| Site | Residue | pLDDT | pLDDT confidence | pLDDT10 | pLDDT10 confidence | SASA | SASA [Ų] | SASA10 | SASA10 [Ų] | RSA | RSA unformatted | RSA10 | RSA10 unformatted | Surface | Surface10 (not used) | Disorder (not used) | Disorder | Sec. str. | Secondary structure | Isomer | Phi (φ) | Psi (ψ) | Omega (ω) | Chi 1 (χ1) | Chi 2 (χ2) | Chi 3 (χ3) | Chi 4 (χ4) | Chi 5 (χ5) | Tau (τ) | Contacts (colored by PAE) | Contact details |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 1 | M | 47.8 | Very low | 59.6 | Low | 224 Ų | 224 | 123.2 Ų | 123.2 | 100% | 1.103 | 72% | 0.716 | S | S | * | * | 0 | 97.3 | 0 | -68.7 | 177.4 | -131.8 | 0 | 0 | 105.9 | |||||
| 2 | T | 51.5 | Low | 60.3 | Low | 99 Ų | 99 | 122.6 Ų | 122.6 | 61% | 0.607 | 72% | 0.724 | S | S | * | * | B | Isolated β-bridge | trans | -112.9 | 124.8 | -159.1 | 44.3 | 0 | 0 | 0 | 0 | 110.5 | ||
| 3 | N | 62.2 | Low | 61 | Low | 105 Ų | 105 | 122 Ų | 122 | 56% | 0.561 | 72% | 0.715 | S | S | * | * | trans | -66 | 152.6 | 160.1 | -63.1 | -8.3 | 0 | 0 | 0 | 107.4 | L5 G6 | N3-L5 PolarHBondContact O-N 2.69Å; N3-G6 PolarHBondContact O-N 3.24Å | ||
| 4 | G | 63.2 | Low | 62.4 | Low | 90 Ų | 90 | 117.7 Ų | 117.7 | 93% | 0.928 | 70% | 0.695 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -59.6 | 14.1 | -169.3 | 0 | 0 | 0 | 0 | 0 | 118.4 | ||
| 5 | L | 67.5 | Low | 63.8 | Low | 148 Ų | 148 | 118.9 Ų | 118.9 | 78% | 0.775 | 70% | 0.696 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -112.2 | 1.8 | 172.1 | -67.5 | 171.9 | 0 | 0 | 0 | 113.4 | N3 E7 | N3-L5 PolarHBondContact O-N 2.69Å; L5-E7 HydrophobicContact CB-CG 4.3Å; L5-E7 PolarHBondContact O-N 3.27Å |
| 6 | G | 61 | Low | 65 | Low | 54 Ų | 54 | 121.4 Ų | 121.4 | 56% | 0.557 | 70% | 0.696 | S | S | * | * | trans | 74.7 | 4.1 | -176.8 | 0 | 0 | 0 | 0 | 0 | 114.1 | N3 I8 | N3-G6 PolarHBondContact O-N 3.24Å; G6-I8 PolarHBondContact O-N 3.1Å | ||
| 7 | E | 62.6 | Low | 66.3 | Low | 131 Ų | 131 | 117.6 Ų | 117.6 | 61% | 0.612 | 68% | 0.675 | S | S | * | * | trans | -71.3 | 118.6 | 174.1 | -64.9 | -175.8 | 111.5 | 0 | 0 | 109.8 | L5 Y9 | L5-E7 HydrophobicContact CB-CG 4.3Å; L5-E7 PolarHBondContact O-N 3.27Å; E7-Y9 PolarHBondContact O-N 3.24Å | ||
| 8 | I | 61 | Low | 67.3 | Low | 139 Ų | 139 | 115.8 Ų | 115.8 | 71% | 0.713 | 66% | 0.662 | S | S | * | * | B | Isolated β-bridge | trans | -72.6 | 114.3 | 169.9 | -61.2 | 174.2 | 0 | 0 | 0 | 106.5 | G6 A10 | G6-I8 PolarHBondContact O-N 3.1Å; I8-A10 VanDerWaalsContact C-N 3.26Å; I8-A10 PolarHBondContact O-N 2.94Å |
| 9 | Y | 52.8 | Low | 68.4 | Low | 187 Ų | 187 | 117.7 Ų | 117.7 | 73% | 0.733 | 66% | 0.662 | S | S | * | * | trans | -66.7 | 88.5 | 168.8 | -155.8 | -90.6 | 0 | 0 | 0 | 108.2 | E7 P11 | E7-Y9 PolarHBondContact O-N 3.24Å; Y9-P11 WeakPolarHBondContact O-CD 3.49Å | ||
| 10 | A | 60.9 | Low | 69.4 | Low | 76 Ų | 76 | 116.3 Ų | 116.3 | 63% | 0.628 | 65% | 0.649 | S | S | * | * | trans | -79.9 | 113.9 | 166.5 | 0 | 0 | 0 | 0 | 0 | 106.7 | I8 S12 | I8-A10 VanDerWaalsContact C-N 3.26Å; I8-A10 PolarHBondContact O-N 2.94Å; A10-S12 PolarHBondContact O-N 3.34Å | ||
| 11 | P | 65.2 | Low | 70.2 | Confident | 102 Ų | 102 | 114 Ų | 114 | 66% | 0.662 | 64% | 0.638 | S | S | * | * | trans | -55.9 | 120.4 | 172.7 | 21.7 | -29.8 | 0 | 0 | 0 | 107.5 | Y9 L13 | Y9-P11 WeakPolarHBondContact O-CD 3.49Å; P11-L13 PolarHBondContact O-N 2.88Å | ||
| 12 | S | 68.1 | Low | 72.1 | Confident | 116 Ų | 116 | 109.6 Ų | 109.6 | 81% | 0.811 | 61% | 0.613 | S | S | * | * | trans | -59.8 | 104.7 | 176.3 | 48.8 | 0 | 0 | 0 | 0 | 107.8 | A10 S14 | A10-S12 PolarHBondContact O-N 3.34Å; S12-S14 PolarHBondContact O-N 3.18Å; S12-S14 VanDerWaalsContact O-N 3.1Å | ||
| 13 | L | 69.6 | Low | 73.9 | Confident | 115 Ų | 115 | 107.9 Ų | 107.9 | 60% | 0.602 | 61% | 0.605 | S | S | * | * | trans | -55.8 | 119.8 | 169.2 | -77.8 | 158.9 | 0 | 0 | 0 | 106.7 | P11 V17 I18 | P11-L13 PolarHBondContact O-N 2.88Å; L13-V17 HydrophobicContact CD2-CB 4.19Å; L13-V17 HydrophobicContact CD2-CG1 3.51Å; L13-I18 HydrophobicContact CB-CD1 4.15Å; L13-I18 HydrophobicContact CB-CG1 3.8Å | ||
| 14 | S | 81 | Confident | 75 | Confident | 62 Ų | 62 | 110 Ų | 110 | 43% | 0.434 | 61% | 0.605 | S | S | . | * | trans | -57.5 | 146.9 | 176.8 | 68 | 0 | 0 | 0 | 0 | 109.1 | S12 K16 V17 I18 | S12-S14 PolarHBondContact O-N 3.18Å; S12-S14 VanDerWaalsContact O-N 3.1Å; S14-K16 PolarHBondContact O-N 3.21Å; S14-V17 PolarHBondContact O-N 2.81Å; S14-V17 WeakPolarHBondContact OG-CG2 3.42Å; S14-V17 PolarHBondContact OG-N 3.19Å; S14-I18 PolarHBondContact O-N 3.48Å | ||
| 15 | L | 82.3 | Confident | 76.1 | Confident | 135 Ų | 135 | 110.6 Ų | 110.6 | 71% | 0.707 | 59% | 0.586 | S | S | * | * | H | α-helix | trans | -51.8 | -30.9 | 175.7 | -72.2 | 171.9 | 0 | 0 | 0 | 111.9 | K19 | L15-K19 WeakPolarHBondContact O-CB 3.29Å; L15-K19 VanDerWaalsContact O-CG 3.25Å; L15-K19 WeakPolarHBondContact O-CG 3.41Å; L15-K19 PolarHBondContact O-N 2.87Å |
| 16 | K | 84.3 | Confident | 77.1 | Confident | 160 Ų | 160 | 108.8 Ų | 108.8 | 70% | 0.696 | 57% | 0.574 | S | S | * | * | H | α-helix | trans | -61.4 | -49.3 | 173.8 | -175.3 | 176.1 | 179.8 | -178 | 0 | 111.7 | S14 K19 E20 | S14-K16 PolarHBondContact O-N 3.21Å; K16-K19 PolarHBondContact O-N 2.58Å; K16-E20 WeakPolarHBondContact O-CB 3.48Å; K16-E20 PolarHBondContact O-N 3.38Å |
| 17 | V | 86.1 | Confident | 78.3 | Confident | 56 Ų | 56 | 108.1 Ų | 108.1 | 34% | 0.339 | 56% | 0.559 | S | S | . | * | H | α-helix | trans | -65.2 | -41.1 | 178.7 | 178 | 0 | 0 | 0 | 0 | 111 | L13 S14 K19 E20 V21 | L13-V17 HydrophobicContact CD2-CB 4.19Å; L13-V17 HydrophobicContact CD2-CG1 3.51Å; S14-V17 PolarHBondContact O-N 2.81Å; S14-V17 WeakPolarHBondContact OG-CG2 3.42Å; S14-V17 PolarHBondContact OG-N 3.19Å; V17-K19 PolarHBondContact O-N 3.44Å; V17-E20 PolarHBondContact O-N 2.85Å; V17-V21 HydrophobicContact CG1-CG2 4.2Å; V17-V21 WeakPolarHBondContact O-CB 3.42Å; V17-V21 VanDerWaalsContact O-CG2 3.31Å; V17-V21 WeakPolarHBondContact O-CG2 3.47Å; V17-V21 PolarHBondContact O-N 2.92Å |
| 18 | I | 85.3 | Confident | 79.2 | Confident | 86 Ų | 86 | 109.8 Ų | 109.8 | 44% | 0.441 | 56% | 0.561 | S | S | . | * | H | α-helix | trans | -60.8 | -45.9 | 177.1 | -62.8 | 173.7 | 0 | 0 | 0 | 110.9 | L13 S14 V21 K22 | L13-I18 HydrophobicContact CB-CD1 4.15Å; L13-I18 HydrophobicContact CB-CG1 3.8Å; S14-I18 PolarHBondContact O-N 3.48Å; I18-V21 PolarHBondContact O-N 2.96Å; I18-K22 WeakPolarHBondContact O-CB 3.44Å; I18-K22 PolarHBondContact O-N 2.91Å |
| 19 | K | 87.6 | Confident | 80.4 | Confident | 152 Ų | 152 | 106 Ų | 106 | 66% | 0.661 | 54% | 0.542 | S | S | * | . | H | α-helix | trans | -62.5 | -42.5 | 176.9 | -75.1 | 176.9 | 179.8 | -174.5 | 0 | 111.9 | L15 K16 V17 K22 S23 | L15-K19 WeakPolarHBondContact O-CB 3.29Å; L15-K19 VanDerWaalsContact O-CG 3.25Å; L15-K19 WeakPolarHBondContact O-CG 3.41Å; L15-K19 PolarHBondContact O-N 2.87Å; K16-K19 PolarHBondContact O-N 2.58Å; V17-K19 PolarHBondContact O-N 3.44Å; K19-K22 PolarHBondContact O-N 3.02Å; K19-S23 WeakPolarHBondContact O-CB 3.26Å; K19-S23 PolarHBondContact O-N 3.34Å |
| 20 | E | 87.6 | Confident | 82 | Confident | 88 Ų | 88 | 104 Ų | 104 | 41% | 0.411 | 53% | 0.534 | S | S | . | . | H | α-helix | trans | -63.6 | -47.6 | 178.3 | -170.1 | -177.9 | 115.3 | 0 | 0 | 111.6 | K16 V17 K22 S23 R24 | K16-E20 WeakPolarHBondContact O-CB 3.48Å; K16-E20 PolarHBondContact O-N 3.38Å; V17-E20 PolarHBondContact O-N 2.85Å; E20-K22 VanDerWaalsContact C-N 3.34Å; E20-K22 PolarHBondContact O-N 3.25Å; E20-S23 PolarHBondContact O-N 2.95Å; E20-R24 WeakPolarHBondContact O-CG 3.38Å; E20-R24 PolarHBondContact O-N 2.83Å; E20-R24 IonicContact OE1-CZ 3.36Å; E20-R24 IonicContact OE1-NE 3.44Å; E20-R24 PolarHBondContact OE1-NE 3.48Å; E20-R24 IonicContact OE1-NH2 3.97Å; E20-R24 PolarHBondContact OE1-NH2 3.42Å |
| 21 | V | 87.6 | Confident | 82.9 | Confident | 70 Ų | 70 | 102.6 Ų | 102.6 | 42% | 0.424 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -61.7 | -43.6 | 177 | 171.6 | 0 | 0 | 0 | 0 | 110.8 | V17 I18 S23 R24 I25 | V17-V21 HydrophobicContact CG1-CG2 4.2Å; V17-V21 WeakPolarHBondContact O-CB 3.42Å; V17-V21 VanDerWaalsContact O-CG2 3.31Å; V17-V21 WeakPolarHBondContact O-CG2 3.47Å; V17-V21 PolarHBondContact O-N 2.92Å; I18-V21 PolarHBondContact O-N 2.96Å; V21-S23 PolarHBondContact O-N 3.38Å; V21-R24 PolarHBondContact O-N 3.35Å; V21-I25 HydrophobicContact CG1-CD1 3.75Å; V21-I25 HydrophobicContact CG1-CG1 4.4Å; V21-I25 VanDerWaalsContact O-CG1 3.29Å; V21-I25 WeakPolarHBondContact O-CG1 3.42Å; V21-I25 PolarHBondContact O-N 3.43Å |
| 22 | K | 87.9 | Confident | 83.8 | Confident | 130 Ų | 130 | 105.6 Ų | 105.6 | 57% | 0.565 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -58.6 | -47.7 | 176 | -175.2 | -179.6 | 174.2 | -174.4 | 0 | 111.5 | I18 K19 E20 R24 I25 E26 | I18-K22 WeakPolarHBondContact O-CB 3.44Å; I18-K22 PolarHBondContact O-N 2.91Å; K19-K22 PolarHBondContact O-N 3.02Å; E20-K22 VanDerWaalsContact C-N 3.34Å; E20-K22 PolarHBondContact O-N 3.25Å; K22-R24 VanDerWaalsContact C-N 3.34Å; K22-R24 PolarHBondContact O-N 2.82Å; K22-I25 PolarHBondContact O-N 2.87Å; K22-E26 VanDerWaalsContact CE-OE1 3.24Å; K22-E26 WeakPolarHBondContact CE-OE1 3.1Å; K22-E26 IonicContact NZ-OE1 2.7Å; K22-E26 WeakPolarHBondContact O-CG 3.09Å; K22-E26 PolarHBondContact O-N 3.42Å |
| 23 | S | 88 | Confident | 84.7 | Confident | 63 Ų | 63 | 106.1 Ų | 106.1 | 44% | 0.441 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -60 | -43.2 | 178.3 | 179.1 | 0 | 0 | 0 | 0 | 111.8 | K19 E20 V21 I25 E26 V27 | K19-S23 WeakPolarHBondContact O-CB 3.26Å; K19-S23 PolarHBondContact O-N 3.34Å; E20-S23 PolarHBondContact O-N 2.95Å; V21-S23 PolarHBondContact O-N 3.38Å; S23-I25 VanDerWaalsContact C-N 3.35Å; S23-I25 PolarHBondContact O-N 3.33Å; S23-E26 PolarHBondContact O-N 2.96Å; S23-V27 WeakPolarHBondContact O-CB 3.24Å; S23-V27 VanDerWaalsContact O-CG2 3.26Å; S23-V27 WeakPolarHBondContact O-CG2 3.44Å; S23-V27 PolarHBondContact O-N 3.3Å |
| 24 | R | 85.2 | Confident | 85.3 | Confident | 149 Ų | 149 | 103.5 Ų | 103.5 | 56% | 0.562 | 48% | 0.482 | S | S | * | . | H | α-helix | trans | -63 | -38.8 | 175.9 | -68.9 | 179.6 | -172.2 | -149 | 6.8 | 112.7 | E20 V21 K22 Y28 | E20-R24 WeakPolarHBondContact O-CG 3.38Å; E20-R24 PolarHBondContact O-N 2.83Å; E20-R24 IonicContact OE1-CZ 3.36Å; E20-R24 IonicContact OE1-NE 3.44Å; E20-R24 PolarHBondContact OE1-NE 3.48Å; E20-R24 IonicContact OE1-NH2 3.97Å; E20-R24 PolarHBondContact OE1-NH2 3.42Å; V21-R24 PolarHBondContact O-N 3.35Å; K22-R24 VanDerWaalsContact C-N 3.34Å; K22-R24 PolarHBondContact O-N 2.82Å; R24-Y28 WeakPolarHBondContact O-CB 3.48Å; R24-Y28 PolarHBondContact O-N 2.7Å |
| 25 | I | 87.5 | Confident | 85.4 | Confident | 104 Ų | 104 | 102.3 Ų | 102.3 | 53% | 0.533 | 47% | 0.474 | S | S | . | . | H | α-helix | trans | -66.4 | -44 | 177 | -68.4 | 166.4 | 0 | 0 | 0 | 110.8 | V21 K22 S23 V27 Y28 D29 | V21-I25 HydrophobicContact CG1-CD1 3.75Å; V21-I25 HydrophobicContact CG1-CG1 4.4Å; V21-I25 VanDerWaalsContact O-CG1 3.29Å; V21-I25 WeakPolarHBondContact O-CG1 3.42Å; V21-I25 PolarHBondContact O-N 3.43Å; K22-I25 PolarHBondContact O-N 2.87Å; S23-I25 VanDerWaalsContact C-N 3.35Å; S23-I25 PolarHBondContact O-N 3.33Å; I25-V27 VanDerWaalsContact C-N 3.34Å; I25-V27 PolarHBondContact O-N 3.3Å; I25-Y28 PolarHBondContact O-N 2.94Å; I25-D29 WeakPolarHBondContact O-CB 3.48Å; I25-D29 PolarHBondContact O-N 2.97Å |
| 26 | E | 88.5 | Confident | 85.5 | Confident | 110 Ų | 110 | 100.8 Ų | 100.8 | 51% | 0.514 | 48% | 0.475 | S | S | . | . | H | α-helix | trans | -61.3 | -43.8 | 177.9 | -73 | 174.3 | 152.1 | 0 | 0 | 111.4 | K22 S23 D29 Y30 | K22-E26 VanDerWaalsContact CE-OE1 3.24Å; K22-E26 WeakPolarHBondContact CE-OE1 3.1Å; K22-E26 IonicContact NZ-OE1 2.7Å; K22-E26 WeakPolarHBondContact O-CG 3.09Å; K22-E26 PolarHBondContact O-N 3.42Å; S23-E26 PolarHBondContact O-N 2.96Å; E26-D29 PolarHBondContact O-N 3.01Å; E26-Y30 WeakPolarHBondContact O-CB 3.31Å; E26-Y30 PolarHBondContact O-N 3.21Å |
| 27 | V | 84.5 | Confident | 85.5 | Confident | 40 Ų | 40 | 99 Ų | 99 | 24% | 0.242 | 48% | 0.477 | C | S | . | . | H | α-helix | trans | -61.1 | -45.7 | 174.6 | 167.6 | 0 | 0 | 0 | 0 | 111.2 | S23 I25 Y30 Y31 L46 | S23-V27 WeakPolarHBondContact O-CB 3.24Å; S23-V27 VanDerWaalsContact O-CG2 3.26Å; S23-V27 WeakPolarHBondContact O-CG2 3.44Å; S23-V27 PolarHBondContact O-N 3.3Å; I25-V27 VanDerWaalsContact C-N 3.34Å; I25-V27 PolarHBondContact O-N 3.3Å; V27-Y30 WeakPolarHBondContact O-CB 3.44Å; V27-Y30 PolarHBondContact O-N 2.94Å; V27-Y31 HydrophobicContact CG1-CD2 3.64Å; V27-Y31 HydrophobicContact CG1-CE2 3.26Å; V27-Y31 WeakPolarHBondContact O-CD2 3.2Å; V27-Y31 PolarHBondContact O-N 3.42Å; V27-L46 HydrophobicContact CG1-CD1 3.5Å; V27-L46 VanDerWaalsContact CG1-CD1 3.5Å; V27-L46 HydrophobicContact CG1-CD2 4.06Å; V27-L46 HydrophobicContact CG1-CG 4.36Å; V27-L46 HydrophobicContact CG2-CD1 4.21Å |
| 28 | Y | 83.2 | Confident | 85.4 | Confident | 166 Ų | 166 | 99.3 Ų | 99.3 | 65% | 0.651 | 48% | 0.479 | S | S | * | . | H | α-helix | trans | -63.3 | -42.6 | 177.5 | -178.2 | -97.2 | 0 | 0 | 0 | 112.3 | R24 I25 Y30 Y31 R32 | R24-Y28 WeakPolarHBondContact O-CB 3.48Å; R24-Y28 PolarHBondContact O-N 2.7Å; I25-Y28 PolarHBondContact O-N 2.94Å; Y28-Y30 VanDerWaalsContact C-N 3.34Å; Y28-Y31 PolarHBondContact O-N 3.36Å; Y28-R32 VanDerWaalsContact O-CB 3.32Å; Y28-R32 WeakPolarHBondContact O-CB 3.32Å; Y28-R32 PolarHBondContact O-N 2.96Å |
| 29 | D | 86.2 | Confident | 85 | Confident | 60 Ų | 60 | 98 Ų | 98 | 32% | 0.321 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -63.7 | -40.6 | 176.5 | -170 | 68.4 | 0 | 0 | 0 | 111.5 | I25 E26 R32 K33 | I25-D29 WeakPolarHBondContact O-CB 3.48Å; I25-D29 PolarHBondContact O-N 2.97Å; E26-D29 PolarHBondContact O-N 3.01Å; D29-R32 PolarHBondContact O-N 3.43Å; D29-K33 WeakPolarHBondContact O-CB 3.28Å; D29-K33 WeakPolarHBondContact O-CG 3.25Å; D29-K33 PolarHBondContact O-N 2.88Å; D29-K33 WeakPolarHBondContact OD2-CE 3.18Å; D29-K33 IonicContact OD2-NZ 2.72Å; D29-K33 PolarHBondContact OD2-NZ 2.99Å |
| 30 | Y | 85 | Confident | 84.5 | Confident | 144 Ų | 144 | 94.7 Ų | 94.7 | 57% | 0.565 | 48% | 0.475 | S | S | * | . | H | α-helix | trans | -58.8 | -50.6 | 172.8 | 176.4 | -95.1 | 0 | 0 | 0 | 111.5 | E26 V27 Y28 R32 K33 F34 | E26-Y30 WeakPolarHBondContact O-CB 3.31Å; E26-Y30 PolarHBondContact O-N 3.21Å; V27-Y30 WeakPolarHBondContact O-CB 3.44Å; V27-Y30 PolarHBondContact O-N 2.94Å; Y28-Y30 VanDerWaalsContact C-N 3.34Å; Y30-R32 VanDerWaalsContact C-N 3.33Å; Y30-R32 PolarHBondContact O-N 3.29Å; Y30-K33 PolarHBondContact O-N 3.28Å; Y30-F34 VanDerWaalsContact O-CB 3.29Å; Y30-F34 WeakPolarHBondContact O-CB 3.41Å; Y30-F34 PolarHBondContact O-N 2.95Å |
| 31 | Y | 80.1 | Confident | 83.6 | Confident | 46 Ų | 46 | 96.6 Ų | 96.6 | 18% | 0.18 | 49% | 0.493 | C | S | . | . | H | α-helix | trans | -64.8 | -37.7 | 178.8 | -74.2 | -59.2 | 0 | 0 | 0 | 112.7 | V27 Y28 F34 S35 S43 P44 L46 | V27-Y31 HydrophobicContact CG1-CD2 3.64Å; V27-Y31 HydrophobicContact CG1-CE2 3.26Å; V27-Y31 WeakPolarHBondContact O-CD2 3.2Å; V27-Y31 PolarHBondContact O-N 3.42Å; Y28-Y31 PolarHBondContact O-N 3.36Å; Y31-F34 PolarHBondContact O-N 3.45Å; Y31-S35 WeakPolarHBondContact O-CB 3.37Å; Y31-S35 PolarHBondContact O-N 3.46Å; Y31-S43 WeakPolarHBondContact CE1-OG 3.44Å; Y31-S43 WeakPolarHBondContact CE2-OG 3.34Å; Y31-S43 VanDerWaalsContact CZ-OG 3.26Å; Y31-P44 HydrophobicContact CD1-CG 4.16Å; Y31-P44 HydrophobicContact CE1-CB 4.22Å; Y31-P44 HydrophobicContact CE1-CG 3.63Å; Y31-P44 WeakPolarHBondContact CE1-O 3.48Å; Y31-P44 VanDerWaalsContact CZ-O 3.29Å; Y31-P44 PolarHBondContact OH-O 3.29Å; Y31-L46 HydrophobicContact CE2-CB 4.48Å; Y31-L46 HydrophobicContact CE2-CD1 4.38Å |
| 32 | R | 83.9 | Confident | 82.5 | Confident | 166 Ų | 166 | 97.5 Ų | 97.5 | 63% | 0.626 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -62.3 | -44.6 | 176.2 | -180 | -178.2 | 157.7 | -159.5 | -5.2 | 111.1 | Y28 D29 Y30 S36 | Y28-R32 VanDerWaalsContact O-CB 3.32Å; Y28-R32 WeakPolarHBondContact O-CB 3.32Å; Y28-R32 PolarHBondContact O-N 2.96Å; D29-R32 PolarHBondContact O-N 3.43Å; Y30-R32 VanDerWaalsContact C-N 3.33Å; Y30-R32 PolarHBondContact O-N 3.29Å; R32-S36 WeakPolarHBondContact O-CB 3.29Å; R32-S36 PolarHBondContact O-N 3.46Å |
| 33 | K | 86.7 | Confident | 81.3 | Confident | 126 Ų | 126 | 94.5 Ų | 94.5 | 55% | 0.548 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -65.3 | -47.8 | 175.2 | -76.6 | 172 | 176.2 | 160.2 | 0 | 111.5 | D29 Y30 S35 S36 T37 | D29-K33 WeakPolarHBondContact O-CB 3.28Å; D29-K33 WeakPolarHBondContact O-CG 3.25Å; D29-K33 PolarHBondContact O-N 2.88Å; D29-K33 WeakPolarHBondContact OD2-CE 3.18Å; D29-K33 IonicContact OD2-NZ 2.72Å; D29-K33 PolarHBondContact OD2-NZ 2.99Å; Y30-K33 PolarHBondContact O-N 3.28Å; K33-S35 PolarHBondContact O-N 2.93Å; K33-S36 PolarHBondContact O-N 3.47Å; K33-T37 PolarHBondContact O-N 3.18Å; K33-T37 PolarHBondContact O-OG1 3.44Å; K33-T37 VanDerWaalsContact O-OG1 3.1Å |
| 34 | F | 81.9 | Confident | 79.8 | Confident | 61 Ų | 61 | 94.6 Ų | 94.6 | 27% | 0.268 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -56.3 | -48.6 | 177.4 | 179.7 | -96 | 0 | 0 | 0 | 111.9 | Y30 Y31 T37 T38 I40 P44 | Y30-F34 VanDerWaalsContact O-CB 3.29Å; Y30-F34 WeakPolarHBondContact O-CB 3.41Å; Y30-F34 PolarHBondContact O-N 2.95Å; Y31-F34 PolarHBondContact O-N 3.45Å; F34-T37 PolarHBondContact O-N 2.97Å; F34-T38 HydrophobicContact CD2-CG2 4.16Å; F34-T38 HydrophobicContact CE1-CG2 4.43Å; F34-T38 HydrophobicContact CE2-CG2 3.85Å; F34-T38 HydrophobicContact CZ-CG2 3.99Å; F34-T38 WeakPolarHBondContact O-CB 3.48Å; F34-T38 WeakPolarHBondContact O-CG2 3.39Å; F34-T38 PolarHBondContact O-N 3.27Å; F34-T38 PolarHBondContact O-OG1 2.87Å; F34-I40 HydrophobicContact CE1-CB 3.93Å; F34-I40 HydrophobicContact CE1-CD1 4.05Å; F34-I40 HydrophobicContact CE1-CG2 4.17Å; F34-I40 HydrophobicContact CZ-CD1 4.01Å; F34-P44 HydrophobicContact CD1-CG 4.47Å; F34-P44 HydrophobicContact CE1-CG 4.14Å |
| 35 | S | 83.2 | Confident | 78.4 | Confident | 37 Ų | 37 | 90.5 Ų | 90.5 | 26% | 0.259 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -62.6 | -42.4 | 176.9 | 176.5 | 0 | 0 | 0 | 0 | 111.6 | Y31 K33 T37 T38 G39 I40 | Y31-S35 WeakPolarHBondContact O-CB 3.37Å; Y31-S35 PolarHBondContact O-N 3.46Å; K33-S35 PolarHBondContact O-N 2.93Å; S35-T37 VanDerWaalsContact C-N 3.28Å; S35-T37 PolarHBondContact O-N 2.72Å; S35-T38 PolarHBondContact O-N 3.33Å; S35-G39 VanDerWaalsContact O-CA 3.28Å; S35-G39 WeakPolarHBondContact O-CA 3.34Å; S35-G39 PolarHBondContact O-N 2.87Å; S35-I40 WeakPolarHBondContact CA-O 3.43Å; S35-I40 VanDerWaalsContact CB-O 3.31Å; S35-I40 WeakPolarHBondContact CB-O 3.37Å; S35-I40 PolarHBondContact OG-O 3.02Å |
| 36 | S | 86.1 | Confident | 76.8 | Confident | 103 Ų | 103 | 89.5 Ų | 89.5 | 72% | 0.72 | 50% | 0.496 | S | S | * | . | H | α-helix | trans | -63.9 | -31.8 | 176.2 | -171.8 | 0 | 0 | 0 | 0 | 113.3 | R32 K33 | R32-S36 WeakPolarHBondContact O-CB 3.29Å; R32-S36 PolarHBondContact O-N 3.46Å; K33-S36 PolarHBondContact O-N 3.47Å |
| 37 | T | 84.4 | Confident | 74.7 | Confident | 123 Ų | 123 | 89.3 Ų | 89.3 | 76% | 0.755 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -84.8 | -35.7 | 179.9 | -59 | 0 | 0 | 0 | 0 | 112.5 | K33 F34 S35 | K33-T37 PolarHBondContact O-N 3.18Å; K33-T37 PolarHBondContact O-OG1 3.44Å; K33-T37 VanDerWaalsContact O-OG1 3.1Å; F34-T37 PolarHBondContact O-N 2.97Å; S35-T37 VanDerWaalsContact C-N 3.28Å; S35-T37 PolarHBondContact O-N 2.72Å |
| 38 | T | 82.1 | Confident | 72.9 | Confident | 62 Ų | 62 | 93.2 Ų | 93.2 | 38% | 0.38 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -105.6 | -15.8 | -171.4 | 61.9 | 0 | 0 | 0 | 0 | 114.2 | F34 S35 I40 | F34-T38 HydrophobicContact CD2-CG2 4.16Å; F34-T38 HydrophobicContact CE1-CG2 4.43Å; F34-T38 HydrophobicContact CE2-CG2 3.85Å; F34-T38 HydrophobicContact CZ-CG2 3.99Å; F34-T38 WeakPolarHBondContact O-CB 3.48Å; F34-T38 WeakPolarHBondContact O-CG2 3.39Å; F34-T38 PolarHBondContact O-N 3.27Å; F34-T38 PolarHBondContact O-OG1 2.87Å; S35-T38 PolarHBondContact O-N 3.33Å; T38-I40 PolarHBondContact O-N 3.05Å; T38-I40 WeakPolarHBondContact OG1-CB 3.31Å; T38-I40 PolarHBondContact OG1-N 3.1Å |
| 39 | G | 77 | Confident | 71.2 | Confident | 57 Ų | 57 | 97.4 Ų | 97.4 | 59% | 0.588 | 54% | 0.543 | S | S | * | . | trans | 71.1 | 1.4 | -169.2 | 0 | 0 | 0 | 0 | 0 | 114 | S35 T41 | S35-G39 VanDerWaalsContact O-CA 3.28Å; S35-G39 WeakPolarHBondContact O-CA 3.34Å; S35-G39 PolarHBondContact O-N 2.87Å; G39-T41 PolarHBondContact O-N 2.85Å | ||
| 40 | I | 77.2 | Confident | 70.4 | Confident | 83 Ų | 83 | 99.3 Ų | 99.3 | 43% | 0.426 | 55% | 0.554 | S | S | . | * | trans | -79.2 | 105.4 | 179.6 | -59.2 | 171.2 | 0 | 0 | 0 | 108.3 | F34 S35 T38 S42 | F34-I40 HydrophobicContact CE1-CB 3.93Å; F34-I40 HydrophobicContact CE1-CD1 4.05Å; F34-I40 HydrophobicContact CE1-CG2 4.17Å; F34-I40 HydrophobicContact CZ-CD1 4.01Å; S35-I40 WeakPolarHBondContact CA-O 3.43Å; S35-I40 VanDerWaalsContact CB-O 3.31Å; S35-I40 WeakPolarHBondContact CB-O 3.37Å; S35-I40 PolarHBondContact OG-O 3.02Å; T38-I40 PolarHBondContact O-N 3.05Å; T38-I40 WeakPolarHBondContact OG1-CB 3.31Å; T38-I40 PolarHBondContact OG1-N 3.1Å; I40-S42 VanDerWaalsContact C-N 3.35Å | ||
| 41 | T | 69.2 | Low | 69.6 | Low | 129 Ų | 129 | 96.9 Ų | 96.9 | 79% | 0.791 | 55% | 0.553 | S | S | * | * | trans | -84.5 | -11.3 | 179.1 | 56.2 | 0 | 0 | 0 | 0 | 113.4 | G39 | G39-T41 PolarHBondContact O-N 2.85Š| ||
| 42 | S | 64.6 | Low | 69.1 | Low | 89 Ų | 89 | 99.7 Ų | 99.7 | 62% | 0.622 | 57% | 0.574 | S | S | * | * | S | Bend | trans | -80.2 | 122.5 | 173.8 | -61.7 | 0 | 0 | 0 | 0 | 109.3 | I40 P44 | I40-S42 VanDerWaalsContact C-N 3.35Å; S42-P44 WeakPolarHBondContact O-CD 3.36Å |
| 43 | S | 62.2 | Low | 68.2 | Low | 66 Ų | 66 | 95.8 Ų | 95.8 | 46% | 0.462 | 57% | 0.571 | S | S | . | * | trans | -62.7 | 117.7 | 173.1 | 179.2 | 0 | 0 | 0 | 0 | 108.9 | Y31 G45 | Y31-S43 WeakPolarHBondContact CE1-OG 3.44Å; Y31-S43 WeakPolarHBondContact CE2-OG 3.34Å; Y31-S43 VanDerWaalsContact CZ-OG 3.26Å; S43-G45 PolarHBondContact O-N 3.3Å | ||
| 44 | P | 57.2 | Low | 67 | Low | 66 Ų | 66 | 93.9 Ų | 93.9 | 43% | 0.429 | 57% | 0.572 | S | S | . | * | trans | -54.3 | 109.4 | 165.2 | -4.4 | 0.3 | 0 | 0 | 0 | 107.4 | Y31 F34 S42 L46 | Y31-P44 HydrophobicContact CD1-CG 4.16Å; Y31-P44 HydrophobicContact CE1-CB 4.22Å; Y31-P44 HydrophobicContact CE1-CG 3.63Å; Y31-P44 WeakPolarHBondContact CE1-O 3.48Å; Y31-P44 VanDerWaalsContact CZ-O 3.29Å; Y31-P44 PolarHBondContact OH-O 3.29Å; F34-P44 HydrophobicContact CD1-CG 4.47Å; F34-P44 HydrophobicContact CE1-CG 4.14Å; S42-P44 WeakPolarHBondContact O-CD 3.36Å; P44-L46 PolarHBondContact O-N 3.28Å | ||
| 45 | G | 56 | Low | 66 | Low | 62 Ų | 62 | 96.1 Ų | 96.1 | 64% | 0.639 | 59% | 0.592 | S | S | * | * | trans | -38.3 | 119.3 | -159.5 | 0 | 0 | 0 | 0 | 0 | 114.2 | S43 V47 | S43-G45 PolarHBondContact O-N 3.3Å; G45-V47 VanDerWaalsContact C-N 3.26Å; G45-V47 PolarHBondContact O-N 2.69Å | ||
| 46 | L | 54.7 | Low | 64.8 | Low | 84 Ų | 84 | 100.4 Ų | 100.4 | 44% | 0.44 | 62% | 0.616 | S | S | . | * | trans | -67.1 | 90.2 | 169 | -172.1 | 67.1 | 0 | 0 | 0 | 108 | V27 Y31 P44 I48 | V27-L46 HydrophobicContact CG1-CD1 3.5Å; V27-L46 VanDerWaalsContact CG1-CD1 3.5Å; V27-L46 HydrophobicContact CG1-CD2 4.06Å; V27-L46 HydrophobicContact CG1-CG 4.36Å; V27-L46 HydrophobicContact CG2-CD1 4.21Å; Y31-L46 HydrophobicContact CE2-CB 4.48Å; Y31-L46 HydrophobicContact CE2-CD1 4.38Å; P44-L46 PolarHBondContact O-N 3.28Å; L46-I48 HydrophobicContact CD2-CD1 3.76Å; L46-I48 HydrophobicContact CD2-CG1 3.88Å; L46-I48 HydrophobicContact CG-CD1 4.2Å; L46-I48 HydrophobicContact CG-CG1 3.73Å; L46-I48 PolarHBondContact O-N 3Å | ||
| 47 | V | 42.6 | Very low | 63.2 | Low | 105 Ų | 105 | 100.2 Ų | 100.2 | 64% | 0.636 | 61% | 0.608 | S | S | * | * | trans | -75.8 | 98.1 | 168.2 | -176.2 | 0 | 0 | 0 | 0 | 106.9 | G45 F49 | G45-V47 VanDerWaalsContact C-N 3.26Å; G45-V47 PolarHBondContact O-N 2.69Å; V47-F49 HydrophobicContact CG1-CD2 4.02Å; V47-F49 HydrophobicContact CG1-CE1 4.24Å; V47-F49 HydrophobicContact CG1-CE2 3.61Å; V47-F49 HydrophobicContact CG1-CG 4.5Å; V47-F49 HydrophobicContact CG1-CZ 3.73Å | ||
| 48 | I | 48.1 | Very low | 61.4 | Low | 123 Ų | 123 | 98.3 Ų | 98.3 | 63% | 0.631 | 60% | 0.596 | S | S | * | * | trans | -91.1 | 115.7 | 165.3 | -45.1 | 178.5 | 0 | 0 | 0 | 105.7 | L46 | L46-I48 HydrophobicContact CD2-CD1 3.76Å; L46-I48 HydrophobicContact CD2-CG1 3.88Å; L46-I48 HydrophobicContact CG-CD1 4.2Å; L46-I48 HydrophobicContact CG-CG1 3.73Å; L46-I48 PolarHBondContact O-N 3Å | ||
| 49 | F | 46.1 | Very low | 59.5 | Low | 253 Ų | 253 | 101.5 Ų | 101.5 | 100% | 1.11 | 62% | 0.616 | S | S | * | * | trans | -82 | 0 | 165 | -67.1 | -80.1 | 0 | 0 | 0 | 110.3 | V47 | V47-F49 HydrophobicContact CG1-CD2 4.02Å; V47-F49 HydrophobicContact CG1-CE1 4.24Å; V47-F49 HydrophobicContact CG1-CE2 3.61Å; V47-F49 HydrophobicContact CG1-CG 4.5Å; V47-F49 HydrophobicContact CG1-CZ 3.73Å |
Retrieved 49 of 49 residues in 207 ms
(Link to these results)