | 0 | 0 | 0 | 108.7 | E149 Y153 S154 | E149-S151 VanDerWaalsContact C-N 3.34Å; E149-S151 PolarHBondContact O-N 2.97Å; S151-Y153 PolarHBondContact O-N 3.21Å; S151-S154 WeakPolarHBondContact O-CB 3.37Å; S151-S154 PolarHBondContact O-N 2.84Å; S151-S154 PolarHBondContact OG-N 3.42Å | ||
| 152 | A | 73.2 | Confident | 69 | Low | 88 Ų | 88 | 103.3 Ų | 103.3 | 73% | 0.727 | 58% | 0.575 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -54.5 | -24.1 | 175.4 | 0 | 0 | 0 | 0 | 0 | 112.9 | ||
| 153 | Y | 66.1 | Low | 69 | Low | 147 Ų | 147 | 101.8 Ų | 101.8 | 58% | 0.576 | 56% | 0.559 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -94.9 | 4.2 | 177.9 | -67.8 | -80.8 | 0 | 0 | 0 | 113.9 | S151 V155 F156 N157 | S151-Y153 PolarHBondContact O-N 3.21Å; Y153-V155 PolarHBondContact O-N 3.07Å; Y153-F156 HydrophobicContact CD1-CD2 4.16Å; Y153-F156 CarbonylContact O-C 3.42Å; Y153-F156 WeakPolarHBondContact O-CA 3.3Å; Y153-F156 PolarHBondContact O-N 3.16Å; Y153-N157 PolarHBondContact O-N 3.5Å |
| 154 | S | 70.8 | Confident | 68.6 | Low | 26 Ų | 26 | 106 Ų | 106 | 18% | 0.182 | 58% | 0.584 | C | S | . | * | T | Hydrogen-bonded Turn | trans | -59.3 | -27.3 | 173.3 | 176.1 | 0 | 0 | 0 | 0 | 112.3 | L150 S151 F156 N157 | L150-S154 WeakPolarHBondContact CD2-OG 3.32Å; S151-S154 WeakPolarHBondContact O-CB 3.37Å; S151-S154 PolarHBondContact O-N 2.84Å; S151-S154 PolarHBondContact OG-N 3.42Å; S154-F156 PolarHBondContact O-N 3.17Å; S154-N157 CarbonylContact O-C 3.54Å; S154-N157 PolarHBondContact O-N 3.21Å |
| 155 | V | 66.3 | Low | 68.7 | Low | 121 Ų | 121 | 104.6 Ų | 104.6 | 73% | 0.733 | 59% | 0.589 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -60.8 | -26.8 | 170.7 | 177.5 | 0 | 0 | 0 | 0 | 112.3 | Y153 | Y153-V155 PolarHBondContact O-N 3.07Š|
| 156 | F | 73 | Confident | 69 | Low | 166 Ų | 166 | 99 Ų | 99 | 73% | 0.728 | 58% | 0.576 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -112.4 | -9.9 | -177.7 | -58.8 | -69.8 | 0 | 0 | 0 | 113.6 | Y153 S154 | Y153-F156 HydrophobicContact CD1-CD2 4.16Å; Y153-F156 CarbonylContact O-C 3.42Å; Y153-F156 WeakPolarHBondContact O-CA 3.3Å; Y153-F156 PolarHBondContact O-N 3.16Å; S154-F156 PolarHBondContact O-N 3.17Å |
| 157 | N | 75.9 | Confident | 69.1 | Low | 27 Ų | 27 | 98.3 Ų | 98.3 | 14% | 0.144 | 58% | 0.578 | C | S | . | * | trans | -140.5 | 75.8 | -178.1 | -175.4 | 12.6 | 0 | 0 | 0 | 109.6 | Y153 S154 D159 C160 Q161 | Y153-N157 PolarHBondContact O-N 3.5Å; S154-N157 CarbonylContact O-C 3.54Å; S154-N157 PolarHBondContact O-N 3.21Å; N157-D159 PolarHBondContact O-N 2.95Å; N157-C160 PolarHBondContact O-N 3.18Å; N157-C160 VanDerWaalsContact O-N 3.17Å; N157-C160 PolarHBondContact OD1-N 3.4Å; N157-Q161 PolarHBondContact ND2-N 3.29Å; N157-Q161 PolarHBondContact ND2-O 3.45Å; N157-Q161 PolarHBondContact OD1-N 3.28Å | ||
| 158 | P | 70.8 | Confident | 69.8 | Low | 99 Ų | 99 | 94.3 Ų | 94.3 | 64% | 0.643 | 55% | 0.551 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -63.1 | -28.8 | -175 | 24.7 | -33.5 | 0 | 0 | 0 | 112.7 | C160 | P158-C160 VanDerWaalsContact C-N 3.29Å; P158-C160 PolarHBondContact O-N 2.93Å |
| 159 | D | 70.4 | Confident | 70.4 | Confident | 122 Ų | 122 | 95.2 Ų | 95.2 | 65% | 0.652 | 55% | 0.553 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -86.6 | 1.2 | -178.7 | -57.9 | -47.6 | 0 | 0 | 0 | 113.1 | N157 Q161 | N157-D159 PolarHBondContact O-N 2.95Å; D159-Q161 HydrophobicContact CB-CG 3.93Å; D159-Q161 PolarHBondContact O-N 3.27Å; D159-Q161 VanDerWaalsContact O-N 3.08Å |
| 160 | C | 65.4 | Low | 70.8 | Confident | 57 Ų | 57 | 97.4 Ų | 97.4 | 39% | 0.385 | 56% | 0.563 | S | S | . | * | trans | 50.2 | 32.9 | -177.5 | -65 | 0 | 0 | 0 | 0 | 113.3 | N157 P158 | N157-C160 PolarHBondContact O-N 3.18Å; N157-C160 VanDerWaalsContact O-N 3.17Å; N157-C160 PolarHBondContact OD1-N 3.4Å; P158-C160 VanDerWaalsContact C-N 3.29Å; P158-C160 PolarHBondContact O-N 2.93Å | ||
| 161 | Q | 72.4 | Confident | 71.6 | Confident | 127 Ų | 127 | 95.2 Ų | 95.2 | 59% | 0.593 | 55% | 0.549 | S | S | * | . | P | Polyproline II helix | trans | -73.1 | 145.9 | 178.8 | -68.6 | -169.2 | -7.7 | 0 | 0 | 110.6 | N157 D159 L163 | N157-Q161 PolarHBondContact ND2-N 3.29Å; N157-Q161 PolarHBondContact ND2-O 3.45Å; N157-Q161 PolarHBondContact OD1-N 3.28Å; D159-Q161 HydrophobicContact CB-CG 3.93Å; D159-Q161 PolarHBondContact O-N 3.27Å; D159-Q161 VanDerWaalsContact O-N 3.08Å; Q161-L163 PolarHBondContact O-N 2.97Å |
| 162 | P | 71.1 | Confident | 72 | Confident | 102 Ų | 102 | 96.3 Ų | 96.3 | 66% | 0.662 | 55% | 0.551 | S | S | * | * | P | Polyproline II helix | trans | -54.7 | 129.6 | 171.2 | 21.5 | -30.3 | 0 | 0 | 0 | 109.6 | ||
| 163 | L | 68.8 | Low | 72.4 | Confident | 97 Ų | 97 | 96.2 Ų | 96.2 | 51% | 0.508 | 54% | 0.536 | S | S | . | . | P | Polyproline II helix | trans | -67.7 | 146.4 | -177.9 | -67.1 | 163.9 | 0 | 0 | 0 | 109.1 | Q161 G165 S166 | Q161-L163 PolarHBondContact O-N 2.97Å; L163-G165 PolarHBondContact O-N 3.36Å; L163-S166 PolarHBondContact N-OG 2.79Å; L163-S166 PolarHBondContact O-N 2.85Å; L163-S166 PolarHBondContact O-OG 3.08Å; L163-S166 VanDerWaalsContact O-OG 3.05Å |
| 164 | L | 65.4 | Low | 73.1 | Confident | 192 Ų | 192 | 91 Ų | 91 | 100% | 1.005 | 53% | 0.526 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -58 | 112.6 | 173.4 | -129.3 | 96.1 | 0 | 0 | 0 | 108.7 | ||
| 165 | G | 71.1 | Confident | 73.6 | Confident | 78 Ų | 78 | 96 Ų | 96 | 80% | 0.804 | 55% | 0.547 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 97.4 | -0.9 | -175.9 | 0 | 0 | 0 | 0 | 0 | 116 | L163 L167 | L163-G165 PolarHBondContact O-N 3.36Å; G165-L167 PolarHBondContact O-N 3.43Å |
| 166 | S | 73 | Confident | 74.3 | Confident | 56 Ų | 56 | 95.2 Ų | 95.2 | 39% | 0.392 | 54% | 0.536 | S | S | . | . | P | Polyproline II helix | trans | -70.6 | 119.7 | 165.2 | 68.2 | 0 | 0 | 0 | 0 | 108.9 | L163 T168 | L163-S166 PolarHBondContact N-OG 2.79Å; L163-S166 PolarHBondContact O-N 2.85Å; L163-S166 PolarHBondContact O-OG 3.08Å; L163-S166 VanDerWaalsContact O-OG 3.05Å; S166-T168 PolarHBondContact O-N 3.4Å; S166-T168 VanDerWaalsContact O-N 3.15Å |
| 167 | L | 70.9 | Confident | 74.6 | Confident | 96 Ų | 96 | 90.2 Ų | 90.2 | 50% | 0.503 | 53% | 0.532 | S | S | . | . | P | Polyproline II helix | trans | -63.2 | 116.8 | 174.2 | -64.6 | 174.7 | 0 | 0 | 0 | 108.8 | G165 L172 | G165-L167 PolarHBondContact O-N 3.43Å; L167-L172 HydrophobicContact CB-CD1 4.43Å; L167-L172 HydrophobicContact CD1-CD1 3.77Å |
| 168 | T | 76.6 | Confident | 74.7 | Confident | 56 Ų | 56 | 97.1 Ų | 97.1 | 34% | 0.344 | 56% | 0.557 | S | S | . | * | P | Polyproline II helix | trans | -67.8 | 149.1 | 169.3 | 64.4 | 0 | 0 | 0 | 0 | 108.4 | S166 E170 Q171 L172 | S166-T168 PolarHBondContact O-N 3.4Å; S166-T168 VanDerWaalsContact O-N 3.15Å; T168-E170 PolarHBondContact O-N 3.45Å; T168-Q171 PolarHBondContact O-N 3.39Å; T168-Q171 VanDerWaalsContact O-N 3.07Å; T168-Q171 VanDerWaalsContact OG1-CB 3.24Å; T168-Q171 WeakPolarHBondContact OG1-CB 3.46Å; T168-Q171 PolarHBondContact OG1-N 3.26Å; T168-Q171 VanDerWaalsContact OG1-N 3.16Å; T168-L172 PolarHBondContact O-N 2.82Å |
| 169 | A | 76.3 | Confident | 74.8 | Confident | 67 Ų | 67 | 99.8 Ų | 99.8 | 55% | 0.554 | 55% | 0.554 | S | S | * | * | H | α-helix | trans | -53.7 | -39.7 | 175.7 | 0 | 0 | 0 | 0 | 0 | 111.1 | Q171 L172 E173 | A169-Q171 PolarHBondContact O-N 3.28Å; A169-L172 PolarHBondContact O-N 3.37Å; A169-E173 WeakPolarHBondContact O-CB 3.33Å; A169-E173 WeakPolarHBondContact O-CG 3.41Å; A169-E173 PolarHBondContact O-N 2.97Å |
| 170 | E | 75.4 | Confident | 74.5 | Confident | 126 Ų | 126 | 99.2 Ų | 99.2 | 59% | 0.589 | 56% | 0.557 | S | S | * | * | H | α-helix | trans | -64.3 | -35.7 | 178.5 | -59.8 | 161.7 | 179.3 | 0 | 0 | 113.6 | T168 G174 | T168-E170 PolarHBondContact O-N 3.45Å; E170-G174 PolarHBondContact O-N 3.15Å |
| 171 | Q | 78.6 | Confident | 74.2 | Confident | 104 Ų | 104 | 104.1 Ų | 104.1 | 49% | 0.486 | 58% | 0.579 | S | S | . | * | H | α-helix | trans | -76.6 | -41.7 | 177.8 | -176.1 | 166.6 | -33.4 | 0 | 0 | 110.9 | T168 A169 E173 G174 E175 | T168-Q171 PolarHBondContact O-N 3.39Å; T168-Q171 VanDerWaalsContact O-N 3.07Å; T168-Q171 VanDerWaalsContact OG1-CB 3.24Å; T168-Q171 WeakPolarHBondContact OG1-CB 3.46Å; T168-Q171 PolarHBondContact OG1-N 3.26Å; T168-Q171 VanDerWaalsContact OG1-N 3.16Å; A169-Q171 PolarHBondContact O-N 3.28Å; Q171-E173 VanDerWaalsContact C-N 3.31Å; Q171-E173 PolarHBondContact O-N 2.84Å; Q171-G174 PolarHBondContact O-N 3.41Å; Q171-G174 VanDerWaalsContact O-N 3.15Å; Q171-E175 PolarHBondContact O-N 2.93Å |
| 172 | L | 81.4 | Confident | 73.6 | Confident | 68 Ų | 68 | 102.3 Ų | 102.3 | 36% | 0.356 | 59% | 0.586 | S | S | . | * | H | α-helix | trans | -61 | -41.2 | 173.3 | -166.8 | 94.6 | 0 | 0 | 0 | 111.2 | L167 T168 A169 G174 E175 M176 | L167-L172 HydrophobicContact CB-CD1 4.43Å; L167-L172 HydrophobicContact CD1-CD1 3.77Å; T168-L172 PolarHBondContact O-N 2.82Å; A169-L172 PolarHBondContact O-N 3.37Å; L172-G174 VanDerWaalsContact C-N 3.31Å; L172-G174 PolarHBondContact O-N 3.08Å; L172-E175 PolarHBondContact O-N 3.42Å; L172-M176 HydrophobicContact CB-CE 4.39Å; L172-M176 HydrophobicContact CD2-CE 3.29Å; L172-M176 HydrophobicContact CD2-SD 4.08Å; L172-M176 HydrophobicContact CG-CE 3.6Å; L172-M176 HydrophobicContact CG-CG 4.49Å; L172-M176 HydrophobicContact CG-SD 4.17Å; L172-M176 WeakPolarHBondContact O-CB 3.32Å; L172-M176 VanDerWaalsContact O-CG 3.3Å; L172-M176 WeakPolarHBondContact O-CG 3.49Å; L172-M176 PolarHBondContact O-N 3.46Å |
| 173 | E | 80.2 | Confident | 72.8 | Confident | 87 Ų | 87 | 105.4 Ų | 105.4 | 41% | 0.407 | 60% | 0.597 | S | S | . | * | H | α-helix | trans | -63.2 | -35.4 | 174.5 | -76.8 | 166.3 | -160.5 | 0 | 0 | 112.4 | A169 Q171 G177 Y178 R179 | A169-E173 WeakPolarHBondContact O-CB 3.33Å; A169-E173 WeakPolarHBondContact O-CG 3.41Å; A169-E173 PolarHBondContact O-N 2.97Å; Q171-E173 VanDerWaalsContact C-N 3.31Å; Q171-E173 PolarHBondContact O-N 2.84Å; E173-G177 PolarHBondContact O-N 3.3Å; E173-Y178 PolarHBondContact O-N 3.26Å; E173-R179 PolarHBondContact O-N 3.42Å |
| 174 | G | 81.5 | Confident | 71.7 | Confident | 37 Ų | 37 | 114.7 Ų | 114.7 | 38% | 0.381 | 63% | 0.625 | S | S | . | * | H | α-helix | trans | -66.3 | -44.2 | 172.4 | 0 | 0 | 0 | 0 | 0 | 112.7 | E170 Q171 L172 G177 | E170-G174 PolarHBondContact O-N 3.15Å; Q171-G174 PolarHBondContact O-N 3.41Å; Q171-G174 VanDerWaalsContact O-N 3.15Å; L172-G174 VanDerWaalsContact C-N 3.31Å; L172-G174 PolarHBondContact O-N 3.08Å; G174-G177 PolarHBondContact O-N 3.3Å |
| 175 | E | 80.8 | Confident | 72 | Confident | 132 Ų | 132 | 110.8 Ų | 110.8 | 62% | 0.617 | 61% | 0.606 | S | S | * | * | H | α-helix | trans | -70.1 | -34.8 | 178.4 | -70.8 | 178.8 | -166.4 | 0 | 0 | 112.8 | Q171 L172 G177 | Q171-E175 PolarHBondContact O-N 2.93Å; L172-E175 PolarHBondContact O-N 3.42Å; E175-G177 PolarHBondContact O-N 3.31Å |
| 176 | M | 80.7 | Confident | 72 | Confident | 103 Ų | 103 | 112.5 Ų | 112.5 | 51% | 0.507 | 60% | 0.596 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -80.9 | 1.8 | 175.4 | -67.6 | -171.9 | -59.4 | 0 | 0 | 113.4 | L172 Y178 | L172-M176 HydrophobicContact CB-CE 4.39Å; L172-M176 HydrophobicContact CD2-CE 3.29Å; L172-M176 HydrophobicContact CD2-SD 4.08Å; L172-M176 HydrophobicContact CG-CE 3.6Å; L172-M176 HydrophobicContact CG-CG 4.49Å; L172-M176 HydrophobicContact CG-SD 4.17Å; L172-M176 WeakPolarHBondContact O-CB 3.32Å; L172-M176 VanDerWaalsContact O-CG 3.3Å; L172-M176 WeakPolarHBondContact O-CG 3.49Å; L172-M176 PolarHBondContact O-N 3.46Å; M176-Y178 VanDerWaalsContact C-N 3.31Å; M176-Y178 HydrophobicContact CB-CD2 3.49Å; M176-Y178 VanDerWaalsContact CB-CD2 3.49Å; M176-Y178 HydrophobicContact CB-CE2 3.64Å; M176-Y178 HydrophobicContact CE-CD2 4.09Å; M176-Y178 HydrophobicContact CE-CE2 4.13Å; M176-Y178 PolarHBondContact O-N 3.39Å; M176-Y178 HydrophobicContact SD-CE2 4.29Å |
| 177 | G | 80.4 | Confident | 72 | Confident | 62 Ų | 62 | 115.7 Ų | 115.7 | 64% | 0.639 | 61% | 0.607 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 75 | 15.1 | 175.5 | 0 | 0 | 0 | 0 | 0 | 115 | E173 G174 E175 | E173-G177 PolarHBondContact O-N 3.3Å; G174-G177 PolarHBondContact O-N 3.3Å; E175-G177 PolarHBondContact O-N 3.31Å |
| 178 | Y | 76.6 | Confident | 72.1 | Confident | 172 Ų | 172 | 116.8 Ų | 116.8 | 68% | 0.675 | 61% | 0.613 | S | S | * | * | trans | -82.9 | -13 | 178.3 | -68.7 | -69.9 | 0 | 0 | 0 | 113.6 | E173 M176 P180 | E173-Y178 PolarHBondContact O-N 3.26Å; M176-Y178 VanDerWaalsContact C-N 3.31Å; M176-Y178 HydrophobicContact CB-CD2 3.49Å; M176-Y178 VanDerWaalsContact CB-CD2 3.49Å; M176-Y178 HydrophobicContact CB-CE2 3.64Å; M176-Y178 HydrophobicContact CE-CD2 4.09Å; M176-Y178 HydrophobicContact CE-CE2 4.13Å; M176-Y178 PolarHBondContact O-N 3.39Å; M176-Y178 HydrophobicContact SD-CE2 4.29Å; Y178-P180 WeakPolarHBondContact O-CD 3.05Å | ||
| 179 | R | 73.4 | Confident | 71.8 | Confident | 154 Ų | 154 | 120.6 Ų | 120.6 | 58% | 0.581 | 63% | 0.63 | S | S | * | * | S | Bend | trans | -73.1 | 119.8 | 171.9 | -78.4 | -174.9 | 80.4 | 104.4 | -3.2 | 110.5 | E173 L181 | E173-R179 PolarHBondContact O-N 3.42Å; R179-L181 PolarHBondContact O-N 3.47Å |
| 180 | P | 64.1 | Low | 71.5 | Confident | 110 Ų | 110 | 124.2 Ų | 124.2 | 71% | 0.714 | 64% | 0.635 | S | S | * | * | trans | -61.8 | 138.5 | 165.6 | -13.3 | 28.1 | 0 | 0 | 0 | 108.4 | Y178 A182 | Y178-P180 WeakPolarHBondContact O-CD 3.05Å; P180-A182 PolarHBondContact O-N 2.72Å | ||
| 181 | L | 60.1 | Low | 71.2 | Confident | 160 Ų | 160 | 124.1 Ų | 124.1 | 84% | 0.838 | 64% | 0.638 | S | S | * | * | trans | -66.3 | 62.9 | 168.6 | -64.5 | 171.1 | 0 | 0 | 0 | 109.9 | R179 N183 | R179-L181 PolarHBondContact O-N 3.47Å; L181-N183 PolarHBondContact O-N 3.27Å | ||
| 182 | A | 58.9 | Low | 70.6 | Confident | 90 Ų | 90 | 125.6 Ų | 125.6 | 74% | 0.744 | 65% | 0.65 | S | S | * | * | trans | -78.1 | 106.6 | 166.8 | 0 | 0 | 0 | 0 | 0 | 106.5 | P180 | P180-A182 PolarHBondContact O-N 2.72Š| ||
| 183 | N | 53.8 | Low | 69.7 | Low | 167 Ų | 167 | 130.4 Ų | 130.4 | 89% | 0.893 | 67% | 0.674 | S | S | * | * | trans | 91.1 | 76.9 | 174.6 | -134 | 22 | 0 | 0 | 0 | 115.4 | L181 | L181-N183 PolarHBondContact O-N 3.27Š| ||
| 184 | R | 46.1 | Very low | 68.8 | Low | 291 Ų | 291 | 134.4 Ų | 134.4 | 100% | 1.098 | 70% | 0.699 | S | S | * | * | trans | -98.9 | 0 | 142.1 | -114 | -166 | -175.2 | 152.4 | 3 | 108.6 |
Retrieved 184 of 184 residues in 341.1 ms
(Link to these results)