| 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 | 69.3 | Low | 87.2 | Confident | 203 Ų | 203 | 126.7 Ų | 126.7 | 100% | 1 | 61% | 0.607 | S | S | * | * | 0 | -53 | 0 | -103.6 | -179.6 | -180 | 0 | 0 | 113.9 | Q3 M4 N5 | M1-Q3 PolarHBondContact O-N 3.31Å; M1-M4 PolarHBondContact O-N 3.16Å; M1-N5 PolarHBondContact O-N 3.18Å; M1-N5 VanDerWaalsContact O-N 3.16Å | |||
| 2 | F | 80.5 | Confident | 87.9 | Confident | 150 Ų | 150 | 125.4 Ų | 125.4 | 66% | 0.658 | 61% | 0.605 | S | S | * | * | H | α-helix | trans | -60.3 | -38.9 | -172.3 | -165.9 | -108.5 | 0 | 0 | 0 | 115.4 | N5 R6 | F2-N5 PolarHBondContact O-N 2.92Å; F2-R6 PolarHBondContact O-N 3.5Å; F2-R6 VanDerWaalsContact O-N 3.1Å |
| 3 | Q | 82.8 | Confident | 88.4 | Confident | 172 Ų | 172 | 123.2 Ų | 123.2 | 80% | 0.804 | 60% | 0.595 | S | S | * | * | H | α-helix | trans | -64.1 | -41.2 | 176.3 | -74.6 | -174.5 | -10.4 | 0 | 0 | 112.6 | M1 R6 F7 | M1-Q3 PolarHBondContact O-N 3.31Å; Q3-R6 PolarHBondContact O-N 3.04Å; Q3-F7 PolarHBondContact O-N 3.26Å; Q3-F7 VanDerWaalsContact O-N 3.1Å |
| 4 | M | 84 | Confident | 88.8 | Confident | 129 Ų | 129 | 123.3 Ų | 123.3 | 64% | 0.635 | 60% | 0.596 | S | S | * | * | H | α-helix | trans | -63.6 | -42.9 | 177.8 | -162.9 | 172.9 | 103.2 | 0 | 0 | 111 | M1 R6 F7 L8 | M1-M4 PolarHBondContact O-N 3.16Å; M4-R6 VanDerWaalsContact C-N 3.34Å; M4-R6 PolarHBondContact O-N 3.38Å; M4-F7 PolarHBondContact O-N 3.1Å; M4-L8 WeakPolarHBondContact O-CG 3.44Å; M4-L8 PolarHBondContact O-N 3.43Å |
| 5 | N | 90.2 | Very high | 89.3 | Confident | 79 Ų | 79 | 123.4 Ų | 123.4 | 42% | 0.422 | 60% | 0.598 | S | S | . | * | H | α-helix | trans | -61.3 | -41.1 | 175.7 | -68.4 | 3.6 | 0 | 0 | 0 | 111.9 | M1 F2 F7 L8 I9 | M1-N5 PolarHBondContact O-N 3.18Å; M1-N5 VanDerWaalsContact O-N 3.16Å; F2-N5 PolarHBondContact O-N 2.92Å; N5-F7 PolarHBondContact O-N 3.47Å; N5-L8 PolarHBondContact O-N 2.95Å; N5-I9 WeakPolarHBondContact O-CD1 3.23Å; N5-I9 VanDerWaalsContact O-CG1 3.23Å; N5-I9 WeakPolarHBondContact O-CG1 3.47Å; N5-I9 PolarHBondContact O-N 3.31Å |
| 6 | R | 90.5 | Very high | 89.7 | Confident | 144 Ų | 144 | 122.1 Ų | 122.1 | 54% | 0.543 | 59% | 0.592 | S | S | . | * | H | α-helix | trans | -64.1 | -39.7 | 177.6 | -171.5 | -175 | -67.5 | -163.2 | -4.3 | 112.3 | F2 Q3 M4 K10 | F2-R6 PolarHBondContact O-N 3.5Å; F2-R6 VanDerWaalsContact O-N 3.1Å; Q3-R6 PolarHBondContact O-N 3.04Å; M4-R6 VanDerWaalsContact C-N 3.34Å; M4-R6 PolarHBondContact O-N 3.38Å; R6-K10 WeakPolarHBondContact O-CG 3.43Å; R6-K10 PolarHBondContact O-N 3.49Å |
| 7 | F | 92.4 | Very high | 90 | Very high | 159 Ų | 159 | 121.3 Ų | 121.3 | 70% | 0.697 | 59% | 0.589 | S | S | * | * | H | α-helix | trans | -65 | -45.3 | 176.8 | -174.1 | -96.8 | 0 | 0 | 0 | 111.3 | Q3 M4 N5 I9 K10 G11 | Q3-F7 PolarHBondContact O-N 3.26Å; Q3-F7 VanDerWaalsContact O-N 3.1Å; M4-F7 PolarHBondContact O-N 3.1Å; N5-F7 PolarHBondContact O-N 3.47Å; F7-I9 PolarHBondContact O-N 3.42Å; F7-K10 PolarHBondContact O-N 3.27Å; F7-G11 PolarHBondContact O-N 3.1Å |
| 8 | L | 92.3 | Very high | 90.4 | Very high | 93 Ų | 93 | 119.9 Ų | 119.9 | 49% | 0.487 | 58% | 0.582 | S | S | . | * | H | α-helix | trans | -60.9 | -44.8 | 176.3 | -70.6 | 171.8 | 0 | 0 | 0 | 112.3 | M4 N5 K10 G11 L12 | M4-L8 WeakPolarHBondContact O-CG 3.44Å; M4-L8 PolarHBondContact O-N 3.43Å; N5-L8 PolarHBondContact O-N 2.95Å; L8-K10 PolarHBondContact O-N 3.32Å; L8-G11 PolarHBondContact O-N 3.49Å; L8-L12 WeakPolarHBondContact O-CB 3.43Å; L8-L12 WeakPolarHBondContact O-CG 3.46Å; L8-L12 PolarHBondContact O-N 3.28Å |
| 9 | I | 92.6 | Very high | 90.7 | Very high | 100 Ų | 100 | 119.4 Ų | 119.4 | 51% | 0.513 | 58% | 0.58 | S | S | . | * | H | α-helix | trans | -61.3 | -45.5 | 176.9 | -67.6 | 163.5 | 0 | 0 | 0 | 110.8 | N5 F7 G11 L12 M13 | N5-I9 WeakPolarHBondContact O-CD1 3.23Å; N5-I9 VanDerWaalsContact O-CG1 3.23Å; N5-I9 WeakPolarHBondContact O-CG1 3.47Å; N5-I9 PolarHBondContact O-N 3.31Å; F7-I9 PolarHBondContact O-N 3.42Å; I9-G11 PolarHBondContact O-N 3.05Å; I9-L12 PolarHBondContact O-N 3.29Å; I9-M13 HydrophobicContact CG2-CG 4.43Å; I9-M13 HydrophobicContact CG2-SD 4.44Å; I9-M13 WeakPolarHBondContact O-CG 3.43Å; I9-M13 PolarHBondContact O-N 3.41Å |
| 10 | K | 91.3 | Very high | 90.9 | Very high | 131 Ų | 131 | 119.2 Ų | 119.2 | 57% | 0.57 | 58% | 0.579 | S | S | * | * | H | α-helix | trans | -62.3 | -43 | 177.3 | -76.9 | -176.7 | 174.5 | -170 | 0 | 112.2 | R6 F7 L8 M13 M14 | R6-K10 WeakPolarHBondContact O-CG 3.43Å; R6-K10 PolarHBondContact O-N 3.49Å; F7-K10 PolarHBondContact O-N 3.27Å; L8-K10 PolarHBondContact O-N 3.32Å; K10-M13 PolarHBondContact O-N 3.42Å; K10-M14 WeakPolarHBondContact O-CB 3.41Å; K10-M14 PolarHBondContact O-N 2.96Å |
| 11 | G | 93.5 | Very high | 91.2 | Very high | 34 Ų | 34 | 119 Ų | 119 | 35% | 0.351 | 58% | 0.579 | S | S | . | * | H | α-helix | trans | -60.9 | -46.5 | 176.3 | 0 | 0 | 0 | 0 | 0 | 112.1 | F7 L8 I9 M14 M15 | F7-G11 PolarHBondContact O-N 3.1Å; L8-G11 PolarHBondContact O-N 3.49Å; I9-G11 PolarHBondContact O-N 3.05Å; G11-M14 PolarHBondContact O-N 2.95Å; G11-M15 WeakPolarHBondContact O-CG 3.4Å; G11-M15 PolarHBondContact O-N 3.38Å |
| 12 | L | 94.8 | Very high | 92.5 | Very high | 111 Ų | 111 | 114.4 Ų | 114.4 | 58% | 0.581 | 56% | 0.556 | S | S | * | * | H | α-helix | trans | -61.2 | -46.5 | 175.8 | -77.5 | 166.1 | 0 | 0 | 0 | 112.2 | L8 I9 M14 M15 M16 | L8-L12 WeakPolarHBondContact O-CB 3.43Å; L8-L12 WeakPolarHBondContact O-CG 3.46Å; L8-L12 PolarHBondContact O-N 3.28Å; I9-L12 PolarHBondContact O-N 3.29Å; L12-M14 VanDerWaalsContact C-N 3.31Å; L12-M14 PolarHBondContact O-N 2.91Å; L12-M15 PolarHBondContact O-N 2.92Å; L12-M16 WeakPolarHBondContact O-CG 3.38Å; L12-M16 PolarHBondContact O-N 2.88Å |
| 13 | M | 94.4 | Very high | 93.2 | Very high | 97 Ų | 97 | 111.6 Ų | 111.6 | 48% | 0.478 | 55% | 0.551 | S | S | . | * | H | α-helix | trans | -60.8 | -41 | 176.8 | -72.1 | -167.7 | -29.6 | 0 | 0 | 111.9 | I9 K10 M16 M17 | I9-M13 HydrophobicContact CG2-CG 4.43Å; I9-M13 HydrophobicContact CG2-SD 4.44Å; I9-M13 WeakPolarHBondContact O-CG 3.43Å; I9-M13 PolarHBondContact O-N 3.41Å; K10-M13 PolarHBondContact O-N 3.42Å; M13-M16 PolarHBondContact O-N 2.96Å; M13-M17 HydrophobicContact CB-CE 4.19Å; M13-M17 WeakPolarHBondContact O-CG 3.35Å; M13-M17 PolarHBondContact O-N 2.94Å |
| 14 | M | 95.1 | Very high | 93.9 | Very high | 124 Ų | 124 | 108.8 Ų | 108.8 | 61% | 0.611 | 54% | 0.54 | S | S | * | . | H | α-helix | trans | -65 | -42.9 | 177.8 | -168.3 | 171.2 | -178.3 | 0 | 0 | 111.5 | K10 G11 L12 M17 M18 | K10-M14 WeakPolarHBondContact O-CB 3.41Å; K10-M14 PolarHBondContact O-N 2.96Å; G11-M14 PolarHBondContact O-N 2.95Å; L12-M14 VanDerWaalsContact C-N 3.31Å; L12-M14 PolarHBondContact O-N 2.91Å; M14-M17 PolarHBondContact O-N 3.5Å; M14-M18 WeakPolarHBondContact O-CG 3.37Å; M14-M18 PolarHBondContact O-N 3.37Å |
| 15 | M | 95.6 | Very high | 94.4 | Very high | 125 Ų | 125 | 107.6 Ų | 107.6 | 62% | 0.616 | 53% | 0.534 | S | S | * | . | H | α-helix | trans | -62.3 | -43.4 | 173.9 | -71.8 | -175 | 79.4 | 0 | 0 | 112 | G11 L12 M17 M18 M19 | G11-M15 WeakPolarHBondContact O-CG 3.4Å; G11-M15 PolarHBondContact O-N 3.38Å; L12-M15 PolarHBondContact O-N 2.92Å; M15-M17 PolarHBondContact O-N 3.36Å; M15-M18 PolarHBondContact O-N 2.92Å; M15-M19 WeakPolarHBondContact O-CG 3.38Å; M15-M19 PolarHBondContact O-N 3.33Å |
| 16 | M | 95.7 | Very high | 94.8 | Very high | 102 Ų | 102 | 110.3 Ų | 110.3 | 50% | 0.502 | 55% | 0.546 | S | S | . | . | H | α-helix | trans | -61.4 | -44.1 | 175.9 | -73.8 | -177 | 71.1 | 0 | 0 | 111.9 | L12 M13 M19 M20 | L12-M16 WeakPolarHBondContact O-CG 3.38Å; L12-M16 PolarHBondContact O-N 2.88Å; M13-M16 PolarHBondContact O-N 2.96Å; M16-M19 HydrophobicContact CG-CE 4.41Å; M16-M19 PolarHBondContact O-N 2.96Å; M16-M20 HydrophobicContact CE-CE 4.4Å; M16-M20 WeakPolarHBondContact O-CG 3.4Å; M16-M20 PolarHBondContact O-N 3.32Å |
| 17 | M | 95.5 | Very high | 95.1 | Very high | 109 Ų | 109 | 108.5 Ų | 108.5 | 54% | 0.537 | 55% | 0.545 | S | S | . | . | H | α-helix | trans | -62.1 | -43.5 | 175.9 | -78.6 | -173.2 | -92.6 | 0 | 0 | 111.9 | M13 M14 M15 M20 M21 | M13-M17 HydrophobicContact CB-CE 4.19Å; M13-M17 WeakPolarHBondContact O-CG 3.35Å; M13-M17 PolarHBondContact O-N 2.94Å; M14-M17 PolarHBondContact O-N 3.5Å; M15-M17 PolarHBondContact O-N 3.36Å; M17-M20 PolarHBondContact O-N 2.91Å; M17-M21 WeakPolarHBondContact O-CG 3.4Å; M17-M21 PolarHBondContact O-N 3.42Å |
| 18 | M | 96.1 | Very high | 95.3 | Very high | 97 Ų | 97 | 105.8 Ų | 105.8 | 48% | 0.478 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -61.8 | -44.1 | 175.8 | -73.3 | -176.2 | 72.5 | 0 | 0 | 111.9 | M14 M15 M21 M22 | M14-M18 WeakPolarHBondContact O-CG 3.37Å; M14-M18 PolarHBondContact O-N 3.37Å; M15-M18 PolarHBondContact O-N 2.92Å; M18-M21 PolarHBondContact O-N 3.33Å; M18-M22 HydrophobicContact CE-CE 4.42Å; M18-M22 WeakPolarHBondContact O-CG 3.44Å; M18-M22 PolarHBondContact O-N 2.89Å |
| 19 | M | 96.3 | Very high | 95.5 | Very high | 110 Ų | 110 | 106.3 Ų | 106.3 | 54% | 0.542 | 54% | 0.537 | S | S | . | . | H | α-helix | trans | -62.4 | -44.8 | 176 | -72.9 | -167.5 | -61.2 | 0 | 0 | 111.7 | M15 M16 M21 M22 V23 | M15-M19 WeakPolarHBondContact O-CG 3.38Å; M15-M19 PolarHBondContact O-N 3.33Å; M16-M19 HydrophobicContact CG-CE 4.41Å; M16-M19 PolarHBondContact O-N 2.96Å; M19-M21 VanDerWaalsContact C-N 3.32Å; M19-M21 PolarHBondContact O-N 3.35Å; M19-M22 PolarHBondContact O-N 3.4Å; M19-V23 WeakPolarHBondContact O-CG2 3.4Å; M19-V23 PolarHBondContact O-N 3.46Å |
| 20 | M | 96 | Very high | 95.7 | Very high | 114 Ų | 114 | 108 Ų | 108 | 56% | 0.562 | 54% | 0.541 | S | S | * | . | H | α-helix | trans | -59.5 | -43.1 | 176.3 | -74.3 | -174.4 | -172.8 | 0 | 0 | 111.7 | M16 M17 V23 M24 | M16-M20 HydrophobicContact CE-CE 4.4Å; M16-M20 WeakPolarHBondContact O-CG 3.4Å; M16-M20 PolarHBondContact O-N 3.32Å; M17-M20 PolarHBondContact O-N 2.91Å; M20-V23 PolarHBondContact O-N 3.33Å; M20-M24 WeakPolarHBondContact O-CG 3.43Å; M20-M24 PolarHBondContact O-N 3.33Å |
| 21 | M | 96.1 | Very high | 96 | Very high | 117 Ų | 117 | 107.2 Ų | 107.2 | 58% | 0.576 | 54% | 0.54 | S | S | * | . | H | α-helix | trans | -63.7 | -42.4 | 176.2 | -71.9 | -147.5 | -65 | 0 | 0 | 112.3 | M17 M18 M19 V23 M24 M25 | M17-M21 WeakPolarHBondContact O-CG 3.4Å; M17-M21 PolarHBondContact O-N 3.42Å; M18-M21 PolarHBondContact O-N 3.33Å; M19-M21 VanDerWaalsContact C-N 3.32Å; M19-M21 PolarHBondContact O-N 3.35Å; M21-V23 VanDerWaalsContact C-N 3.33Å; M21-V23 PolarHBondContact O-N 2.92Å; M21-M24 HydrophobicContact CG-CE 4.27Å; M21-M24 PolarHBondContact O-N 3.22Å; M21-M25 WeakPolarHBondContact O-CG 3.33Å; M21-M25 PolarHBondContact O-N 2.94Å |
| 22 | M | 96.4 | Very high | 96.1 | Very high | 106 Ų | 106 | 111.3 Ų | 111.3 | 52% | 0.522 | 55% | 0.552 | S | S | . | * | H | α-helix | trans | -61.2 | -42.4 | 175.4 | -71.1 | -173.4 | -154.4 | 0 | 0 | 112 | M18 M19 M25 M26 | M18-M22 HydrophobicContact CE-CE 4.42Å; M18-M22 WeakPolarHBondContact O-CG 3.44Å; M18-M22 PolarHBondContact O-N 2.89Å; M19-M22 PolarHBondContact O-N 3.4Å; M22-M25 PolarHBondContact O-N 2.93Å; M22-M26 WeakPolarHBondContact O-CG 3.27Å; M22-M26 PolarHBondContact O-N 3.38Å |
| 23 | V | 96.1 | Very high | 96.2 | Very high | 91 Ų | 91 | 111.3 Ų | 111.3 | 55% | 0.552 | 55% | 0.549 | S | S | * | . | H | α-helix | trans | -63 | -46.1 | 176.6 | 172.2 | 0 | 0 | 0 | 0 | 110.7 | M19 M20 M21 M25 M26 M27 | M19-V23 WeakPolarHBondContact O-CG2 3.4Å; M19-V23 PolarHBondContact O-N 3.46Å; M20-V23 PolarHBondContact O-N 3.33Å; M21-V23 VanDerWaalsContact C-N 3.33Å; M21-V23 PolarHBondContact O-N 2.92Å; V23-M25 VanDerWaalsContact C-N 3.32Å; V23-M25 PolarHBondContact O-N 3.33Å; V23-M26 PolarHBondContact O-N 3.45Å; V23-M27 HydrophobicContact CG1-CG 4.43Å; V23-M27 VanDerWaalsContact O-CG 3.31Å; V23-M27 WeakPolarHBondContact O-CG 3.31Å; V23-M27 PolarHBondContact O-N 2.94Å |
| 24 | M | 96.3 | Very high | 96.2 | Very high | 113 Ų | 113 | 114.8 Ų | 114.8 | 56% | 0.557 | 56% | 0.557 | S | S | * | * | H | α-helix | trans | -59.8 | -41.9 | 176.3 | -73.1 | -166.5 | -67.8 | 0 | 0 | 112 | M20 M21 M27 M28 | M20-M24 WeakPolarHBondContact O-CG 3.43Å; M20-M24 PolarHBondContact O-N 3.33Å; M21-M24 HydrophobicContact CG-CE 4.27Å; M21-M24 PolarHBondContact O-N 3.22Å; M24-M27 PolarHBondContact O-N 2.92Å; M24-M28 WeakPolarHBondContact O-CG 3.4Å; M24-M28 PolarHBondContact O-N 3.28Å |
| 25 | M | 96.4 | Very high | 96.3 | Very high | 104 Ų | 104 | 114.2 Ų | 114.2 | 51% | 0.512 | 56% | 0.556 | S | S | . | * | H | α-helix | trans | -63.2 | -44.1 | 175.5 | -72.2 | -164.1 | -61.3 | 0 | 0 | 112.4 | M21 M22 V23 M27 M28 I29 | M21-M25 WeakPolarHBondContact O-CG 3.33Å; M21-M25 PolarHBondContact O-N 2.94Å; M22-M25 PolarHBondContact O-N 2.93Å; V23-M25 VanDerWaalsContact C-N 3.32Å; V23-M25 PolarHBondContact O-N 3.33Å; M25-M27 VanDerWaalsContact C-N 3.31Å; M25-M27 PolarHBondContact O-N 3.23Å; M25-M28 HydrophobicContact CG-CE 4.22Å; M25-M28 PolarHBondContact O-N 2.92Å; M25-I29 VanDerWaalsContact O-CG1 3.27Å; M25-I29 WeakPolarHBondContact O-CG1 3.29Å; M25-I29 PolarHBondContact O-N 3.19Å |
| 26 | M | 96.8 | Very high | 96.3 | Very high | 136 Ų | 136 | 112.5 Ų | 112.5 | 67% | 0.67 | 55% | 0.549 | S | S | * | . | H | α-helix | trans | -60.2 | -42.1 | 176.2 | -76.7 | -74.8 | 174 | 0 | 0 | 111.7 | M22 V23 I29 F30 | M22-M26 WeakPolarHBondContact O-CG 3.27Å; M22-M26 PolarHBondContact O-N 3.38Å; V23-M26 PolarHBondContact O-N 3.45Å; M26-I29 PolarHBondContact O-N 3.44Å; M26-F30 WeakPolarHBondContact O-CB 3.42Å; M26-F30 PolarHBondContact O-N 3.36Å |
| 27 | M | 96.6 | Very high | 96.2 | Very high | 106 Ų | 106 | 112.4 Ų | 112.4 | 52% | 0.522 | 55% | 0.548 | S | S | . | . | H | α-helix | trans | -63.3 | -45.1 | 176 | -69 | -64.9 | -69.6 | 0 | 0 | 111.6 | V23 M24 M25 I29 F30 E31 | V23-M27 HydrophobicContact CG1-CG 4.43Å; V23-M27 VanDerWaalsContact O-CG 3.31Å; V23-M27 WeakPolarHBondContact O-CG 3.31Å; V23-M27 PolarHBondContact O-N 2.94Å; M24-M27 PolarHBondContact O-N 2.92Å; M25-M27 VanDerWaalsContact C-N 3.31Å; M25-M27 PolarHBondContact O-N 3.23Å; M27-I29 VanDerWaalsContact C-N 3.35Å; M27-I29 PolarHBondContact O-N 2.89Å; M27-F30 WeakPolarHBondContact O-CB 3.48Å; M27-F30 PolarHBondContact O-N 3.46Å; M27-E31 WeakPolarHBondContact O-CG 3.41Å; M27-E31 PolarHBondContact O-N 3.43Å |
| 28 | M | 97.4 | Very high | 96.2 | Very high | 102 Ų | 102 | 113.3 Ų | 113.3 | 50% | 0.502 | 55% | 0.549 | S | S | . | . | H | α-helix | trans | -61.5 | -42.6 | 176.3 | -74.1 | -172.7 | -76.8 | 0 | 0 | 112 | M24 M25 F30 E31 I32 | M24-M28 WeakPolarHBondContact O-CG 3.4Å; M24-M28 PolarHBondContact O-N 3.28Å; M25-M28 HydrophobicContact CG-CE 4.22Å; M25-M28 PolarHBondContact O-N 2.92Å; M28-F30 VanDerWaalsContact C-N 3.31Å; M28-F30 PolarHBondContact O-N 2.96Å; M28-E31 PolarHBondContact O-N 3.35Å; M28-I32 WeakPolarHBondContact O-CD1 3.34Å; M28-I32 VanDerWaalsContact O-CG1 3.25Å; M28-I32 WeakPolarHBondContact O-CG1 3.25Å; M28-I32 PolarHBondContact O-N 2.93Å |
| 29 | I | 97 | Very high | 96.1 | Very high | 103 Ų | 103 | 111 Ų | 111 | 53% | 0.528 | 54% | 0.543 | S | S | . | . | H | α-helix | trans | -61.5 | -43.9 | 175.9 | -67.8 | 164.4 | 0 | 0 | 0 | 110 | M25 M26 M27 I32 H33 | M25-I29 VanDerWaalsContact O-CG1 3.27Å; M25-I29 WeakPolarHBondContact O-CG1 3.29Å; M25-I29 PolarHBondContact O-N 3.19Å; M26-I29 PolarHBondContact O-N 3.44Å; M27-I29 VanDerWaalsContact C-N 3.35Å; M27-I29 PolarHBondContact O-N 2.89Å; I29-I32 PolarHBondContact O-N 2.87Å; I29-H33 VanDerWaalsContact O-CB 3.29Å; I29-H33 WeakPolarHBondContact O-CB 3.43Å; I29-H33 PolarHBondContact O-N 2.99Å |
| 30 | F | 97.4 | Very high | 96 | Very high | 136 Ų | 136 | 110 Ų | 110 | 60% | 0.596 | 54% | 0.539 | S | S | * | . | H | α-helix | trans | -62.9 | -44 | 178 | -176.7 | -97.4 | 0 | 0 | 0 | 112.3 | M26 M27 M28 H33 W34 | M26-F30 WeakPolarHBondContact O-CB 3.42Å; M26-F30 PolarHBondContact O-N 3.36Å; M27-F30 WeakPolarHBondContact O-CB 3.48Å; M27-F30 PolarHBondContact O-N 3.46Å; M28-F30 VanDerWaalsContact C-N 3.31Å; M28-F30 PolarHBondContact O-N 2.96Å; F30-H33 PolarHBondContact O-N 3.35Å; F30-W34 WeakPolarHBondContact O-CB 3.44Å; F30-W34 PolarHBondContact O-N 3.35Å |
| 31 | E | 96.8 | Very high | 95.8 | Very high | 115 Ų | 115 | 108.6 Ų | 108.6 | 54% | 0.537 | 54% | 0.536 | S | S | . | . | H | α-helix | trans | -61.5 | -45.5 | 176.7 | -75.2 | -178 | 174.4 | 0 | 0 | 112.1 | M27 M28 H33 W34 L35 | M27-E31 WeakPolarHBondContact O-CG 3.41Å; M27-E31 PolarHBondContact O-N 3.43Å; M28-E31 PolarHBondContact O-N 3.35Å; E31-H33 VanDerWaalsContact C-N 3.32Å; E31-H33 PolarHBondContact O-N 2.96Å; E31-W34 PolarHBondContact O-N 2.94Å; E31-L35 WeakPolarHBondContact O-CG 3.48Å; E31-L35 PolarHBondContact O-N 2.83Å |
| 32 | I | 96.6 | Very high | 95.7 | Very high | 119 Ų | 119 | 106.6 Ų | 106.6 | 61% | 0.61 | 53% | 0.528 | S | S | * | . | H | α-helix | trans | -61.3 | -45 | 175.8 | -66.9 | 165.1 | 0 | 0 | 0 | 110.1 | M28 I29 W34 L35 L36 | M28-I32 WeakPolarHBondContact O-CD1 3.34Å; M28-I32 VanDerWaalsContact O-CG1 3.25Å; M28-I32 WeakPolarHBondContact O-CG1 3.25Å; M28-I32 PolarHBondContact O-N 2.93Å; I29-I32 PolarHBondContact O-N 2.87Å; I32-W34 VanDerWaalsContact C-N 3.35Å; I32-W34 PolarHBondContact O-N 3.47Å; I32-L35 PolarHBondContact O-N 2.97Å; I32-L36 WeakPolarHBondContact O-CB 3.34Å; I32-L36 PolarHBondContact O-N 3.25Å |
| 33 | H | 95.4 | Very high | 95.5 | Very high | 112 Ų | 112 | 105.4 Ų | 105.4 | 52% | 0.519 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -62.5 | -42.6 | 179.1 | -155.9 | 82.6 | 0 | 0 | 0 | 111.5 | I29 F30 E31 L36 M37 | I29-H33 VanDerWaalsContact O-CB 3.29Å; I29-H33 WeakPolarHBondContact O-CB 3.43Å; I29-H33 PolarHBondContact O-N 2.99Å; F30-H33 PolarHBondContact O-N 3.35Å; E31-H33 VanDerWaalsContact C-N 3.32Å; E31-H33 PolarHBondContact O-N 2.96Å; H33-L36 PolarHBondContact O-N 3.01Å; H33-M37 WeakPolarHBondContact O-CG 3.32Å; H33-M37 PolarHBondContact O-N 3.44Å |
| 34 | W | 95.6 | Very high | 95.4 | Very high | 170 Ų | 170 | 110.7 Ų | 110.7 | 64% | 0.644 | 53% | 0.533 | S | S | * | . | H | α-helix | trans | -62.7 | -45.3 | 176 | 176.9 | -107.2 | 0 | 0 | 0 | 112.6 | F30 E31 I32 L36 M37 K38 | F30-W34 WeakPolarHBondContact O-CB 3.44Å; F30-W34 PolarHBondContact O-N 3.35Å; E31-W34 PolarHBondContact O-N 2.94Å; I32-W34 VanDerWaalsContact C-N 3.35Å; I32-W34 PolarHBondContact O-N 3.47Å; W34-L36 VanDerWaalsContact C-N 3.31Å; W34-L36 PolarHBondContact O-N 2.85Å; W34-M37 PolarHBondContact O-N 3.38Å; W34-K38 PolarHBondContact O-N 3.33Å |
| 35 | L | 95.5 | Very high | 95.3 | Very high | 111 Ų | 111 | 111.4 Ų | 111.4 | 58% | 0.581 | 53% | 0.534 | S | S | * | . | H | α-helix | trans | -62.3 | -39 | 176.7 | -73.3 | 172.8 | 0 | 0 | 0 | 111.9 | E31 I32 K38 S39 | E31-L35 WeakPolarHBondContact O-CG 3.48Å; E31-L35 PolarHBondContact O-N 2.83Å; I32-L35 PolarHBondContact O-N 2.97Å; L35-K38 PolarHBondContact O-N 3.48Å; L35-S39 PolarHBondContact O-N 3.28Å |
| 36 | L | 95.8 | Very high | 95.1 | Very high | 90 Ų | 90 | 111 Ų | 111 | 47% | 0.471 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -63.5 | -45.2 | 174.5 | -176.4 | 66.9 | 0 | 0 | 0 | 111.5 | I32 H33 W34 K38 S39 L40 | I32-L36 WeakPolarHBondContact O-CB 3.34Å; I32-L36 PolarHBondContact O-N 3.25Å; H33-L36 PolarHBondContact O-N 3.01Å; W34-L36 VanDerWaalsContact C-N 3.31Å; W34-L36 PolarHBondContact O-N 2.85Å; L36-K38 VanDerWaalsContact C-N 3.28Å; L36-K38 PolarHBondContact O-N 2.95Å; L36-S39 PolarHBondContact O-N 3.17Å; L36-S39 VanDerWaalsContact O-N 3.17Å; L36-S39 PolarHBondContact O-OG 3.44Å; L36-L40 HydrophobicContact CG-CD1 4.41Å; L36-L40 WeakPolarHBondContact O-CG 3.42Å; L36-L40 PolarHBondContact O-N 3.36Å |
| 37 | M | 95.4 | Very high | 94.9 | Very high | 100 Ų | 100 | 111.3 Ų | 111.3 | 49% | 0.493 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -61.4 | -39.5 | 177.3 | -68.8 | -61.3 | -83.2 | 0 | 0 | 111.7 | H33 W34 L40 V41 | H33-M37 WeakPolarHBondContact O-CG 3.32Å; H33-M37 PolarHBondContact O-N 3.44Å; W34-M37 PolarHBondContact O-N 3.38Å; M37-L40 PolarHBondContact O-N 3.46Å; M37-L40 HydrophobicContact SD-CD1 4.17Å; M37-V41 WeakPolarHBondContact O-CG2 3.36Å; M37-V41 PolarHBondContact O-N 3.14Å; M37-V41 VanDerWaalsContact O-N 3.12Å |
| 38 | K | 94.8 | Very high | 94.7 | Very high | 127 Ų | 127 | 111.6 Ų | 111.6 | 55% | 0.552 | 53% | 0.53 | S | S | * | . | H | α-helix | trans | -64.2 | -41.1 | 174.8 | -173.6 | 175.6 | 179.8 | -179.9 | 0 | 112.3 | W34 L35 L36 V41 N42 | W34-K38 PolarHBondContact O-N 3.33Å; L35-K38 PolarHBondContact O-N 3.48Å; L36-K38 VanDerWaalsContact C-N 3.28Å; L36-K38 PolarHBondContact O-N 2.95Å; K38-V41 PolarHBondContact O-N 2.85Å; K38-N42 PolarHBondContact O-N 2.98Å; K38-N42 VanDerWaalsContact O-N 3.15Å |
| 39 | S | 93.7 | Very high | 94.5 | Very high | 50 Ų | 50 | 110.7 Ų | 110.7 | 35% | 0.35 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -67.5 | -38.4 | 178.1 | 73.6 | 0 | 0 | 0 | 0 | 111.9 | L35 L36 V41 N42 L43 | L35-S39 PolarHBondContact O-N 3.28Å; L36-S39 PolarHBondContact O-N 3.17Å; L36-S39 VanDerWaalsContact O-N 3.17Å; L36-S39 PolarHBondContact O-OG 3.44Å; S39-V41 PolarHBondContact O-N 3.15Å; S39-N42 WeakPolarHBondContact O-CB 3.47Å; S39-N42 PolarHBondContact O-N 2.95Å; S39-N42 VanDerWaalsContact O-N 3.14Å; S39-L43 WeakPolarHBondContact O-CG 3.46Å; S39-L43 PolarHBondContact O-N 3.29Å |
| 40 | L | 93.3 | Very high | 94.3 | Very high | 89 Ų | 89 | 109.8 Ų | 109.8 | 47% | 0.466 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -61.3 | -41.6 | 174.3 | -70.4 | 174 | 0 | 0 | 0 | 112.4 | L36 M37 N42 L43 R44 | L36-L40 HydrophobicContact CG-CD1 4.41Å; L36-L40 WeakPolarHBondContact O-CG 3.42Å; L36-L40 PolarHBondContact O-N 3.36Å; M37-L40 PolarHBondContact O-N 3.46Å; M37-L40 HydrophobicContact SD-CD1 4.17Å; L40-N42 VanDerWaalsContact C-N 3.3Å; L40-N42 PolarHBondContact O-N 3.41Å; L40-L43 HydrophobicContact CD2-CD1 4.34Å; L40-L43 PolarHBondContact O-N 3.12Å; L40-R44 PolarHBondContact O-N 3.43Å |
| 41 | V | 93.4 | Very high | 94.1 | Very high | 83 Ų | 83 | 108 Ų | 108 | 50% | 0.503 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -62.1 | -39.6 | 174.3 | 171.3 | 0 | 0 | 0 | 0 | 111.2 | M37 K38 S39 R44 K45 | M37-V41 WeakPolarHBondContact O-CG2 3.36Å; M37-V41 PolarHBondContact O-N 3.14Å; M37-V41 VanDerWaalsContact O-N 3.12Å; K38-V41 PolarHBondContact O-N 2.85Å; S39-V41 PolarHBondContact O-N 3.15Å; V41-R44 WeakPolarHBondContact O-CB 3.47Å; V41-R44 PolarHBondContact O-N 3.06Å; V41-K45 PolarHBondContact O-N 3.41Å |
| 42 | N | 93.3 | Very high | 94 | Very high | 75 Ų | 75 | 105.8 Ų | 105.8 | 40% | 0.401 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -67.7 | -41 | 176.1 | -72.7 | -16.4 | 0 | 0 | 0 | 112.1 | K38 S39 L40 R44 K45 I46 | K38-N42 PolarHBondContact O-N 2.98Å; K38-N42 VanDerWaalsContact O-N 3.15Å; S39-N42 WeakPolarHBondContact O-CB 3.47Å; S39-N42 PolarHBondContact O-N 2.95Å; S39-N42 VanDerWaalsContact O-N 3.14Å; L40-N42 VanDerWaalsContact C-N 3.3Å; L40-N42 PolarHBondContact O-N 3.41Å; N42-R44 VanDerWaalsContact C-N 3.3Å; N42-R44 PolarHBondContact O-N 3.06Å; N42-K45 WeakPolarHBondContact O-CB 3.49Å; N42-K45 PolarHBondContact O-N 3.43Å; N42-K45 VanDerWaalsContact O-N 3.09Å; N42-I46 WeakPolarHBondContact O-CG1 3.46Å; N42-I46 PolarHBondContact O-N 3.39Å |
| 43 | L | 92.9 | Very high | 93.9 | Very high | 82 Ų | 82 | 103.9 Ų | 103.9 | 43% | 0.429 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -58.7 | -43.2 | 173.5 | -74.3 | 172.3 | 0 | 0 | 0 | 111.1 | S39 L40 K45 I46 F47 | S39-L43 WeakPolarHBondContact O-CG 3.46Å; S39-L43 PolarHBondContact O-N 3.29Å; L40-L43 HydrophobicContact CD2-CD1 4.34Å; L40-L43 PolarHBondContact O-N 3.12Å; L43-K45 VanDerWaalsContact C-N 3.26Å; L43-K45 PolarHBondContact O-N 2.88Å; L43-I46 HydrophobicContact CD2-CD1 4.47Å; L43-I46 WeakPolarHBondContact O-CB 3.13Å; L43-I46 PolarHBondContact O-N 3.3Å; L43-F47 HydrophobicContact CB-CE2 4.39Å; L43-F47 WeakPolarHBondContact O-CD2 3.39Å; L43-F47 PolarHBondContact O-N 3.27Å |
| 44 | R | 93.9 | Very high | 93.9 | Very high | 201 Ų | 201 | 102.5 Ų | 102.5 | 76% | 0.758 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -57.2 | -39.3 | 174.8 | -173.5 | 179.6 | 178.5 | -173.2 | -0.3 | 112.3 | L40 V41 N42 F47 H48 | L40-R44 PolarHBondContact O-N 3.43Å; V41-R44 WeakPolarHBondContact O-CB 3.47Å; V41-R44 PolarHBondContact O-N 3.06Å; N42-R44 VanDerWaalsContact C-N 3.3Å; N42-R44 PolarHBondContact O-N 3.06Å; R44-F47 PolarHBondContact O-N 3.3Å; R44-H48 WeakPolarHBondContact O-CB 3.34Å; R44-H48 PolarHBondContact O-N 2.89Å |
| 45 | K | 92.6 | Very high | 93.8 | Very high | 129 Ų | 129 | 99.8 Ų | 99.8 | 56% | 0.561 | 50% | 0.497 | S | S | * | . | H | α-helix | trans | -64.7 | -41.9 | 174.8 | -67.4 | 176.6 | -179.4 | 177.5 | 0 | 111.7 | V41 N42 L43 H48 V49 | V41-K45 PolarHBondContact O-N 3.41Å; N42-K45 WeakPolarHBondContact O-CB 3.49Å; N42-K45 PolarHBondContact O-N 3.43Å; N42-K45 VanDerWaalsContact O-N 3.09Å; L43-K45 VanDerWaalsContact C-N 3.26Å; L43-K45 PolarHBondContact O-N 2.88Å; K45-H48 PolarHBondContact O-N 3.31Å; K45-V49 WeakPolarHBondContact O-CG2 3.41Å; K45-V49 PolarHBondContact O-N 3.4Å |
| 46 | I | 93.5 | Very high | 93.8 | Very high | 95 Ų | 95 | 100.6 Ų | 100.6 | 49% | 0.487 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -61.9 | -45.7 | 176.4 | -62.8 | 170.7 | 0 | 0 | 0 | 110.2 | N42 L43 H48 V49 N50 | N42-I46 WeakPolarHBondContact O-CG1 3.46Å; N42-I46 PolarHBondContact O-N 3.39Å; L43-I46 HydrophobicContact CD2-CD1 4.47Å; L43-I46 WeakPolarHBondContact O-CB 3.13Å; L43-I46 PolarHBondContact O-N 3.3Å; I46-H48 VanDerWaalsContact C-N 3.32Å; I46-H48 PolarHBondContact O-N 3.09Å; I46-V49 PolarHBondContact O-N 2.68Å; I46-N50 WeakPolarHBondContact O-CB 3.38Å; I46-N50 VanDerWaalsContact O-CG 3.27Å; I46-N50 PolarHBondContact O-N 2.98Å |
| 47 | F | 93 | Very high | 93.7 | Very high | 143 Ų | 143 | 100.3 Ų | 100.3 | 63% | 0.627 | 50% | 0.499 | S | S | * | . | H | α-helix | trans | -59.4 | -42 | 175.4 | -77.3 | -64.7 | 0 | 0 | 0 | 112.4 | L43 R44 N50 E51 | L43-F47 HydrophobicContact CB-CE2 4.39Å; L43-F47 WeakPolarHBondContact O-CD2 3.39Å; L43-F47 PolarHBondContact O-N 3.27Å; R44-F47 PolarHBondContact O-N 3.3Å; F47-N50 PolarHBondContact O-N 2.87Å; F47-E51 WeakPolarHBondContact O-CB 3.46Å; F47-E51 PolarHBondContact O-N 3.19Å |
| 48 | H | 92.6 | Very high | 93.7 | Very high | 111 Ų | 111 | 101 Ų | 101 | 51% | 0.514 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -64.3 | -43 | 177.9 | -173 | -89.8 | 0 | 0 | 0 | 112.5 | R44 K45 I46 N50 E51 I52 | R44-H48 WeakPolarHBondContact O-CB 3.34Å; R44-H48 PolarHBondContact O-N 2.89Å; K45-H48 PolarHBondContact O-N 3.31Å; I46-H48 VanDerWaalsContact C-N 3.32Å; I46-H48 PolarHBondContact O-N 3.09Å; H48-N50 VanDerWaalsContact C-N 3.35Å; H48-E51 PolarHBondContact O-N 3.02Å; H48-I52 WeakPolarHBondContact O-CG1 3.5Å; H48-I52 PolarHBondContact O-N 3.47Å; H48-I52 VanDerWaalsContact O-N 3.09Å |
| 49 | V | 93 | Very high | 93.7 | Very high | 83 Ų | 83 | 100.4 Ų | 100.4 | 50% | 0.503 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -63.4 | -44 | 174.5 | 174.4 | 0 | 0 | 0 | 0 | 110.4 | K45 I46 E51 I52 V53 | K45-V49 WeakPolarHBondContact O-CG2 3.41Å; K45-V49 PolarHBondContact O-N 3.4Å; I46-V49 PolarHBondContact O-N 2.68Å; V49-E51 VanDerWaalsContact C-N 3.32Å; V49-E51 PolarHBondContact O-N 3.38Å; V49-I52 WeakPolarHBondContact O-CB 3.48Å; V49-I52 PolarHBondContact O-N 3.48Å; V49-V53 HydrophobicContact CG1-CG2 4.44Å; V49-V53 WeakPolarHBondContact O-CG2 3.19Å; V49-V53 PolarHBondContact O-N 3.39Å |
| 50 | N | 92.3 | Very high | 93.7 | Very high | 84 Ų | 84 | 102.5 Ų | 102.5 | 45% | 0.449 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -60.2 | -41.6 | 177 | -74.2 | -8.2 | 0 | 0 | 0 | 111.9 | I46 F47 H48 I52 V53 V54 | I46-N50 WeakPolarHBondContact O-CB 3.38Å; I46-N50 VanDerWaalsContact O-CG 3.27Å; I46-N50 PolarHBondContact O-N 2.98Å; F47-N50 PolarHBondContact O-N 2.87Å; H48-N50 VanDerWaalsContact C-N 3.35Å; N50-I52 VanDerWaalsContact C-N 3.35Å; N50-I52 PolarHBondContact O-N 3.19Å; N50-V53 PolarHBondContact O-N 3.27Å; N50-V54 WeakPolarHBondContact O-CG2 3.46Å; N50-V54 PolarHBondContact O-N 3.4Å |
| 51 | E | 93.5 | Very high | 93.8 | Very high | 98 Ų | 98 | 102.4 Ų | 102.4 | 46% | 0.458 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -61 | -43.3 | 175.8 | -169.5 | -169 | 159.9 | 0 | 0 | 111.7 | F47 H48 V49 V54 K55 | F47-E51 WeakPolarHBondContact O-CB 3.46Å; F47-E51 PolarHBondContact O-N 3.19Å; H48-E51 PolarHBondContact O-N 3.02Å; V49-E51 VanDerWaalsContact C-N 3.32Å; V49-E51 PolarHBondContact O-N 3.38Å; E51-V54 PolarHBondContact O-N 3.37Å; E51-K55 WeakPolarHBondContact O-CG 3.41Å; E51-K55 PolarHBondContact O-N 2.95Å; E51-K55 WeakPolarHBondContact OE1-CE 3.37Å; E51-K55 IonicContact OE1-NZ 2.68Å; E51-K55 PolarHBondContact OE1-NZ 2.92Å |
| 52 | I | 94.7 | Very high | 93.9 | Very high | 70 Ų | 70 | 104.8 Ų | 104.8 | 36% | 0.359 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -61 | -46.3 | 175.6 | -68.1 | 167.5 | 0 | 0 | 0 | 110.4 | H48 V49 N50 V54 K55 H56 | H48-I52 WeakPolarHBondContact O-CG1 3.5Å; H48-I52 PolarHBondContact O-N 3.47Å; H48-I52 VanDerWaalsContact O-N 3.09Å; V49-I52 WeakPolarHBondContact O-CB 3.48Å; V49-I52 PolarHBondContact O-N 3.48Å; N50-I52 VanDerWaalsContact C-N 3.35Å; N50-I52 PolarHBondContact O-N 3.19Å; I52-V54 PolarHBondContact O-N 3.26Å; I52-K55 PolarHBondContact O-N 2.98Å; I52-H56 VanDerWaalsContact CG2-CE1 3.46Å; I52-H56 WeakPolarHBondContact CG2-CE1 3.37Å; I52-H56 WeakPolarHBondContact CG2-ND1 3.49Å; I52-H56 PolarHBondContact O-N 3Å; I52-H56 PolarHBondContact O-ND1 3.09Å |
| 53 | V | 93.9 | Very high | 93.9 | Very high | 78 Ų | 78 | 104.5 Ų | 104.5 | 47% | 0.473 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -60.4 | -45.8 | 178.9 | 172.7 | 0 | 0 | 0 | 0 | 110.6 | V49 N50 K55 H56 V57 | V49-V53 HydrophobicContact CG1-CG2 4.44Å; V49-V53 WeakPolarHBondContact O-CG2 3.19Å; V49-V53 PolarHBondContact O-N 3.39Å; N50-V53 PolarHBondContact O-N 3.27Å; V53-K55 VanDerWaalsContact C-N 3.33Å; V53-K55 PolarHBondContact O-N 3.41Å; V53-H56 PolarHBondContact O-N 3.28Å; V53-H56 VanDerWaalsContact O-N 3.15Å; V53-V57 HydrophobicContact CG1-CG2 4.32Å; V53-V57 WeakPolarHBondContact O-CG2 3.38Å; V53-V57 PolarHBondContact O-N 2.88Å |
| 54 | V | 95 | Very high | 93.9 | Very high | 83 Ų | 83 | 106.5 Ų | 106.5 | 50% | 0.503 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -59.6 | -43.6 | 177.7 | 175.4 | 0 | 0 | 0 | 0 | 111.2 | N50 E51 I52 H56 V57 M58 | N50-V54 WeakPolarHBondContact O-CG2 3.46Å; N50-V54 PolarHBondContact O-N 3.4Å; E51-V54 PolarHBondContact O-N 3.37Å; I52-V54 PolarHBondContact O-N 3.26Å; V54-H56 VanDerWaalsContact C-N 3.35Å; V54-H56 PolarHBondContact O-N 2.88Å; V54-V57 PolarHBondContact O-N 3.23Å; V54-M58 HydrophobicContact CG1-CE 4.14Å; V54-M58 WeakPolarHBondContact O-CG 3.47Å; V54-M58 PolarHBondContact O-N 3.33Å |
| 55 | K | 94.5 | Very high | 93.8 | Very high | 114 Ų | 114 | 101.9 Ų | 101.9 | 50% | 0.496 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -59.8 | -42.8 | 175.1 | -75.2 | 174.2 | -178.7 | 164.6 | 0 | 112.4 | E51 I52 V53 M58 L59 | E51-K55 WeakPolarHBondContact O-CG 3.41Å; E51-K55 PolarHBondContact O-N 2.95Å; E51-K55 WeakPolarHBondContact OE1-CE 3.37Å; E51-K55 IonicContact OE1-NZ 2.68Å; E51-K55 PolarHBondContact OE1-NZ 2.92Å; I52-K55 PolarHBondContact O-N 2.98Å; V53-K55 VanDerWaalsContact C-N 3.33Å; V53-K55 PolarHBondContact O-N 3.41Å; K55-M58 HydrophobicContact CG-CE 4.25Å; K55-M58 PolarHBondContact O-N 2.9Å; K55-L59 WeakPolarHBondContact O-CB 3.49Å; K55-L59 PolarHBondContact O-N 3.15Å |
| 56 | H | 94.4 | Very high | 93.8 | Very high | 128 Ų | 128 | 98 Ų | 98 | 59% | 0.593 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -66.5 | -41.6 | 178 | -76.5 | 78.8 | 0 | 0 | 0 | 112.2 | I52 V53 V54 L59 L60 | I52-H56 VanDerWaalsContact CG2-CE1 3.46Å; I52-H56 WeakPolarHBondContact CG2-CE1 3.37Å; I52-H56 WeakPolarHBondContact CG2-ND1 3.49Å; I52-H56 PolarHBondContact O-N 3Å; I52-H56 PolarHBondContact O-ND1 3.09Å; V53-H56 PolarHBondContact O-N 3.28Å; V53-H56 VanDerWaalsContact O-N 3.15Å; V54-H56 VanDerWaalsContact C-N 3.35Å; V54-H56 PolarHBondContact O-N 2.88Å; H56-L59 PolarHBondContact O-N 3.01Å; H56-L60 WeakPolarHBondContact O-CB 3.45Å; H56-L60 PolarHBondContact O-N 3.35Å |
| 57 | V | 94.5 | Very high | 93.6 | Very high | 84 Ų | 84 | 99 Ų | 99 | 51% | 0.509 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -62.6 | -44.5 | 175.9 | 174.6 | 0 | 0 | 0 | 0 | 110.5 | V53 V54 L59 L60 V61 | V53-V57 HydrophobicContact CG1-CG2 4.32Å; V53-V57 WeakPolarHBondContact O-CG2 3.38Å; V53-V57 PolarHBondContact O-N 2.88Å; V54-V57 PolarHBondContact O-N 3.23Å; V57-L59 VanDerWaalsContact C-N 3.31Å; V57-L59 PolarHBondContact O-N 2.78Å; V57-L60 PolarHBondContact O-N 2.93Å; V57-V61 HydrophobicContact CG1-CG2 4.41Å; V57-V61 WeakPolarHBondContact O-CG2 3.37Å; V57-V61 PolarHBondContact O-N 3.43Å |
| 58 | M | 94.9 | Very high | 93.4 | Very high | 115 Ų | 115 | 94.8 Ų | 94.8 | 57% | 0.567 | 49% | 0.494 | S | S | * | . | H | α-helix | trans | -59.8 | -42.1 | 175.7 | -72.9 | -169.5 | -63.7 | 0 | 0 | 112.1 | V54 K55 V61 F62 | V54-M58 HydrophobicContact CG1-CE 4.14Å; V54-M58 WeakPolarHBondContact O-CG 3.47Å; V54-M58 PolarHBondContact O-N 3.33Å; K55-M58 HydrophobicContact CG-CE 4.25Å; K55-M58 PolarHBondContact O-N 2.9Å; M58-V61 PolarHBondContact O-N 2.91Å; M58-F62 WeakPolarHBondContact O-CB 3.33Å; M58-F62 PolarHBondContact O-N 3.44Å |
| 59 | L | 94.4 | Very high | 93.3 | Very high | 113 Ų | 113 | 93.9 Ų | 93.9 | 59% | 0.592 | 49% | 0.49 | S | S | * | . | H | α-helix | trans | -64.8 | -41.3 | 177.3 | -172.1 | 139.7 | 0 | 0 | 0 | 111.6 | K55 H56 V57 F62 T63 | K55-L59 WeakPolarHBondContact O-CB 3.49Å; K55-L59 PolarHBondContact O-N 3.15Å; H56-L59 PolarHBondContact O-N 3.01Å; V57-L59 VanDerWaalsContact C-N 3.31Å; V57-L59 PolarHBondContact O-N 2.78Å; L59-F62 PolarHBondContact O-N 3.42Å; L59-T63 HydrophobicContact CD2-CG2 4.21Å; L59-T63 WeakPolarHBondContact O-CG2 3.39Å; L59-T63 PolarHBondContact O-N 3.26Å; L59-T63 PolarHBondContact O-OG1 3.46Å |
| 60 | L | 94.8 | Very high | 92.9 | Very high | 95 Ų | 95 | 98.4 Ų | 98.4 | 50% | 0.497 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -64 | -40.7 | 175.4 | -175.5 | 142.3 | 0 | 0 | 0 | 112.1 | H56 V57 F62 T63 M64 | H56-L60 WeakPolarHBondContact O-CB 3.45Å; H56-L60 PolarHBondContact O-N 3.35Å; V57-L60 PolarHBondContact O-N 2.93Å; L60-F62 VanDerWaalsContact C-N 3.33Å; L60-T63 WeakPolarHBondContact CA-OG1 3.3Å; L60-T63 PolarHBondContact O-N 3.18Å; L60-T63 PolarHBondContact O-OG1 3.46Å; L60-M64 HydrophobicContact CD2-CE 4.26Å; L60-M64 HydrophobicContact CD2-CG 4.19Å; L60-M64 WeakPolarHBondContact O-CB 3.14Å; L60-M64 WeakPolarHBondContact O-CG 3.36Å; L60-M64 PolarHBondContact O-N 2.86Å |
| 61 | V | 94.8 | Very high | 92.5 | Very high | 86 Ų | 86 | 102 Ų | 102 | 52% | 0.521 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -63.8 | -41.9 | 174.1 | 171.5 | 0 | 0 | 0 | 0 | 110.5 | V57 M58 M64 H65 | V57-V61 HydrophobicContact CG1-CG2 4.41Å; V57-V61 WeakPolarHBondContact O-CG2 3.37Å; V57-V61 PolarHBondContact O-N 3.43Å; M58-V61 PolarHBondContact O-N 2.91Å; V61-M64 PolarHBondContact O-N 3.36Å; V61-H65 VanDerWaalsContact O-CB 3.3Å; V61-H65 WeakPolarHBondContact O-CB 3.38Å; V61-H65 PolarHBondContact O-N 3.26Å |
| 62 | F | 95 | Very high | 91.8 | Very high | 134 Ų | 134 | 100.4 Ų | 100.4 | 59% | 0.588 | 51% | 0.505 | S | S | * | . | H | α-helix | trans | -64.3 | -42.5 | 177.4 | -176.3 | -98.3 | 0 | 0 | 0 | 112.5 | M58 L59 L60 H65 T66 | M58-F62 WeakPolarHBondContact O-CB 3.33Å; M58-F62 PolarHBondContact O-N 3.44Å; L59-F62 PolarHBondContact O-N 3.42Å; L60-F62 VanDerWaalsContact C-N 3.33Å; F62-H65 PolarHBondContact O-N 3.44Å; F62-T66 HydrophobicContact CD1-CG2 4.33Å; F62-T66 HydrophobicContact CE1-CG2 3.91Å; F62-T66 HydrophobicContact CE2-CG2 4.32Å; F62-T66 HydrophobicContact CZ-CG2 3.9Å; F62-T66 WeakPolarHBondContact O-CG2 3.28Å; F62-T66 PolarHBondContact O-N 2.89Å; F62-T66 PolarHBondContact O-OG1 3.31Å |
| 63 | T | 94.2 | Very high | 91 | Very high | 69 Ų | 69 | 105.3 Ų | 105.3 | 42% | 0.423 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -67.1 | -40.5 | 176 | 56.4 | 0 | 0 | 0 | 0 | 111.9 | L59 L60 T66 F67 | L59-T63 HydrophobicContact CD2-CG2 4.21Å; L59-T63 WeakPolarHBondContact O-CG2 3.39Å; L59-T63 PolarHBondContact O-N 3.26Å; L59-T63 PolarHBondContact O-OG1 3.46Å; L60-T63 WeakPolarHBondContact CA-OG1 3.3Å; L60-T63 PolarHBondContact O-N 3.18Å; L60-T63 PolarHBondContact O-OG1 3.46Å; T63-T66 WeakPolarHBondContact CA-OG1 3.38Å; T63-T66 PolarHBondContact O-OG1 3.24Å; T63-F67 VanDerWaalsContact O-CB 3.28Å; T63-F67 WeakPolarHBondContact O-CB 3.45Å; T63-F67 PolarHBondContact O-N 2.93Å |
| 64 | M | 93.3 | Very high | 90.1 | Very high | 124 Ų | 124 | 108.5 Ų | 108.5 | 61% | 0.611 | 53% | 0.528 | S | S | * | . | H | α-helix | trans | -59.8 | -45.2 | 172.1 | -72.8 | -89.3 | -174.6 | 0 | 0 | 111.7 | L60 V61 F67 A68 | L60-M64 HydrophobicContact CD2-CE 4.26Å; L60-M64 HydrophobicContact CD2-CG 4.19Å; L60-M64 WeakPolarHBondContact O-CB 3.14Å; L60-M64 WeakPolarHBondContact O-CG 3.36Å; L60-M64 PolarHBondContact O-N 2.86Å; V61-M64 PolarHBondContact O-N 3.36Å; M64-F67 PolarHBondContact O-N 2.95Å; M64-A68 WeakPolarHBondContact O-CB 3.09Å; M64-A68 PolarHBondContact O-N 2.89Å |
| 65 | H | 92 | Very high | 89.1 | Confident | 103 Ų | 103 | 111.4 Ų | 111.4 | 48% | 0.477 | 54% | 0.541 | S | S | . | . | H | α-helix | trans | -64.4 | -47.9 | -179.7 | -176.7 | -91.8 | 0 | 0 | 0 | 112 | V61 F62 F67 A68 Q69 | V61-H65 VanDerWaalsContact O-CB 3.3Å; V61-H65 WeakPolarHBondContact O-CB 3.38Å; V61-H65 PolarHBondContact O-N 3.26Å; F62-H65 PolarHBondContact O-N 3.44Å; H65-F67 VanDerWaalsContact C-N 3.32Å; H65-F67 PolarHBondContact O-N 2.96Å; H65-A68 PolarHBondContact O-N 2.92Å; H65-Q69 PolarHBondContact CE1-NE2 3.27Å; H65-Q69 PolarHBondContact ND1-OE1 2.97Å; H65-Q69 WeakPolarHBondContact O-CG 3.45Å; H65-Q69 PolarHBondContact O-N 2.94Å |
| 66 | T | 90.6 | Very high | 87.8 | Confident | 49 Ų | 49 | 115.9 Ų | 115.9 | 30% | 0.301 | 56% | 0.556 | S | S | . | * | H | α-helix | trans | -62.8 | -38.3 | 176.6 | 49.3 | 0 | 0 | 0 | 0 | 112.4 | F62 T63 R70 | F62-T66 HydrophobicContact CD1-CG2 4.33Å; F62-T66 HydrophobicContact CE1-CG2 3.91Å; F62-T66 HydrophobicContact CE2-CG2 4.32Å; F62-T66 HydrophobicContact CZ-CG2 3.9Å; F62-T66 WeakPolarHBondContact O-CG2 3.28Å; F62-T66 PolarHBondContact O-N 2.89Å; F62-T66 PolarHBondContact O-OG1 3.31Å; T63-T66 WeakPolarHBondContact CA-OG1 3.38Å; T63-T66 PolarHBondContact O-OG1 3.24Å; T66-R70 WeakPolarHBondContact O-CG 3.41Å; T66-R70 PolarHBondContact O-N 3.28Å |
| 67 | F | 90.3 | Very high | 85.9 | Confident | 116 Ų | 116 | 120.3 Ų | 120.3 | 51% | 0.509 | 58% | 0.577 | S | S | . | * | H | α-helix | trans | -66.3 | -42.5 | 174.3 | -174.8 | -101.3 | 0 | 0 | 0 | 112.2 | T63 M64 H65 R70 R71 | T63-F67 VanDerWaalsContact O-CB 3.28Å; T63-F67 WeakPolarHBondContact O-CB 3.45Å; T63-F67 PolarHBondContact O-N 2.93Å; M64-F67 PolarHBondContact O-N 2.95Å; H65-F67 VanDerWaalsContact C-N 3.32Å; H65-F67 PolarHBondContact O-N 2.96Å; F67-R70 PolarHBondContact O-N 3.02Å; F67-R71 HydrophobicContact CE1-CG 4.28Å; F67-R71 VanDerWaalsContact CE1-CZ 3.47Å; F67-R71 VanDerWaalsContact CE1-NE 3.3Å; F67-R71 HydrophobicContact CZ-CG 4.47Å; F67-R71 PolarHBondContact O-N 3.13Å |
| 68 | A | 89.2 | Confident | 85.5 | Confident | 53 Ų | 53 | 122.1 Ų | 122.1 | 44% | 0.438 | 58% | 0.58 | S | S | . | * | H | α-helix | trans | -62.2 | -45.6 | 175.8 | 0 | 0 | 0 | 0 | 0 | 111.6 | M64 H65 R70 R71 S72 | M64-A68 WeakPolarHBondContact O-CB 3.09Å; M64-A68 PolarHBondContact O-N 2.89Å; H65-A68 PolarHBondContact O-N 2.92Å; A68-R70 PolarHBondContact O-N 3.47Å; A68-R71 PolarHBondContact O-N 3Å; A68-S72 PolarHBondContact O-N 3.4Å; A68-S72 PolarHBondContact O-OG 2.99Å |
| 69 | Q | 89.1 | Confident | 85 | Confident | 93 Ų | 93 | 122.5 Ų | 122.5 | 44% | 0.435 | 58% | 0.581 | S | S | . | * | H | α-helix | trans | -58.5 | -47.4 | 174.8 | -74.4 | -176.7 | -42.7 | 0 | 0 | 111.6 | H65 R71 S72 Y73 | H65-Q69 PolarHBondContact CE1-NE2 3.27Å; H65-Q69 PolarHBondContact ND1-OE1 2.97Å; H65-Q69 WeakPolarHBondContact O-CG 3.45Å; H65-Q69 PolarHBondContact O-N 2.94Å; Q69-R71 VanDerWaalsContact C-N 3.34Å; Q69-R71 PolarHBondContact O-N 2.87Å; Q69-S72 WeakPolarHBondContact O-CB 3.18Å; Q69-S72 PolarHBondContact O-N 3.06Å; Q69-S72 VanDerWaalsContact O-N 3.13Å; Q69-Y73 WeakPolarHBondContact O-CD2 3.31Å; Q69-Y73 PolarHBondContact O-N 3.36Å |
| 70 | R | 85.3 | Confident | 84.5 | Confident | 178 Ų | 178 | 123 Ų | 123 | 67% | 0.672 | 58% | 0.581 | S | S | * | * | H | α-helix | trans | -59.1 | -42.4 | 176.6 | -78.6 | -166.2 | 179.7 | -154.1 | 1.3 | 112.6 | T66 F67 A68 S72 Y73 F74 | T66-R70 WeakPolarHBondContact O-CG 3.41Å; T66-R70 PolarHBondContact O-N 3.28Å; F67-R70 PolarHBondContact O-N 3.02Å; A68-R70 PolarHBondContact O-N 3.47Å; R70-S72 VanDerWaalsContact C-N 3.32Å; R70-S72 PolarHBondContact O-N 3.4Å; R70-Y73 PolarHBondContact O-N 3.01Å; R70-F74 VanDerWaalsContact O-CD2 3.31Å; R70-F74 WeakPolarHBondContact O-CD2 3.33Å; R70-F74 PolarHBondContact O-N 3.47Å |
| 71 | R | 83.6 | Confident | 83.9 | Confident | 159 Ų | 159 | 124.6 Ų | 124.6 | 60% | 0.6 | 59% | 0.585 | S | S | * | * | H | α-helix | trans | -61.2 | -39.8 | 174.6 | -86.7 | -169.1 | 175.8 | 174 | 1.2 | 112.5 | F67 A68 Q69 F74 N75 | F67-R71 HydrophobicContact CE1-CG 4.28Å; F67-R71 VanDerWaalsContact CE1-CZ 3.47Å; F67-R71 VanDerWaalsContact CE1-NE 3.3Å; F67-R71 HydrophobicContact CZ-CG 4.47Å; F67-R71 PolarHBondContact O-N 3.13Å; A68-R71 PolarHBondContact O-N 3Å; Q69-R71 VanDerWaalsContact C-N 3.34Å; Q69-R71 PolarHBondContact O-N 2.87Å; R71-F74 PolarHBondContact O-N 3.39Å; R71-N75 PolarHBondContact O-N 3.19Å |
| 72 | S | 79.6 | Confident | 83.2 | Confident | 64 Ų | 64 | 127.1 Ų | 127.1 | 45% | 0.448 | 59% | 0.589 | S | S | . | * | H | α-helix | trans | -61.4 | -47 | 174.8 | -62.5 | 0 | 0 | 0 | 0 | 111.1 | A68 Q69 R70 F74 N75 Y76 | A68-S72 PolarHBondContact O-N 3.4Å; A68-S72 PolarHBondContact O-OG 2.99Å; Q69-S72 WeakPolarHBondContact O-CB 3.18Å; Q69-S72 PolarHBondContact O-N 3.06Å; Q69-S72 VanDerWaalsContact O-N 3.13Å; R70-S72 VanDerWaalsContact C-N 3.32Å; R70-S72 PolarHBondContact O-N 3.4Å; S72-F74 PolarHBondContact O-N 3.33Å; S72-N75 PolarHBondContact O-N 3.17Å; S72-Y76 WeakPolarHBondContact O-CD2 3.48Å; S72-Y76 PolarHBondContact O-N 3.44Å |
| 73 | Y | 77.1 | Confident | 82.4 | Confident | 174 Ų | 174 | 126.6 Ų | 126.6 | 68% | 0.682 | 59% | 0.59 | S | S | * | * | H | α-helix | trans | -58.1 | -45.6 | 177.2 | -80.5 | -75.7 | 0 | 0 | 0 | 113.1 | Q69 R70 N75 Y76 | Q69-Y73 WeakPolarHBondContact O-CD2 3.31Å; Q69-Y73 PolarHBondContact O-N 3.36Å; R70-Y73 PolarHBondContact O-N 3.01Å; Y73-N75 VanDerWaalsContact C-N 3.27Å; Y73-N75 PolarHBondContact O-N 3.2Å; Y73-Y76 PolarHBondContact O-N 3.49Å |
| 74 | F | 74.5 | Confident | 81.6 | Confident | 145 Ų | 145 | 130.7 Ų | 130.7 | 64% | 0.636 | 60% | 0.601 | S | S | * | * | H | α-helix | trans | -66.5 | -23.8 | 178 | -84.8 | -70.1 | 0 | 0 | 0 | 114.4 | R70 R71 S72 Y76 | R70-F74 VanDerWaalsContact O-CD2 3.31Å; R70-F74 WeakPolarHBondContact O-CD2 3.33Å; R70-F74 PolarHBondContact O-N 3.47Å; R71-F74 PolarHBondContact O-N 3.39Å; S72-F74 PolarHBondContact O-N 3.33Å; F74-Y76 VanDerWaalsContact C-N 3.34Å |
| 75 | N | 74.6 | Confident | 80.7 | Confident | 143 Ų | 143 | 131.2 Ų | 131.2 | 77% | 0.765 | 60% | 0.601 | S | S | * | * | H | α-helix | trans | -84.1 | -9.6 | 176.7 | -78.9 | -2.6 | 0 | 0 | 0 | 113.1 | R71 S72 Y73 | R71-N75 PolarHBondContact O-N 3.19Å; S72-N75 PolarHBondContact O-N 3.17Å; Y73-N75 VanDerWaalsContact C-N 3.27Å; Y73-N75 PolarHBondContact O-N 3.2Å |
| 76 | Y | 68.2 | Low | 79.8 | Confident | 209 Ų | 209 | 133.6 Ų | 133.6 | 82% | 0.82 | 61% | 0.611 | S | S | * | * | H | α-helix | trans | -98.4 | -10.9 | 176.3 | -78.6 | -70.9 | 0 | 0 | 0 | 113.4 | S72 Y73 F74 | S72-Y76 WeakPolarHBondContact O-CD2 3.48Å; S72-Y76 PolarHBondContact O-N 3.44Å; Y73-Y76 PolarHBondContact O-N 3.49Å; F74-Y76 VanDerWaalsContact C-N 3.34Å |
| 77 | E | 54.9 | Low | 78.8 | Confident | 220 Ų | 220 | 141.3 Ų | 141.3 | 100% | 1.028 | 64% | 0.639 | S | S | * | * | trans | -91.8 | 0 | 166.8 | -72.4 | -174.6 | 155.5 | 0 | 0 | 110.8 |
Retrieved 77 of 77 residues in 39.2 ms
(Link to these results)