| 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 | 42.5 | Very low | 55.9 | Low | 211 Ų | 211 | 108.5 Ų | 108.5 | 100% | 1.039 | 62% | 0.62 | S | S | * | * | 0 | 14.5 | 0 | -76.2 | -174.9 | 104.7 | 0 | 0 | 111.4 | |||||
| 2 | D | 45.4 | Very low | 57.3 | Low | 142 Ų | 142 | 105.7 Ų | 105.7 | 76% | 0.759 | 61% | 0.607 | S | S | * | * | H | α-helix | trans | -89.4 | -26.4 | -167 | -53.2 | -93.6 | 0 | 0 | 0 | 113.2 | G6 | D2-G6 PolarHBondContact O-N 2.98Å |
| 3 | I | 52.4 | Low | 58.4 | Low | 149 Ų | 149 | 101.9 Ų | 101.9 | 76% | 0.764 | 58% | 0.58 | S | S | * | * | H | α-helix | trans | -69.6 | -37.6 | -179.9 | -111.6 | 82.2 | 0 | 0 | 0 | 112.5 | T7 | I3-T7 PolarHBondContact O-N 3.28Å; I3-T7 PolarHBondContact O-OG1 3.48Å; I3-T7 VanDerWaalsContact O-OG1 3.11Å |
| 4 | V | 51.5 | Low | 59.2 | Low | 110 Ų | 110 | 96.9 Ų | 96.9 | 67% | 0.667 | 56% | 0.557 | S | S | * | * | H | α-helix | trans | -78.2 | -34.1 | -173.5 | -168.7 | 0 | 0 | 0 | 0 | 111.5 | G6 T7 | V4-G6 VanDerWaalsContact C-N 3.31Å; V4-G6 PolarHBondContact O-N 3.43Å; V4-T7 PolarHBondContact O-N 3.43Å |
| 5 | C | 50.1 | Low | 60.1 | Low | 98 Ų | 98 | 95.7 Ų | 95.7 | 66% | 0.662 | 56% | 0.556 | S | S | * | * | H | α-helix | trans | -65.9 | -35.6 | 174.7 | -165.2 | 0 | 0 | 0 | 0 | 111.5 | F8 S9 | C5-F8 PolarHBondContact O-N 3.22Å; C5-S9 PolarHBondContact O-N 3.4Å |
| 6 | G | 53.9 | Low | 60.8 | Low | 41 Ų | 41 | 99.1 Ų | 99.1 | 42% | 0.423 | 56% | 0.562 | S | S | . | * | H | α-helix | trans | -64.3 | -38.4 | 175.1 | 0 | 0 | 0 | 0 | 0 | 113.6 | D2 V4 F8 S9 F10 | D2-G6 PolarHBondContact O-N 2.98Å; V4-G6 VanDerWaalsContact C-N 3.31Å; V4-G6 PolarHBondContact O-N 3.43Å; G6-F8 VanDerWaalsContact C-N 3.33Å; G6-F8 PolarHBondContact O-N 3.49Å; G6-S9 PolarHBondContact O-N 3.37Å; G6-F10 VanDerWaalsContact O-CB 3.28Å; G6-F10 WeakPolarHBondContact O-CB 3.31Å; G6-F10 PolarHBondContact O-N 3.35Å |
| 7 | T | 62.3 | Low | 61.5 | Low | 94 Ų | 94 | 93.7 Ų | 93.7 | 58% | 0.577 | 53% | 0.533 | S | S | * | . | H | α-helix | trans | -63.8 | -37.1 | -179.8 | -40.7 | 0 | 0 | 0 | 0 | 112.4 | I3 V4 G11 | I3-T7 PolarHBondContact O-N 3.28Å; I3-T7 PolarHBondContact O-OG1 3.48Å; I3-T7 VanDerWaalsContact O-OG1 3.11Å; V4-T7 PolarHBondContact O-N 3.43Å; T7-G11 PolarHBondContact O-N 3.12Å |
| 8 | F | 62.1 | Low | 62.1 | Low | 170 Ų | 170 | 95.4 Ų | 95.4 | 75% | 0.746 | 53% | 0.534 | S | S | * | . | H | α-helix | trans | -68.4 | -42.6 | 179 | -159.7 | -104.6 | 0 | 0 | 0 | 111.8 | C5 G6 G11 T12 | C5-F8 PolarHBondContact O-N 3.22Å; G6-F8 VanDerWaalsContact C-N 3.33Å; G6-F8 PolarHBondContact O-N 3.49Å; F8-G11 PolarHBondContact O-N 3.49Å; F8-T12 PolarHBondContact O-N 3.49Å |
| 9 | S | 65.9 | Low | 62.8 | Low | 79 Ų | 79 | 100.2 Ų | 100.2 | 55% | 0.552 | 54% | 0.543 | S | S | * | . | H | α-helix | trans | -68.6 | -41.4 | 176.4 | -160.3 | 0 | 0 | 0 | 0 | 111.6 | C5 G6 G11 T12 F13 | C5-S9 PolarHBondContact O-N 3.4Å; G6-S9 PolarHBondContact O-N 3.37Å; S9-G11 VanDerWaalsContact C-N 3.34Å; S9-G11 PolarHBondContact O-N 3.31Å; S9-T12 PolarHBondContact O-N 3.11Å; S9-T12 PolarHBondContact O-OG1 2.84Å; S9-F13 PolarHBondContact O-N 3.43Å |
| 10 | F | 60.7 | Low | 63.4 | Low | 65 Ų | 65 | 98.5 Ų | 98.5 | 29% | 0.285 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -59.3 | -41.6 | 176.2 | -171.1 | -107.4 | 0 | 0 | 0 | 112.4 | G6 T12 F13 A14 V74 | G6-F10 VanDerWaalsContact O-CB 3.28Å; G6-F10 WeakPolarHBondContact O-CB 3.31Å; G6-F10 PolarHBondContact O-N 3.35Å; F10-T12 PolarHBondContact O-N 3.33Å; F10-F13 PolarHBondContact O-N 2.93Å; F10-A14 WeakPolarHBondContact O-CB 3.39Å; F10-A14 PolarHBondContact O-N 3.07Å; F10-V74 HydrophobicContact CD2-CG2 3.67Å; F10-V74 HydrophobicContact CE2-CB 4.38Å; F10-V74 HydrophobicContact CE2-CG2 3.57Å; F10-V74 HydrophobicContact CZ-CG2 4.46Å |
| 11 | G | 68 | Low | 63.9 | Low | 34 Ų | 34 | 96.1 Ų | 96.1 | 35% | 0.351 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -62 | -41.3 | 177.3 | 0 | 0 | 0 | 0 | 0 | 113.5 | T7 F8 S9 S15 | T7-G11 PolarHBondContact O-N 3.12Å; F8-G11 PolarHBondContact O-N 3.49Å; S9-G11 VanDerWaalsContact C-N 3.34Å; S9-G11 PolarHBondContact O-N 3.31Å; G11-S15 WeakPolarHBondContact O-CB 3.34Å; G11-S15 PolarHBondContact O-N 3.47Å; G11-S15 PolarHBondContact O-OG 3.03Å |
| 12 | T | 73 | Confident | 65.5 | Low | 75 Ų | 75 | 93.4 Ų | 93.4 | 46% | 0.46 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -69.6 | -37.6 | 177 | 66.6 | 0 | 0 | 0 | 0 | 112.3 | F8 S9 F10 S15 K16 | F8-T12 PolarHBondContact O-N 3.49Å; S9-T12 PolarHBondContact O-N 3.11Å; S9-T12 PolarHBondContact O-OG1 2.84Å; F10-T12 PolarHBondContact O-N 3.33Å; T12-S15 PolarHBondContact O-N 3.49Å; T12-K16 PolarHBondContact O-N 3.49Å |
| 13 | F | 71.1 | Confident | 67 | Low | 57 Ų | 57 | 92 Ų | 92 | 25% | 0.25 | 49% | 0.488 | C | S | . | . | H | α-helix | trans | -66.8 | -48.3 | 177.2 | -178.7 | -115.9 | 0 | 0 | 0 | 111.8 | S9 F10 S15 K16 A17 Q77 M81 | S9-F13 PolarHBondContact O-N 3.43Å; F10-F13 PolarHBondContact O-N 2.93Å; F13-S15 VanDerWaalsContact C-N 3.27Å; F13-S15 PolarHBondContact O-N 3.29Å; F13-K16 PolarHBondContact O-N 3.38Å; F13-K16 VanDerWaalsContact O-N 3.15Å; F13-A17 PolarHBondContact O-N 3.43Å; F13-Q77 HydrophobicContact CD1-CB 4.48Å; F13-Q77 HydrophobicContact CD1-CG 3.76Å; F13-Q77 HydrophobicContact CE1-CB 3.77Å; F13-Q77 HydrophobicContact CE1-CG 3.25Å; F13-Q77 HydrophobicContact CZ-CG 4.17Å; F13-M81 HydrophobicContact CE1-CG 4.21Å; F13-M81 HydrophobicContact CE2-CB 4.16Å; F13-M81 HydrophobicContact CE2-CE 4.31Å; F13-M81 HydrophobicContact CE2-CG 3.72Å; F13-M81 HydrophobicContact CZ-CB 3.87Å; F13-M81 HydrophobicContact CZ-CG 3.35Å |
| 14 | A | 70.2 | Confident | 68 | Low | 32 Ų | 32 | 85.9 Ų | 85.9 | 26% | 0.264 | 46% | 0.457 | S | S | . | . | H | α-helix | trans | -59.4 | -38.4 | 174.5 | 0 | 0 | 0 | 0 | 0 | 111.7 | F10 A17 F18 | F10-A14 WeakPolarHBondContact O-CB 3.39Å; F10-A14 PolarHBondContact O-N 3.07Å; A14-A17 PolarHBondContact O-N 3.22Å; A14-F18 WeakPolarHBondContact O-CB 3.41Å; A14-F18 PolarHBondContact O-N 2.98Å |
| 15 | S | 72.8 | Confident | 69 | Low | 78 Ų | 78 | 88.2 Ų | 88.2 | 55% | 0.545 | 46% | 0.459 | S | S | . | . | H | α-helix | trans | -64.4 | -39.5 | 175.7 | -62.5 | 0 | 0 | 0 | 0 | 112.8 | G11 T12 F13 R19 | G11-S15 WeakPolarHBondContact O-CB 3.34Å; G11-S15 PolarHBondContact O-N 3.47Å; G11-S15 PolarHBondContact O-OG 3.03Å; T12-S15 PolarHBondContact O-N 3.49Å; F13-S15 VanDerWaalsContact C-N 3.27Å; F13-S15 PolarHBondContact O-N 3.29Å; S15-R19 PolarHBondContact O-N 3.02Å |
| 16 | K | 70.7 | Confident | 70.4 | Confident | 150 Ų | 150 | 87.3 Ų | 87.3 | 65% | 0.652 | 45% | 0.453 | S | S | * | . | H | α-helix | trans | -64.8 | -42.8 | 172.3 | -75.2 | -175.6 | 179.9 | -173.9 | 0 | 111.4 | T12 F13 R19 L20 | T12-K16 PolarHBondContact O-N 3.49Å; F13-K16 PolarHBondContact O-N 3.38Å; F13-K16 VanDerWaalsContact O-N 3.15Å; K16-R19 PolarHBondContact O-N 3.38Å; K16-L20 PolarHBondContact O-N 2.89Å |
| 17 | A | 72.3 | Confident | 71.2 | Confident | 8 Ų | 8 | 88.8 Ų | 88.8 | 7% | 0.066 | 45% | 0.454 | C | S | . | . | H | α-helix | trans | -63.4 | -42 | 178.6 | 0 | 0 | 0 | 0 | 0 | 112.6 | F13 A14 R19 L20 Q21 M81 | F13-A17 PolarHBondContact O-N 3.43Å; A14-A17 PolarHBondContact O-N 3.22Å; A17-R19 VanDerWaalsContact C-N 3.29Å; A17-R19 PolarHBondContact O-N 3.31Å; A17-L20 PolarHBondContact O-N 3.38Å; A17-Q21 PolarHBondContact O-N 3.4Å; A17-M81 HydrophobicContact CB-CE 4.46Å; A17-M81 HydrophobicContact CB-SD 3.74Å |
| 18 | F | 72.4 | Confident | 71.2 | Confident | 124 Ų | 124 | 87.6 Ų | 87.6 | 54% | 0.544 | 45% | 0.449 | S | S | . | . | H | α-helix | trans | -65.4 | -30.2 | 179.3 | -164.8 | -104.4 | 0 | 0 | 0 | 112.9 | A14 R22 | A14-F18 WeakPolarHBondContact O-CB 3.41Å; A14-F18 PolarHBondContact O-N 2.98Å; F18-R22 HydrophobicContact CE1-CG 4.2Å; F18-R22 HydrophobicContact CZ-CG 4.41Å; F18-R22 WeakPolarHBondContact O-CG 3.41Å; F18-R22 PolarHBondContact O-N 2.93Å |
| 19 | R | 75.6 | Confident | 71.3 | Confident | 187 Ų | 187 | 88 Ų | 88 | 71% | 0.706 | 45% | 0.451 | S | S | * | . | H | α-helix | trans | -67.8 | -45.1 | 173.1 | -71.3 | -154.1 | -150.2 | -150.3 | 9.1 | 112.2 | S15 K16 A17 L23 | S15-R19 PolarHBondContact O-N 3.02Å; K16-R19 PolarHBondContact O-N 3.38Å; A17-R19 VanDerWaalsContact C-N 3.29Å; A17-R19 PolarHBondContact O-N 3.31Å; R19-L23 WeakPolarHBondContact O-CG 3.45Å |
| 20 | L | 75.5 | Confident | 70.9 | Confident | 65 Ų | 65 | 91.2 Ų | 91.2 | 34% | 0.34 | 46% | 0.461 | S | S | . | . | H | α-helix | trans | -64.3 | -53.6 | 178.4 | -72.9 | 172.8 | 0 | 0 | 0 | 109.9 | K16 A17 R22 L23 L24 M81 Y84 | K16-L20 PolarHBondContact O-N 2.89Å; A17-L20 PolarHBondContact O-N 3.38Å; L20-R22 VanDerWaalsContact C-N 3.28Å; L20-R22 PolarHBondContact O-N 3.41Å; L20-R22 VanDerWaalsContact O-N 3.12Å; L20-L23 WeakPolarHBondContact O-CA 3.31Å; L20-L23 WeakPolarHBondContact O-CB 3.36Å; L20-L23 PolarHBondContact O-N 3.36Å; L20-L24 VanDerWaalsContact C-CD2 3.43Å; L20-L24 HydrophobicContact CB-CD2 4.46Å; L20-L24 WeakPolarHBondContact O-CD2 3.4Å; L20-L24 PolarHBondContact O-N 3.29Å; L20-M81 HydrophobicContact CD1-CE 4.22Å; L20-Y84 HydrophobicContact CB-CE1 4.28Å; L20-Y84 HydrophobicContact CD1-CD1 4.1Å; L20-Y84 HydrophobicContact CD1-CE1 3.76Å; L20-Y84 HydrophobicContact CD2-CE1 4.18Å; L20-Y84 HydrophobicContact CG-CE1 4.29Å |
| 21 | Q | 73.4 | Confident | 70.8 | Confident | 49 Ų | 49 | 94.2 Ų | 94.2 | 23% | 0.229 | 48% | 0.477 | C | S | . | . | H | α-helix | trans | -51.9 | -42.2 | -176.8 | -165 | 62.2 | -119.2 | 0 | 0 | 113.7 | A17 L23 L24 F25 M55 | A17-Q21 PolarHBondContact O-N 3.4Å; Q21-L23 VanDerWaalsContact C-N 3.34Å; Q21-L23 PolarHBondContact O-N 2.86Å; Q21-L24 PolarHBondContact O-N 2.76Å; Q21-F25 PolarHBondContact O-N 3.25Å; Q21-M55 VanDerWaalsContact NE2-CE 3.28Å; Q21-M55 PolarHBondContact NE2-SD 3.23Å |
| 22 | R | 76.2 | Confident | 70.4 | Confident | 155 Ų | 155 | 95 Ų | 95 | 59% | 0.585 | 49% | 0.485 | S | S | * | . | H | α-helix | trans | -59.6 | -40.6 | 176.4 | -80.3 | -165.3 | -83.1 | 176.1 | -10 | 113.1 | F18 L20 S26 | F18-R22 HydrophobicContact CE1-CG 4.2Å; F18-R22 HydrophobicContact CZ-CG 4.41Å; F18-R22 WeakPolarHBondContact O-CG 3.41Å; F18-R22 PolarHBondContact O-N 2.93Å; L20-R22 VanDerWaalsContact C-N 3.28Å; L20-R22 PolarHBondContact O-N 3.41Å; L20-R22 VanDerWaalsContact O-N 3.12Å; R22-S26 PolarHBondContact O-N 2.95Å |
| 23 | L | 77.4 | Confident | 69.5 | Low | 111 Ų | 111 | 95.7 Ų | 95.7 | 58% | 0.581 | 49% | 0.491 | S | S | * | . | H | α-helix | trans | -64.5 | -44.6 | 178 | -65.7 | 163.6 | 0 | 0 | 0 | 110.7 | R19 L20 Q21 F25 S26 T27 | R19-L23 WeakPolarHBondContact O-CG 3.45Å; L20-L23 WeakPolarHBondContact O-CA 3.31Å; L20-L23 WeakPolarHBondContact O-CB 3.36Å; L20-L23 PolarHBondContact O-N 3.36Å; Q21-L23 VanDerWaalsContact C-N 3.34Å; Q21-L23 PolarHBondContact O-N 2.86Å; L23-F25 PolarHBondContact O-N 3.47Å; L23-S26 PolarHBondContact O-N 2.79Å; L23-T27 WeakPolarHBondContact O-CG2 3.14Å; L23-T27 PolarHBondContact O-N 3.25Å; L23-T27 PolarHBondContact O-OG1 3.05Å |
| 24 | L | 72.8 | Confident | 68.7 | Low | 22 Ų | 22 | 101.1 Ų | 101.1 | 12% | 0.115 | 52% | 0.519 | C | S | . | . | H | α-helix | trans | -61.5 | -49 | 179 | -71.3 | -55 | 0 | 0 | 0 | 111.3 | L20 Q21 S26 T27 C28 Y84 Y88 | L20-L24 VanDerWaalsContact C-CD2 3.43Å; L20-L24 HydrophobicContact CB-CD2 4.46Å; L20-L24 WeakPolarHBondContact O-CD2 3.4Å; L20-L24 PolarHBondContact O-N 3.29Å; Q21-L24 PolarHBondContact O-N 2.76Å; L24-S26 PolarHBondContact O-N 3.34Å; L24-T27 WeakPolarHBondContact CA-OG1 3.28Å; L24-T27 CarbonylContact O-C 3.49Å; L24-T27 WeakPolarHBondContact O-CA 3.41Å; L24-T27 PolarHBondContact O-N 2.91Å; L24-T27 PolarHBondContact O-OG1 3.46Å; L24-C28 WeakPolarHBondContact O-CB 3.5Å; L24-C28 PolarHBondContact O-N 2.97Å; L24-C28 PolarHBondContact O-SG 3.06Å; L24-C28 VanDerWaalsContact O-SG 3.38Å; L24-Y84 HydrophobicContact CD1-CE2 3.8Å; L24-Y84 WeakPolarHBondContact CD1-OH 3.06Å; L24-Y84 HydrophobicContact CD2-CE2 3.52Å; L24-Y84 WeakPolarHBondContact CD2-OH 3.32Å; L24-Y84 HydrophobicContact CG-CE2 3.66Å; L24-Y88 WeakPolarHBondContact CD1-OH 3.5Å |
| 25 | F | 73.5 | Confident | 68 | Low | 159 Ų | 159 | 109.2 Ų | 109.2 | 70% | 0.697 | 55% | 0.548 | S | S | * | . | H | α-helix | trans | -56.9 | -43.5 | -178 | -175.4 | -98.5 | 0 | 0 | 0 | 111.3 | Q21 L23 C28 F29 | Q21-F25 PolarHBondContact O-N 3.25Å; L23-F25 PolarHBondContact O-N 3.47Å; F25-C28 PolarHBondContact O-N 3.02Å; F25-F29 PolarHBondContact O-N 3.22Å; F25-F29 VanDerWaalsContact O-N 3.16Å |
| 26 | S | 77.8 | Confident | 66.9 | Low | 78 Ų | 78 | 109.2 Ų | 109.2 | 55% | 0.545 | 54% | 0.54 | S | S | . | . | H | α-helix | trans | -61.6 | -44.2 | 174.2 | -176.2 | 0 | 0 | 0 | 0 | 112.1 | R22 L23 L24 L30 | R22-S26 PolarHBondContact O-N 2.95Å; L23-S26 PolarHBondContact O-N 2.79Å; L24-S26 PolarHBondContact O-N 3.34Å; S26-L30 PolarHBondContact O-N 2.89Å |
| 27 | T | 71.2 | Confident | 66 | Low | 73 Ų | 73 | 108.1 Ų | 108.1 | 45% | 0.448 | 54% | 0.54 | S | S | . | . | H | α-helix | trans | -70.2 | -32.3 | 176.5 | 61.7 | 0 | 0 | 0 | 0 | 114 | L23 L24 F29 L30 M31 | L23-T27 WeakPolarHBondContact O-CG2 3.14Å; L23-T27 PolarHBondContact O-N 3.25Å; L23-T27 PolarHBondContact O-OG1 3.05Å; L24-T27 WeakPolarHBondContact CA-OG1 3.28Å; L24-T27 CarbonylContact O-C 3.49Å; L24-T27 WeakPolarHBondContact O-CA 3.41Å; L24-T27 PolarHBondContact O-N 2.91Å; L24-T27 PolarHBondContact O-OG1 3.46Å; T27-F29 VanDerWaalsContact C-N 3.32Å; T27-L30 PolarHBondContact O-N 3.25Å; T27-L30 VanDerWaalsContact O-N 3.16Å; T27-M31 PolarHBondContact O-N 3.47Å |
| 28 | C | 63 | Low | 65.2 | Low | 68 Ų | 68 | 117.2 Ų | 117.2 | 46% | 0.459 | 58% | 0.578 | S | S | . | * | H | α-helix | trans | -68.3 | -34.3 | 177.9 | -77 | 0 | 0 | 0 | 0 | 111.6 | L24 F25 L30 | L24-C28 WeakPolarHBondContact O-CB 3.5Å; L24-C28 PolarHBondContact O-N 2.97Å; L24-C28 PolarHBondContact O-SG 3.06Å; L24-C28 VanDerWaalsContact O-SG 3.38Å; F25-C28 PolarHBondContact O-N 3.02Å; C28-L30 VanDerWaalsContact C-N 3.35Å |
| 29 | F | 63.6 | Low | 64.2 | Low | 179 Ų | 179 | 120.1 Ų | 120.1 | 79% | 0.785 | 59% | 0.591 | S | S | * | * | H | α-helix | trans | -70.2 | -34.7 | 171.2 | -167.8 | -104.3 | 0 | 0 | 0 | 111.6 | F25 T27 | F25-F29 PolarHBondContact O-N 3.22Å; F25-F29 VanDerWaalsContact O-N 3.16Å; T27-F29 VanDerWaalsContact C-N 3.32Å |
| 30 | L | 57.2 | Low | 63 | Low | 146 Ų | 146 | 115.2 Ų | 115.2 | 76% | 0.764 | 58% | 0.577 | S | S | * | * | H | α-helix | trans | -77.6 | -39.8 | -178.8 | -145.7 | 76.3 | 0 | 0 | 0 | 113.7 | S26 T27 C28 G32 | S26-L30 PolarHBondContact O-N 2.89Å; T27-L30 PolarHBondContact O-N 3.25Å; T27-L30 VanDerWaalsContact O-N 3.16Å; C28-L30 VanDerWaalsContact C-N 3.35Å; L30-G32 PolarHBondContact O-N 3.38Å |
| 31 | M | 59 | Low | 61.9 | Low | 129 Ų | 129 | 116.9 Ų | 116.9 | 64% | 0.635 | 60% | 0.6 | S | S | * | * | S | Bend | trans | -83.7 | 90.1 | 174 | -117.6 | 80.8 | 174.2 | 0 | 0 | 109.4 | T27 | T27-M31 PolarHBondContact O-N 3.47Š|
| 32 | G | 59.1 | Low | 60.8 | Low | 49 Ų | 49 | 119.5 Ų | 119.5 | 51% | 0.505 | 62% | 0.616 | S | S | . | * | trans | -38 | 115.5 | -175.7 | 0 | 0 | 0 | 0 | 0 | 115.9 | L30 | L30-G32 PolarHBondContact O-N 3.38Š| ||
| 33 | P | 55.9 | Low | 59.9 | Low | 91 Ų | 91 | 117.6 Ų | 117.6 | 59% | 0.591 | 62% | 0.623 | S | S | * | * | H | α-helix | trans | -73.9 | -28.1 | -169.4 | 23.5 | -32.6 | 0 | 0 | 0 | 115.6 | ||
| 34 | M | 54.1 | Low | 59 | Low | 171 Ų | 171 | 117 Ų | 117 | 84% | 0.842 | 62% | 0.62 | S | S | * | * | H | α-helix | trans | -78.2 | -36.6 | -164.6 | -77.2 | -68.9 | -163.6 | 0 | 0 | 115.5 | ||
| 35 | K | 53.9 | Low | 58.3 | Low | 201 Ų | 201 | 120.1 Ų | 120.1 | 87% | 0.874 | 63% | 0.631 | S | S | * | * | H | α-helix | trans | -88.1 | -18 | -177.8 | -91.5 | -179 | 177.4 | 177.2 | 0 | 114 | ||
| 36 | Q | 49.7 | Very low | 57.6 | Low | 78 Ų | 78 | 121.7 Ų | 121.7 | 36% | 0.364 | 63% | 0.632 | S | S | . | * | H | α-helix | trans | -95.1 | -19.5 | -176.4 | -140.3 | 161.6 | -77.4 | 0 | 0 | 113.3 | M40 R45 | Q36-M40 HydrophobicContact CG-SD 4.45Å; Q36-M40 PolarHBondContact O-N 3.15Å; Q36-R45 VanDerWaalsContact CG-NH1 3.27Å; Q36-R45 VanDerWaalsContact NE2-CZ 3.33Å |
| 37 | L | 53.3 | Low | 57.1 | Low | 127 Ų | 127 | 119.8 Ų | 119.8 | 67% | 0.665 | 62% | 0.615 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -68.6 | -36.1 | 178.1 | -168.4 | 66 | 0 | 0 | 0 | 112.6 | ||
| 38 | K | 54.1 | Low | 57 | Low | 200 Ų | 200 | 119.4 Ų | 119.4 | 87% | 0.87 | 62% | 0.616 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -77.5 | -22.3 | -179.9 | -155.1 | 177.4 | -176.5 | -174 | 0 | 113.5 | ||
| 39 | K | 51.8 | Low | 57.3 | Low | 184 Ų | 184 | 119 Ų | 119 | 80% | 0.8 | 61% | 0.614 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -99.6 | -5.5 | -177.6 | -126.8 | -172.4 | -171.8 | -169.8 | 0 | 114.2 | ||
| 40 | M | 49.9 | Very low | 57.8 | Low | 85 Ų | 85 | 112.5 Ų | 112.5 | 42% | 0.419 | 59% | 0.589 | S | S | . | * | trans | -131.6 | 51.3 | -178.4 | -64.4 | -159.2 | 175.7 | 0 | 0 | 111.7 | Q36 D42 | Q36-M40 HydrophobicContact CG-SD 4.45Å; Q36-M40 PolarHBondContact O-N 3.15Å; M40-D42 PolarHBondContact O-N 2.97Å | ||
| 41 | A | 52.9 | Low | 58.5 | Low | 99 Ų | 99 | 106 Ų | 106 | 82% | 0.818 | 56% | 0.555 | S | S | * | * | trans | -67.7 | 21.9 | 152.9 | 0 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 42 | D | 51.4 | Low | 59.2 | Low | 105 Ų | 105 | 103 Ų | 103 | 56% | 0.561 | 54% | 0.544 | S | S | * | . | trans | -71 | 127.8 | 164.4 | -75.2 | -64.7 | 0 | 0 | 0 | 108.5 | M40 N44 R45 | M40-D42 PolarHBondContact O-N 2.97Å; D42-N44 PolarHBondContact O-N 3.35Å; D42-R45 PolarHBondContact O-N 3.32Å; D42-R45 VanDerWaalsContact O-N 3.11Å | ||
| 43 | P | 56.7 | Low | 60 | Low | 114 Ų | 114 | 104.7 Ų | 104.7 | 74% | 0.74 | 54% | 0.544 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -56.4 | -21.3 | -168.7 | 21.7 | -34.6 | 0 | 0 | 0 | 113.8 | R45 | P43-R45 VanDerWaalsContact C-N 3.29Å; P43-R45 PolarHBondContact O-N 3.01Å |
| 44 | N | 58.6 | Low | 61 | Low | 99 Ų | 99 | 102.3 Ų | 102.3 | 53% | 0.529 | 53% | 0.525 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -72.8 | -16.4 | -176.9 | -141.7 | 59.4 | 0 | 0 | 0 | 114 | D42 I47 | D42-N44 PolarHBondContact O-N 3.35Å; N44-I47 WeakPolarHBondContact O-CG2 3.27Å |
| 45 | R | 58.2 | Low | 61.8 | Low | 88 Ų | 88 | 96 Ų | 96 | 33% | 0.332 | 49% | 0.494 | S | S | . | . | S | Bend | trans | -99.1 | -16.1 | -175 | -150.7 | 170.8 | -179.3 | -138.8 | -4.2 | 114.8 | Q36 D42 P43 I47 S48 | Q36-R45 VanDerWaalsContact CG-NH1 3.27Å; Q36-R45 VanDerWaalsContact NE2-CZ 3.33Å; D42-R45 PolarHBondContact O-N 3.32Å; D42-R45 VanDerWaalsContact O-N 3.11Å; P43-R45 VanDerWaalsContact C-N 3.29Å; P43-R45 PolarHBondContact O-N 3.01Å; R45-I47 PolarHBondContact O-N 2.89Å; R45-S48 PolarHBondContact O-N 2.88Å; R45-S48 VanDerWaalsContact O-N 3.15Å |
| 46 | W | 59 | Low | 62.8 | Low | 192 Ų | 192 | 91.5 Ų | 91.5 | 73% | 0.727 | 48% | 0.479 | S | S | * | . | H | α-helix | trans | -56.5 | -25.9 | 173.3 | -170.4 | 8.5 | 0 | 0 | 0 | 111.8 | S48 S49 V50 | W46-S48 PolarHBondContact O-N 2.74Å; W46-S48 VanDerWaalsContact O-N 3.1Å; W46-S49 PolarHBondContact O-N 3.42Å; W46-V50 HydrophobicContact CG-CG2 4.27Å; W46-V50 WeakPolarHBondContact O-CG2 3.48Å; W46-V50 PolarHBondContact O-N 3.01Å |
| 47 | I | 66 | Low | 64.1 | Low | 37 Ų | 37 | 90.9 Ų | 90.9 | 19% | 0.19 | 48% | 0.48 | C | S | . | . | H | α-helix | trans | -45.7 | -40.6 | 173.8 | -162.2 | 64.2 | 0 | 0 | 0 | 114.5 | N44 R45 V50 I51 W83 S87 | N44-I47 WeakPolarHBondContact O-CG2 3.27Å; R45-I47 PolarHBondContact O-N 2.89Å; I47-V50 PolarHBondContact O-N 3.26Å; I47-I51 WeakPolarHBondContact O-CD1 3.22Å; I47-I51 PolarHBondContact O-N 3.25Å; I47-I51 VanDerWaalsContact O-N 3.17Å; I47-W83 HydrophobicContact CD1-CD2 4.47Å; I47-W83 HydrophobicContact CD1-CG 4.09Å; I47-S87 WeakPolarHBondContact CD1-OG 3.2Å; I47-S87 WeakPolarHBondContact CG1-OG 3.28Å |
| 48 | S | 69.9 | Low | 64.8 | Low | 66 Ų | 66 | 85.6 Ų | 85.6 | 46% | 0.462 | 45% | 0.452 | S | S | . | . | H | α-helix | trans | -70.2 | -42.5 | -179.3 | -55.8 | 0 | 0 | 0 | 0 | 111.7 | R45 W46 V50 I51 V52 | R45-S48 PolarHBondContact O-N 2.88Å; R45-S48 VanDerWaalsContact O-N 3.15Å; W46-S48 PolarHBondContact O-N 2.74Å; W46-S48 VanDerWaalsContact O-N 3.1Å; S48-V50 VanDerWaalsContact C-N 3.34Å; S48-I51 PolarHBondContact O-N 3.23Å; S48-V52 PolarHBondContact O-N 3.46Å |
| 49 | S | 70 | Confident | 65.6 | Low | 60 Ų | 60 | 80.9 Ų | 80.9 | 42% | 0.42 | 44% | 0.44 | S | S | . | . | H | α-helix | trans | -66.7 | -38.8 | 177.3 | -57.3 | 0 | 0 | 0 | 0 | 111.3 | W46 I51 V52 V53 | W46-S49 PolarHBondContact O-N 3.42Å; S49-I51 VanDerWaalsContact C-N 3.31Å; S49-I51 PolarHBondContact O-N 3.35Å; S49-V52 PolarHBondContact O-N 2.89Å; S49-V53 VanDerWaalsContact O-CG2 3.29Å; S49-V53 WeakPolarHBondContact O-CG2 3.33Å; S49-V53 PolarHBondContact O-N 2.78Å |
| 50 | V | 73.2 | Confident | 66.5 | Low | 42 Ų | 42 | 77.9 Ų | 77.9 | 26% | 0.255 | 43% | 0.433 | S | S | . | . | H | α-helix | trans | -58.8 | -43.6 | 176.2 | 173.2 | 0 | 0 | 0 | 0 | 110.9 | W46 I47 S48 V52 V53 I54 | W46-V50 HydrophobicContact CG-CG2 4.27Å; W46-V50 WeakPolarHBondContact O-CG2 3.48Å; W46-V50 PolarHBondContact O-N 3.01Å; I47-V50 PolarHBondContact O-N 3.26Å; S48-V50 VanDerWaalsContact C-N 3.34Å; V50-V52 VanDerWaalsContact C-N 3.34Å; V50-V52 PolarHBondContact O-N 3.37Å; V50-V53 PolarHBondContact O-N 2.93Å; V50-I54 HydrophobicContact CG1-CD1 3.58Å; V50-I54 HydrophobicContact CG1-CG1 4.27Å; V50-I54 WeakPolarHBondContact O-CD1 3.33Å; V50-I54 WeakPolarHBondContact O-CG1 3.48Å; V50-I54 PolarHBondContact O-N 2.94Å |
| 51 | I | 71 | Confident | 67.4 | Low | 10 Ų | 10 | 79.3 Ų | 79.3 | 5% | 0.051 | 44% | 0.437 | C | S | . | . | H | α-helix | trans | -58.3 | -43.8 | 177.2 | -103.5 | 89.8 | 0 | 0 | 0 | 112.4 | I47 S48 S49 M55 Y84 | I47-I51 WeakPolarHBondContact O-CD1 3.22Å; I47-I51 PolarHBondContact O-N 3.25Å; I47-I51 VanDerWaalsContact O-N 3.17Å; S48-I51 PolarHBondContact O-N 3.23Å; S49-I51 VanDerWaalsContact C-N 3.31Å; S49-I51 PolarHBondContact O-N 3.35Å; I51-M55 VanDerWaalsContact O-CG 3.27Å; I51-M55 WeakPolarHBondContact O-CG 3.33Å; I51-M55 PolarHBondContact O-N 3.07Å; I51-Y84 HydrophobicContact CG1-CD2 4.17Å |
| 52 | V | 74.4 | Confident | 68 | Low | 66 Ų | 66 | 77.7 Ų | 77.7 | 40% | 0.4 | 42% | 0.423 | S | S | . | . | H | α-helix | trans | -70.1 | -42.2 | -178.1 | 176.7 | 0 | 0 | 0 | 0 | 110.5 | S48 S49 V50 M55 I56 | S48-V52 PolarHBondContact O-N 3.46Å; S49-V52 PolarHBondContact O-N 2.89Å; V50-V52 VanDerWaalsContact C-N 3.34Å; V50-V52 PolarHBondContact O-N 3.37Å; V52-M55 PolarHBondContact O-N 3.36Å; V52-I56 HydrophobicContact CG1-CD1 4.06Å; V52-I56 WeakPolarHBondContact O-CG1 3.17Å; V52-I56 PolarHBondContact O-N 3.25Å; V52-I56 VanDerWaalsContact O-N 3.15Å |
| 53 | V | 77 | Confident | 68.8 | Low | 84 Ų | 84 | 77 Ų | 77 | 51% | 0.509 | 43% | 0.432 | S | S | . | . | H | α-helix | trans | -63.1 | -43.5 | 178.3 | 172.9 | 0 | 0 | 0 | 0 | 111 | S49 V50 M55 I56 V57 | S49-V53 VanDerWaalsContact O-CG2 3.29Å; S49-V53 WeakPolarHBondContact O-CG2 3.33Å; S49-V53 PolarHBondContact O-N 2.78Å; V50-V53 PolarHBondContact O-N 2.93Å; V53-M55 VanDerWaalsContact C-N 3.28Å; V53-M55 PolarHBondContact O-N 2.92Å; V53-I56 PolarHBondContact O-N 3.49Å; V53-V57 HydrophobicContact CG1-CG2 4.23Å; V53-V57 WeakPolarHBondContact O-CG2 3.44Å; V53-V57 PolarHBondContact O-N 3.42Å |
| 54 | I | 75.7 | Confident | 69.4 | Low | 40 Ų | 40 | 79.9 Ų | 79.9 | 21% | 0.205 | 43% | 0.433 | C | S | . | . | H | α-helix | trans | -58.3 | -41.5 | 176.5 | -69.1 | 164.5 | 0 | 0 | 0 | 110.9 | V50 M58 A80 | V50-I54 HydrophobicContact CG1-CD1 3.58Å; V50-I54 HydrophobicContact CG1-CG1 4.27Å; V50-I54 WeakPolarHBondContact O-CD1 3.33Å; V50-I54 WeakPolarHBondContact O-CG1 3.48Å; V50-I54 PolarHBondContact O-N 2.94Å; I54-M58 WeakPolarHBondContact O-CB 3.39Å; I54-M58 PolarHBondContact O-N 3.38Å; I54-A80 HydrophobicContact CG2-CB 4.15Å |
| 55 | M | 70.8 | Confident | 69.5 | Low | 39 Ų | 39 | 83 Ų | 83 | 19% | 0.192 | 44% | 0.439 | C | S | . | . | H | α-helix | trans | -64.7 | -40.5 | 179.1 | -69.1 | -79.6 | 163.6 | 0 | 0 | 112.6 | Q21 I51 V52 V53 M58 T59 A80 | Q21-M55 VanDerWaalsContact NE2-CE 3.28Å; Q21-M55 PolarHBondContact NE2-SD 3.23Å; I51-M55 VanDerWaalsContact O-CG 3.27Å; I51-M55 WeakPolarHBondContact O-CG 3.33Å; I51-M55 PolarHBondContact O-N 3.07Å; V52-M55 PolarHBondContact O-N 3.36Å; V53-M55 VanDerWaalsContact C-N 3.28Å; V53-M55 PolarHBondContact O-N 2.92Å; M55-M58 HydrophobicContact SD-CE 4.3Å; M55-T59 WeakPolarHBondContact O-CB 3.36Å; M55-T59 PolarHBondContact O-N 3.24Å; M55-T59 PolarHBondContact O-OG1 3.06Å; M55-A80 HydrophobicContact CE-CB 4.21Å |
| 56 | I | 74.3 | Confident | 69.7 | Low | 106 Ų | 106 | 84.9 Ų | 84.9 | 54% | 0.544 | 46% | 0.46 | S | S | . | . | H | α-helix | trans | -68.6 | -47.9 | 179.2 | -67.3 | 168.2 | 0 | 0 | 0 | 110.7 | V52 V53 M58 T59 L60 | V52-I56 HydrophobicContact CG1-CD1 4.06Å; V52-I56 WeakPolarHBondContact O-CG1 3.17Å; V52-I56 PolarHBondContact O-N 3.25Å; V52-I56 VanDerWaalsContact O-N 3.15Å; V53-I56 PolarHBondContact O-N 3.49Å; I56-M58 VanDerWaalsContact C-N 3.33Å; I56-M58 PolarHBondContact O-N 3.15Å; I56-T59 PolarHBondContact O-N 3.01Å; I56-L60 PolarHBondContact O-N 3.37Å |
| 57 | V | 77.4 | Confident | 69.9 | Low | 66 Ų | 66 | 80.9 Ų | 80.9 | 40% | 0.4 | 46% | 0.461 | S | S | . | . | H | α-helix | trans | -59.2 | -47.7 | 177.2 | 173.9 | 0 | 0 | 0 | 0 | 109.6 | V53 T59 L60 F61 | V53-V57 HydrophobicContact CG1-CG2 4.23Å; V53-V57 WeakPolarHBondContact O-CG2 3.44Å; V53-V57 PolarHBondContact O-N 3.42Å; V57-T59 VanDerWaalsContact C-N 3.3Å; V57-T59 PolarHBondContact O-N 2.99Å; V57-L60 PolarHBondContact O-N 3.17Å; V57-F61 HydrophobicContact CG1-CD2 3.62Å; V57-F61 HydrophobicContact CG1-CE2 3.56Å; V57-F61 WeakPolarHBondContact O-CD2 3.23Å; V57-F61 PolarHBondContact O-N 3.34Å |
| 58 | M | 68.1 | Low | 69.8 | Low | 15 Ų | 15 | 82.9 Ų | 82.9 | 7% | 0.074 | 48% | 0.483 | C | S | . | . | H | α-helix | trans | -59.8 | -39.6 | 179.3 | -169.5 | 157.9 | 70.2 | 0 | 0 | 112.7 | I54 M55 I56 A62 L76 Q77 | I54-M58 WeakPolarHBondContact O-CB 3.39Å; I54-M58 PolarHBondContact O-N 3.38Å; M55-M58 HydrophobicContact SD-CE 4.3Å; I56-M58 VanDerWaalsContact C-N 3.33Å; I56-M58 PolarHBondContact O-N 3.15Å; M58-A62 WeakPolarHBondContact O-CB 3.12Å; M58-A62 PolarHBondContact O-N 3.4Å; M58-L76 HydrophobicContact SD-CB 3.75Å; M58-Q77 HydrophobicContact CE-CB 4.41Å; M58-Q77 HydrophobicContact SD-CB 4.43Å |
| 59 | T | 71.7 | Confident | 69.2 | Low | 101 Ų | 101 | 81.7 Ų | 81.7 | 62% | 0.62 | 47% | 0.471 | S | S | * | . | H | α-helix | trans | -65.7 | -44.1 | 177.9 | -56.1 | 0 | 0 | 0 | 0 | 111.8 | M55 I56 V57 A63 | M55-T59 WeakPolarHBondContact O-CB 3.36Å; M55-T59 PolarHBondContact O-N 3.24Å; M55-T59 PolarHBondContact O-OG1 3.06Å; I56-T59 PolarHBondContact O-N 3.01Å; V57-T59 VanDerWaalsContact C-N 3.3Å; V57-T59 PolarHBondContact O-N 2.99Å; T59-A63 PolarHBondContact O-N 2.91Å |
| 60 | L | 70.3 | Confident | 69 | Low | 122 Ų | 122 | 82.7 Ų | 82.7 | 64% | 0.639 | 48% | 0.477 | S | S | * | . | H | α-helix | trans | -68.4 | -39.9 | -178.4 | -164.6 | 120.3 | 0 | 0 | 0 | 111.8 | I56 V57 A63 | I56-L60 PolarHBondContact O-N 3.37Å; V57-L60 PolarHBondContact O-N 3.17Å; L60-A63 PolarHBondContact O-N 3.44Å |
| 61 | F | 68.7 | Low | 68.7 | Low | 114 Ų | 114 | 86.8 Ų | 86.8 | 50% | 0.5 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -69.9 | -38.6 | 178.5 | -83.2 | -105.5 | 0 | 0 | 0 | 112.2 | V57 A63 F64 L69 | V57-F61 HydrophobicContact CG1-CD2 3.62Å; V57-F61 HydrophobicContact CG1-CE2 3.56Å; V57-F61 WeakPolarHBondContact O-CD2 3.23Å; V57-F61 PolarHBondContact O-N 3.34Å; F61-A63 PolarHBondContact O-N 3.39Å; F61-F64 PolarHBondContact O-N 3.35Å; F61-L69 VanDerWaalsContact O-CD1 3.31Å; F61-L69 WeakPolarHBondContact O-CD1 3.27Å |
| 62 | A | 65.9 | Low | 68.7 | Low | 65 Ų | 65 | 90.3 Ų | 90.3 | 54% | 0.537 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -61.9 | -29.7 | 176.6 | 0 | 0 | 0 | 0 | 0 | 113.2 | M58 | M58-A62 WeakPolarHBondContact O-CB 3.12Å; M58-A62 PolarHBondContact O-N 3.4Å |
| 63 | A | 67.1 | Low | 68.6 | Low | 90 Ų | 90 | 88.7 Ų | 88.7 | 74% | 0.744 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -74.6 | -22.7 | -179.5 | 0 | 0 | 0 | 0 | 0 | 113.9 | T59 L60 F61 | T59-A63 PolarHBondContact O-N 2.91Å; L60-A63 PolarHBondContact O-N 3.44Å; F61-A63 PolarHBondContact O-N 3.39Å |
| 64 | F | 70.7 | Confident | 68.3 | Low | 175 Ų | 175 | 87.5 Ų | 87.5 | 77% | 0.768 | 50% | 0.499 | S | S | * | . | H | α-helix | trans | -98.9 | -25.4 | -164.7 | -156.8 | -105.7 | 0 | 0 | 0 | 115.3 | F61 | F61-F64 PolarHBondContact O-N 3.35Å |
| 65 | Y | 60.3 | Low | 68.3 | Low | 166 Ų | 166 | 90 Ų | 90 | 65% | 0.651 | 51% | 0.513 | S | S | * | . | trans | -147.5 | 114.8 | -167 | -134 | -106.7 | 0 | 0 | 0 | 115 | ||||
| 66 | V | 61.6 | Low | 68.4 | Low | 127 Ų | 127 | 91.2 Ų | 91.2 | 77% | 0.77 | 52% | 0.519 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -61.9 | 142.9 | -175.5 | 167.8 | 0 | 0 | 0 | 0 | 113.6 | A68 | V66-A68 PolarHBondContact O-N 3.38Š|
| 67 | S | 64.3 | Low | 68.3 | Low | 107 Ų | 107 | 87.2 Ų | 87.2 | 75% | 0.748 | 50% | 0.498 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 66.5 | -54.5 | 169.6 | -52 | 0 | 0 | 0 | 0 | 119.8 | L69 | S67-L69 PolarHBondContact O-N 3.36Š|
| 68 | A | 62.7 | Low | 68.2 | Low | 79 Ų | 79 | 91.2 Ų | 91.2 | 65% | 0.653 | 51% | 0.507 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -72.6 | -27.7 | -171.4 | 0 | 0 | 0 | 0 | 0 | 113.6 | V66 C70 | V66-A68 PolarHBondContact O-N 3.38Å; A68-C70 VanDerWaalsContact C-N 3.31Å; A68-C70 PolarHBondContact O-N 3.25Å |
| 69 | L | 57.9 | Low | 68.5 | Low | 41 Ų | 41 | 93.6 Ų | 93.6 | 22% | 0.215 | 52% | 0.523 | C | S | . | . | H | α-helix | trans | -78.9 | -9.3 | -178 | -75.2 | 171.9 | 0 | 0 | 0 | 114.3 | F61 S67 L71 L72 C73 | F61-L69 VanDerWaalsContact O-CD1 3.31Å; F61-L69 WeakPolarHBondContact O-CD1 3.27Å; S67-L69 PolarHBondContact O-N 3.36Å; L69-L71 VanDerWaalsContact C-N 3.3Å; L69-L71 PolarHBondContact O-N 2.99Å; L69-L72 HydrophobicContact CD2-CB 4.2Å; L69-L72 HydrophobicContact CD2-CD2 3.65Å; L69-L72 PolarHBondContact O-N 3.29Å; L69-C73 VanDerWaalsContact O-CB 3.31Å; L69-C73 WeakPolarHBondContact O-CB 3.42Å; L69-C73 PolarHBondContact O-N 3.16Å |
| 70 | C | 66 | Low | 68.6 | Low | 82 Ų | 82 | 89 Ų | 89 | 55% | 0.554 | 49% | 0.494 | S | S | * | . | H | α-helix | trans | -59.8 | -43.9 | 178.1 | -168.1 | 0 | 0 | 0 | 0 | 111 | A68 C73 V74 | A68-C70 VanDerWaalsContact C-N 3.31Å; A68-C70 PolarHBondContact O-N 3.25Å; C70-C73 WeakPolarHBondContact O-CB 3.29Å; C70-C73 PolarHBondContact O-N 3.07Å; C70-V74 WeakPolarHBondContact O-CG2 3.48Å; C70-V74 PolarHBondContact O-N 3.34Å |
| 71 | L | 67.6 | Low | 68.5 | Low | 128 Ų | 128 | 85.1 Ų | 85.1 | 67% | 0.67 | 47% | 0.474 | S | S | * | . | H | α-helix | trans | -62.5 | -43.7 | 175.9 | -110.6 | 167.6 | 0 | 0 | 0 | 112.1 | L69 C73 V74 I75 | L69-L71 VanDerWaalsContact C-N 3.3Å; L69-L71 PolarHBondContact O-N 2.99Å; L71-C73 VanDerWaalsContact C-N 3.34Å; L71-C73 PolarHBondContact O-N 3.32Å; L71-V74 PolarHBondContact O-N 3.42Å; L71-I75 WeakPolarHBondContact O-CG1 3.23Å; L71-I75 PolarHBondContact O-N 3.14Å; L71-I75 VanDerWaalsContact O-N 3.12Å |
| 72 | L | 70.5 | Confident | 68.7 | Low | 84 Ų | 84 | 82.2 Ų | 82.2 | 44% | 0.44 | 47% | 0.465 | S | S | . | . | H | α-helix | trans | -65.2 | -39.8 | 178.3 | -168.2 | 67.7 | 0 | 0 | 0 | 111.5 | L69 V74 I75 L76 | L69-L72 HydrophobicContact CD2-CB 4.2Å; L69-L72 HydrophobicContact CD2-CD2 3.65Å; L69-L72 PolarHBondContact O-N 3.29Å; L72-V74 VanDerWaalsContact C-N 3.35Å; L72-V74 PolarHBondContact O-N 3.34Å; L72-I75 PolarHBondContact O-N 2.57Å; L72-L76 HydrophobicContact CG-CD1 4.11Å; L72-L76 WeakPolarHBondContact O-CB 3.48Å; L72-L76 WeakPolarHBondContact O-CG 3.46Å; L72-L76 PolarHBondContact O-N 2.87Å |
| 73 | C | 71.2 | Confident | 68.9 | Low | 31 Ų | 31 | 84.8 Ų | 84.8 | 21% | 0.209 | 46% | 0.461 | C | S | . | . | H | α-helix | trans | -60.1 | -43.2 | 175.2 | -172 | 0 | 0 | 0 | 0 | 111.5 | L69 C70 L71 L76 Q77 | L69-C73 VanDerWaalsContact O-CB 3.31Å; L69-C73 WeakPolarHBondContact O-CB 3.42Å; L69-C73 PolarHBondContact O-N 3.16Å; C70-C73 WeakPolarHBondContact O-CB 3.29Å; C70-C73 PolarHBondContact O-N 3.07Å; L71-C73 VanDerWaalsContact C-N 3.34Å; L71-C73 PolarHBondContact O-N 3.32Å; C73-L76 PolarHBondContact O-N 3.35Å; C73-Q77 VanDerWaalsContact O-CB 3.28Å; C73-Q77 WeakPolarHBondContact O-CB 3.34Å; C73-Q77 PolarHBondContact O-N 3.49Å |
| 74 | V | 71.3 | Confident | 68.9 | Low | 59 Ų | 59 | 82.2 Ų | 82.2 | 36% | 0.358 | 43% | 0.432 | S | S | . | . | H | α-helix | trans | -61.2 | -48.2 | 176.2 | 172.3 | 0 | 0 | 0 | 0 | 111.7 | F10 C70 L71 L72 Q77 Y78 | F10-V74 HydrophobicContact CD2-CG2 3.67Å; F10-V74 HydrophobicContact CE2-CB 4.38Å; F10-V74 HydrophobicContact CE2-CG2 3.57Å; F10-V74 HydrophobicContact CZ-CG2 4.46Å; C70-V74 WeakPolarHBondContact O-CG2 3.48Å; C70-V74 PolarHBondContact O-N 3.34Å; L71-V74 PolarHBondContact O-N 3.42Å; L72-V74 VanDerWaalsContact C-N 3.35Å; L72-V74 PolarHBondContact O-N 3.34Å; V74-Q77 PolarHBondContact O-N 3.35Å; V74-Y78 WeakPolarHBondContact O-CB 2.79Å; V74-Y78 PolarHBondContact O-N 3.11Å |
| 75 | I | 76.4 | Confident | 68.8 | Low | 94 Ų | 94 | 76.2 Ų | 76.2 | 48% | 0.482 | 42% | 0.416 | S | S | . | . | H | α-helix | trans | -64.2 | -43.9 | -178.9 | -63.9 | 166.7 | 0 | 0 | 0 | 110.4 | L71 L72 Y78 V79 | L71-I75 WeakPolarHBondContact O-CG1 3.23Å; L71-I75 PolarHBondContact O-N 3.14Å; L71-I75 VanDerWaalsContact O-N 3.12Å; L72-I75 PolarHBondContact O-N 2.57Å; I75-Y78 WeakPolarHBondContact O-CB 3.35Å; I75-Y78 PolarHBondContact O-N 2.88Å; I75-V79 WeakPolarHBondContact O-CG2 3.48Å; I75-V79 PolarHBondContact O-N 3.06Å |
| 76 | L | 72.9 | Confident | 68.8 | Low | 63 Ų | 63 | 73.1 Ų | 73.1 | 33% | 0.33 | 41% | 0.41 | S | S | . | . | H | α-helix | trans | -65.3 | -41 | 177.3 | -76.2 | 171.8 | 0 | 0 | 0 | 112.2 | M58 L72 C73 Y78 V79 A80 | M58-L76 HydrophobicContact SD-CB 3.75Å; L72-L76 HydrophobicContact CG-CD1 4.11Å; L72-L76 WeakPolarHBondContact O-CB 3.48Å; L72-L76 WeakPolarHBondContact O-CG 3.46Å; L72-L76 PolarHBondContact O-N 2.87Å; C73-L76 PolarHBondContact O-N 3.35Å; L76-Y78 VanDerWaalsContact C-N 3.27Å; L76-Y78 PolarHBondContact O-N 3.1Å; L76-V79 PolarHBondContact O-N 3.03Å; L76-A80 VanDerWaalsContact O-CB 3.27Å; L76-A80 WeakPolarHBondContact O-CB 3.2Å; L76-A80 PolarHBondContact O-N 3.49Å |
| 77 | Q | 72.6 | Confident | 68.9 | Low | 22 Ų | 22 | 68.4 Ų | 68.4 | 10% | 0.103 | 38% | 0.382 | C | S | . | . | H | α-helix | trans | -62.6 | -37.9 | 175.2 | -165.9 | 75.3 | 78.1 | 0 | 0 | 110.7 | F13 M58 C73 V74 M81 | F13-Q77 HydrophobicContact CD1-CB 4.48Å; F13-Q77 HydrophobicContact CD1-CG 3.76Å; F13-Q77 HydrophobicContact CE1-CB 3.77Å; F13-Q77 HydrophobicContact CE1-CG 3.25Å; F13-Q77 HydrophobicContact CZ-CG 4.17Å; M58-Q77 HydrophobicContact CE-CB 4.41Å; M58-Q77 HydrophobicContact SD-CB 4.43Å; C73-Q77 VanDerWaalsContact O-CB 3.28Å; C73-Q77 WeakPolarHBondContact O-CB 3.34Å; C73-Q77 PolarHBondContact O-N 3.49Å; V74-Q77 PolarHBondContact O-N 3.35Å; Q77-M81 WeakPolarHBondContact O-CG 3.1Å; Q77-M81 PolarHBondContact O-N 2.86Å |
| 78 | Y | 74.6 | Confident | 68.5 | Low | 151 Ų | 151 | 69.6 Ų | 69.6 | 59% | 0.592 | 37% | 0.371 | S | S | * | . | H | α-helix | trans | -62.9 | -50 | 173.7 | -175.3 | -100.6 | 0 | 0 | 0 | 112.1 | V74 I75 L76 A80 M81 T82 | V74-Y78 WeakPolarHBondContact O-CB 2.79Å; V74-Y78 PolarHBondContact O-N 3.11Å; I75-Y78 WeakPolarHBondContact O-CB 3.35Å; I75-Y78 PolarHBondContact O-N 2.88Å; L76-Y78 VanDerWaalsContact C-N 3.27Å; L76-Y78 PolarHBondContact O-N 3.1Å; Y78-A80 PolarHBondContact O-N 3.15Å; Y78-M81 PolarHBondContact O-N 3.13Å; Y78-T82 PolarHBondContact O-N 2.67Å; Y78-T82 PolarHBondContact O-OG1 3.29Å |
| 79 | V | 75.1 | Confident | 68.3 | Low | 65 Ų | 65 | 70.3 Ų | 70.3 | 39% | 0.394 | 36% | 0.363 | S | S | . | . | H | α-helix | trans | -62.5 | -42.5 | 177.6 | 174.4 | 0 | 0 | 0 | 0 | 111.2 | I75 L76 M81 T82 W83 | I75-V79 WeakPolarHBondContact O-CG2 3.48Å; I75-V79 PolarHBondContact O-N 3.06Å; L76-V79 PolarHBondContact O-N 3.03Å; V79-M81 VanDerWaalsContact C-N 3.28Å; V79-M81 PolarHBondContact O-N 3.45Å; V79-T82 PolarHBondContact O-N 3.41Å; V79-W83 VanDerWaalsContact O-CB 3.23Å; V79-W83 WeakPolarHBondContact O-CB 2.95Å; V79-W83 PolarHBondContact O-N 3.23Å |
| 80 | A | 72 | Confident | 67.8 | Low | 3 Ų | 3 | 70 Ų | 70 | 3% | 0.025 | 36% | 0.364 | C | S | . | . | H | α-helix | trans | -58.9 | -40.6 | 177.1 | 0 | 0 | 0 | 0 | 0 | 111.6 | I54 M55 L76 Y78 Y84 | I54-A80 HydrophobicContact CG2-CB 4.15Å; M55-A80 HydrophobicContact CE-CB 4.21Å; L76-A80 VanDerWaalsContact O-CB 3.27Å; L76-A80 WeakPolarHBondContact O-CB 3.2Å; L76-A80 PolarHBondContact O-N 3.49Å; Y78-A80 PolarHBondContact O-N 3.15Å; A80-Y84 WeakPolarHBondContact O-CB 3.07Å; A80-Y84 PolarHBondContact O-N 3.11Å |
| 81 | M | 69.5 | Low | 67.2 | Low | 41 Ų | 41 | 74.6 Ų | 74.6 | 20% | 0.202 | 37% | 0.371 | C | S | . | . | H | α-helix | trans | -70.3 | -42.8 | 177 | -69 | -65.7 | -71.4 | 0 | 0 | 112.2 | F13 A17 L20 Q77 Y78 V79 Y84 A85 | F13-M81 HydrophobicContact CE1-CG 4.21Å; F13-M81 HydrophobicContact CE2-CB 4.16Å; F13-M81 HydrophobicContact CE2-CE 4.31Å; F13-M81 HydrophobicContact CE2-CG 3.72Å; F13-M81 HydrophobicContact CZ-CB 3.87Å; F13-M81 HydrophobicContact CZ-CG 3.35Å; A17-M81 HydrophobicContact CB-CE 4.46Å; A17-M81 HydrophobicContact CB-SD 3.74Å; L20-M81 HydrophobicContact CD1-CE 4.22Å; Q77-M81 WeakPolarHBondContact O-CG 3.1Å; Q77-M81 PolarHBondContact O-N 2.86Å; Y78-M81 PolarHBondContact O-N 3.13Å; V79-M81 VanDerWaalsContact C-N 3.28Å; V79-M81 PolarHBondContact O-N 3.45Å; M81-Y84 PolarHBondContact O-N 3.41Å; M81-A85 WeakPolarHBondContact O-CB 3.02Å; M81-A85 PolarHBondContact O-N 3.36Å |
| 82 | T | 73.6 | Confident | 66.5 | Low | 54 Ų | 54 | 71.5 Ų | 71.5 | 33% | 0.331 | 36% | 0.364 | S | S | . | . | H | α-helix | trans | -63.9 | -45.1 | 177.5 | -59.5 | 0 | 0 | 0 | 0 | 111.2 | Y78 V79 A85 L86 | Y78-T82 PolarHBondContact O-N 2.67Å; Y78-T82 PolarHBondContact O-OG1 3.29Å; V79-T82 PolarHBondContact O-N 3.41Å; T82-A85 PolarHBondContact O-N 3.46Å; T82-L86 HydrophobicContact CG2-CD1 3.78Å; T82-L86 WeakPolarHBondContact O-CB 3.49Å; T82-L86 WeakPolarHBondContact O-CD1 3.4Å; T82-L86 WeakPolarHBondContact O-CG 3.38Å; T82-L86 PolarHBondContact O-N 2.94Å |
| 83 | W | 68.3 | Low | 65.6 | Low | 119 Ų | 119 | 77.4 Ų | 77.4 | 45% | 0.451 | 38% | 0.38 | S | S | . | . | H | α-helix | trans | -66.6 | -42.3 | 178.3 | -148.2 | -108 | 0 | 0 | 0 | 110.7 | I47 V79 L86 S87 | I47-W83 HydrophobicContact CD1-CD2 4.47Å; I47-W83 HydrophobicContact CD1-CG 4.09Å; V79-W83 VanDerWaalsContact O-CB 3.23Å; V79-W83 WeakPolarHBondContact O-CB 2.95Å; V79-W83 PolarHBondContact O-N 3.23Å; W83-L86 PolarHBondContact O-N 3.41Å; W83-S87 PolarHBondContact O-N 3.37Å; W83-S87 PolarHBondContact O-OG 3.42Å |
| 84 | Y | 67.7 | Low | 64.9 | Low | 35 Ų | 35 | 82.6 Ų | 82.6 | 14% | 0.137 | 40% | 0.399 | C | S | . | . | H | α-helix | trans | -57.1 | -52.3 | 172.9 | -175.5 | -96.3 | 0 | 0 | 0 | 110.9 | L20 L24 I51 A80 M81 L86 S87 Y88 | L20-Y84 HydrophobicContact CB-CE1 4.28Å; L20-Y84 HydrophobicContact CD1-CD1 4.1Å; L20-Y84 HydrophobicContact CD1-CE1 3.76Å; L20-Y84 HydrophobicContact CD2-CE1 4.18Å; L20-Y84 HydrophobicContact CG-CE1 4.29Å; L24-Y84 HydrophobicContact CD1-CE2 3.8Å; L24-Y84 WeakPolarHBondContact CD1-OH 3.06Å; L24-Y84 HydrophobicContact CD2-CE2 3.52Å; L24-Y84 WeakPolarHBondContact CD2-OH 3.32Å; L24-Y84 HydrophobicContact CG-CE2 3.66Å; I51-Y84 HydrophobicContact CG1-CD2 4.17Å; A80-Y84 WeakPolarHBondContact O-CB 3.07Å; A80-Y84 PolarHBondContact O-N 3.11Å; M81-Y84 PolarHBondContact O-N 3.41Å; Y84-L86 PolarHBondContact O-N 3.45Å; Y84-S87 WeakPolarHBondContact O-CB 3.37Å; Y84-S87 PolarHBondContact O-N 3.16Å; Y84-S87 VanDerWaalsContact O-N 3.16Å; Y84-S87 PolarHBondContact O-OG 2.9Å; Y84-Y88 HydrophobicContact CD1-CD2 4.3Å; Y84-Y88 HydrophobicContact CD1-CE2 4.09Å; Y84-Y88 AromaticContact CD2-CE2 3.99Å; Y84-Y88 HydrophobicContact CD2-CE2 3.99Å; Y84-Y88 HydrophobicContact CE1-CD2 4.02Å; Y84-Y88 AromaticContact CE1-CE2 3.54Å; Y84-Y88 HydrophobicContact CE1-CE2 3.54Å; Y84-Y88 HydrophobicContact CE2-CD2 4.48Å; Y84-Y88 AromaticContact CE2-CE2 3.45Å; Y84-Y88 HydrophobicContact CE2-CE2 3.45Å; Y84-Y88 VanDerWaalsContact CE2-CE2 3.45Å; Y84-Y88 HydrophobicContact CG-CE2 4.29Å; Y84-Y88 AromaticContact CZ-CE2 3.18Å; Y84-Y88 AromaticContact CZ-CZ 3.75Å; Y84-Y88 VanDerWaalsContact O-CD2 3.23Å; Y84-Y88 WeakPolarHBondContact O-CD2 2.97Å; Y84-Y88 PolarHBondContact O-N 3.22Å; Y84-Y88 VanDerWaalsContact OH-CE2 3.32Å; Y84-Y88 WeakPolarHBondContact OH-CE2 3.35Å; Y84-Y88 PolarHBondContact OH-OH 3.02Å |
| 85 | A | 68.5 | Low | 64 | Low | 50 Ų | 50 | 81.6 Ų | 81.6 | 41% | 0.413 | 40% | 0.397 | S | S | . | . | H | α-helix | trans | -58.1 | -47.3 | 177 | 0 | 0 | 0 | 0 | 0 | 112.4 | M81 T82 S87 Y88 I89 | M81-A85 WeakPolarHBondContact O-CB 3.02Å; M81-A85 PolarHBondContact O-N 3.36Å; T82-A85 PolarHBondContact O-N 3.46Å; A85-S87 VanDerWaalsContact C-N 3.26Å; A85-S87 PolarHBondContact O-N 2.72Å; A85-Y88 PolarHBondContact O-N 3.12Å; A85-Y88 VanDerWaalsContact O-N 3.14Å; A85-I89 WeakPolarHBondContact O-CD1 3.1Å; A85-I89 PolarHBondContact O-N 3.07Å |
| 86 | L | 60.6 | Low | 63.1 | Low | 101 Ų | 101 | 80.5 Ų | 80.5 | 53% | 0.529 | 40% | 0.398 | S | S | . | . | H | α-helix | trans | -60 | -34.2 | 177.4 | -81.8 | 158.6 | 0 | 0 | 0 | 112.9 | T82 W83 Y84 Y88 I89 | T82-L86 HydrophobicContact CG2-CD1 3.78Å; T82-L86 WeakPolarHBondContact O-CB 3.49Å; T82-L86 WeakPolarHBondContact O-CD1 3.4Å; T82-L86 WeakPolarHBondContact O-CG 3.38Å; T82-L86 PolarHBondContact O-N 2.94Å; W83-L86 PolarHBondContact O-N 3.41Å; Y84-L86 PolarHBondContact O-N 3.45Å; L86-Y88 PolarHBondContact O-N 3.38Å; L86-I89 CarbonylContact O-C 3.26Å; L86-I89 VanDerWaalsContact O-C 3.26Å; L86-I89 PolarHBondContact O-N 3.3Å; L86-I89 VanDerWaalsContact O-N 3.07Å |
| 87 | S | 64.8 | Low | 62.3 | Low | 27 Ų | 27 | 84.7 Ų | 84.7 | 19% | 0.189 | 41% | 0.414 | C | S | . | . | H | α-helix | trans | -59.9 | -35.5 | 177.2 | -49.2 | 0 | 0 | 0 | 0 | 112.7 | I47 W83 Y84 A85 P90 | I47-S87 WeakPolarHBondContact CD1-OG 3.2Å; I47-S87 WeakPolarHBondContact CG1-OG 3.28Å; W83-S87 PolarHBondContact O-N 3.37Å; W83-S87 PolarHBondContact O-OG 3.42Å; Y84-S87 WeakPolarHBondContact O-CB 3.37Å; Y84-S87 PolarHBondContact O-N 3.16Å; Y84-S87 VanDerWaalsContact O-N 3.16Å; Y84-S87 PolarHBondContact O-OG 2.9Å; A85-S87 VanDerWaalsContact C-N 3.26Å; A85-S87 PolarHBondContact O-N 2.72Å; S87-P90 WeakPolarHBondContact O-CD 3.49Å |
| 88 | Y | 54.4 | Low | 61.6 | Low | 132 Ų | 132 | 85.8 Ų | 85.8 | 52% | 0.518 | 43% | 0.426 | S | S | . | . | H | α-helix | trans | -83.7 | -13.7 | 178.2 | -74.9 | -84.5 | 0 | 0 | 0 | 113 | L24 Y84 A85 L86 P90 | L24-Y88 WeakPolarHBondContact CD1-OH 3.5Å; Y84-Y88 HydrophobicContact CD1-CD2 4.3Å; Y84-Y88 HydrophobicContact CD1-CE2 4.09Å; Y84-Y88 AromaticContact CD2-CE2 3.99Å; Y84-Y88 HydrophobicContact CD2-CE2 3.99Å; Y84-Y88 HydrophobicContact CE1-CD2 4.02Å; Y84-Y88 AromaticContact CE1-CE2 3.54Å; Y84-Y88 HydrophobicContact CE1-CE2 3.54Å; Y84-Y88 HydrophobicContact CE2-CD2 4.48Å; Y84-Y88 AromaticContact CE2-CE2 3.45Å; Y84-Y88 HydrophobicContact CE2-CE2 3.45Å; Y84-Y88 VanDerWaalsContact CE2-CE2 3.45Å; Y84-Y88 HydrophobicContact CG-CE2 4.29Å; Y84-Y88 AromaticContact CZ-CE2 3.18Å; Y84-Y88 AromaticContact CZ-CZ 3.75Å; Y84-Y88 VanDerWaalsContact O-CD2 3.23Å; Y84-Y88 WeakPolarHBondContact O-CD2 2.97Å; Y84-Y88 PolarHBondContact O-N 3.22Å; Y84-Y88 VanDerWaalsContact OH-CE2 3.32Å; Y84-Y88 WeakPolarHBondContact OH-CE2 3.35Å; Y84-Y88 PolarHBondContact OH-OH 3.02Å; A85-Y88 PolarHBondContact O-N 3.12Å; A85-Y88 VanDerWaalsContact O-N 3.14Å; L86-Y88 PolarHBondContact O-N 3.38Å; Y88-P90 WeakPolarHBondContact O-CD 2.85Å |
| 89 | I | 58.8 | Low | 60.7 | Low | 94 Ų | 94 | 85 Ų | 85 | 48% | 0.482 | 43% | 0.431 | S | S | . | . | trans | -103.1 | 67.2 | 167.5 | -64.7 | 88.3 | 0 | 0 | 0 | 109.5 | A85 L86 Y91 A92 | A85-I89 WeakPolarHBondContact O-CD1 3.1Å; A85-I89 PolarHBondContact O-N 3.07Å; L86-I89 CarbonylContact O-C 3.26Å; L86-I89 VanDerWaalsContact O-C 3.26Å; L86-I89 PolarHBondContact O-N 3.3Å; L86-I89 VanDerWaalsContact O-N 3.07Å; I89-Y91 PolarHBondContact O-N 2.78Å; I89-A92 HydrophobicContact CG2-CB 3.89Å | ||
| 90 | P | 48.7 | Very low | 60 | Low | 36 Ų | 36 | 89.1 Ų | 89.1 | 23% | 0.234 | 45% | 0.451 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -72.2 | -8.1 | 152.3 | 32.5 | -27 | 0 | 0 | 0 | 110.6 | S87 Y88 A92 R93 F94 | S87-P90 WeakPolarHBondContact O-CD 3.49Å; Y88-P90 WeakPolarHBondContact O-CD 2.85Å; P90-A92 VanDerWaalsContact C-N 3.35Å; P90-A92 PolarHBondContact O-N 3.31Å; P90-R93 PolarHBondContact O-N 2.74Å; P90-F94 HydrophobicContact CB-CD2 4.45Å; P90-F94 HydrophobicContact CB-CE2 4.22Å; P90-F94 WeakPolarHBondContact O-CD2 3.42Å; P90-F94 PolarHBondContact O-N 3.12Å |
| 91 | Y | 51.9 | Low | 59.4 | Low | 178 Ų | 178 | 93.3 Ų | 93.3 | 70% | 0.698 | 48% | 0.479 | S | S | * | . | H | α-helix | trans | -65.7 | -22.8 | 178.2 | -93.3 | -80.8 | 0 | 0 | 0 | 115 | I89 R93 F94 A95 | I89-Y91 PolarHBondContact O-N 2.78Å; Y91-R93 VanDerWaalsContact C-N 3.32Å; Y91-R93 PolarHBondContact O-N 2.76Å; Y91-F94 PolarHBondContact O-N 3.04Å; Y91-A95 WeakPolarHBondContact O-CA 3.44Å; Y91-A95 WeakPolarHBondContact O-CB 3.38Å; Y91-A95 PolarHBondContact O-N 3.32Å |
| 92 | A | 52.7 | Low | 58.6 | Low | 63 Ų | 63 | 97.3 Ų | 97.3 | 52% | 0.521 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -69.7 | -32.2 | 178 | 0 | 0 | 0 | 0 | 0 | 112.5 | I89 P90 S96 | I89-A92 HydrophobicContact CG2-CB 3.89Å; P90-A92 VanDerWaalsContact C-N 3.35Å; P90-A92 PolarHBondContact O-N 3.31Å; A92-S96 PolarHBondContact O-N 2.98Å; A92-S96 VanDerWaalsContact O-N 3.13Å; A92-S96 PolarHBondContact O-OG 3.36Å |
| 93 | R | 52.4 | Low | 57.4 | Low | 207 Ų | 207 | 99.6 Ų | 99.6 | 78% | 0.781 | 52% | 0.516 | S | S | * | . | H | α-helix | trans | -75.3 | -37 | 174.6 | -63.6 | -173.3 | -173.6 | -158.8 | 1.8 | 111.6 | P90 Y91 S96 | P90-R93 PolarHBondContact O-N 2.74Å; Y91-R93 VanDerWaalsContact C-N 3.32Å; Y91-R93 PolarHBondContact O-N 2.76Å; R93-S96 PolarHBondContact O-OG 3.49Å; R93-S96 VanDerWaalsContact O-OG 3.11Å |
| 94 | F | 55.7 | Low | 56.8 | Low | 140 Ų | 140 | 102.9 Ų | 102.9 | 61% | 0.614 | 54% | 0.536 | S | S | * | . | H | α-helix | trans | -76.2 | -32.3 | 173.9 | -66.2 | -67.6 | 0 | 0 | 0 | 112.9 | P90 Y91 F97 A98 | P90-F94 HydrophobicContact CB-CD2 4.45Å; P90-F94 HydrophobicContact CB-CE2 4.22Å; P90-F94 WeakPolarHBondContact O-CD2 3.42Å; P90-F94 PolarHBondContact O-N 3.12Å; Y91-F94 PolarHBondContact O-N 3.04Å; F94-F97 PolarHBondContact O-N 3.37Å; F94-A98 WeakPolarHBondContact O-CB 3.24Å; F94-A98 PolarHBondContact O-N 3.19Å |
| 95 | A | 54 | Low | 55.9 | Low | 38 Ų | 38 | 113.1 Ų | 113.1 | 31% | 0.314 | 59% | 0.586 | S | S | . | * | H | α-helix | trans | -76.4 | -31.1 | -179.6 | 0 | 0 | 0 | 0 | 0 | 112.2 | Y91 F97 A98 L99 | Y91-A95 WeakPolarHBondContact O-CA 3.44Å; Y91-A95 WeakPolarHBondContact O-CB 3.38Å; Y91-A95 PolarHBondContact O-N 3.32Å; A95-F97 VanDerWaalsContact C-N 3.3Å; A95-A98 PolarHBondContact O-N 3.48Å; A95-L99 WeakPolarHBondContact O-CA 3.13Å; A95-L99 WeakPolarHBondContact O-CB 3.49Å; A95-L99 VanDerWaalsContact O-CG 3.24Å; A95-L99 WeakPolarHBondContact O-CG 3.11Å; A95-L99 PolarHBondContact O-N 2.79Å |
| 96 | S | 56.2 | Low | 55.2 | Low | 71 Ų | 71 | 116.3 Ų | 116.3 | 50% | 0.497 | 59% | 0.594 | S | S | . | * | H | α-helix | trans | -66.1 | -35.6 | 170.9 | 42.1 | 0 | 0 | 0 | 0 | 111.8 | A92 R93 L100 | A92-S96 PolarHBondContact O-N 2.98Å; A92-S96 VanDerWaalsContact O-N 3.13Å; A92-S96 PolarHBondContact O-OG 3.36Å; R93-S96 PolarHBondContact O-OG 3.49Å; R93-S96 VanDerWaalsContact O-OG 3.11Å; S96-L100 WeakPolarHBondContact O-CG 3.4Å |
| 97 | F | 57.1 | Low | 55 | Low | 152 Ų | 152 | 117.1 Ų | 117.1 | 67% | 0.667 | 60% | 0.598 | S | S | * | * | H | α-helix | trans | -78.3 | -37.2 | 173.5 | -162.1 | -101.6 | 0 | 0 | 0 | 112.6 | F94 A95 L100 C101 | F94-F97 PolarHBondContact O-N 3.37Å; A95-F97 VanDerWaalsContact C-N 3.3Å; F97-L100 PolarHBondContact O-N 3.16Å; F97-C101 PolarHBondContact O-N 3.35Å |
| 98 | A | 57.7 | Low | 54.4 | Low | 44 Ų | 44 | 122.1 Ų | 122.1 | 36% | 0.364 | 62% | 0.621 | S | S | . | * | H | α-helix | trans | -75 | -29.9 | 178.5 | 0 | 0 | 0 | 0 | 0 | 112.9 | F94 A95 L100 C101 L102 | F94-A98 WeakPolarHBondContact O-CB 3.24Å; F94-A98 PolarHBondContact O-N 3.19Å; A95-A98 PolarHBondContact O-N 3.48Å; A98-L100 VanDerWaalsContact C-N 3.28Å; A98-C101 CarbonylContact O-C 3.44Å; A98-C101 PolarHBondContact O-N 2.74Å; A98-C101 VanDerWaalsContact O-N 3.12Å; A98-L102 PolarHBondContact O-N 3.21Å |
| 99 | L | 54.8 | Low | 54.4 | Low | 134 Ų | 134 | 121.5 Ų | 121.5 | 70% | 0.702 | 63% | 0.627 | S | S | * | * | H | α-helix | trans | -71.5 | -23.2 | 170.3 | -77.7 | 177.5 | 0 | 0 | 0 | 112.3 | A95 C101 | A95-L99 WeakPolarHBondContact O-CA 3.13Å; A95-L99 WeakPolarHBondContact O-CB 3.49Å; A95-L99 VanDerWaalsContact O-CG 3.24Å; A95-L99 WeakPolarHBondContact O-CG 3.11Å; A95-L99 PolarHBondContact O-N 2.79Å; L99-C101 VanDerWaalsContact C-N 3.33Å |
| 100 | L | 61.7 | Low | 54.1 | Low | 152 Ų | 152 | 123.3 Ų | 123.3 | 80% | 0.796 | 64% | 0.636 | S | S | * | * | H | α-helix | trans | -79.2 | -18.5 | 168.1 | -68.2 | 173.8 | 0 | 0 | 0 | 112.6 | S96 F97 A98 | S96-L100 WeakPolarHBondContact O-CG 3.4Å; F97-L100 PolarHBondContact O-N 3.16Å; A98-L100 VanDerWaalsContact C-N 3.28Å |
| 101 | C | 58.4 | Low | 54.5 | Low | 92 Ų | 92 | 129.1 Ų | 129.1 | 62% | 0.622 | 66% | 0.662 | S | S | * | * | H | α-helix | trans | -109.4 | -5.9 | -178.8 | -108.2 | 0 | 0 | 0 | 0 | 115.3 | F97 A98 L99 P103 | F97-C101 PolarHBondContact O-N 3.35Å; A98-C101 CarbonylContact O-C 3.44Å; A98-C101 PolarHBondContact O-N 2.74Å; A98-C101 VanDerWaalsContact O-N 3.12Å; L99-C101 VanDerWaalsContact C-N 3.33Å; C101-P103 WeakPolarHBondContact O-CD 3.06Å |
| 102 | L | 52.2 | Low | 54.7 | Low | 125 Ų | 125 | 125.6 Ų | 125.6 | 65% | 0.654 | 66% | 0.66 | S | S | * | * | trans | -89.1 | 102.2 | 163.9 | -77.8 | 174.2 | 0 | 0 | 0 | 107.7 | A98 E104 | A98-L102 PolarHBondContact O-N 3.21Å; L102-E104 PolarHBondContact O-N 3.22Å | ||
| 103 | P | 50 | Low | 54.8 | Low | 102 Ų | 102 | 130.4 Ų | 130.4 | 66% | 0.662 | 67% | 0.671 | S | S | * | * | trans | -57.2 | 128.3 | 151.5 | 27.4 | -32 | 0 | 0 | 0 | 106.9 | C101 Q105 | C101-P103 WeakPolarHBondContact O-CD 3.06Å; P103-Q105 PolarHBondContact O-N 2.92Å | ||
| 104 | E | 55.1 | Low | 55.1 | Low | 187 Ų | 187 | 124 Ų | 124 | 87% | 0.874 | 66% | 0.661 | S | S | * | * | trans | -37.4 | 104.4 | 169.2 | -97.5 | -88.3 | 113.7 | 0 | 0 | 111.3 | L102 | L102-E104 PolarHBondContact O-N 3.22Š| ||
| 105 | Q | 47.8 | Very low | 55 | Low | 251 Ų | 251 | 122.5 Ų | 122.5 | 100% | 1.173 | 67% | 0.666 | S | S | * | * | trans | -147.8 | 0 | 167.6 | -63.2 | -72.6 | -74.8 | 0 | 0 | 108.1 | P103 | P103-Q105 PolarHBondContact O-N 2.92Š|
Retrieved 105 of 105 residues in 27 ms
(Link to these results)