| 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 | 37.5 | Very low | 57.5 | Low | 235 Ų | 235 | 109.8 Ų | 109.8 | 100% | 1.158 | 61% | 0.607 | S | S | * | * | 0 | 97.8 | 0 | -68.8 | -170 | -171.8 | 0 | 0 | 108.2 | I3 | M1-I3 PolarHBondContact O-N 2.97Š| |||
| 2 | S | 43.5 | Very low | 59.3 | Low | 121 Ų | 121 | 114.3 Ų | 114.3 | 85% | 0.846 | 62% | 0.615 | S | S | * | * | trans | -87.9 | 94.8 | -176.2 | -48.6 | 0 | 0 | 0 | 0 | 108.7 | L4 | S2-L4 PolarHBondContact O-N 2.9Š| ||
| 3 | I | 53.9 | Low | 61 | Low | 164 Ų | 164 | 113.8 Ų | 113.8 | 84% | 0.841 | 60% | 0.599 | S | S | * | * | trans | -61.8 | 100.9 | 167.6 | 42.9 | 157.6 | 0 | 0 | 0 | 108.2 | M1 | M1-I3 PolarHBondContact O-N 2.97Š| ||
| 4 | L | 54.3 | Low | 62.5 | Low | 153 Ų | 153 | 107.1 Ų | 107.1 | 80% | 0.801 | 56% | 0.564 | S | S | * | * | trans | -51.7 | 132.1 | 171.9 | -72.3 | 150.8 | 0 | 0 | 0 | 108.6 | S2 F6 | S2-L4 PolarHBondContact O-N 2.9Å; L4-F6 PolarHBondContact O-N 3.48Å | ||
| 5 | P | 52.4 | Low | 63.7 | Low | 107 Ų | 107 | 102.9 Ų | 102.9 | 70% | 0.695 | 54% | 0.542 | S | S | * | . | trans | -64.1 | 109.6 | 176.1 | 25.7 | -30.3 | 0 | 0 | 0 | 107.9 | T7 | P5-T7 PolarHBondContact O-N 3.34Š| ||
| 6 | F | 52.3 | Low | 64.8 | Low | 195 Ų | 195 | 100.8 Ų | 100.8 | 86% | 0.855 | 55% | 0.552 | S | S | * | * | S | Bend | trans | -71.8 | 13.7 | -177.8 | -160.4 | -101.5 | 0 | 0 | 0 | 112.9 | L4 | L4-F6 PolarHBondContact O-N 3.48Š|
| 7 | T | 54.5 | Low | 65.9 | Low | 61 Ų | 61 | 101.5 Ų | 101.5 | 37% | 0.374 | 55% | 0.545 | S | S | . | . | S | Bend | trans | -101.5 | 117.3 | 167.9 | 44.8 | 0 | 0 | 0 | 0 | 108.1 | P5 | P5-T7 PolarHBondContact O-N 3.34Š|
| 8 | P | 61.8 | Low | 66.6 | Low | 53 Ų | 53 | 99.4 Ų | 99.4 | 34% | 0.344 | 53% | 0.53 | S | S | . | . | trans | -50.4 | 126.9 | 172.4 | -25 | 33.2 | 0 | 0 | 0 | 108.7 | I10 V11 | P8-I10 HydrophobicContact CB-CG2 3.6Å; P8-I10 PolarHBondContact O-N 3.09Å; P8-V11 HydrophobicContact CB-CG2 4.16Å; P8-V11 HydrophobicContact CG-CG2 4.25Å; P8-V11 WeakPolarHBondContact O-CB 3.31Å; P8-V11 PolarHBondContact O-N 3.34Å | ||
| 9 | P | 70.1 | Confident | 66.9 | Low | 105 Ų | 105 | 105.2 Ų | 105.2 | 68% | 0.682 | 55% | 0.55 | S | S | * | . | H | α-helix | trans | -55 | -27.9 | -175.4 | 17.3 | -30 | 0 | 0 | 0 | 112.4 | V11 K12 R13 | P9-V11 PolarHBondContact O-N 3.04Å; P9-K12 PolarHBondContact O-N 3.25Å; P9-R13 PolarHBondContact O-N 3.02Å |
| 10 | I | 75.2 | Confident | 66.9 | Low | 10 Ų | 10 | 102.5 Ų | 102.5 | 5% | 0.051 | 55% | 0.549 | C | S | . | . | H | α-helix | trans | -56.7 | -40.3 | 171.3 | -168.6 | 84.3 | 0 | 0 | 0 | 113.4 | P8 R13 L14 V38 L47 E51 | P8-I10 HydrophobicContact CB-CG2 3.6Å; P8-I10 PolarHBondContact O-N 3.09Å; I10-R13 PolarHBondContact O-N 3.17Å; I10-L14 HydrophobicContact CG1-CD1 3.93Å; I10-L14 HydrophobicContact CG1-CG 4.34Å; I10-L14 WeakPolarHBondContact O-CB 3.22Å; I10-L14 VanDerWaalsContact O-CG 3.23Å; I10-L14 WeakPolarHBondContact O-CG 3.35Å; I10-L14 PolarHBondContact O-N 3.48Å; I10-V38 HydrophobicContact CG1-CG2 4.39Å; I10-V38 HydrophobicContact CG2-CG1 3.68Å; I10-V38 HydrophobicContact CG2-CG2 4.01Å; I10-L47 HydrophobicContact CB-CD2 4.42Å; I10-L47 HydrophobicContact CD1-CD2 4.47Å; I10-L47 HydrophobicContact CD1-CG 4.24Å; I10-L47 HydrophobicContact CG1-CD1 4.05Å; I10-L47 HydrophobicContact CG1-CD2 4.23Å; I10-L47 HydrophobicContact CG1-CG 4.07Å; I10-L47 HydrophobicContact CG2-CD1 4.34Å; I10-L47 HydrophobicContact CG2-CD2 4.18Å; I10-E51 HydrophobicContact CD1-CB 3.61Å; I10-E51 HydrophobicContact CD1-CG 3.54Å; I10-E51 WeakPolarHBondContact CD1-OE2 3.31Å |
| 11 | V | 77.4 | Confident | 66.6 | Low | 4 Ų | 4 | 107.3 Ų | 107.3 | 2% | 0.024 | 57% | 0.568 | C | S | . | * | H | α-helix | trans | -66.8 | -44 | -179.1 | 175.4 | 0 | 0 | 0 | 0 | 109.9 | P8 P9 L14 L15 V34 V38 | P8-V11 HydrophobicContact CB-CG2 4.16Å; P8-V11 HydrophobicContact CG-CG2 4.25Å; P8-V11 WeakPolarHBondContact O-CB 3.31Å; P8-V11 PolarHBondContact O-N 3.34Å; P9-V11 PolarHBondContact O-N 3.04Å; V11-L14 PolarHBondContact O-N 3.31Å; V11-L15 HydrophobicContact CG1-CD1 3.94Å; V11-L15 HydrophobicContact CG1-CG 4.48Å; V11-L15 WeakPolarHBondContact O-CB 3.3Å; V11-L15 VanDerWaalsContact O-CG 3.29Å; V11-L15 WeakPolarHBondContact O-CG 3.44Å; V11-L15 PolarHBondContact O-N 3.01Å; V11-V34 HydrophobicContact CB-CG1 4.32Å; V11-V34 HydrophobicContact CG1-CB 4.42Å; V11-V34 HydrophobicContact CG1-CG1 3.89Å; V11-V34 HydrophobicContact CG2-CG1 4.4Å; V11-V38 HydrophobicContact CG2-CB 4.09Å; V11-V38 HydrophobicContact CG2-CG1 4.1Å; V11-V38 HydrophobicContact CG2-CG2 3.87Å |
| 12 | K | 78.9 | Confident | 67.8 | Low | 164 Ų | 164 | 97.9 Ų | 97.9 | 71% | 0.713 | 52% | 0.521 | S | S | * | . | H | α-helix | trans | -65.1 | -40.2 | 177.1 | -169 | 175.9 | -179.1 | 178.9 | 0 | 111.5 | P9 G16 | P9-K12 PolarHBondContact O-N 3.25Å; K12-G16 PolarHBondContact O-N 3.41Å |
| 13 | R | 81.4 | Confident | 68.9 | Low | 107 Ų | 107 | 98.1 Ų | 98.1 | 40% | 0.404 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -62.6 | -49.9 | 173.9 | -79 | 176.8 | 65.4 | -167.8 | -4.2 | 111.6 | P9 I10 L15 G16 W17 E51 | P9-R13 PolarHBondContact O-N 3.02Å; I10-R13 PolarHBondContact O-N 3.17Å; R13-L15 VanDerWaalsContact C-N 3.33Å; R13-L15 PolarHBondContact O-N 3.13Å; R13-G16 WeakPolarHBondContact O-CA 3.28Å; R13-G16 PolarHBondContact O-N 3.03Å; R13-W17 PolarHBondContact O-N 3.39Å; R13-E51 IonicContact CZ-OE1 3.11Å; R13-E51 IonicContact CZ-OE2 3.46Å; R13-E51 IonicContact NH1-OE1 2.73Å; R13-E51 PolarHBondContact NH1-OE1 3.22Å; R13-E51 IonicContact NH1-OE2 2.85Å; R13-E51 PolarHBondContact NH1-OE2 2.92Å; R13-E51 IonicContact NH2-OE1 2.74Å; R13-E51 PolarHBondContact NH2-OE1 2.87Å; R13-E51 IonicContact NH2-OE2 3.79Å |
| 14 | L | 82.2 | Confident | 69.6 | Low | 20 Ų | 20 | 92.5 Ų | 92.5 | 11% | 0.105 | 50% | 0.496 | C | S | . | . | H | α-helix | trans | -61.1 | -39.5 | 178.8 | -72.4 | 169.2 | 0 | 0 | 0 | 112.4 | I10 V11 G16 W17 K18 V34 V38 L50 I54 | I10-L14 HydrophobicContact CG1-CD1 3.93Å; I10-L14 HydrophobicContact CG1-CG 4.34Å; I10-L14 WeakPolarHBondContact O-CB 3.22Å; I10-L14 VanDerWaalsContact O-CG 3.23Å; I10-L14 WeakPolarHBondContact O-CG 3.35Å; I10-L14 PolarHBondContact O-N 3.48Å; V11-L14 PolarHBondContact O-N 3.31Å; L14-G16 VanDerWaalsContact C-N 3.3Å; L14-G16 PolarHBondContact O-N 2.84Å; L14-W17 PolarHBondContact O-N 3.49Å; L14-K18 PolarHBondContact O-N 3.06Å; L14-V34 HydrophobicContact CB-CG1 3.79Å; L14-V34 HydrophobicContact CD1-CG1 3.83Å; L14-V34 HydrophobicContact CG-CG1 4.49Å; L14-V38 HydrophobicContact CD1-CG2 3.66Å; L14-L50 HydrophobicContact CD1-CD2 3.68Å; L14-L50 HydrophobicContact CD2-CD2 4.07Å; L14-L50 HydrophobicContact CD2-CG 4.11Å; L14-I54 HydrophobicContact CD2-CB 4.23Å; L14-I54 HydrophobicContact CD2-CG1 3.79Å; L14-I54 HydrophobicContact CD2-CG2 4.32Å |
| 15 | L | 80.4 | Confident | 70.6 | Confident | 45 Ų | 45 | 93.5 Ų | 93.5 | 24% | 0.236 | 50% | 0.496 | C | S | . | . | H | α-helix | trans | -65.9 | -31.1 | 173.8 | -73.5 | 169.7 | 0 | 0 | 0 | 112.7 | V11 R13 W17 K18 C30 E31 V34 | V11-L15 HydrophobicContact CG1-CD1 3.94Å; V11-L15 HydrophobicContact CG1-CG 4.48Å; V11-L15 WeakPolarHBondContact O-CB 3.3Å; V11-L15 VanDerWaalsContact O-CG 3.29Å; V11-L15 WeakPolarHBondContact O-CG 3.44Å; V11-L15 PolarHBondContact O-N 3.01Å; R13-L15 VanDerWaalsContact C-N 3.33Å; R13-L15 PolarHBondContact O-N 3.13Å; L15-W17 VanDerWaalsContact C-N 3.26Å; L15-W17 PolarHBondContact O-N 2.93Å; L15-K18 WeakPolarHBondContact O-CB 3.2Å; L15-K18 PolarHBondContact O-N 3.31Å; L15-C30 HydrophobicContact CD2-CB 4.2Å; L15-E31 HydrophobicContact CD1-CB 4.13Å; L15-E31 HydrophobicContact CD1-CG 4.02Å; L15-V34 HydrophobicContact CD2-CB 4.48Å; L15-V34 HydrophobicContact CD2-CG2 3.94Å; L15-V34 HydrophobicContact CG-CG2 4.39Å |
| 16 | G | 80.7 | Confident | 71.8 | Confident | 68 Ų | 68 | 93 Ų | 93 | 70% | 0.701 | 49% | 0.485 | S | S | * | . | H | α-helix | trans | -68.3 | -23.8 | 172.5 | 0 | 0 | 0 | 0 | 0 | 113.9 | K12 R13 L14 K18 | K12-G16 PolarHBondContact O-N 3.41Å; R13-G16 WeakPolarHBondContact O-CA 3.28Å; R13-G16 PolarHBondContact O-N 3.03Å; L14-G16 VanDerWaalsContact C-N 3.3Å; L14-G16 PolarHBondContact O-N 2.84Å; G16-K18 VanDerWaalsContact C-N 3.33Å |
| 17 | W | 82.9 | Confident | 73.2 | Confident | 113 Ų | 113 | 88.9 Ų | 88.9 | 43% | 0.428 | 47% | 0.468 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -86.2 | -3.6 | 173 | -73.4 | 104.4 | 0 | 0 | 0 | 113.6 | R13 L14 L15 K19 I54 T55 | R13-W17 PolarHBondContact O-N 3.39Å; L14-W17 PolarHBondContact O-N 3.49Å; L15-W17 VanDerWaalsContact C-N 3.26Å; L15-W17 PolarHBondContact O-N 2.93Å; W17-K19 PolarHBondContact O-N 2.87Å; W17-I54 HydrophobicContact CB-CG2 3.42Å; W17-I54 VanDerWaalsContact CB-CG2 3.42Å; W17-I54 VanDerWaalsContact CD1-CG2 3.45Å; W17-I54 HydrophobicContact CD2-CG2 3.68Å; W17-I54 HydrophobicContact CE3-CG2 4.36Å; W17-I54 HydrophobicContact CG-CG2 3.23Å; W17-T55 HydrophobicContact CZ2-CG2 4.02Å |
| 18 | K | 78.8 | Confident | 74.5 | Confident | 64 Ų | 64 | 93.7 Ų | 93.7 | 28% | 0.278 | 48% | 0.484 | S | S | . | . | trans | -61.1 | 126.1 | 176.4 | -172.8 | -169.3 | 84.9 | 176.1 | 0 | 109.6 | L14 L15 G16 G20 Q22 C30 | L14-K18 PolarHBondContact O-N 3.06Å; L15-K18 WeakPolarHBondContact O-CB 3.2Å; L15-K18 PolarHBondContact O-N 3.31Å; G16-K18 VanDerWaalsContact C-N 3.33Å; K18-G20 VanDerWaalsContact CE-O 3.31Å; K18-G20 WeakPolarHBondContact CE-O 3.32Å; K18-Q22 HydrophobicContact CD-CG 4.37Å; K18-Q22 VanDerWaalsContact NZ-CB 3.26Å; K18-Q22 VanDerWaalsContact NZ-CD 3.29Å; K18-Q22 VanDerWaalsContact NZ-CG 3.28Å; K18-C30 HydrophobicContact CD-CB 4.36Å | ||
| 19 | K | 73.7 | Confident | 75.6 | Confident | 210 Ų | 210 | 100.6 Ų | 100.6 | 91% | 0.913 | 50% | 0.503 | S | S | * | . | trans | -92.5 | 121.1 | 176.1 | -155.4 | 172.6 | -175.6 | 177.7 | 0 | 109.6 | W17 | W17-K19 PolarHBondContact O-N 2.87Š| ||
| 20 | G | 66.1 | Low | 76.4 | Confident | 51 Ų | 51 | 96.9 Ų | 96.9 | 53% | 0.526 | 48% | 0.479 | S | S | . | . | S | Bend | trans | 119.7 | 137.4 | 175.8 | 0 | 0 | 0 | 0 | 0 | 113.9 | K18 Q22 | K18-G20 VanDerWaalsContact CE-O 3.31Å; K18-G20 WeakPolarHBondContact CE-O 3.32Å; G20-Q22 PolarHBondContact O-N 3.42Å |
| 21 | E | 60.3 | Low | 76.8 | Confident | 204 Ų | 204 | 100.7 Ų | 100.7 | 95% | 0.953 | 50% | 0.497 | S | S | * | . | trans | -71.6 | 119.7 | 168.5 | -166.2 | 160.3 | 91.5 | 0 | 0 | 107.6 | ||||
| 22 | Q | 62.7 | Low | 77.2 | Confident | 37 Ų | 37 | 108 Ų | 108 | 17% | 0.173 | 53% | 0.529 | C | S | . | . | trans | -111.9 | 130.9 | -178.6 | -73.3 | -166.3 | -34.7 | 0 | 0 | 108.6 | K18 G20 E26 E27 C30 | K18-Q22 HydrophobicContact CD-CG 4.37Å; K18-Q22 VanDerWaalsContact NZ-CB 3.26Å; K18-Q22 VanDerWaalsContact NZ-CD 3.29Å; K18-Q22 VanDerWaalsContact NZ-CG 3.28Å; G20-Q22 PolarHBondContact O-N 3.42Å; Q22-E26 HydrophobicContact CB-CB 3.7Å; Q22-E26 HydrophobicContact CG-CB 4.02Å; Q22-E26 PolarHBondContact NE2-OE1 3.46Å; Q22-E26 PolarHBondContact OE1-O 2.96Å; Q22-E27 HydrophobicContact CB-CG 3.93Å; Q22-C30 VanDerWaalsContact CD-SG 3.51Å; Q22-C30 PolarHBondContact NE2-SG 2.92Å; Q22-C30 PolarHBondContact OE1-SG 3.28Å | ||
| 23 | N | 67.1 | Low | 77.7 | Confident | 125 Ų | 125 | 102.7 Ų | 102.7 | 67% | 0.668 | 52% | 0.515 | S | S | * | . | trans | -55.8 | 143.9 | 169.3 | -68 | -33.3 | 0 | 0 | 0 | 108.9 | Q25 E26 E27 | N23-Q25 PolarHBondContact O-N 3.27Å; N23-E26 WeakPolarHBondContact O-CB 3.36Å; N23-E26 PolarHBondContact O-N 3.42Å; N23-E27 PolarHBondContact O-N 3.09Å | ||
| 24 | G | 69.3 | Low | 78 | Confident | 47 Ų | 47 | 98.9 Ų | 98.9 | 49% | 0.485 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -55.2 | -14.6 | -167.4 | 0 | 0 | 0 | 0 | 0 | 116.9 | ||
| 25 | Q | 73.8 | Confident | 78.2 | Confident | 173 Ų | 173 | 102.7 Ų | 102.7 | 81% | 0.808 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -77.4 | -37.9 | 171.6 | -170 | 163.7 | -34.9 | 0 | 0 | 113.2 | N23 W29 | N23-Q25 PolarHBondContact O-N 3.27Å; Q25-W29 PolarHBondContact O-N 3.16Å |
| 26 | E | 78.3 | Confident | 78.6 | Confident | 98 Ų | 98 | 103.8 Ų | 103.8 | 46% | 0.458 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -70 | -33 | 174.8 | -86.3 | 176.4 | 74.6 | 0 | 0 | 111.7 | Q22 N23 K28 W29 C30 | Q22-E26 HydrophobicContact CB-CB 3.7Å; Q22-E26 HydrophobicContact CG-CB 4.02Å; Q22-E26 PolarHBondContact NE2-OE1 3.46Å; Q22-E26 PolarHBondContact OE1-O 2.96Å; N23-E26 WeakPolarHBondContact O-CB 3.36Å; N23-E26 PolarHBondContact O-N 3.42Å; E26-K28 PolarHBondContact O-N 3.5Å; E26-W29 PolarHBondContact O-N 3.41Å; E26-W29 VanDerWaalsContact O-N 3.12Å; E26-C30 WeakPolarHBondContact O-CB 3.49Å; E26-C30 PolarHBondContact O-N 2.85Å; E26-C30 PolarHBondContact O-SG 3.38Å; E26-C30 VanDerWaalsContact O-SG 3.36Å |
| 27 | E | 80.8 | Confident | 79 | Confident | 108 Ų | 108 | 103 Ų | 103 | 51% | 0.505 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -60.4 | -44.6 | 175.5 | -66.5 | -165.6 | 91.8 | 0 | 0 | 112.2 | Q22 N23 W29 C30 E31 | Q22-E27 HydrophobicContact CB-CG 3.93Å; N23-E27 PolarHBondContact O-N 3.09Å; E27-W29 VanDerWaalsContact C-N 3.26Å; E27-W29 PolarHBondContact O-N 2.83Å; E27-C30 PolarHBondContact O-N 3.25Å; E27-E31 PolarHBondContact O-N 3.29Å |
| 28 | K | 82.9 | Confident | 79.2 | Confident | 162 Ų | 162 | 98 Ų | 98 | 70% | 0.704 | 49% | 0.492 | S | S | * | . | H | α-helix | trans | -62.3 | -35.6 | 175.1 | -73.3 | -178.9 | -179.8 | 173.5 | 0 | 112.1 | E26 K32 | E26-K28 PolarHBondContact O-N 3.5Å; K28-K32 PolarHBondContact O-N 3.06Å |
| 29 | W | 84.4 | Confident | 79.6 | Confident | 197 Ų | 197 | 102.1 Ų | 102.1 | 75% | 0.746 | 51% | 0.51 | S | S | * | . | H | α-helix | trans | -72.7 | -41.6 | 178.6 | -142 | 79.6 | 0 | 0 | 0 | 111.4 | Q25 E26 E27 K32 A33 | Q25-W29 PolarHBondContact O-N 3.16Å; E26-W29 PolarHBondContact O-N 3.41Å; E26-W29 VanDerWaalsContact O-N 3.12Å; E27-W29 VanDerWaalsContact C-N 3.26Å; E27-W29 PolarHBondContact O-N 2.83Å; W29-K32 WeakPolarHBondContact O-CB 3.5Å; W29-K32 PolarHBondContact O-N 2.69Å; W29-A33 PolarHBondContact O-N 2.74Å |
| 30 | C | 86.2 | Confident | 80.3 | Confident | 28 Ų | 28 | 96.5 Ų | 96.5 | 19% | 0.189 | 49% | 0.486 | C | S | . | . | H | α-helix | trans | -62.9 | -43.5 | 174.1 | -75.1 | 0 | 0 | 0 | 0 | 112.5 | L15 K18 Q22 E26 E27 K32 A33 V34 | L15-C30 HydrophobicContact CD2-CB 4.2Å; K18-C30 HydrophobicContact CD-CB 4.36Å; Q22-C30 VanDerWaalsContact CD-SG 3.51Å; Q22-C30 PolarHBondContact NE2-SG 2.92Å; Q22-C30 PolarHBondContact OE1-SG 3.28Å; E26-C30 WeakPolarHBondContact O-CB 3.49Å; E26-C30 PolarHBondContact O-N 2.85Å; E26-C30 PolarHBondContact O-SG 3.38Å; E26-C30 VanDerWaalsContact O-SG 3.36Å; E27-C30 PolarHBondContact O-N 3.25Å; C30-K32 VanDerWaalsContact C-N 3.32Å; C30-K32 PolarHBondContact O-N 3.41Å; C30-A33 PolarHBondContact O-N 2.85Å; C30-V34 WeakPolarHBondContact O-CG2 3.36Å; C30-V34 PolarHBondContact O-N 3.24Å |
| 31 | E | 84.3 | Confident | 81.3 | Confident | 90 Ų | 90 | 94.1 Ų | 94.1 | 42% | 0.421 | 46% | 0.461 | S | S | . | . | H | α-helix | trans | -61 | -42.2 | 175.7 | -173.4 | 177.6 | 101 | 0 | 0 | 111.3 | L15 E27 K35 | L15-E31 HydrophobicContact CD1-CB 4.13Å; L15-E31 HydrophobicContact CD1-CG 4.02Å; E27-E31 PolarHBondContact O-N 3.29Å; E31-K35 WeakPolarHBondContact O-CB 3.09Å; E31-K35 PolarHBondContact O-N 3.45Å |
| 32 | K | 87.1 | Confident | 82.5 | Confident | 158 Ų | 158 | 92 Ų | 92 | 69% | 0.687 | 45% | 0.448 | S | S | * | . | H | α-helix | trans | -61.1 | -44.1 | 173.9 | -87.8 | -179.1 | 176.7 | 176.9 | 0 | 112.3 | K28 W29 C30 K35 S36 | K28-K32 PolarHBondContact O-N 3.06Å; W29-K32 WeakPolarHBondContact O-CB 3.5Å; W29-K32 PolarHBondContact O-N 2.69Å; C30-K32 VanDerWaalsContact C-N 3.32Å; C30-K32 PolarHBondContact O-N 3.41Å; K32-K35 PolarHBondContact O-N 3.29Å; K32-S36 WeakPolarHBondContact O-CB 3.23Å; K32-S36 PolarHBondContact O-N 2.93Å |
| 33 | A | 87.6 | Confident | 83.6 | Confident | 52 Ų | 52 | 99 Ų | 99 | 43% | 0.43 | 48% | 0.478 | S | S | . | . | H | α-helix | trans | -63.1 | -50.1 | 179.6 | 0 | 0 | 0 | 0 | 0 | 111.4 | W29 C30 K35 S36 L37 | W29-A33 PolarHBondContact O-N 2.74Å; C30-A33 PolarHBondContact O-N 2.85Å; A33-K35 PolarHBondContact O-N 3.32Å; A33-S36 PolarHBondContact O-N 2.85Å; A33-L37 WeakPolarHBondContact O-CB 3.37Å; A33-L37 PolarHBondContact O-N 2.73Å |
| 34 | V | 88.2 | Confident | 84.4 | Confident | 27 Ų | 27 | 96.3 Ų | 96.3 | 16% | 0.164 | 47% | 0.466 | C | S | . | . | H | α-helix | trans | -62.4 | -42.5 | 177.9 | 177 | 0 | 0 | 0 | 0 | 110.8 | V11 L14 L15 C30 S36 L37 V38 | V11-V34 HydrophobicContact CB-CG1 4.32Å; V11-V34 HydrophobicContact CG1-CB 4.42Å; V11-V34 HydrophobicContact CG1-CG1 3.89Å; V11-V34 HydrophobicContact CG2-CG1 4.4Å; L14-V34 HydrophobicContact CB-CG1 3.79Å; L14-V34 HydrophobicContact CD1-CG1 3.83Å; L14-V34 HydrophobicContact CG-CG1 4.49Å; L15-V34 HydrophobicContact CD2-CB 4.48Å; L15-V34 HydrophobicContact CD2-CG2 3.94Å; L15-V34 HydrophobicContact CG-CG2 4.39Å; C30-V34 WeakPolarHBondContact O-CG2 3.36Å; C30-V34 PolarHBondContact O-N 3.24Å; V34-S36 PolarHBondContact O-N 3.45Å; V34-L37 PolarHBondContact O-N 3.29Å; V34-V38 HydrophobicContact CG1-CG2 4.26Å; V34-V38 WeakPolarHBondContact O-CB 3.38Å; V34-V38 WeakPolarHBondContact O-CG2 3.3Å; V34-V38 PolarHBondContact O-N 2.84Å |
| 35 | K | 87 | Confident | 85.1 | Confident | 100 Ų | 100 | 96.8 Ų | 96.8 | 44% | 0.435 | 47% | 0.471 | S | S | . | . | H | α-helix | trans | -63.4 | -40.5 | 178.4 | -168.7 | 173.7 | -172.1 | 171.9 | 0 | 112 | E31 K32 A33 K39 | E31-K35 WeakPolarHBondContact O-CB 3.09Å; E31-K35 PolarHBondContact O-N 3.45Å; K32-K35 PolarHBondContact O-N 3.29Å; A33-K35 PolarHBondContact O-N 3.32Å; K35-K39 VanDerWaalsContact O-CB 3.28Å; K35-K39 WeakPolarHBondContact O-CB 3.36Å; K35-K39 PolarHBondContact O-N 2.99Å |
| 36 | S | 89 | Confident | 85.7 | Confident | 68 Ų | 68 | 90.3 Ų | 90.3 | 48% | 0.476 | 44% | 0.441 | S | S | . | . | H | α-helix | trans | -65.6 | -44.3 | 175.1 | -167 | 0 | 0 | 0 | 0 | 111.6 | K32 A33 V34 K39 K40 | K32-S36 WeakPolarHBondContact O-CB 3.23Å; K32-S36 PolarHBondContact O-N 2.93Å; A33-S36 PolarHBondContact O-N 2.85Å; V34-S36 PolarHBondContact O-N 3.45Å; S36-K39 PolarHBondContact O-N 3.29Å; S36-K40 PolarHBondContact O-N 3Å |
| 37 | L | 88.4 | Confident | 86.1 | Confident | 52 Ų | 52 | 87.2 Ų | 87.2 | 27% | 0.272 | 43% | 0.427 | S | S | . | . | H | α-helix | trans | -60 | -53.4 | 176.3 | -177.6 | 70.3 | 0 | 0 | 0 | 111.1 | A33 V34 K39 K40 L41 L50 I66 | A33-L37 WeakPolarHBondContact O-CB 3.37Å; A33-L37 PolarHBondContact O-N 2.73Å; V34-L37 PolarHBondContact O-N 3.29Å; L37-K39 VanDerWaalsContact C-N 3.26Å; L37-K39 PolarHBondContact O-N 3.46Å; L37-K40 PolarHBondContact O-N 3.02Å; L37-L41 HydrophobicContact CD1-CD1 4.18Å; L37-L41 HydrophobicContact CD1-CG 4.27Å; L37-L41 HydrophobicContact CD2-CD1 4.44Å; L37-L41 HydrophobicContact CG-CD1 3.92Å; L37-L41 HydrophobicContact CG-CG 4.3Å; L37-L41 WeakPolarHBondContact O-CG 3.41Å; L37-L41 PolarHBondContact O-N 3.43Å; L37-L50 HydrophobicContact CD2-CD2 3.95Å; L37-L50 HydrophobicContact CG-CD2 4.5Å; L37-I66 HydrophobicContact CD1-CD1 3.35Å; L37-I66 HydrophobicContact CD1-CG1 4.15Å |
| 38 | V | 87.3 | Confident | 86.3 | Confident | 6 Ų | 6 | 87.9 Ų | 87.9 | 4% | 0.036 | 43% | 0.434 | C | S | . | . | H | α-helix | trans | -55.9 | -41.4 | 176.8 | 163.2 | 0 | 0 | 0 | 0 | 111.3 | I10 V11 L14 V34 K40 L41 K42 L47 | I10-V38 HydrophobicContact CG1-CG2 4.39Å; I10-V38 HydrophobicContact CG2-CG1 3.68Å; I10-V38 HydrophobicContact CG2-CG2 4.01Å; V11-V38 HydrophobicContact CG2-CB 4.09Å; V11-V38 HydrophobicContact CG2-CG1 4.1Å; V11-V38 HydrophobicContact CG2-CG2 3.87Å; L14-V38 HydrophobicContact CD1-CG2 3.66Å; V34-V38 HydrophobicContact CG1-CG2 4.26Å; V34-V38 WeakPolarHBondContact O-CB 3.38Å; V34-V38 WeakPolarHBondContact O-CG2 3.3Å; V34-V38 PolarHBondContact O-N 2.84Å; V38-K40 VanDerWaalsContact C-N 3.33Å; V38-K40 PolarHBondContact O-N 3.27Å; V38-L41 PolarHBondContact O-N 3.2Å; V38-K42 WeakPolarHBondContact O-CB 3.46Å; V38-K42 PolarHBondContact O-N 3.17Å; V38-L47 HydrophobicContact CB-CD1 4.13Å; V38-L47 HydrophobicContact CG1-CD1 3.76Å; V38-L47 HydrophobicContact CG2-CD1 4.03Å |
| 39 | K | 87.8 | Confident | 86.5 | Confident | 151 Ų | 151 | 82.7 Ų | 82.7 | 66% | 0.657 | 41% | 0.412 | S | S | * | . | H | α-helix | trans | -64.6 | -36.9 | 177.7 | -168.9 | 175.8 | -177.5 | 178.8 | 0 | 112.2 | K35 S36 L37 | K35-K39 VanDerWaalsContact O-CB 3.28Å; K35-K39 WeakPolarHBondContact O-CB 3.36Å; K35-K39 PolarHBondContact O-N 2.99Å; S36-K39 PolarHBondContact O-N 3.29Å; L37-K39 VanDerWaalsContact C-N 3.26Å; L37-K39 PolarHBondContact O-N 3.46Å |
| 40 | K | 88.3 | Confident | 86.5 | Confident | 93 Ų | 93 | 74 Ų | 74 | 40% | 0.404 | 38% | 0.381 | S | S | . | . | H | α-helix | trans | -70.8 | -46.6 | 174.1 | -73.2 | -167.5 | 178.5 | -162.7 | 0 | 111.6 | S36 L37 V38 K42 K43 T44 I66 | S36-K40 PolarHBondContact O-N 3Å; L37-K40 PolarHBondContact O-N 3.02Å; V38-K40 VanDerWaalsContact C-N 3.33Å; V38-K40 PolarHBondContact O-N 3.27Å; K40-K42 VanDerWaalsContact C-N 3.32Å; K40-K42 PolarHBondContact O-N 3.23Å; K40-K43 WeakPolarHBondContact O-CB 3.21Å; K40-K43 PolarHBondContact O-N 3.47Å; K40-T44 PolarHBondContact O-N 3.05Å; K40-I66 HydrophobicContact CB-CG2 4.38Å; K40-I66 HydrophobicContact CD-CG2 3.32Å; K40-I66 HydrophobicContact CG-CG2 4.48Å |
| 41 | L | 87.1 | Confident | 86.5 | Confident | 1 Ų | 1 | 75.4 Ų | 75.4 | 1% | 0.005 | 38% | 0.384 | C | S | . | . | H | α-helix | trans | -68.5 | -30.2 | -179 | -62.3 | -178.1 | 0 | 0 | 0 | 113.4 | L37 V38 K43 T44 G45 Q46 L47 L50 I64 | L37-L41 HydrophobicContact CD1-CD1 4.18Å; L37-L41 HydrophobicContact CD1-CG 4.27Å; L37-L41 HydrophobicContact CD2-CD1 4.44Å; L37-L41 HydrophobicContact CG-CD1 3.92Å; L37-L41 HydrophobicContact CG-CG 4.3Å; L37-L41 WeakPolarHBondContact O-CG 3.41Å; L37-L41 PolarHBondContact O-N 3.43Å; V38-L41 PolarHBondContact O-N 3.2Å; L41-K43 PolarHBondContact O-N 3.39Å; L41-T44 WeakPolarHBondContact CA-OG1 3.41Å; L41-T44 CarbonylContact O-C 3.59Å; L41-T44 PolarHBondContact O-N 3.45Å; L41-T44 PolarHBondContact O-OG1 3.41Å; L41-G45 PolarHBondContact O-N 2.85Å; L41-Q46 HydrophobicContact CD2-CB 4.15Å; L41-Q46 PolarHBondContact O-N 3.41Å; L41-Q46 VanDerWaalsContact O-N 3.09Å; L41-L47 HydrophobicContact CB-CD1 4.22Å; L41-L50 HydrophobicContact CD1-CB 3.84Å; L41-L50 HydrophobicContact CD1-CD2 3.35Å; L41-L50 HydrophobicContact CD1-CG 4.09Å; L41-I64 HydrophobicContact CD1-CG2 3.66Å; L41-I64 HydrophobicContact CD2-CG2 3.35Å; L41-I64 HydrophobicContact CG-CG2 4.14Å |
| 42 | K | 84.8 | Confident | 86.6 | Confident | 160 Ų | 160 | 77 Ų | 77 | 70% | 0.696 | 39% | 0.39 | S | S | * | . | H | α-helix | trans | -64.9 | -28.5 | 172.2 | -169.1 | 172.2 | -176.7 | 178 | 0 | 112.2 | V38 K40 | V38-K42 WeakPolarHBondContact O-CB 3.46Å; V38-K42 PolarHBondContact O-N 3.17Å; K40-K42 VanDerWaalsContact C-N 3.32Å; K40-K42 PolarHBondContact O-N 3.23Å |
| 43 | K | 85.6 | Confident | 86.6 | Confident | 184 Ų | 184 | 70.3 Ų | 70.3 | 80% | 0.8 | 36% | 0.364 | S | S | * | . | H | α-helix | trans | -75.3 | -34.6 | 173.3 | -71.9 | -173.5 | 173.4 | -168.5 | 0 | 112.5 | K40 L41 | K40-K43 WeakPolarHBondContact O-CB 3.21Å; K40-K43 PolarHBondContact O-N 3.47Å; L41-K43 PolarHBondContact O-N 3.39Å |
| 44 | T | 84.1 | Confident | 86.5 | Confident | 67 Ų | 67 | 70.6 Ų | 70.6 | 41% | 0.411 | 36% | 0.358 | S | S | . | . | H | α-helix | trans | -88.6 | -9.8 | 179.2 | 61 | 0 | 0 | 0 | 0 | 113.6 | K40 L41 Q46 | K40-T44 PolarHBondContact O-N 3.05Å; L41-T44 WeakPolarHBondContact CA-OG1 3.41Å; L41-T44 CarbonylContact O-C 3.59Å; L41-T44 PolarHBondContact O-N 3.45Å; L41-T44 PolarHBondContact O-OG1 3.41Å; T44-Q46 VanDerWaalsContact C-N 3.28Å; T44-Q46 PolarHBondContact O-N 3.06Å; T44-Q46 PolarHBondContact OG1-OE1 3Å |
| 45 | G | 85.4 | Confident | 86.3 | Confident | 57 Ų | 57 | 72.1 Ų | 72.1 | 59% | 0.588 | 37% | 0.367 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 74.3 | 14.3 | -176.7 | 0 | 0 | 0 | 0 | 0 | 114.1 | L41 L47 | L41-G45 PolarHBondContact O-N 2.85Å; G45-L47 VanDerWaalsContact C-N 3.32Å |
| 46 | Q | 86.3 | Confident | 86.2 | Confident | 37 Ų | 37 | 71.2 Ų | 71.2 | 17% | 0.173 | 37% | 0.37 | C | S | . | . | trans | -93.8 | 14.1 | -177.6 | -67 | 172.3 | -71 | 0 | 0 | 113.1 | L41 T44 E49 L50 C63 T65 | L41-Q46 HydrophobicContact CD2-CB 4.15Å; L41-Q46 PolarHBondContact O-N 3.41Å; L41-Q46 VanDerWaalsContact O-N 3.09Å; T44-Q46 VanDerWaalsContact C-N 3.28Å; T44-Q46 PolarHBondContact O-N 3.06Å; T44-Q46 PolarHBondContact OG1-OE1 3Å; Q46-E49 PolarHBondContact O-N 3.37Å; Q46-L50 PolarHBondContact O-N 3.44Å; Q46-L50 VanDerWaalsContact O-N 3.16Å; Q46-C63 PolarHBondContact NE2-O 2.78Å; Q46-T65 PolarHBondContact NE2-OG1 2.97Å; Q46-T65 PolarHBondContact OE1-O 2.96Å; Q46-T65 VanDerWaalsContact OE1-O 3.13Å; Q46-T65 PolarHBondContact OE1-OG1 2.92Å | ||
| 47 | L | 85.1 | Confident | 85.8 | Confident | 33 Ų | 33 | 75 Ų | 75 | 17% | 0.173 | 38% | 0.381 | C | S | . | . | H | α-helix | trans | -66.4 | -45.8 | -176.8 | -167.3 | 81.7 | 0 | 0 | 0 | 111.8 | I10 V38 L41 G45 E49 L50 E51 | I10-L47 HydrophobicContact CB-CD2 4.42Å; I10-L47 HydrophobicContact CD1-CD2 4.47Å; I10-L47 HydrophobicContact CD1-CG 4.24Å; I10-L47 HydrophobicContact CG1-CD1 4.05Å; I10-L47 HydrophobicContact CG1-CD2 4.23Å; I10-L47 HydrophobicContact CG1-CG 4.07Å; I10-L47 HydrophobicContact CG2-CD1 4.34Å; I10-L47 HydrophobicContact CG2-CD2 4.18Å; V38-L47 HydrophobicContact CB-CD1 4.13Å; V38-L47 HydrophobicContact CG1-CD1 3.76Å; V38-L47 HydrophobicContact CG2-CD1 4.03Å; L41-L47 HydrophobicContact CB-CD1 4.22Å; G45-L47 VanDerWaalsContact C-N 3.32Å; L47-E49 VanDerWaalsContact C-N 3.29Å; L47-E49 PolarHBondContact O-N 3.38Å; L47-L50 PolarHBondContact O-N 2.92Å; L47-E51 PolarHBondContact O-N 3.45Å |
| 48 | D | 85.7 | Confident | 85.4 | Confident | 123 Ų | 123 | 75.8 Ų | 75.8 | 66% | 0.658 | 39% | 0.385 | S | S | * | . | H | α-helix | trans | -61 | -39.2 | 178.1 | -66.4 | -98.6 | 0 | 0 | 0 | 111.9 | E51 K52 | D48-E51 WeakPolarHBondContact O-CB 3.28Å; D48-E51 PolarHBondContact O-N 3.27Å; D48-K52 WeakPolarHBondContact O-CB 3.06Å; D48-K52 PolarHBondContact O-N 2.81Å |
| 49 | E | 86.3 | Confident | 85.2 | Confident | 52 Ų | 52 | 83.2 Ų | 83.2 | 24% | 0.243 | 42% | 0.422 | C | S | . | . | H | α-helix | trans | -66.5 | -41.1 | 178.5 | -141.8 | 92.8 | 91.5 | 0 | 0 | 111.1 | Q46 L47 K52 A53 K62 | Q46-E49 PolarHBondContact O-N 3.37Å; L47-E49 VanDerWaalsContact C-N 3.29Å; L47-E49 PolarHBondContact O-N 3.38Å; E49-K52 PolarHBondContact O-N 2.98Å; E49-A53 VanDerWaalsContact O-CB 3.3Å; E49-A53 WeakPolarHBondContact O-CB 3.48Å; E49-A53 PolarHBondContact O-N 3.44Å; E49-K62 HydrophobicContact CG-CB 3.94Å; E49-K62 HydrophobicContact CG-CG 4.46Å; E49-K62 WeakPolarHBondContact OE1-CD 3.5Å; E49-K62 IonicContact OE1-NZ 3.6Å |
| 50 | L | 86.2 | Confident | 85.1 | Confident | 15 Ų | 15 | 82.6 Ų | 82.6 | 8% | 0.079 | 43% | 0.427 | C | S | . | . | H | α-helix | trans | -61.6 | -45.6 | 171.6 | 174.8 | 70 | 0 | 0 | 0 | 111.4 | L14 L37 L41 Q46 L47 K52 A53 I54 I64 | L14-L50 HydrophobicContact CD1-CD2 3.68Å; L14-L50 HydrophobicContact CD2-CD2 4.07Å; L14-L50 HydrophobicContact CD2-CG 4.11Å; L37-L50 HydrophobicContact CD2-CD2 3.95Å; L37-L50 HydrophobicContact CG-CD2 4.5Å; L41-L50 HydrophobicContact CD1-CB 3.84Å; L41-L50 HydrophobicContact CD1-CD2 3.35Å; L41-L50 HydrophobicContact CD1-CG 4.09Å; Q46-L50 PolarHBondContact O-N 3.44Å; Q46-L50 VanDerWaalsContact O-N 3.16Å; L47-L50 PolarHBondContact O-N 2.92Å; L50-K52 VanDerWaalsContact C-N 3.3Å; L50-K52 PolarHBondContact O-N 3.36Å; L50-A53 PolarHBondContact O-N 2.8Å; L50-I54 HydrophobicContact CD1-CD1 4.44Å; L50-I54 HydrophobicContact CD1-CG1 3.98Å; L50-I54 HydrophobicContact CG-CG1 4.47Å; L50-I54 VanDerWaalsContact O-CG1 3.32Å; L50-I54 WeakPolarHBondContact O-CG1 3.29Å; L50-I54 PolarHBondContact O-N 2.88Å; L50-I64 HydrophobicContact CB-CD1 3.82Å; L50-I64 HydrophobicContact CB-CG1 4.41Å; L50-I64 HydrophobicContact CD1-CD1 3.67Å; L50-I64 HydrophobicContact CG-CD1 4.36Å |
| 51 | E | 84.9 | Confident | 84.9 | Confident | 57 Ų | 57 | 80 Ų | 80 | 27% | 0.266 | 42% | 0.418 | S | S | . | . | H | α-helix | trans | -59 | -46 | 179.4 | -162.5 | -172.3 | 106.4 | 0 | 0 | 111.4 | I10 R13 L47 D48 I54 T55 | I10-E51 HydrophobicContact CD1-CB 3.61Å; I10-E51 HydrophobicContact CD1-CG 3.54Å; I10-E51 WeakPolarHBondContact CD1-OE2 3.31Å; R13-E51 IonicContact CZ-OE1 3.11Å; R13-E51 IonicContact CZ-OE2 3.46Å; R13-E51 IonicContact NH1-OE1 2.73Å; R13-E51 PolarHBondContact NH1-OE1 3.22Å; R13-E51 IonicContact NH1-OE2 2.85Å; R13-E51 PolarHBondContact NH1-OE2 2.92Å; R13-E51 IonicContact NH2-OE1 2.74Å; R13-E51 PolarHBondContact NH2-OE1 2.87Å; R13-E51 IonicContact NH2-OE2 3.79Å; L47-E51 PolarHBondContact O-N 3.45Å; D48-E51 WeakPolarHBondContact O-CB 3.28Å; D48-E51 PolarHBondContact O-N 3.27Å; E51-I54 PolarHBondContact O-N 3.19Å; E51-T55 VanDerWaalsContact O-CB 3.3Å; E51-T55 WeakPolarHBondContact O-CB 3.41Å; E51-T55 PolarHBondContact O-N 2.88Å; E51-T55 PolarHBondContact O-OG1 3.32Å |
| 52 | K | 86.1 | Confident | 84.8 | Confident | 124 Ų | 124 | 86.9 Ų | 86.9 | 54% | 0.539 | 45% | 0.448 | S | S | . | . | H | α-helix | trans | -64.6 | -43.9 | 178 | -171.4 | 177.1 | -179.8 | -179.6 | 0 | 111.4 | D48 E49 L50 I54 T55 T56 | D48-K52 WeakPolarHBondContact O-CB 3.06Å; D48-K52 PolarHBondContact O-N 2.81Å; E49-K52 PolarHBondContact O-N 2.98Å; L50-K52 VanDerWaalsContact C-N 3.3Å; L50-K52 PolarHBondContact O-N 3.36Å; K52-I54 VanDerWaalsContact C-N 3.33Å; K52-I54 PolarHBondContact O-N 3.12Å; K52-T55 PolarHBondContact O-N 3.41Å; K52-T56 WeakPolarHBondContact O-CB 3.48Å; K52-T56 PolarHBondContact O-N 2.87Å; K52-T56 PolarHBondContact O-OG1 3.47Å |
| 53 | A | 87.5 | Confident | 84.9 | Confident | 17 Ų | 17 | 84.3 Ų | 84.3 | 14% | 0.14 | 45% | 0.449 | C | S | . | . | H | α-helix | trans | -58 | -45.3 | 178.3 | 0 | 0 | 0 | 0 | 0 | 112.2 | E49 L50 Q57 T61 I64 | E49-A53 VanDerWaalsContact O-CB 3.3Å; E49-A53 WeakPolarHBondContact O-CB 3.48Å; E49-A53 PolarHBondContact O-N 3.44Å; L50-A53 PolarHBondContact O-N 2.8Å; A53-Q57 VanDerWaalsContact O-CA 3.28Å; A53-Q57 WeakPolarHBondContact O-CA 3.4Å; A53-Q57 PolarHBondContact O-N 3.22Å; A53-T61 HydrophobicContact CB-CG2 3.79Å; A53-T61 WeakPolarHBondContact CB-OG1 3.12Å; A53-I64 HydrophobicContact CB-CD1 4.23Å |
| 54 | I | 85.6 | Confident | 85 | Confident | 59 Ų | 59 | 78.1 Ų | 78.1 | 30% | 0.303 | 43% | 0.425 | S | S | . | . | H | α-helix | trans | -73.2 | -43.4 | -179.5 | -61.3 | -61.9 | 0 | 0 | 0 | 111.5 | L14 W17 L50 E51 K52 Q57 | L14-I54 HydrophobicContact CD2-CB 4.23Å; L14-I54 HydrophobicContact CD2-CG1 3.79Å; L14-I54 HydrophobicContact CD2-CG2 4.32Å; W17-I54 HydrophobicContact CB-CG2 3.42Å; W17-I54 VanDerWaalsContact CB-CG2 3.42Å; W17-I54 VanDerWaalsContact CD1-CG2 3.45Å; W17-I54 HydrophobicContact CD2-CG2 3.68Å; W17-I54 HydrophobicContact CE3-CG2 4.36Å; W17-I54 HydrophobicContact CG-CG2 3.23Å; L50-I54 HydrophobicContact CD1-CD1 4.44Å; L50-I54 HydrophobicContact CD1-CG1 3.98Å; L50-I54 HydrophobicContact CG-CG1 4.47Å; L50-I54 VanDerWaalsContact O-CG1 3.32Å; L50-I54 WeakPolarHBondContact O-CG1 3.29Å; L50-I54 PolarHBondContact O-N 2.88Å; E51-I54 PolarHBondContact O-N 3.19Å; K52-I54 VanDerWaalsContact C-N 3.33Å; K52-I54 PolarHBondContact O-N 3.12Å; I54-Q57 WeakPolarHBondContact O-CG 3.48Å |
| 55 | T | 83.8 | Confident | 85.1 | Confident | 59 Ų | 59 | 78.9 Ų | 78.9 | 36% | 0.362 | 43% | 0.429 | S | S | . | . | H | α-helix | trans | -73.1 | -40.8 | -176 | -47.3 | 0 | 0 | 0 | 0 | 112.1 | W17 E51 K52 | W17-T55 HydrophobicContact CZ2-CG2 4.02Å; E51-T55 VanDerWaalsContact O-CB 3.3Å; E51-T55 WeakPolarHBondContact O-CB 3.41Å; E51-T55 PolarHBondContact O-N 2.88Å; E51-T55 PolarHBondContact O-OG1 3.32Å; K52-T55 PolarHBondContact O-N 3.41Å |
| 56 | T | 85.8 | Confident | 85.1 | Confident | 80 Ų | 80 | 80.1 Ų | 80.1 | 49% | 0.491 | 42% | 0.421 | S | S | . | . | H | α-helix | trans | -85.8 | -14.2 | -179.6 | -44.9 | 0 | 0 | 0 | 0 | 112.2 | K52 N58 | K52-T56 WeakPolarHBondContact O-CB 3.48Å; K52-T56 PolarHBondContact O-N 2.87Å; K52-T56 PolarHBondContact O-OG1 3.47Å; T56-N58 HydrophobicContact CG2-CB 3.86Å; T56-N58 PolarHBondContact O-N 3.29Å; T56-N58 VanDerWaalsContact O-N 3.09Å |
| 57 | Q | 80.1 | Confident | 84.7 | Confident | 149 Ų | 149 | 82.7 Ų | 82.7 | 70% | 0.696 | 44% | 0.441 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 48.7 | 36.1 | -175.2 | -60.2 | 174.8 | 40.4 | 0 | 0 | 112.2 | A53 I54 | A53-Q57 VanDerWaalsContact O-CA 3.28Å; A53-Q57 WeakPolarHBondContact O-CA 3.4Å; A53-Q57 PolarHBondContact O-N 3.22Å; I54-Q57 WeakPolarHBondContact O-CG 3.48Å |
| 58 | N | 80.8 | Confident | 84.3 | Confident | 67 Ų | 67 | 96.3 Ų | 96.3 | 36% | 0.358 | 49% | 0.491 | S | S | . | . | trans | -98.5 | 127.7 | -171.7 | -164.2 | -40.9 | 0 | 0 | 0 | 110 | T56 N60 T61 | T56-N58 HydrophobicContact CG2-CB 3.86Å; T56-N58 PolarHBondContact O-N 3.29Å; T56-N58 VanDerWaalsContact O-N 3.09Å; N58-N60 PolarHBondContact O-N 3.42Å; N58-N60 VanDerWaalsContact OD1-CB 3.31Å; N58-N60 WeakPolarHBondContact OD1-CB 3.32Å; N58-N60 PolarHBondContact OD1-N 2.81Å; N58-N60 PolarHBondContact OD1-ND2 3.34Å; N58-T61 HydrophobicContact CB-CG2 4.35Å; N58-T61 PolarHBondContact O-OG1 2.93Å | ||
| 59 | I | 81.7 | Confident | 84.2 | Confident | 162 Ų | 162 | 95 Ų | 95 | 83% | 0.831 | 48% | 0.482 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -73.1 | -15.3 | 179.8 | -156.8 | 156.3 | 0 | 0 | 0 | 113.3 | T61 | I59-T61 VanDerWaalsContact C-N 3.31Å; I59-T61 PolarHBondContact O-N 2.96Å |
| 60 | N | 85.5 | Confident | 84.1 | Confident | 139 Ų | 139 | 97.3 Ų | 97.3 | 74% | 0.743 | 50% | 0.495 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -87.4 | 7.9 | -179.6 | -57.4 | -75.5 | 0 | 0 | 0 | 113.5 | N58 | N58-N60 PolarHBondContact O-N 3.42Å; N58-N60 VanDerWaalsContact OD1-CB 3.31Å; N58-N60 WeakPolarHBondContact OD1-CB 3.32Å; N58-N60 PolarHBondContact OD1-N 2.81Å; N58-N60 PolarHBondContact OD1-ND2 3.34Å |
| 61 | T | 85.3 | Confident | 84 | Confident | 38 Ų | 38 | 101.8 Ų | 101.8 | 23% | 0.233 | 52% | 0.518 | C | S | . | . | S | Bend | trans | -68.5 | 149.3 | 173.7 | 53.4 | 0 | 0 | 0 | 0 | 111.5 | A53 N58 I59 | A53-T61 HydrophobicContact CB-CG2 3.79Å; A53-T61 WeakPolarHBondContact CB-OG1 3.12Å; N58-T61 HydrophobicContact CB-CG2 4.35Å; N58-T61 PolarHBondContact O-OG1 2.93Å; I59-T61 VanDerWaalsContact C-N 3.31Å; I59-T61 PolarHBondContact O-N 2.96Å |
| 62 | K | 85.3 | Confident | 83.9 | Confident | 146 Ų | 146 | 104.5 Ų | 104.5 | 64% | 0.635 | 53% | 0.533 | S | S | * | . | P | Polyproline II helix | trans | -63.1 | 153.8 | 179.9 | -57.2 | -169.2 | -162.6 | 153.6 | 0 | 111.6 | E49 I64 | E49-K62 HydrophobicContact CG-CB 3.94Å; E49-K62 HydrophobicContact CG-CG 4.46Å; E49-K62 WeakPolarHBondContact OE1-CD 3.5Å; E49-K62 IonicContact OE1-NZ 3.6Å; K62-I64 PolarHBondContact O-N 3.37Å |
| 63 | C | 86.4 | Confident | 83.8 | Confident | 106 Ų | 106 | 103.3 Ų | 103.3 | 72% | 0.716 | 53% | 0.532 | S | S | * | . | P | Polyproline II helix | trans | -60.1 | 128 | 177 | -63.2 | 0 | 0 | 0 | 0 | 111.2 | Q46 T65 | Q46-C63 PolarHBondContact NE2-O 2.78Å; C63-T65 HydrophobicContact CB-CG2 4.37Å |
| 64 | I | 87.6 | Confident | 83.5 | Confident | 54 Ų | 54 | 109 Ų | 109 | 28% | 0.277 | 56% | 0.558 | S | S | . | * | trans | -94.1 | 101.5 | 175.6 | -60.2 | 153.8 | 0 | 0 | 0 | 106.8 | L41 L50 A53 K62 | L41-I64 HydrophobicContact CD1-CG2 3.66Å; L41-I64 HydrophobicContact CD2-CG2 3.35Å; L41-I64 HydrophobicContact CG-CG2 4.14Å; L50-I64 HydrophobicContact CB-CD1 3.82Å; L50-I64 HydrophobicContact CB-CG1 4.41Å; L50-I64 HydrophobicContact CD1-CD1 3.67Å; L50-I64 HydrophobicContact CG-CD1 4.36Å; A53-I64 HydrophobicContact CB-CD1 4.23Å; K62-I64 PolarHBondContact O-N 3.37Å | ||
| 65 | T | 85.6 | Confident | 83.4 | Confident | 83 Ų | 83 | 112.6 Ų | 112.6 | 51% | 0.509 | 58% | 0.577 | S | S | . | * | trans | -97.4 | 138.1 | -171.3 | 49.7 | 0 | 0 | 0 | 0 | 111.2 | Q46 C63 | Q46-T65 PolarHBondContact NE2-OG1 2.97Å; Q46-T65 PolarHBondContact OE1-O 2.96Å; Q46-T65 VanDerWaalsContact OE1-O 3.13Å; Q46-T65 PolarHBondContact OE1-OG1 2.92Å; C63-T65 HydrophobicContact CB-CG2 4.37Å | ||
| 66 | I | 84.6 | Confident | 83.3 | Confident | 82 Ų | 82 | 116.7 Ų | 116.7 | 42% | 0.421 | 59% | 0.593 | S | S | . | * | trans | -123.8 | 132.6 | 177.6 | -43.3 | 170.7 | 0 | 0 | 0 | 106.8 | L37 K40 R68 | L37-I66 HydrophobicContact CD1-CD1 3.35Å; L37-I66 HydrophobicContact CD1-CG1 4.15Å; K40-I66 HydrophobicContact CB-CG2 4.38Å; K40-I66 HydrophobicContact CD-CG2 3.32Å; K40-I66 HydrophobicContact CG-CG2 4.48Å; I66-R68 PolarHBondContact O-N 3.27Å | ||
| 67 | P | 78.3 | Confident | 83.1 | Confident | 92 Ų | 92 | 119.8 Ų | 119.8 | 60% | 0.597 | 60% | 0.602 | S | S | * | * | trans | -57.5 | 131.9 | 173.7 | 21.8 | -31.4 | 0 | 0 | 0 | 109.7 | ||||
| 68 | R | 76.4 | Confident | 83.4 | Confident | 319 Ų | 319 | 117.1 Ų | 117.1 | 100% | 1.204 | 59% | 0.593 | S | S | * | * | trans | -75.2 | 0 | -174.3 | -146.6 | -173.6 | 118.3 | 116.3 | 3.2 | 111.7 | I66 | I66-R68 PolarHBondContact O-N 3.27Š|
Retrieved 68 of 68 residues in 13.3 ms
(Link to these results)