| 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 | L | 59.6 | Low | 75.8 | Confident | 194 Ų | 194 | 124.3 Ų | 124.3 | 100% | 1.016 | 65% | 0.646 | S | S | * | * | 0 | -49.4 | 0 | -113.3 | 84.9 | 0 | 0 | 0 | 113.2 | L3 D4 C5 | L1-L3 PolarHBondContact O-N 3.19Å; L1-D4 PolarHBondContact O-N 3.19Å; L1-C5 PolarHBondContact O-N 3.05Å | |||
| 2 | V | 58.7 | Low | 76.9 | Confident | 123 Ų | 123 | 120.5 Ų | 120.5 | 75% | 0.745 | 63% | 0.626 | S | S | * | * | H | α-helix | trans | -67 | -34.9 | -178.3 | 179.5 | 0 | 0 | 0 | 0 | 113.6 | D4 C5 W6 | V2-D4 VanDerWaalsContact C-N 3.33Å; V2-D4 PolarHBondContact O-N 3.41Å; V2-C5 PolarHBondContact O-N 3.05Å; V2-W6 WeakPolarHBondContact O-CB 3.48Å; V2-W6 PolarHBondContact O-N 3.27Å |
| 3 | L | 59.3 | Low | 77.8 | Confident | 152 Ų | 152 | 123.3 Ų | 123.3 | 80% | 0.796 | 63% | 0.625 | S | S | * | * | H | α-helix | trans | -65.2 | -34.8 | 178.8 | -68.8 | 169.5 | 0 | 0 | 0 | 113 | L1 D7 | L1-L3 PolarHBondContact O-N 3.19Å; L3-D7 WeakPolarHBondContact O-CB 3.45Å; L3-D7 PolarHBondContact O-N 2.94Å |
| 4 | D | 66.8 | Low | 78.5 | Confident | 127 Ų | 127 | 119 Ų | 119 | 68% | 0.679 | 61% | 0.612 | S | S | * | * | H | α-helix | trans | -74.1 | -41.7 | -179.5 | -152.3 | -92.3 | 0 | 0 | 0 | 110.9 | L1 V2 W6 H8 | L1-D4 PolarHBondContact O-N 3.19Å; V2-D4 VanDerWaalsContact C-N 3.33Å; V2-D4 PolarHBondContact O-N 3.41Å; D4-W6 PolarHBondContact O-N 3.36Å; D4-H8 WeakPolarHBondContact O-CB 3.47Å; D4-H8 PolarHBondContact O-N 3.1Å; D4-H8 VanDerWaalsContact O-CB 3.26Å |
| 5 | C | 74.8 | Confident | 79 | Confident | 79 Ų | 79 | 119.9 Ų | 119.9 | 53% | 0.534 | 61% | 0.606 | S | S | . | * | H | α-helix | trans | -64 | -39.6 | 172.6 | -66.7 | 0 | 0 | 0 | 0 | 112.4 | L1 V2 C9 | L1-C5 PolarHBondContact O-N 3.05Å; V2-C5 PolarHBondContact O-N 3.05Å; C5-C9 VanDerWaalsContact O-CB 3.31Å; C5-C9 WeakPolarHBondContact O-CB 3.5Å; C5-C9 PolarHBondContact O-N 3.11Å; C5-C9 PolarHBondContact O-SG 3.12Å |
| 6 | W | 81.8 | Confident | 79.5 | Confident | 183 Ų | 183 | 117.6 Ų | 117.6 | 69% | 0.693 | 59% | 0.592 | S | S | * | * | H | α-helix | trans | -67.5 | -47.4 | 178.9 | 179.4 | -92.7 | 0 | 0 | 0 | 112.2 | V2 D4 H8 C9 V10 | V2-W6 WeakPolarHBondContact O-CB 3.48Å; V2-W6 PolarHBondContact O-N 3.27Å; D4-W6 PolarHBondContact O-N 3.36Å; W6-H8 VanDerWaalsContact C-N 3.3Å; W6-H8 PolarHBondContact O-N 2.89Å; W6-C9 PolarHBondContact O-N 2.8Å; W6-V10 HydrophobicContact CG-CG2 4.45Å; W6-V10 PolarHBondContact O-N 3.33Å; W6-V10 WeakPolarHBondContact O-CG2 3.44Å; W6-V10 HydrophobicContact CZ2-CG2 4.2Å; W6-V10 HydrophobicContact CD2-CG2 4.32Å |
| 7 | D | 84.6 | Confident | 80 | Confident | 108 Ų | 108 | 115.7 Ų | 115.7 | 58% | 0.578 | 58% | 0.583 | S | S | * | * | H | α-helix | trans | -58.3 | -44.6 | 176.2 | -176 | -96.6 | 0 | 0 | 0 | 111.3 | L3 C9 V10 K11 | L3-D7 WeakPolarHBondContact O-CB 3.45Å; L3-D7 PolarHBondContact O-N 2.94Å; D7-C9 PolarHBondContact O-N 3.45Å; D7-V10 PolarHBondContact O-N 2.89Å; D7-K11 WeakPolarHBondContact O-CB 3.4Å; D7-K11 PolarHBondContact O-N 3.26Å |
| 8 | H | 85.2 | Confident | 80.2 | Confident | 109 Ų | 109 | 120.9 Ų | 120.9 | 51% | 0.505 | 60% | 0.595 | S | S | . | * | H | α-helix | trans | -60.6 | -46.2 | 176.2 | -165.3 | 104.6 | 0 | 0 | 0 | 112 | D4 W6 K11 I12 | D4-H8 WeakPolarHBondContact O-CB 3.47Å; D4-H8 PolarHBondContact O-N 3.1Å; D4-H8 VanDerWaalsContact O-CB 3.26Å; W6-H8 VanDerWaalsContact C-N 3.3Å; W6-H8 PolarHBondContact O-N 2.89Å; H8-K11 PolarHBondContact O-N 2.93Å; H8-I12 WeakPolarHBondContact O-CG1 3.16Å; H8-I12 PolarHBondContact O-N 3.44Å; H8-I12 WeakPolarHBondContact NE2-CD1 3.39Å; H8-I12 VanDerWaalsContact NE2-CD1 3.31Å; H8-I12 WeakPolarHBondContact CD2-CD1 3.3Å |
| 9 | C | 87.2 | Confident | 80.2 | Confident | 79 Ų | 79 | 122.8 Ų | 122.8 | 53% | 0.534 | 60% | 0.595 | S | S | . | * | H | α-helix | trans | -62.9 | -43.4 | 177.3 | -74.9 | 0 | 0 | 0 | 0 | 112.2 | C5 W6 D7 I12 Y13 | C5-C9 VanDerWaalsContact O-CB 3.31Å; C5-C9 WeakPolarHBondContact O-CB 3.5Å; C5-C9 PolarHBondContact O-N 3.11Å; C5-C9 PolarHBondContact O-SG 3.12Å; W6-C9 PolarHBondContact O-N 2.8Å; D7-C9 PolarHBondContact O-N 3.45Å; C9-I12 PolarHBondContact O-N 3.06Å; C9-Y13 VanDerWaalsContact O-CB 3.31Å; C9-Y13 WeakPolarHBondContact O-CB 3.11Å; C9-Y13 PolarHBondContact O-N 3.35Å |
| 10 | V | 88.2 | Confident | 80 | Confident | 59 Ų | 59 | 125.6 Ų | 125.6 | 36% | 0.358 | 60% | 0.6 | S | S | . | * | H | α-helix | trans | -63.4 | -44.9 | 178.1 | 170.2 | 0 | 0 | 0 | 0 | 110.6 | W6 D7 I12 Y13 S14 | W6-V10 HydrophobicContact CG-CG2 4.45Å; W6-V10 PolarHBondContact O-N 3.33Å; W6-V10 WeakPolarHBondContact O-CG2 3.44Å; W6-V10 HydrophobicContact CZ2-CG2 4.2Å; W6-V10 HydrophobicContact CD2-CG2 4.32Å; D7-V10 PolarHBondContact O-N 2.89Å; V10-I12 PolarHBondContact O-N 3.45Å; V10-Y13 PolarHBondContact O-N 2.9Å; V10-S14 VanDerWaalsContact O-OG 3.1Å; V10-S14 WeakPolarHBondContact O-CB 3.38Å; V10-S14 PolarHBondContact O-N 3.47Å; V10-S14 PolarHBondContact O-OG 3.45Å |
| 11 | K | 88.3 | Confident | 79.5 | Confident | 154 Ų | 154 | 123.4 Ų | 123.4 | 67% | 0.67 | 60% | 0.598 | S | S | * | * | H | α-helix | trans | -61.1 | -43.8 | 178.5 | -172.7 | 176.4 | -177.8 | 177.5 | 0 | 112.4 | D7 H8 Y15 | D7-K11 WeakPolarHBondContact O-CB 3.4Å; D7-K11 PolarHBondContact O-N 3.26Å; H8-K11 PolarHBondContact O-N 2.93Å; K11-Y15 WeakPolarHBondContact O-CB 3.33Å; K11-Y15 PolarHBondContact O-N 3.25Å |
| 12 | I | 89 | Confident | 79.9 | Confident | 79 Ų | 79 | 118.9 Ų | 118.9 | 41% | 0.405 | 58% | 0.579 | S | S | . | * | H | α-helix | trans | -63.9 | -47.5 | 175.3 | -71.8 | -178.2 | 0 | 0 | 0 | 110.6 | H8 C9 V10 S14 Y15 H16 | H8-I12 WeakPolarHBondContact O-CG1 3.16Å; H8-I12 PolarHBondContact O-N 3.44Å; H8-I12 WeakPolarHBondContact NE2-CD1 3.39Å; H8-I12 VanDerWaalsContact NE2-CD1 3.31Å; H8-I12 WeakPolarHBondContact CD2-CD1 3.3Å; C9-I12 PolarHBondContact O-N 3.06Å; V10-I12 PolarHBondContact O-N 3.45Å; I12-S14 PolarHBondContact O-N 3.43Å; I12-Y15 WeakPolarHBondContact O-CB 3.31Å; I12-Y15 PolarHBondContact O-N 2.86Å; I12-H16 PolarHBondContact O-CD2 2.98Å; I12-H16 VanDerWaalsContact O-CD2 3.25Å; I12-H16 PolarHBondContact O-N 3.44Å |
| 13 | Y | 88 | Confident | 80.2 | Confident | 157 Ų | 157 | 122.5 Ų | 122.5 | 62% | 0.616 | 61% | 0.605 | S | S | * | * | H | α-helix | trans | -59.1 | -46.9 | 179.3 | 179.3 | -99.7 | 0 | 0 | 0 | 111.7 | C9 V10 Y15 H16 L17 | C9-Y13 VanDerWaalsContact O-CB 3.31Å; C9-Y13 WeakPolarHBondContact O-CB 3.11Å; C9-Y13 PolarHBondContact O-N 3.35Å; V10-Y13 PolarHBondContact O-N 2.9Å; Y13-Y15 PolarHBondContact O-N 2.86Å; Y13-Y15 VanDerWaalsContact C-N 3.33Å; Y13-H16 PolarHBondContact O-N 3.45Å; Y13-L17 HydrophobicContact CE1-CD2 4.3Å; Y13-L17 VanDerWaalsContact O-CB 3.3Å; Y13-L17 WeakPolarHBondContact O-CB 3.26Å; Y13-L17 PolarHBondContact O-N 3.05Å |
| 14 | S | 87.6 | Confident | 81.2 | Confident | 63 Ų | 63 | 121.1 Ų | 121.1 | 44% | 0.441 | 60% | 0.595 | S | S | . | * | H | α-helix | trans | -62.6 | -36.9 | 176.5 | -63.1 | 0 | 0 | 0 | 0 | 112.9 | V10 I12 R18 | V10-S14 VanDerWaalsContact O-OG 3.1Å; V10-S14 WeakPolarHBondContact O-CB 3.38Å; V10-S14 PolarHBondContact O-N 3.47Å; V10-S14 PolarHBondContact O-OG 3.45Å; I12-S14 PolarHBondContact O-N 3.43Å; S14-R18 WeakPolarHBondContact O-CB 3.47Å; S14-R18 PolarHBondContact O-N 3.27Å |
| 15 | Y | 86.5 | Confident | 82 | Confident | 132 Ų | 132 | 120.7 Ų | 120.7 | 52% | 0.518 | 59% | 0.591 | S | S | . | * | H | α-helix | trans | -64.3 | -49 | 175.5 | 176.9 | -95.9 | 0 | 0 | 0 | 111.9 | K11 I12 Y13 R18 R19 | K11-Y15 WeakPolarHBondContact O-CB 3.33Å; K11-Y15 PolarHBondContact O-N 3.25Å; I12-Y15 WeakPolarHBondContact O-CB 3.31Å; I12-Y15 PolarHBondContact O-N 2.86Å; Y13-Y15 PolarHBondContact O-N 2.86Å; Y13-Y15 VanDerWaalsContact C-N 3.33Å; Y15-R18 PolarHBondContact O-N 3.5Å; Y15-R19 WeakPolarHBondContact O-CB 3.31Å; Y15-R19 PolarHBondContact OH-NH1 3.41Å; Y15-R19 PolarHBondContact O-N 3.13Å; Y15-R19 VanDerWaalsContact O-N 3.12Å |
| 16 | H | 87.3 | Confident | 82.4 | Confident | 84 Ų | 84 | 123.1 Ų | 123.1 | 39% | 0.389 | 59% | 0.594 | S | S | . | * | H | α-helix | trans | -64.2 | -45.7 | 177.7 | -78.7 | -70.9 | 0 | 0 | 0 | 111.5 | I12 Y13 R18 R19 Y20 | I12-H16 PolarHBondContact O-CD2 2.98Å; I12-H16 VanDerWaalsContact O-CD2 3.25Å; I12-H16 PolarHBondContact O-N 3.44Å; Y13-H16 PolarHBondContact O-N 3.45Å; H16-R18 VanDerWaalsContact C-N 3.33Å; H16-R18 PolarHBondContact O-N 2.96Å; H16-R19 PolarHBondContact O-N 2.92Å; H16-R19 VanDerWaalsContact O-N 3.11Å; H16-Y20 WeakPolarHBondContact O-CD2 3.37Å; H16-Y20 PolarHBondContact O-N 3.04Å; H16-Y20 AromaticContact ND1-CE2 3.52Å; H16-Y20 HydrophobicContact CB-CE2 4.2Å; H16-Y20 HydrophobicContact CB-CD2 4.1Å |
| 17 | L | 86.9 | Confident | 82.4 | Confident | 85 Ų | 85 | 119.5 Ų | 119.5 | 45% | 0.445 | 59% | 0.588 | S | S | . | * | H | α-helix | trans | -54.4 | -50.9 | 177.1 | -177 | 65.4 | 0 | 0 | 0 | 110.6 | Y13 R19 Y20 S21 | Y13-L17 HydrophobicContact CE1-CD2 4.3Å; Y13-L17 VanDerWaalsContact O-CB 3.3Å; Y13-L17 WeakPolarHBondContact O-CB 3.26Å; Y13-L17 PolarHBondContact O-N 3.05Å; L17-R19 VanDerWaalsContact C-N 3.28Å; L17-R19 PolarHBondContact O-N 3.49Å; L17-Y20 PolarHBondContact O-N 2.87Å; L17-S21 WeakPolarHBondContact O-CB 3.31Å; L17-S21 PolarHBondContact O-N 3.41Å; L17-S21 PolarHBondContact O-OG 3.22Å |
| 18 | R | 83.6 | Confident | 82.3 | Confident | 209 Ų | 209 | 120.3 Ų | 120.3 | 79% | 0.789 | 59% | 0.589 | S | S | * | * | H | α-helix | trans | -61.2 | -35.8 | 179.8 | -169.7 | 173.4 | -180 | -164.6 | -0.4 | 113.3 | S14 Y15 H16 | S14-R18 WeakPolarHBondContact O-CB 3.47Å; S14-R18 PolarHBondContact O-N 3.27Å; Y15-R18 PolarHBondContact O-N 3.5Å; H16-R18 VanDerWaalsContact C-N 3.33Å; H16-R18 PolarHBondContact O-N 2.96Å |
| 19 | R | 80.3 | Confident | 82.1 | Confident | 157 Ų | 157 | 121 Ų | 121 | 59% | 0.592 | 60% | 0.595 | S | S | * | * | H | α-helix | trans | -76.3 | -31.6 | -179.9 | -170.3 | 172.5 | -177.5 | 133.5 | 3.4 | 113.3 | Y15 H16 L17 T22 | Y15-R19 WeakPolarHBondContact O-CB 3.31Å; Y15-R19 PolarHBondContact OH-NH1 3.41Å; Y15-R19 PolarHBondContact O-N 3.13Å; Y15-R19 VanDerWaalsContact O-N 3.12Å; H16-R19 PolarHBondContact O-N 2.92Å; H16-R19 VanDerWaalsContact O-N 3.11Å; L17-R19 VanDerWaalsContact C-N 3.28Å; L17-R19 PolarHBondContact O-N 3.49Å; R19-T22 PolarHBondContact O-OG1 3.48Å |
| 20 | Y | 75.9 | Confident | 81.7 | Confident | 178 Ų | 178 | 124 Ų | 124 | 70% | 0.698 | 60% | 0.599 | S | S | * | * | H | α-helix | trans | -95.5 | -10.9 | 178.9 | -68.5 | -67.6 | 0 | 0 | 0 | 113.3 | H16 L17 | H16-Y20 WeakPolarHBondContact O-CD2 3.37Å; H16-Y20 PolarHBondContact O-N 3.04Å; H16-Y20 AromaticContact ND1-CE2 3.52Å; H16-Y20 HydrophobicContact CB-CE2 4.2Å; H16-Y20 HydrophobicContact CB-CD2 4.1Å; L17-Y20 PolarHBondContact O-N 2.87Å |
| 21 | S | 69.7 | Low | 81.2 | Confident | 80 Ų | 80 | 129 Ų | 129 | 56% | 0.559 | 62% | 0.617 | S | S | * | * | S | Bend | trans | -86.5 | -1.4 | 174 | -66.4 | 0 | 0 | 0 | 0 | 114.1 | L17 P23 | L17-S21 WeakPolarHBondContact O-CB 3.31Å; L17-S21 PolarHBondContact O-N 3.41Å; L17-S21 PolarHBondContact O-OG 3.22Å; S21-P23 WeakPolarHBondContact O-CD 3.41Å |
| 22 | T | 68.4 | Low | 80.6 | Confident | 99 Ų | 99 | 126.9 Ų | 126.9 | 61% | 0.607 | 61% | 0.613 | S | S | * | * | trans | -86.3 | 116.1 | 163.7 | 49.4 | 0 | 0 | 0 | 0 | 108.5 | R19 | R19-T22 PolarHBondContact O-OG1 3.48Š| ||
| 23 | P | 64.2 | Low | 79.9 | Confident | 200 Ų | 200 | 131.3 Ų | 131.3 | 100% | 1.299 | 63% | 0.632 | S | S | * | * | trans | -64 | 0 | 171.6 | 28.1 | -33.5 | 0 | 0 | 0 | 112.2 | S21 | S21-P23 WeakPolarHBondContact O-CD 3.41Š|
Retrieved 23 of 23 residues in 94.2 ms
(Link to these results)