| Site | Residue | pLDDT | pLDDT confidence | pLDDT10 | pLDDT10 confidence | SASA | SASA [Ų] | SASA10 | SASA10 [Ų] | RSA | RSA unformatted | RSA10 | RSA10 unformatted | Surface | Surface10 (not used) | Disorder (not used) | Disorder | Sec. str. | Secondary structure | Isomer | Phi (φ) | Psi (ψ) | Omega (ω) | Chi 1 (χ1) | Chi 2 (χ2) | Chi 3 (χ3) | Chi 4 (χ4) | Chi 5 (χ5) | Tau (τ) | Contacts (colored by PAE) | Contact details |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 1 | M | 53.8 | Low | 55.7 | Low | 215 Ų | 215 | 119.3 Ų | 119.3 | 100% | 1.059 | 61% | 0.612 | S | S | * | * | 0 | 34 | 0 | -161.8 | 174.4 | 152.4 | 0 | 0 | 112.8 | |||||
| 2 | F | 52.3 | Low | 56 | Low | 178 Ų | 178 | 119.9 Ų | 119.9 | 78% | 0.781 | 62% | 0.616 | S | S | * | * | trans | -103.8 | -36.5 | 178.2 | -96.1 | -93.2 | 0 | 0 | 0 | 112.4 | H4 K5 T6 | F2-H4 VanDerWaalsContact C-N 3.34Å; F2-H4 PolarHBondContact O-N 2.8Å; F2-K5 PolarHBondContact O-N 3.36Å; F2-K5 VanDerWaalsContact O-N 3.16Å; F2-T6 PolarHBondContact O-N 2.82Å; F2-T6 PolarHBondContact O-OG1 3.33Å | ||
| 3 | I | 62.1 | Low | 56 | Low | 126 Ų | 126 | 121.5 Ų | 121.5 | 65% | 0.646 | 63% | 0.625 | S | S | * | * | H | α-helix | trans | -57.2 | -43.5 | -176.3 | -58.2 | 171.2 | 0 | 0 | 0 | 112.2 | K5 T6 I7 | I3-K5 PolarHBondContact O-N 2.72Å; I3-T6 PolarHBondContact O-N 2.88Å; I3-I7 HydrophobicContact CG2-CD1 3.73Å; I3-I7 HydrophobicContact CG2-CG1 4.35Å; I3-I7 WeakPolarHBondContact O-CG1 3.01Å; I3-I7 PolarHBondContact O-N 3.27Å |
| 4 | H | 55.3 | Low | 56.1 | Low | 162 Ų | 162 | 122.9 Ų | 122.9 | 75% | 0.75 | 63% | 0.627 | S | S | * | * | H | α-helix | trans | -62.5 | -39.6 | 179.4 | -104.3 | -129.3 | 0 | 0 | 0 | 113.4 | F2 A8 | F2-H4 VanDerWaalsContact C-N 3.34Å; F2-H4 PolarHBondContact O-N 2.8Å; H4-A8 WeakPolarHBondContact O-CB 3.44Å; H4-A8 PolarHBondContact O-N 2.98Å; H4-A8 VanDerWaalsContact O-N 3.15Å |
| 5 | K | 55.8 | Low | 56.3 | Low | 154 Ų | 154 | 122.1 Ų | 122.1 | 67% | 0.67 | 62% | 0.624 | S | S | * | * | H | α-helix | trans | -67.4 | -41.6 | 177.1 | -85.1 | -174.5 | 175.9 | -178.1 | 0 | 110.8 | F2 I3 A8 V9 | F2-K5 PolarHBondContact O-N 3.36Å; F2-K5 VanDerWaalsContact O-N 3.16Å; I3-K5 PolarHBondContact O-N 2.72Å; K5-A8 PolarHBondContact O-N 2.86Å; K5-V9 WeakPolarHBondContact O-CG2 3.28Å; K5-V9 PolarHBondContact O-N 2.83Å; K5-V9 VanDerWaalsContact O-N 3.08Å |
| 6 | T | 57.7 | Low | 56.4 | Low | 83 Ų | 83 | 118.8 Ų | 118.8 | 51% | 0.509 | 61% | 0.613 | S | S | . | * | H | α-helix | trans | -61.7 | -49 | 178.3 | -50.5 | 0 | 0 | 0 | 0 | 111.4 | F2 I3 A8 V9 T10 | F2-T6 PolarHBondContact O-N 2.82Å; F2-T6 PolarHBondContact O-OG1 3.33Å; I3-T6 PolarHBondContact O-N 2.88Å; T6-A8 VanDerWaalsContact C-N 3.35Å; T6-A8 PolarHBondContact O-N 3.04Å; T6-V9 PolarHBondContact O-N 2.9Å; T6-T10 PolarHBondContact O-N 2.66Å; T6-T10 PolarHBondContact O-OG1 2.67Å |
| 7 | I | 55.6 | Low | 56.8 | Low | 90 Ų | 90 | 115.5 Ų | 115.5 | 46% | 0.462 | 60% | 0.602 | S | S | . | * | H | α-helix | trans | -60.2 | -44 | 179.7 | -65.6 | 170.1 | 0 | 0 | 0 | 111.2 | I3 V9 T10 I11 | I3-I7 HydrophobicContact CG2-CD1 3.73Å; I3-I7 HydrophobicContact CG2-CG1 4.35Å; I3-I7 WeakPolarHBondContact O-CG1 3.01Å; I3-I7 PolarHBondContact O-N 3.27Å; I7-V9 PolarHBondContact O-N 2.94Å; I7-T10 PolarHBondContact O-N 2.78Å; I7-I11 HydrophobicContact CG2-CD1 3.76Å; I7-I11 HydrophobicContact CG2-CG1 4.37Å; I7-I11 VanDerWaalsContact O-CG1 3.32Å; I7-I11 WeakPolarHBondContact O-CG1 3.32Å; I7-I11 PolarHBondContact O-N 3.27Å |
| 8 | A | 51.5 | Low | 57.2 | Low | 47 Ų | 47 | 121.8 Ų | 121.8 | 39% | 0.388 | 62% | 0.617 | S | S | . | * | H | α-helix | trans | -62.3 | -43.9 | 179.3 | 0 | 0 | 0 | 0 | 0 | 112.4 | H4 K5 T6 I11 I12 | H4-A8 WeakPolarHBondContact O-CB 3.44Å; H4-A8 PolarHBondContact O-N 2.98Å; H4-A8 VanDerWaalsContact O-N 3.15Å; K5-A8 PolarHBondContact O-N 2.86Å; T6-A8 VanDerWaalsContact C-N 3.35Å; T6-A8 PolarHBondContact O-N 3.04Å; A8-I11 PolarHBondContact O-N 3.48Å; A8-I12 VanDerWaalsContact O-CG1 3.28Å; A8-I12 WeakPolarHBondContact O-CG1 3.18Å; A8-I12 PolarHBondContact O-N 3.33Å |
| 9 | V | 55.6 | Low | 57.7 | Low | 91 Ų | 91 | 118.6 Ų | 118.6 | 55% | 0.552 | 61% | 0.611 | S | S | * | * | H | α-helix | trans | -63.8 | -42.7 | 176.2 | 173.9 | 0 | 0 | 0 | 0 | 110.7 | K5 T6 I7 I11 I12 L13 | K5-V9 WeakPolarHBondContact O-CG2 3.28Å; K5-V9 PolarHBondContact O-N 2.83Å; K5-V9 VanDerWaalsContact O-N 3.08Å; T6-V9 PolarHBondContact O-N 2.9Å; I7-V9 PolarHBondContact O-N 2.94Å; V9-I11 PolarHBondContact O-N 2.88Å; V9-I12 PolarHBondContact O-N 3.37Å; V9-L13 WeakPolarHBondContact O-CB 3.35Å; V9-L13 PolarHBondContact O-N 3.39Å |
| 10 | T | 56.3 | Low | 58 | Low | 67 Ų | 67 | 118.5 Ų | 118.5 | 41% | 0.411 | 61% | 0.608 | S | S | . | * | H | α-helix | trans | -59.6 | -47 | 175.8 | -55.7 | 0 | 0 | 0 | 0 | 111.1 | T6 I7 I12 L13 H14 | T6-T10 PolarHBondContact O-N 2.66Å; T6-T10 PolarHBondContact O-OG1 2.67Å; I7-T10 PolarHBondContact O-N 2.78Å; T10-I12 PolarHBondContact O-N 2.75Å; T10-L13 PolarHBondContact O-N 2.79Å; T10-H14 WeakPolarHBondContact CG2-ND1 3.19Å; T10-H14 PolarHBondContact O-N 2.56Å; T10-H14 PolarHBondContact O-ND1 3.29Å |
| 11 | I | 56.5 | Low | 58.4 | Low | 99 Ų | 99 | 118.2 Ų | 118.2 | 51% | 0.508 | 60% | 0.602 | S | S | . | * | H | α-helix | trans | -59.5 | -50.3 | 178.4 | -69.4 | 168.4 | 0 | 0 | 0 | 110 | I7 A8 V9 L13 H14 L15 | I7-I11 HydrophobicContact CG2-CD1 3.76Å; I7-I11 HydrophobicContact CG2-CG1 4.37Å; I7-I11 VanDerWaalsContact O-CG1 3.32Å; I7-I11 WeakPolarHBondContact O-CG1 3.32Å; I7-I11 PolarHBondContact O-N 3.27Å; A8-I11 PolarHBondContact O-N 3.48Å; V9-I11 PolarHBondContact O-N 2.88Å; I11-L13 VanDerWaalsContact C-N 3.31Å; I11-L13 PolarHBondContact O-N 3.29Å; I11-H14 PolarHBondContact O-N 2.71Å; I11-H14 VanDerWaalsContact O-N 3.15Å; I11-L15 HydrophobicContact CB-CD1 4.49Å; I11-L15 HydrophobicContact CG2-CD1 3.34Å; I11-L15 WeakPolarHBondContact O-CD1 3.17Å; I11-L15 PolarHBondContact O-N 2.95Å |
| 12 | I | 59.1 | Low | 58.4 | Low | 127 Ų | 127 | 114.4 Ų | 114.4 | 65% | 0.651 | 58% | 0.58 | S | S | * | * | H | α-helix | trans | -59.2 | -40.6 | -178.8 | -65.9 | 165.1 | 0 | 0 | 0 | 111.9 | A8 V9 T10 H14 L15 | A8-I12 VanDerWaalsContact O-CG1 3.28Å; A8-I12 WeakPolarHBondContact O-CG1 3.18Å; A8-I12 PolarHBondContact O-N 3.33Å; V9-I12 PolarHBondContact O-N 3.37Å; T10-I12 PolarHBondContact O-N 2.75Å; I12-H14 VanDerWaalsContact C-N 3.31Å; I12-H14 PolarHBondContact O-N 3.33Å; I12-L15 PolarHBondContact O-N 2.75Å |
| 13 | L | 56.9 | Low | 58.9 | Low | 141 Ų | 141 | 115 Ų | 115 | 74% | 0.738 | 58% | 0.577 | S | S | * | * | H | α-helix | trans | -69.4 | -28.3 | -179.1 | -142 | 83.1 | 0 | 0 | 0 | 113.2 | V9 T10 I11 | V9-L13 WeakPolarHBondContact O-CB 3.35Å; V9-L13 PolarHBondContact O-N 3.39Å; T10-L13 PolarHBondContact O-N 2.79Å; I11-L13 VanDerWaalsContact C-N 3.31Å; I11-L13 PolarHBondContact O-N 3.29Å |
| 14 | H | 57.5 | Low | 58.7 | Low | 140 Ų | 140 | 114.8 Ų | 114.8 | 65% | 0.648 | 58% | 0.577 | S | S | * | * | H | α-helix | trans | -98 | -3.7 | -178.8 | -63.7 | 98.5 | 0 | 0 | 0 | 113.5 | T10 I11 I12 P16 | T10-H14 WeakPolarHBondContact CG2-ND1 3.19Å; T10-H14 PolarHBondContact O-N 2.56Å; T10-H14 PolarHBondContact O-ND1 3.29Å; I11-H14 PolarHBondContact O-N 2.71Å; I11-H14 VanDerWaalsContact O-N 3.15Å; I12-H14 VanDerWaalsContact C-N 3.31Å; I12-H14 PolarHBondContact O-N 3.33Å; H14-P16 WeakPolarHBondContact O-CD 3.08Å |
| 15 | L | 57.9 | Low | 59 | Low | 112 Ų | 112 | 110.9 Ų | 110.9 | 59% | 0.586 | 56% | 0.56 | S | S | * | * | S | Bend | trans | -69.2 | 121.3 | 171.9 | -98.8 | 97.8 | 0 | 0 | 0 | 108.8 | I11 I12 S17 | I11-L15 HydrophobicContact CB-CD1 4.49Å; I11-L15 HydrophobicContact CG2-CD1 3.34Å; I11-L15 WeakPolarHBondContact O-CD1 3.17Å; I11-L15 PolarHBondContact O-N 2.95Å; I12-L15 PolarHBondContact O-N 2.75Å; L15-S17 PolarHBondContact O-N 2.9Å |
| 16 | P | 59.3 | Low | 59 | Low | 68 Ų | 68 | 108.1 Ų | 108.1 | 44% | 0.442 | 55% | 0.55 | S | S | . | . | P | Polyproline II helix | trans | -58.2 | 138.9 | 175 | 24.6 | -32.8 | 0 | 0 | 0 | 108.9 | H14 E20 | H14-P16 WeakPolarHBondContact O-CD 3.08Å; P16-E20 HydrophobicContact CB-CB 3.91Å |
| 17 | S | 61.9 | Low | 59 | Low | 63 Ų | 63 | 106.5 Ų | 106.5 | 44% | 0.441 | 55% | 0.545 | S | S | . | . | P | Polyproline II helix | trans | -56.5 | 155 | 177.2 | 71.2 | 0 | 0 | 0 | 0 | 110.4 | L15 A19 E20 F21 | L15-S17 PolarHBondContact O-N 2.9Å; S17-A19 PolarHBondContact O-N 3.21Å; S17-E20 PolarHBondContact O-N 2.9Å; S17-E20 PolarHBondContact OG-N 2.97Å; S17-F21 PolarHBondContact O-N 3.35Å |
| 18 | R | 64.2 | Low | 59 | Low | 230 Ų | 230 | 109.3 Ų | 109.3 | 87% | 0.868 | 55% | 0.554 | S | S | * | * | H | α-helix | trans | -50.1 | -33.4 | 176.3 | -174.5 | 179.3 | 180 | -174.5 | 1.3 | 112.4 | K22 | R18-K22 WeakPolarHBondContact O-CB 3.34Å; R18-K22 PolarHBondContact O-N 2.82Å |
| 19 | A | 66.9 | Low | 59.1 | Low | 61 Ų | 61 | 110.4 Ų | 110.4 | 50% | 0.504 | 56% | 0.555 | S | S | . | * | H | α-helix | trans | -69.1 | -46.7 | 176.3 | 0 | 0 | 0 | 0 | 0 | 112.4 | S17 K22 R23 | S17-A19 PolarHBondContact O-N 3.21Å; A19-K22 PolarHBondContact O-N 3.46Å; A19-R23 WeakPolarHBondContact O-CG 3.16Å; A19-R23 PolarHBondContact O-N 3.28Å |
| 20 | E | 64.5 | Low | 58.7 | Low | 115 Ų | 115 | 115.5 Ų | 115.5 | 54% | 0.537 | 57% | 0.565 | S | S | . | * | H | α-helix | trans | -64.3 | -43.3 | 175.5 | -73 | -169.2 | 150.5 | 0 | 0 | 111.8 | P16 S17 K22 R23 L24 | P16-E20 HydrophobicContact CB-CB 3.91Å; S17-E20 PolarHBondContact O-N 2.9Å; S17-E20 PolarHBondContact OG-N 2.97Å; E20-K22 VanDerWaalsContact C-N 3.32Å; E20-K22 PolarHBondContact O-N 2.8Å; E20-R23 CarbonylContact O-C 3.59Å; E20-R23 WeakPolarHBondContact O-CB 3.48Å; E20-R23 PolarHBondContact O-N 2.82Å; E20-R23 VanDerWaalsContact O-N 3.12Å; E20-L24 WeakPolarHBondContact O-CB 3.39Å; E20-L24 PolarHBondContact O-N 2.8Å |
| 21 | F | 65.7 | Low | 58.2 | Low | 114 Ų | 114 | 122 Ų | 122 | 50% | 0.5 | 58% | 0.582 | S | S | . | * | H | α-helix | trans | -57.8 | -45.8 | 174.4 | -173.6 | -98.9 | 0 | 0 | 0 | 111.1 | S17 R23 L24 I25 | S17-F21 PolarHBondContact O-N 3.35Å; F21-R23 VanDerWaalsContact C-N 3.34Å; F21-R23 PolarHBondContact O-N 3.32Å; F21-L24 WeakPolarHBondContact O-CB 3.32Å; F21-L24 PolarHBondContact O-N 3.46Å; F21-I25 HydrophobicContact CD1-CG1 4.15Å; F21-I25 HydrophobicContact CE1-CD1 4.29Å; F21-I25 HydrophobicContact CE1-CG1 3.82Å; F21-I25 HydrophobicContact CZ-CD1 4.06Å; F21-I25 HydrophobicContact CZ-CG1 4.07Å; F21-I25 WeakPolarHBondContact O-CG1 3.39Å; F21-I25 PolarHBondContact O-N 2.9Å |
| 22 | K | 54.6 | Low | 57.8 | Low | 134 Ų | 134 | 121 Ų | 121 | 58% | 0.583 | 58% | 0.58 | S | S | * | * | H | α-helix | trans | -61 | -41.2 | 175.5 | -170.9 | 178.5 | -177.8 | -177.9 | 0 | 111.9 | R18 A19 E20 I25 Q26 | R18-K22 WeakPolarHBondContact O-CB 3.34Å; R18-K22 PolarHBondContact O-N 2.82Å; A19-K22 PolarHBondContact O-N 3.46Å; E20-K22 VanDerWaalsContact C-N 3.32Å; E20-K22 PolarHBondContact O-N 2.8Å; K22-I25 PolarHBondContact O-N 3.01Å; K22-Q26 WeakPolarHBondContact O-CB 3.35Å; K22-Q26 VanDerWaalsContact O-CG 3.3Å; K22-Q26 WeakPolarHBondContact O-CG 3.33Å; K22-Q26 PolarHBondContact O-N 2.94Å |
| 23 | R | 61.4 | Low | 56.9 | Low | 191 Ų | 191 | 122.1 Ų | 122.1 | 72% | 0.721 | 58% | 0.581 | S | S | * | * | H | α-helix | trans | -64 | -40.7 | 174.9 | -73.7 | -179 | -178.1 | -150.1 | 2.3 | 111.7 | A19 E20 F21 Q26 A27 | A19-R23 WeakPolarHBondContact O-CG 3.16Å; A19-R23 PolarHBondContact O-N 3.28Å; E20-R23 CarbonylContact O-C 3.59Å; E20-R23 WeakPolarHBondContact O-CB 3.48Å; E20-R23 PolarHBondContact O-N 2.82Å; E20-R23 VanDerWaalsContact O-N 3.12Å; F21-R23 VanDerWaalsContact C-N 3.34Å; F21-R23 PolarHBondContact O-N 3.32Å; R23-Q26 PolarHBondContact O-N 3.49Å; R23-A27 WeakPolarHBondContact O-CB 3.33Å; R23-A27 PolarHBondContact O-N 3.19Å |
| 24 | L | 58.9 | Low | 56.4 | Low | 122 Ų | 122 | 117.1 Ų | 117.1 | 64% | 0.639 | 56% | 0.563 | S | S | * | * | H | α-helix | trans | -63.7 | -45 | 178.2 | -157.8 | 106.2 | 0 | 0 | 0 | 111.2 | E20 F21 K28 | E20-L24 WeakPolarHBondContact O-CB 3.39Å; E20-L24 PolarHBondContact O-N 2.8Å; F21-L24 WeakPolarHBondContact O-CB 3.32Å; F21-L24 PolarHBondContact O-N 3.46Å; L24-K28 WeakPolarHBondContact O-CB 3.02Å; L24-K28 PolarHBondContact O-N 3.44Å |
| 25 | I | 61.4 | Low | 55.5 | Low | 79 Ų | 79 | 115 Ų | 115 | 41% | 0.405 | 56% | 0.556 | S | S | . | * | H | α-helix | trans | -64 | -48 | 174.6 | -62.7 | -61.8 | 0 | 0 | 0 | 110.6 | F21 K22 A27 K28 T29 | F21-I25 HydrophobicContact CD1-CG1 4.15Å; F21-I25 HydrophobicContact CE1-CD1 4.29Å; F21-I25 HydrophobicContact CE1-CG1 3.82Å; F21-I25 HydrophobicContact CZ-CD1 4.06Å; F21-I25 HydrophobicContact CZ-CG1 4.07Å; F21-I25 WeakPolarHBondContact O-CG1 3.39Å; F21-I25 PolarHBondContact O-N 2.9Å; K22-I25 PolarHBondContact O-N 3.01Å; I25-A27 PolarHBondContact O-N 2.97Å; I25-K28 WeakPolarHBondContact O-CB 3.47Å; I25-K28 PolarHBondContact O-N 2.77Å; I25-T29 PolarHBondContact O-N 2.78Å; I25-T29 PolarHBondContact O-OG1 2.81Å |
| 26 | Q | 56.4 | Low | 54.5 | Low | 96 Ų | 96 | 113.8 Ų | 113.8 | 45% | 0.449 | 55% | 0.553 | S | S | . | * | H | α-helix | trans | -62.9 | -39.9 | 178.1 | -77.6 | -177.5 | -12.5 | 0 | 0 | 112.8 | K22 R23 K28 T29 R30 | K22-Q26 WeakPolarHBondContact O-CB 3.35Å; K22-Q26 VanDerWaalsContact O-CG 3.3Å; K22-Q26 WeakPolarHBondContact O-CG 3.33Å; K22-Q26 PolarHBondContact O-N 2.94Å; R23-Q26 PolarHBondContact O-N 3.49Å; Q26-K28 VanDerWaalsContact C-N 3.32Å; Q26-T29 PolarHBondContact O-N 3.19Å; Q26-R30 WeakPolarHBondContact O-CB 3.47Å; Q26-R30 WeakPolarHBondContact O-CG 3.46Å; Q26-R30 PolarHBondContact O-N 3.4Å |
| 27 | A | 57.2 | Low | 53.3 | Low | 49 Ų | 49 | 114 Ų | 114 | 41% | 0.405 | 56% | 0.56 | S | S | . | * | H | α-helix | trans | -63.6 | -40.7 | 175.4 | 0 | 0 | 0 | 0 | 0 | 110.6 | R23 I25 R31 | R23-A27 WeakPolarHBondContact O-CB 3.33Å; R23-A27 PolarHBondContact O-N 3.19Å; I25-A27 PolarHBondContact O-N 2.97Å; A27-R31 WeakPolarHBondContact O-CB 3.3Å; A27-R31 VanDerWaalsContact O-CG 3.32Å; A27-R31 WeakPolarHBondContact O-CG 3.34Å; A27-R31 PolarHBondContact O-N 3.02Å |
| 28 | K | 54.8 | Low | 52.1 | Low | 150 Ų | 150 | 115.3 Ų | 115.3 | 65% | 0.652 | 57% | 0.566 | S | S | * | * | H | α-helix | trans | -64.6 | -46 | 173.8 | -162.7 | 169.6 | -175.6 | 177.4 | 0 | 111.2 | L24 I25 Q26 R31 T32 | L24-K28 WeakPolarHBondContact O-CB 3.02Å; L24-K28 PolarHBondContact O-N 3.44Å; I25-K28 WeakPolarHBondContact O-CB 3.47Å; I25-K28 PolarHBondContact O-N 2.77Å; Q26-K28 VanDerWaalsContact C-N 3.32Å; K28-R31 PolarHBondContact O-N 3.38Å; K28-T32 PolarHBondContact O-N 2.86Å; K28-T32 PolarHBondContact O-OG1 3.12Å |
| 29 | T | 53.5 | Low | 50.7 | Low | 69 Ų | 69 | 109.1 Ų | 109.1 | 42% | 0.423 | 55% | 0.554 | S | S | . | * | H | α-helix | trans | -65.4 | -40.7 | 177.3 | -52.4 | 0 | 0 | 0 | 0 | 112.8 | I25 Q26 T32 K33 | I25-T29 PolarHBondContact O-N 2.78Å; I25-T29 PolarHBondContact O-OG1 2.81Å; Q26-T29 PolarHBondContact O-N 3.19Å; T29-T32 PolarHBondContact O-N 3.42Å; T29-K33 PolarHBondContact O-N 2.94Å |
| 30 | R | 49 | Very low | 49 | Very low | 199 Ų | 199 | 117.2 Ų | 117.2 | 75% | 0.751 | 57% | 0.571 | S | S | * | * | H | α-helix | trans | -65.6 | -40.6 | 174.8 | -77.7 | -172.6 | -177.6 | -144.8 | 2.5 | 111.1 | Q26 K33 G34 | Q26-R30 WeakPolarHBondContact O-CB 3.47Å; Q26-R30 WeakPolarHBondContact O-CG 3.46Å; Q26-R30 PolarHBondContact O-N 3.4Å; R30-K33 PolarHBondContact O-N 2.92Å; R30-G34 PolarHBondContact O-N 3.34Å |
| 31 | R | 44.7 | Very low | 47.7 | Very low | 202 Ų | 202 | 117.3 Ų | 117.3 | 76% | 0.762 | 57% | 0.574 | S | S | * | * | H | α-helix | trans | -61.4 | -44.5 | 171.2 | -78.2 | -177 | -176.1 | -179 | 2.5 | 110.8 | A27 K28 G34 L35 | A27-R31 WeakPolarHBondContact O-CB 3.3Å; A27-R31 VanDerWaalsContact O-CG 3.32Å; A27-R31 WeakPolarHBondContact O-CG 3.34Å; A27-R31 PolarHBondContact O-N 3.02Å; K28-R31 PolarHBondContact O-N 3.38Å; R31-G34 PolarHBondContact O-N 2.98Å; R31-L35 WeakPolarHBondContact O-CB 3.18Å; R31-L35 PolarHBondContact O-N 3.39Å |
| 32 | T | 47.5 | Very low | 46.3 | Very low | 78 Ų | 78 | 116.7 Ų | 116.7 | 48% | 0.479 | 58% | 0.58 | S | S | . | * | H | α-helix | trans | -64.5 | -45.1 | 176.8 | -52.1 | 0 | 0 | 0 | 0 | 111.9 | K28 T29 L35 V36 | K28-T32 PolarHBondContact O-N 2.86Å; K28-T32 PolarHBondContact O-OG1 3.12Å; T29-T32 PolarHBondContact O-N 3.42Å; T32-L35 PolarHBondContact O-N 2.86Å; T32-V36 HydrophobicContact CG2-CG2 4.1Å; T32-V36 WeakPolarHBondContact O-CB 3.37Å; T32-V36 WeakPolarHBondContact O-CG2 3.32Å; T32-V36 PolarHBondContact O-N 3.27Å |
| 33 | K | 41.5 | Very low | 45.5 | Very low | 152 Ų | 152 | 116.2 Ų | 116.2 | 66% | 0.661 | 59% | 0.593 | S | S | * | * | H | α-helix | trans | -67.5 | -38.2 | 177.3 | -74.8 | -168.6 | 177.9 | -172.6 | 0 | 112.6 | T29 R30 A37 | T29-K33 PolarHBondContact O-N 2.94Å; R30-K33 PolarHBondContact O-N 2.92Å; K33-A37 WeakPolarHBondContact O-CB 3.39Å; K33-A37 PolarHBondContact O-N 3.19Å |
| 34 | G | 45.1 | Very low | 44.2 | Very low | 36 Ų | 36 | 114.7 Ų | 114.7 | 37% | 0.371 | 59% | 0.594 | S | S | . | * | H | α-helix | trans | -64.9 | -45.5 | 173.1 | 0 | 0 | 0 | 0 | 0 | 111.1 | R30 R31 A37 T38 | R30-G34 PolarHBondContact O-N 3.34Å; R31-G34 PolarHBondContact O-N 2.98Å; G34-A37 PolarHBondContact O-N 3.43Å; G34-T38 PolarHBondContact O-N 3.16Å; G34-T38 PolarHBondContact O-OG1 3.29Å |
| 35 | L | 38.7 | Very low | 43 | Very low | 96 Ų | 96 | 115.6 Ų | 115.6 | 50% | 0.503 | 60% | 0.6 | S | S | . | * | H | α-helix | trans | -63.9 | -43.8 | 176.7 | -145.7 | 82.5 | 0 | 0 | 0 | 110.8 | R31 T32 T38 T39 F54 | R31-L35 WeakPolarHBondContact O-CB 3.18Å; R31-L35 PolarHBondContact O-N 3.39Å; T32-L35 PolarHBondContact O-N 2.86Å; L35-T38 CarbonylContact O-C 3.58Å; L35-T38 PolarHBondContact O-N 3.15Å; L35-T39 VanDerWaalsContact C-OG1 3.29Å; L35-T39 WeakPolarHBondContact O-CB 3.33Å; L35-T39 PolarHBondContact O-N 3.01Å; L35-T39 PolarHBondContact O-OG1 3.49Å; L35-F54 HydrophobicContact CD2-CE1 4.41Å |
| 36 | V | 37.7 | Very low | 42.1 | Very low | 86 Ų | 86 | 120.2 Ų | 120.2 | 52% | 0.521 | 62% | 0.623 | S | S | . | * | H | α-helix | trans | -65.4 | -37.7 | 176.2 | 169.8 | 0 | 0 | 0 | 0 | 111.4 | T32 T38 T39 R40 | T32-V36 HydrophobicContact CG2-CG2 4.1Å; T32-V36 WeakPolarHBondContact O-CB 3.37Å; T32-V36 WeakPolarHBondContact O-CG2 3.32Å; T32-V36 PolarHBondContact O-N 3.27Å; V36-T38 VanDerWaalsContact C-N 3.32Å; V36-T39 VanDerWaalsContact CA-OG1 3.28Å; V36-T39 WeakPolarHBondContact CA-OG1 3.48Å; V36-T39 CarbonylContact O-C 3.45Å; V36-T39 PolarHBondContact O-N 3.28Å; V36-R40 PolarHBondContact O-N 3.29Å |
| 37 | A | 33.9 | Very low | 41.1 | Very low | 71 Ų | 71 | 119.4 Ų | 119.4 | 59% | 0.587 | 63% | 0.625 | S | S | * | * | H | α-helix | trans | -66.9 | -35.4 | 173.8 | 0 | 0 | 0 | 0 | 0 | 111.3 | K33 G34 | K33-A37 WeakPolarHBondContact O-CB 3.39Å; K33-A37 PolarHBondContact O-N 3.19Å; G34-A37 PolarHBondContact O-N 3.43Å |
| 38 | T | 36.9 | Very low | 39.9 | Very low | 92 Ų | 92 | 124.2 Ų | 124.2 | 56% | 0.564 | 64% | 0.643 | S | S | * | * | H | α-helix | trans | -80.8 | -22.7 | 173.8 | -42.8 | 0 | 0 | 0 | 0 | 113 | G34 L35 V36 I41 | G34-T38 PolarHBondContact O-N 3.16Å; G34-T38 PolarHBondContact O-OG1 3.29Å; L35-T38 CarbonylContact O-C 3.58Å; L35-T38 PolarHBondContact O-N 3.15Å; V36-T38 VanDerWaalsContact C-N 3.32Å; T38-I41 HydrophobicContact CG2-CD1 4.14Å; T38-I41 WeakPolarHBondContact O-CB 3.46Å; T38-I41 WeakPolarHBondContact O-CD1 3.41Å; T38-I41 WeakPolarHBondContact O-CG1 3.28Å; T38-I41 PolarHBondContact O-N 3.08Å |
| 39 | T | 33.9 | Very low | 39.2 | Very low | 100 Ų | 100 | 125.1 Ų | 125.1 | 61% | 0.613 | 65% | 0.654 | S | S | * | * | H | α-helix | trans | -92.6 | -1 | 175.2 | 30.5 | 0 | 0 | 0 | 0 | 114 | L35 V36 I41 | L35-T39 VanDerWaalsContact C-OG1 3.29Å; L35-T39 WeakPolarHBondContact O-CB 3.33Å; L35-T39 PolarHBondContact O-N 3.01Å; L35-T39 PolarHBondContact O-OG1 3.49Å; V36-T39 VanDerWaalsContact CA-OG1 3.28Å; V36-T39 WeakPolarHBondContact CA-OG1 3.48Å; V36-T39 CarbonylContact O-C 3.45Å; V36-T39 PolarHBondContact O-N 3.28Å; T39-I41 PolarHBondContact O-N 3.23Å |
| 40 | R | 32.6 | Very low | 38.3 | Very low | 230 Ų | 230 | 131.3 Ų | 131.3 | 87% | 0.868 | 68% | 0.675 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -74.4 | 3.2 | 159.6 | -155.5 | 177.5 | 164 | 163.1 | -5.1 | 112 | V36 T42 | V36-R40 PolarHBondContact O-N 3.29Å; R40-T42 VanDerWaalsContact C-N 3.3Å; R40-T42 PolarHBondContact O-N 3.4Å |
| 41 | I | 36.2 | Very low | 37.7 | Very low | 117 Ų | 117 | 131.2 Ų | 131.2 | 60% | 0.6 | 68% | 0.68 | S | S | * | * | S | Bend | trans | -73.6 | 93.6 | 161.5 | -58.9 | 175.4 | 0 | 0 | 0 | 106.6 | T38 T39 | T38-I41 HydrophobicContact CG2-CD1 4.14Å; T38-I41 WeakPolarHBondContact O-CB 3.46Å; T38-I41 WeakPolarHBondContact O-CD1 3.41Å; T38-I41 WeakPolarHBondContact O-CG1 3.28Å; T38-I41 PolarHBondContact O-N 3.08Å; T39-I41 PolarHBondContact O-N 3.23Å |
| 42 | T | 36.2 | Very low | 37.2 | Very low | 101 Ų | 101 | 124.8 Ų | 124.8 | 62% | 0.62 | 68% | 0.676 | S | S | * | * | trans | 40.7 | 116.7 | 151.6 | 38.3 | 0 | 0 | 0 | 0 | 116.8 | R40 H44 | R40-T42 VanDerWaalsContact C-N 3.3Å; R40-T42 PolarHBondContact O-N 3.4Å; T42-H44 PolarHBondContact O-N 3.43Å | ||
| 43 | S | 38.3 | Very low | 36.4 | Very low | 124 Ų | 124 | 127.2 Ų | 127.2 | 87% | 0.867 | 70% | 0.696 | S | S | * | * | S | Bend | trans | -50.6 | 30.6 | 173.2 | -166.7 | 0 | 0 | 0 | 0 | 117.7 | ||
| 44 | H | 33.4 | Very low | 36.1 | Very low | 160 Ų | 160 | 127.1 Ų | 127.1 | 74% | 0.741 | 70% | 0.696 | S | S | * | * | S | Bend | trans | -133.8 | 121.6 | 179.7 | -61.2 | 79.4 | 0 | 0 | 0 | 107.3 | T42 | T42-H44 PolarHBondContact O-N 3.43Š|
| 45 | N | 34.7 | Very low | 35.7 | Very low | 141 Ų | 141 | 129.3 Ų | 129.3 | 75% | 0.754 | 71% | 0.706 | S | S | * | * | trans | 85.2 | 73.2 | 174.1 | -123.7 | 16.5 | 0 | 0 | 0 | 115.8 | T47 | N45-T47 PolarHBondContact O-N 2.9Å; N45-T47 PolarHBondContact OD1-OG1 3.3Å | ||
| 46 | I | 40.9 | Very low | 35.7 | Very low | 175 Ų | 175 | 129.9 Ų | 129.9 | 90% | 0.897 | 72% | 0.717 | S | S | * | * | trans | -70.8 | 72.5 | 158.2 | -52.2 | 171.2 | 0 | 0 | 0 | 107.3 | ||||
| 47 | T | 36.2 | Very low | 35.5 | Very low | 80 Ų | 80 | 135 Ų | 135 | 49% | 0.491 | 73% | 0.728 | S | S | . | * | trans | -153.7 | 115.7 | -175.8 | -1.8 | 0 | 0 | 0 | 0 | 109.8 | N45 | N45-T47 PolarHBondContact O-N 2.9Å; N45-T47 PolarHBondContact OD1-OG1 3.3Å | ||
| 48 | L | 32.7 | Very low | 35.7 | Very low | 149 Ų | 149 | 136.6 Ų | 136.6 | 78% | 0.78 | 73% | 0.734 | S | S | * | * | trans | 70.9 | 110.8 | 171.3 | -70.1 | 82.5 | 0 | 0 | 0 | 116.5 | ||||
| 49 | I | 40.3 | Very low | 35.9 | Very low | 170 Ų | 170 | 139.9 Ų | 139.9 | 87% | 0.872 | 75% | 0.748 | S | S | * | * | -138.2 | 111.8 | 112.6 | -57.6 | -170.8 | 0 | 0 | 0 | 109.2 | K51 | I49-K51 PolarHBondContact O-N 2.94Š| |||
| 50 | K | 33.9 | Very low | 36.1 | Very low | 199 Ų | 199 | 137.1 Ų | 137.1 | 87% | 0.865 | 74% | 0.739 | S | S | * | * | trans | -77.5 | 96.6 | -178.6 | -172.2 | -175.6 | -172 | -178.3 | 0 | 110.3 | ||||
| 51 | K | 36.4 | Very low | 36.3 | Very low | 197 Ų | 197 | 135.9 Ų | 135.9 | 86% | 0.857 | 74% | 0.735 | S | S | * | * | S | Bend | trans | -168.7 | 101.6 | 150 | -134.8 | 175.1 | -179.3 | 175.3 | 0 | 110.3 | I49 | I49-K51 PolarHBondContact O-N 2.94Š|
| 52 | G | 33.3 | Very low | 36.5 | Very low | 66 Ų | 66 | 136.2 Ų | 136.2 | 68% | 0.68 | 74% | 0.742 | S | S | * | * | S | Bend | trans | 72.5 | 73.8 | 165.6 | 0 | 0 | 0 | 0 | 0 | 115.9 | ||
| 53 | S | 32.1 | Very low | 36.3 | Very low | 129 Ų | 129 | 137 Ų | 137 | 90% | 0.902 | 74% | 0.74 | S | S | * | * | trans | 53.6 | 68.7 | 149.8 | -49 | 0 | 0 | 0 | 0 | 117 | S55 | S53-S55 PolarHBondContact O-N 2.94Š| ||
| 54 | F | 35.7 | Very low | 36 | Very low | 150 Ų | 150 | 137.7 Ų | 137.7 | 66% | 0.658 | 73% | 0.734 | S | S | * | * | trans | -80 | 103.3 | 156.9 | -83.2 | -90.6 | 0 | 0 | 0 | 108.7 | L35 C56 | L35-F54 HydrophobicContact CD2-CE1 4.41Å; F54-C56 VanDerWaalsContact C-N 3.29Å; F54-C56 PolarHBondContact O-N 3.3Å | ||
| 55 | S | 35.9 | Very low | 36.1 | Very low | 83 Ų | 83 | 137.2 Ų | 137.2 | 58% | 0.58 | 74% | 0.736 | S | S | * | * | trans | -67.9 | 93.9 | 165.5 | -167.1 | 0 | 0 | 0 | 0 | 107.4 | S53 Y57 | S53-S55 PolarHBondContact O-N 2.94Å; S55-Y57 PolarHBondContact O-N 3.36Å; S55-Y57 WeakPolarHBondContact OG-CE2 3.45Å | ||
| 56 | C | 38.8 | Very low | 36.3 | Very low | 108 Ų | 108 | 141.4 Ų | 141.4 | 73% | 0.73 | 74% | 0.741 | S | S | * | * | trans | -67.5 | 82.4 | 169 | -66.6 | 0 | 0 | 0 | 0 | 107.9 | F54 S58 | F54-C56 VanDerWaalsContact C-N 3.29Å; F54-C56 PolarHBondContact O-N 3.3Å; C56-S58 PolarHBondContact O-N 2.99Å | ||
| 57 | Y | 32.6 | Very low | 35.9 | Very low | 193 Ų | 193 | 139.8 Ų | 139.8 | 76% | 0.757 | 77% | 0.767 | S | S | * | * | trans | -68.9 | 79.8 | 154.4 | -65.5 | -82.6 | 0 | 0 | 0 | 106.2 | S55 L59 | S55-Y57 PolarHBondContact O-N 3.36Å; S55-Y57 WeakPolarHBondContact OG-CE2 3.45Å; Y57-L59 PolarHBondContact O-N 3.48Å | ||
| 58 | S | 38.6 | Very low | 35.9 | Very low | 104 Ų | 104 | 142.8 Ų | 142.8 | 73% | 0.727 | 78% | 0.781 | S | S | * | * | trans | -61.2 | 93.9 | 154.2 | -173 | 0 | 0 | 0 | 0 | 104.2 | C56 G60 | C56-S58 PolarHBondContact O-N 2.99Å; S58-G60 PolarHBondContact O-N 3.36Å; S58-G60 PolarHBondContact OG-N 3.03Å | ||
| 59 | L | 42.1 | Very low | 36.1 | Very low | 162 Ų | 162 | 142.4 Ų | 142.4 | 85% | 0.848 | 78% | 0.781 | S | S | * | * | trans | -66.8 | 59.5 | 150 | -64.7 | 174.3 | 0 | 0 | 0 | 105.9 | Y57 R61 | Y57-L59 PolarHBondContact O-N 3.48Å; L59-R61 VanDerWaalsContact C-N 3.28Å; L59-R61 PolarHBondContact O-N 3.03Å | ||
| 60 | G | 36.6 | Very low | 35.9 | Very low | 42 Ų | 42 | 140.9 Ų | 140.9 | 43% | 0.433 | 78% | 0.776 | S | S | . | * | trans | -53.2 | 108.6 | 161.3 | 0 | 0 | 0 | 0 | 0 | 103 | S58 V62 | S58-G60 PolarHBondContact O-N 3.36Å; S58-G60 PolarHBondContact OG-N 3.03Å; G60-V62 PolarHBondContact O-N 3.15Å | ||
| 61 | R | 38.4 | Very low | 36 | Very low | 203 Ų | 203 | 137.5 Ų | 137.5 | 77% | 0.766 | 77% | 0.771 | S | S | * | * | trans | -18.8 | 99.2 | 171 | -169.2 | 175.5 | 77.3 | -173.5 | 7.9 | 108.7 | L59 M63 | L59-R61 VanDerWaalsContact C-N 3.28Å; L59-R61 PolarHBondContact O-N 3.03Å; R61-M63 PolarHBondContact NH2-SD 3.36Å; R61-M63 VanDerWaalsContact NH2-SD 3.36Å; R61-M63 PolarHBondContact O-N 3.49Å | ||
| 62 | V | 38.7 | Very low | 35.9 | Very low | 125 Ų | 125 | 133.8 Ų | 133.8 | 76% | 0.758 | 77% | 0.766 | S | S | * | * | trans | -67.2 | 88 | 172.5 | 177.2 | 0 | 0 | 0 | 0 | 104 | G60 N64 | G60-V62 PolarHBondContact O-N 3.15Å; V62-N64 VanDerWaalsContact C-N 3.26Å; V62-N64 PolarHBondContact O-N 2.7Å | ||
| 63 | M | 32.9 | Very low | 36.1 | Very low | 117 Ų | 117 | 138.3 Ų | 138.3 | 58% | 0.576 | 77% | 0.771 | S | S | * | * | trans | -74.2 | 93.9 | 175 | -165.4 | 152.6 | 172 | 0 | 0 | 104.2 | R61 L65 | R61-M63 PolarHBondContact NH2-SD 3.36Å; R61-M63 VanDerWaalsContact NH2-SD 3.36Å; R61-M63 PolarHBondContact O-N 3.49Å; M63-L65 HydrophobicContact CG-CG 4.42Å; M63-L65 PolarHBondContact O-N 3.19Å | ||
| 64 | N | 32.7 | Very low | 36.4 | Very low | 139 Ų | 139 | 138.9 Ų | 138.9 | 74% | 0.743 | 76% | 0.762 | S | S | * | * | trans | -57.6 | 89.4 | 169.8 | -101 | -32.1 | 0 | 0 | 0 | 107.8 | V62 R66 | V62-N64 VanDerWaalsContact C-N 3.26Å; V62-N64 PolarHBondContact O-N 2.7Å; N64-R66 PolarHBondContact O-N 3.49Å | ||
| 65 | L | 34.7 | Very low | 36.5 | Very low | 149 Ų | 149 | 138.1 Ų | 138.1 | 78% | 0.78 | 77% | 0.77 | S | S | * | * | trans | -86.8 | 71.4 | 162.5 | -66.5 | 170.9 | 0 | 0 | 0 | 106.7 | M63 G67 | M63-L65 HydrophobicContact CG-CG 4.42Å; M63-L65 PolarHBondContact O-N 3.19Å; L65-G67 PolarHBondContact O-N 3.44Å | ||
| 66 | R | 37.8 | Very low | 36.5 | Very low | 230 Ų | 230 | 142.7 Ų | 142.7 | 87% | 0.868 | 79% | 0.786 | S | S | * | * | trans | -79.8 | 95.5 | 155.5 | -89.3 | -175.7 | 171.3 | -174.5 | -3.6 | 106.1 | N64 | N64-R66 PolarHBondContact O-N 3.49Š| ||
| 67 | G | 34.2 | Very low | 36.3 | Very low | 140 Ų | 140 | 145.8 Ų | 145.8 | 100% | 1.443 | 79% | 0.791 | S | S | * | * | trans | -67.2 | 0 | 141.6 | 0 | 0 | 0 | 0 | 0 | 110.1 | L65 | L65-G67 PolarHBondContact O-N 3.44Š|
Retrieved 67 of 67 residues in 40.5 ms
(Link to these results)