| 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 | 50.6 | Low | 42.7 | Very low | 205 Ų | 205 | 112.6 Ų | 112.6 | 100% | 1.01 | 62% | 0.621 | S | S | * | * | 0 | -36.7 | 0 | -82 | -169 | -89.4 | 0 | 0 | 112.1 | |||||
| 2 | A | 50.3 | Low | 42.4 | Very low | 73 Ų | 73 | 111.2 Ų | 111.2 | 60% | 0.603 | 62% | 0.617 | S | S | * | * | H | α-helix | trans | -62.9 | -39.6 | 174.2 | 0 | 0 | 0 | 0 | 0 | 113.9 | V4 Q5 A6 | A2-V4 PolarHBondContact O-N 3.44Å; A2-Q5 PolarHBondContact O-N 2.96Å; A2-A6 PolarHBondContact O-N 3.27Å |
| 3 | D | 46.1 | Very low | 42.2 | Very low | 133 Ų | 133 | 110.2 Ų | 110.2 | 71% | 0.711 | 61% | 0.609 | S | S | * | * | H | α-helix | trans | -69 | -32.8 | -176.1 | -53.4 | -38.2 | 0 | 0 | 0 | 113.8 | Q5 N7 | D3-Q5 VanDerWaalsContact C-N 3.33Å; D3-N7 PolarHBondContact O-N 3.06Å; D3-N7 VanDerWaalsContact O-N 3.13Å |
| 4 | V | 45.3 | Very low | 42.8 | Very low | 103 Ų | 103 | 108.7 Ų | 108.7 | 62% | 0.624 | 60% | 0.604 | S | S | * | * | H | α-helix | trans | -70.9 | -34.3 | 176 | 179.5 | 0 | 0 | 0 | 0 | 110.6 | A2 V8 | A2-V4 PolarHBondContact O-N 3.44Å; V4-V8 HydrophobicContact CG1-CG2 4.47Å; V4-V8 WeakPolarHBondContact O-CG2 3.37Å; V4-V8 PolarHBondContact O-N 2.98Å; V4-V8 VanDerWaalsContact O-N 3.1Å |
| 5 | Q | 39 | Very low | 43.2 | Very low | 146 Ų | 146 | 106.5 Ų | 106.5 | 68% | 0.682 | 60% | 0.599 | S | S | * | * | H | α-helix | trans | -73.4 | -37.4 | -179.9 | -144.3 | 163.4 | -15.8 | 0 | 0 | 111.2 | A2 D3 T9 | A2-Q5 PolarHBondContact O-N 2.96Å; D3-Q5 VanDerWaalsContact C-N 3.33Å; Q5-T9 PolarHBondContact O-N 2.89Å; Q5-T9 PolarHBondContact O-OG1 3.13Å |
| 6 | A | 40.9 | Very low | 44 | Very low | 52 Ų | 52 | 100.8 Ų | 100.8 | 43% | 0.43 | 57% | 0.572 | S | S | . | * | H | α-helix | trans | -62.1 | -48.6 | 172.7 | 0 | 0 | 0 | 0 | 0 | 112 | A2 V8 T9 E10 | A2-A6 PolarHBondContact O-N 3.27Å; A6-V8 PolarHBondContact O-N 3.33Å; A6-T9 WeakPolarHBondContact CA-OG1 3.47Å; A6-T9 PolarHBondContact O-N 3.41Å; A6-T9 PolarHBondContact O-OG1 3.47Å; A6-E10 WeakPolarHBondContact O-CB 3.18Å; A6-E10 PolarHBondContact O-N 2.97Å |
| 7 | N | 35.6 | Very low | 45.5 | Very low | 102 Ų | 102 | 98.8 Ų | 98.8 | 55% | 0.545 | 56% | 0.559 | S | S | . | * | H | α-helix | trans | -62.2 | -40.1 | 178.9 | -118.2 | 22.8 | 0 | 0 | 0 | 112.6 | D3 E10 E11 | D3-N7 PolarHBondContact O-N 3.06Å; D3-N7 VanDerWaalsContact O-N 3.13Å; N7-E10 PolarHBondContact O-N 3.39Å; N7-E11 PolarHBondContact O-N 3.16Å |
| 8 | V | 42.4 | Very low | 47.2 | Very low | 77 Ų | 77 | 96.7 Ų | 96.7 | 47% | 0.467 | 55% | 0.548 | S | S | . | . | H | α-helix | trans | -69.7 | -38.4 | 177.7 | 173.4 | 0 | 0 | 0 | 0 | 111.2 | V4 A6 E10 V12 | V4-V8 HydrophobicContact CG1-CG2 4.47Å; V4-V8 WeakPolarHBondContact O-CG2 3.37Å; V4-V8 PolarHBondContact O-N 2.98Å; V4-V8 VanDerWaalsContact O-N 3.1Å; A6-V8 PolarHBondContact O-N 3.33Å; V8-E10 VanDerWaalsContact C-N 3.32Å; V8-E10 PolarHBondContact O-N 3.13Å; V8-V12 HydrophobicContact CG1-CG2 4.4Å; V8-V12 WeakPolarHBondContact O-CB 3.25Å; V8-V12 WeakPolarHBondContact O-CG2 3.4Å; V8-V12 PolarHBondContact O-N 3.35Å |
| 9 | T | 42 | Very low | 49 | Very low | 87 Ų | 87 | 95.5 Ų | 95.5 | 53% | 0.534 | 54% | 0.543 | S | S | . | . | H | α-helix | trans | -64.6 | -37.5 | 173.4 | 32.1 | 0 | 0 | 0 | 0 | 112.3 | Q5 A6 L13 | Q5-T9 PolarHBondContact O-N 2.89Å; Q5-T9 PolarHBondContact O-OG1 3.13Å; A6-T9 WeakPolarHBondContact CA-OG1 3.47Å; A6-T9 PolarHBondContact O-N 3.41Å; A6-T9 PolarHBondContact O-OG1 3.47Å; T9-L13 VanDerWaalsContact O-CB 3.32Å; T9-L13 WeakPolarHBondContact O-CB 3.31Å; T9-L13 PolarHBondContact O-N 3.35Å |
| 10 | E | 41.6 | Very low | 50.6 | Low | 124 Ų | 124 | 91.6 Ų | 91.6 | 58% | 0.579 | 52% | 0.521 | S | S | * | . | H | α-helix | trans | -70.7 | -45.1 | -179.6 | -157.5 | 168 | -169.2 | 0 | 0 | 111.6 | A6 N7 V8 V12 L13 V14 | A6-E10 WeakPolarHBondContact O-CB 3.18Å; A6-E10 PolarHBondContact O-N 2.97Å; N7-E10 PolarHBondContact O-N 3.39Å; V8-E10 VanDerWaalsContact C-N 3.32Å; V8-E10 PolarHBondContact O-N 3.13Å; E10-V12 PolarHBondContact O-N 2.8Å; E10-L13 PolarHBondContact O-N 2.93Å; E10-V14 WeakPolarHBondContact O-CB 3.4Å; E10-V14 VanDerWaalsContact O-CG2 3.26Å; E10-V14 WeakPolarHBondContact O-CG2 3.13Å; E10-V14 PolarHBondContact O-N 3.22Å |
| 11 | E | 35.5 | Very low | 52 | Low | 137 Ų | 137 | 87.4 Ų | 87.4 | 64% | 0.64 | 50% | 0.497 | S | S | * | . | H | α-helix | trans | -61.3 | -40.4 | 173.5 | -79 | -172.6 | 158.7 | 0 | 0 | 112.6 | N7 S15 | N7-E11 PolarHBondContact O-N 3.16Å; E11-S15 VanDerWaalsContact O-CB 3.29Å; E11-S15 WeakPolarHBondContact O-CB 3.23Å; E11-S15 PolarHBondContact O-N 3.13Å |
| 12 | V | 40 | Very low | 53.5 | Low | 95 Ų | 95 | 82 Ų | 82 | 58% | 0.576 | 47% | 0.47 | S | S | * | . | H | α-helix | trans | -71.5 | -31.7 | 176.6 | 174.6 | 0 | 0 | 0 | 0 | 111.6 | V8 E10 G16 | V8-V12 HydrophobicContact CG1-CG2 4.4Å; V8-V12 WeakPolarHBondContact O-CB 3.25Å; V8-V12 WeakPolarHBondContact O-CG2 3.4Å; V8-V12 PolarHBondContact O-N 3.35Å; E10-V12 PolarHBondContact O-N 2.8Å; V12-G16 PolarHBondContact O-N 2.91Å |
| 13 | L | 39.5 | Very low | 55.3 | Low | 98 Ų | 98 | 80.5 Ų | 80.5 | 51% | 0.513 | 45% | 0.452 | S | S | . | . | H | α-helix | trans | -67.4 | -47 | 174.4 | -137.6 | 84.6 | 0 | 0 | 0 | 111 | T9 E10 G16 N17 | T9-L13 VanDerWaalsContact O-CB 3.32Å; T9-L13 WeakPolarHBondContact O-CB 3.31Å; T9-L13 PolarHBondContact O-N 3.35Å; E10-L13 PolarHBondContact O-N 2.93Å; L13-G16 PolarHBondContact O-N 3.18Å; L13-N17 PolarHBondContact O-N 3.34Å |
| 14 | V | 50.7 | Low | 57.1 | Low | 90 Ų | 90 | 74.7 Ų | 74.7 | 55% | 0.545 | 42% | 0.421 | S | S | . | . | H | α-helix | trans | -64.5 | -45.6 | 178.4 | 174.1 | 0 | 0 | 0 | 0 | 110.5 | E10 G16 N17 V18 | E10-V14 WeakPolarHBondContact O-CB 3.4Å; E10-V14 VanDerWaalsContact O-CG2 3.26Å; E10-V14 WeakPolarHBondContact O-CG2 3.13Å; E10-V14 PolarHBondContact O-N 3.22Å; V14-G16 VanDerWaalsContact C-N 3.31Å; V14-G16 PolarHBondContact O-N 3.2Å; V14-N17 PolarHBondContact O-N 3.07Å; V14-V18 WeakPolarHBondContact O-CG2 3.32Å; V14-V18 PolarHBondContact O-N 2.87Å |
| 15 | S | 48.6 | Very low | 59.1 | Low | 75 Ų | 75 | 72.1 Ų | 72.1 | 52% | 0.524 | 40% | 0.403 | S | S | . | . | H | α-helix | trans | -64.9 | -33.2 | 177.9 | -174.7 | 0 | 0 | 0 | 0 | 112.9 | E11 V19 | E11-S15 VanDerWaalsContact O-CB 3.29Å; E11-S15 WeakPolarHBondContact O-CB 3.23Å; E11-S15 PolarHBondContact O-N 3.13Å; S15-V19 PolarHBondContact O-N 3.22Å |
| 16 | G | 55.8 | Low | 61.4 | Low | 16 Ų | 16 | 68.2 Ų | 68.2 | 17% | 0.165 | 39% | 0.391 | C | S | . | . | H | α-helix | trans | -68.7 | -38.5 | 177.7 | 0 | 0 | 0 | 0 | 0 | 113.1 | V12 L13 V14 L20 | V12-G16 PolarHBondContact O-N 2.91Å; L13-G16 PolarHBondContact O-N 3.18Å; V14-G16 VanDerWaalsContact C-N 3.31Å; V14-G16 PolarHBondContact O-N 3.2Å; G16-L20 PolarHBondContact O-N 2.92Å |
| 17 | N | 69.7 | Low | 63.8 | Low | 67 Ų | 67 | 66.3 Ų | 66.3 | 36% | 0.358 | 37% | 0.373 | S | S | . | . | H | α-helix | trans | -70.7 | -39 | 179 | -70.5 | 2.2 | 0 | 0 | 0 | 111.4 | L13 V14 V19 L20 D21 | L13-N17 PolarHBondContact O-N 3.34Å; V14-N17 PolarHBondContact O-N 3.07Å; N17-V19 PolarHBondContact O-N 3.32Å; N17-L20 WeakPolarHBondContact O-CB 3.48Å; N17-L20 PolarHBondContact O-N 2.66Å; N17-D21 WeakPolarHBondContact O-CB 3.31Å; N17-D21 VanDerWaalsContact O-CG 3.24Å; N17-D21 PolarHBondContact O-N 3.26Å |
| 18 | V | 76.1 | Confident | 66.3 | Low | 60 Ų | 60 | 61.5 Ų | 61.5 | 36% | 0.364 | 35% | 0.347 | S | S | . | . | H | α-helix | trans | -62 | -40.9 | 178.3 | 176.3 | 0 | 0 | 0 | 0 | 112.2 | V14 D21 M22 | V14-V18 WeakPolarHBondContact O-CG2 3.32Å; V14-V18 PolarHBondContact O-N 2.87Å; V18-D21 PolarHBondContact O-N 2.98Å; V18-M22 HydrophobicContact CG1-CG 4.42Å; V18-M22 WeakPolarHBondContact O-CB 3.45Å; V18-M22 WeakPolarHBondContact O-CG 2.99Å; V18-M22 PolarHBondContact O-N 2.72Å |
| 19 | V | 80.5 | Confident | 68.6 | Low | 75 Ų | 75 | 61.4 Ų | 61.4 | 46% | 0.455 | 34% | 0.342 | S | S | . | . | H | α-helix | trans | -65 | -44.4 | 177.9 | 174.9 | 0 | 0 | 0 | 0 | 110.8 | S15 N17 M22 L23 | S15-V19 PolarHBondContact O-N 3.22Å; N17-V19 PolarHBondContact O-N 3.32Å; V19-M22 PolarHBondContact O-N 3.22Å; V19-L23 HydrophobicContact CG1-CD1 4.13Å; V19-L23 HydrophobicContact CG1-CG 4.49Å; V19-L23 VanDerWaalsContact O-CG 3.3Å; V19-L23 WeakPolarHBondContact O-CG 3.38Å; V19-L23 PolarHBondContact O-N 3.13Å |
| 20 | L | 81 | Confident | 70.9 | Confident | 16 Ų | 16 | 58.6 Ų | 58.6 | 8% | 0.084 | 32% | 0.323 | C | S | . | . | H | α-helix | trans | -60.8 | -46.7 | 177.7 | -171.6 | 80.3 | 0 | 0 | 0 | 111.5 | G16 N17 M22 L23 N24 D265 Y266 T269 | G16-L20 PolarHBondContact O-N 2.92Å; N17-L20 WeakPolarHBondContact O-CB 3.48Å; N17-L20 PolarHBondContact O-N 2.66Å; L20-M22 VanDerWaalsContact C-N 3.33Å; L20-M22 PolarHBondContact O-N 2.83Å; L20-L23 WeakPolarHBondContact O-CB 3.46Å; L20-L23 PolarHBondContact O-N 2.96Å; L20-L23 VanDerWaalsContact O-N 3.16Å; L20-N24 WeakPolarHBondContact O-CB 2.97Å; L20-N24 PolarHBondContact O-N 2.76Å; L20-D265 HydrophobicContact CD1-CB 3.96Å; L20-D265 HydrophobicContact CD2-CB 3.67Å; L20-D265 HydrophobicContact CG-CB 4.49Å; L20-Y266 HydrophobicContact CD1-CD1 4.09Å; L20-Y266 HydrophobicContact CD1-CE1 4.21Å; L20-T269 HydrophobicContact CD1-CG2 3.26Å; L20-T269 HydrophobicContact CG-CG2 4.07Å |
| 21 | D | 81.1 | Confident | 73.4 | Confident | 4 Ų | 4 | 52.7 Ų | 52.7 | 2% | 0.021 | 30% | 0.296 | C | S | . | . | H | α-helix | trans | -59 | -44.5 | 177.4 | -74 | 5.4 | 0 | 0 | 0 | 111.6 | N17 V18 L23 N24 L25 C73 D74 F172 | N17-D21 WeakPolarHBondContact O-CB 3.31Å; N17-D21 VanDerWaalsContact O-CG 3.24Å; N17-D21 PolarHBondContact O-N 3.26Å; V18-D21 PolarHBondContact O-N 2.98Å; D21-L23 VanDerWaalsContact C-N 3.34Å; D21-L23 PolarHBondContact O-N 3.35Å; D21-N24 PolarHBondContact O-N 3.17Å; D21-L25 VanDerWaalsContact O-CB 3.27Å; D21-L25 WeakPolarHBondContact O-CB 3.46Å; D21-L25 PolarHBondContact O-N 3.41Å; D21-C73 HydrophobicContact CB-CB 4.39Å; D21-D74 PolarHBondContact OD2-N 3.42Å; D21-F172 WeakPolarHBondContact OD1-CZ 3.27Å |
| 22 | M | 83 | Confident | 76.1 | Confident | 92 Ų | 92 | 48.8 Ų | 48.8 | 45% | 0.453 | 28% | 0.277 | S | S | . | . | H | α-helix | trans | -65 | -38.1 | 177.2 | -71 | -68.8 | 172.4 | 0 | 0 | 111.9 | V18 V19 L20 C26 | V18-M22 HydrophobicContact CG1-CG 4.42Å; V18-M22 WeakPolarHBondContact O-CB 3.45Å; V18-M22 WeakPolarHBondContact O-CG 2.99Å; V18-M22 PolarHBondContact O-N 2.72Å; V19-M22 PolarHBondContact O-N 3.22Å; L20-M22 VanDerWaalsContact C-N 3.33Å; L20-M22 PolarHBondContact O-N 2.83Å; M22-C26 VanDerWaalsContact O-CB 3.28Å; M22-C26 WeakPolarHBondContact O-CB 3.49Å; M22-C26 PolarHBondContact O-N 3.27Å; M22-C26 PolarHBondContact O-SG 2.85Å |
| 23 | L | 86.1 | Confident | 78.6 | Confident | 42 Ų | 42 | 49 Ų | 49 | 22% | 0.22 | 27% | 0.274 | C | S | . | . | H | α-helix | trans | -67.3 | -46.4 | 175.1 | -71.3 | 173.4 | 0 | 0 | 0 | 111.5 | V19 L20 D21 L25 C26 F27 | V19-L23 HydrophobicContact CG1-CD1 4.13Å; V19-L23 HydrophobicContact CG1-CG 4.49Å; V19-L23 VanDerWaalsContact O-CG 3.3Å; V19-L23 WeakPolarHBondContact O-CG 3.38Å; V19-L23 PolarHBondContact O-N 3.13Å; L20-L23 WeakPolarHBondContact O-CB 3.46Å; L20-L23 PolarHBondContact O-N 2.96Å; L20-L23 VanDerWaalsContact O-N 3.16Å; D21-L23 VanDerWaalsContact C-N 3.34Å; D21-L23 PolarHBondContact O-N 3.35Å; L23-L25 VanDerWaalsContact C-N 3.33Å; L23-L25 PolarHBondContact O-N 3.01Å; L23-C26 PolarHBondContact O-N 3.24Å; L23-F27 HydrophobicContact CB-CD2 4.39Å; L23-F27 HydrophobicContact CB-CE2 4.32Å; L23-F27 HydrophobicContact CD2-CE1 4.43Å; L23-F27 HydrophobicContact CD2-CE2 3.84Å; L23-F27 HydrophobicContact CD2-CZ 3.75Å; L23-F27 VanDerWaalsContact O-CB 3.27Å; L23-F27 WeakPolarHBondContact O-CB 3.4Å; L23-F27 WeakPolarHBondContact O-CG 3.44Å; L23-F27 PolarHBondContact O-N 3.11Å |
| 24 | N | 85.3 | Confident | 81.2 | Confident | 11 Ų | 11 | 44.3 Ų | 44.3 | 6% | 0.059 | 25% | 0.25 | C | C | . | . | H | α-helix | trans | -57.7 | -46.3 | 175.6 | -81 | -18 | 0 | 0 | 0 | 111.4 | L20 D21 G28 F69 T269 | L20-N24 WeakPolarHBondContact O-CB 2.97Å; L20-N24 PolarHBondContact O-N 2.76Å; D21-N24 PolarHBondContact O-N 3.17Å; N24-G28 VanDerWaalsContact O-CA 3.23Å; N24-G28 WeakPolarHBondContact O-CA 3.47Å; N24-G28 PolarHBondContact O-N 3.29Å; N24-F69 CarbonylContact C-O 3.6Å; N24-F69 HydrophobicContact CB-CD1 4.49Å; N24-F69 WeakPolarHBondContact OD1-CD1 3.36Å; N24-T269 WeakPolarHBondContact OD1-CG2 3.42Å |
| 25 | L | 86 | Confident | 83.2 | Confident | 49 Ų | 49 | 40 Ų | 40 | 26% | 0.257 | 22% | 0.224 | S | C | . | . | H | α-helix | trans | -62.8 | -52.1 | 176.9 | -177.2 | 63.3 | 0 | 0 | 0 | 111.5 | D21 L23 Q29 | D21-L25 VanDerWaalsContact O-CB 3.27Å; D21-L25 WeakPolarHBondContact O-CB 3.46Å; D21-L25 PolarHBondContact O-N 3.41Å; L23-L25 VanDerWaalsContact C-N 3.33Å; L23-L25 PolarHBondContact O-N 3.01Å; L25-Q29 HydrophobicContact CD1-CG 4.15Å; L25-Q29 VanDerWaalsContact O-CB 3.32Å; L25-Q29 WeakPolarHBondContact O-CB 3.44Å; L25-Q29 WeakPolarHBondContact O-CG 3.27Å; L25-Q29 PolarHBondContact O-N 2.78Å |
| 26 | C | 88.5 | Confident | 85.4 | Confident | 63 Ų | 63 | 38.3 Ų | 38.3 | 43% | 0.426 | 21% | 0.208 | S | C | . | . | H | α-helix | trans | -66.2 | -49 | -176.2 | -70.1 | 0 | 0 | 0 | 0 | 112.3 | M22 L23 L30 | M22-C26 VanDerWaalsContact O-CB 3.28Å; M22-C26 WeakPolarHBondContact O-CB 3.49Å; M22-C26 PolarHBondContact O-N 3.27Å; M22-C26 PolarHBondContact O-SG 2.85Å; L23-C26 PolarHBondContact O-N 3.24Å; C26-L30 WeakPolarHBondContact O-CB 3.31Å; C26-L30 PolarHBondContact O-N 3.31Å |
| 27 | F | 90.2 | Very high | 87.1 | Confident | 13 Ų | 13 | 39.1 Ų | 39.1 | 6% | 0.057 | 21% | 0.209 | C | C | . | . | H | α-helix | trans | -70.9 | -38.5 | 179.9 | -62.9 | -21.3 | 0 | 0 | 0 | 111.3 | L23 L30 A31 T269 P272 L273 F312 | L23-F27 HydrophobicContact CB-CD2 4.39Å; L23-F27 HydrophobicContact CB-CE2 4.32Å; L23-F27 HydrophobicContact CD2-CE1 4.43Å; L23-F27 HydrophobicContact CD2-CE2 3.84Å; L23-F27 HydrophobicContact CD2-CZ 3.75Å; L23-F27 VanDerWaalsContact O-CB 3.27Å; L23-F27 WeakPolarHBondContact O-CB 3.4Å; L23-F27 WeakPolarHBondContact O-CG 3.44Å; L23-F27 PolarHBondContact O-N 3.11Å; F27-L30 PolarHBondContact O-N 3.49Å; F27-A31 VanDerWaalsContact O-CB 3.29Å; F27-A31 WeakPolarHBondContact O-CB 3.25Å; F27-A31 PolarHBondContact O-N 2.92Å; F27-T269 WeakPolarHBondContact CD2-O 3.43Å; F27-P272 HydrophobicContact CB-CB 3.95Å; F27-P272 HydrophobicContact CB-CG 3.64Å; F27-L273 HydrophobicContact CD1-CD1 4.38Å; F27-L273 HydrophobicContact CE1-CD1 4.35Å; F27-F312 HydrophobicContact CD1-CE1 4.23Å; F27-F312 AromaticContact CD1-CZ 3.91Å; F27-F312 HydrophobicContact CD1-CZ 3.91Å; F27-F312 AromaticContact CE1-CE1 3.78Å; F27-F312 HydrophobicContact CE1-CE1 3.78Å; F27-F312 HydrophobicContact CE1-CE2 4.48Å; F27-F312 AromaticContact CE1-CZ 3.49Å; F27-F312 HydrophobicContact CE1-CZ 3.49Å; F27-F312 VanDerWaalsContact CE1-CZ 3.49Å |
| 28 | G | 89.9 | Confident | 88.1 | Confident | 0 Ų | 0 | 36 Ų | 36 | 0% | 0 | 19% | 0.192 | C | C | . | . | H | α-helix | trans | -58.2 | -49.3 | 174.7 | 0 | 0 | 0 | 0 | 0 | 112 | N24 L30 A31 F32 G66 | N24-G28 VanDerWaalsContact O-CA 3.23Å; N24-G28 WeakPolarHBondContact O-CA 3.47Å; N24-G28 PolarHBondContact O-N 3.29Å; G28-L30 PolarHBondContact O-N 3.03Å; G28-A31 WeakPolarHBondContact O-CB 3.32Å; G28-A31 PolarHBondContact O-N 3.34Å; G28-F32 WeakPolarHBondContact O-CB 3.14Å; G28-F32 PolarHBondContact O-N 2.8Å; G28-G66 CarbonylContact C-O 3.35Å; G28-G66 WeakPolarHBondContact CA-O 3.29Å; G28-G66 CarbonylContact O-C 3.58Å; G28-G66 WeakPolarHBondContact O-CA 2.88Å; G28-G66 VanDerWaalsContact O-O 3.09Å |
| 29 | Q | 89.4 | Confident | 89 | Confident | 75 Ų | 75 | 35.8 Ų | 35.8 | 35% | 0.35 | 19% | 0.186 | S | C | . | . | H | α-helix | trans | -64.2 | -41.7 | 177.7 | -70.2 | -66.8 | -17 | 0 | 0 | 111.7 | L25 A31 F32 L33 S70 | L25-Q29 HydrophobicContact CD1-CG 4.15Å; L25-Q29 VanDerWaalsContact O-CB 3.32Å; L25-Q29 WeakPolarHBondContact O-CB 3.44Å; L25-Q29 WeakPolarHBondContact O-CG 3.27Å; L25-Q29 PolarHBondContact O-N 2.78Å; Q29-A31 VanDerWaalsContact C-N 3.34Å; Q29-A31 PolarHBondContact O-N 3.17Å; Q29-F32 PolarHBondContact O-N 3.39Å; Q29-L33 WeakPolarHBondContact O-CB 3.44Å; Q29-L33 VanDerWaalsContact O-CG 3.29Å; Q29-L33 WeakPolarHBondContact O-CG 3.49Å; Q29-L33 PolarHBondContact O-N 2.86Å; Q29-S70 PolarHBondContact N-OG 3.42Å; Q29-S70 VanDerWaalsContact N-OG 3.11Å; Q29-S70 PolarHBondContact NE2-OG 2.97Å |
| 30 | L | 91.5 | Very high | 89.5 | Confident | 28 Ų | 28 | 35.1 Ų | 35.1 | 15% | 0.147 | 18% | 0.18 | C | C | . | . | H | α-helix | trans | -60.9 | -44.5 | 174.9 | -178.2 | 64.7 | 0 | 0 | 0 | 111.4 | C26 F27 G28 S34 L302 F312 | C26-L30 WeakPolarHBondContact O-CB 3.31Å; C26-L30 PolarHBondContact O-N 3.31Å; F27-L30 PolarHBondContact O-N 3.49Å; G28-L30 PolarHBondContact O-N 3.03Å; L30-S34 WeakPolarHBondContact O-CB 3.39Å; L30-S34 PolarHBondContact O-N 3.45Å; L30-S34 PolarHBondContact O-OG 3.45Å; L30-L302 HydrophobicContact CD1-CD1 4.08Å; L30-F312 HydrophobicContact CD2-CE1 4.1Å; L30-F312 HydrophobicContact CD2-CZ 4.4Å |
| 31 | A | 92.4 | Very high | 89.9 | Confident | 0 Ų | 0 | 35.1 Ų | 35.1 | 0% | 0 | 18% | 0.179 | C | C | . | . | H | α-helix | trans | -63 | -46.1 | 176.7 | 0 | 0 | 0 | 0 | 0 | 111.5 | F27 G28 Q29 S34 N35 P272 | F27-A31 VanDerWaalsContact O-CB 3.29Å; F27-A31 WeakPolarHBondContact O-CB 3.25Å; F27-A31 PolarHBondContact O-N 2.92Å; G28-A31 WeakPolarHBondContact O-CB 3.32Å; G28-A31 PolarHBondContact O-N 3.34Å; Q29-A31 VanDerWaalsContact C-N 3.34Å; Q29-A31 PolarHBondContact O-N 3.17Å; A31-S34 PolarHBondContact O-OG 3.43Å; A31-N35 WeakPolarHBondContact O-CB 3.27Å; A31-N35 PolarHBondContact O-N 3.04Å; A31-N35 VanDerWaalsContact O-N 3.08Å; A31-N35 PolarHBondContact O-ND2 2.8Å; A31-P272 HydrophobicContact CB-CB 3.82Å; A31-P272 WeakPolarHBondContact CB-O 3.45Å |
| 32 | F | 93.6 | Very high | 90.3 | Very high | 55 Ų | 55 | 35.1 Ų | 35.1 | 24% | 0.241 | 18% | 0.179 | C | C | . | . | H | α-helix | trans | -59.7 | -57.3 | 177.4 | 176 | -111.5 | 0 | 0 | 0 | 111.6 | G28 Q29 S34 N35 I36 G63 L67 | G28-F32 WeakPolarHBondContact O-CB 3.14Å; G28-F32 PolarHBondContact O-N 2.8Å; Q29-F32 PolarHBondContact O-N 3.39Å; F32-S34 PolarHBondContact O-N 2.99Å; F32-N35 PolarHBondContact O-N 3.43Å; F32-I36 HydrophobicContact CD2-CD1 4.46Å; F32-I36 HydrophobicContact CD2-CG1 3.74Å; F32-I36 HydrophobicContact CE2-CD1 4.04Å; F32-I36 HydrophobicContact CE2-CG1 3.51Å; F32-I36 HydrophobicContact CG-CG1 4.37Å; F32-I36 HydrophobicContact CZ-CG1 3.95Å; F32-I36 WeakPolarHBondContact O-CB 3.47Å; F32-I36 VanDerWaalsContact O-CG1 3.29Å; F32-I36 WeakPolarHBondContact O-CG1 3.2Å; F32-I36 PolarHBondContact O-N 2.93Å; F32-G63 WeakPolarHBondContact CD2-O 3.37Å; F32-L67 HydrophobicContact CD2-CB 3.79Å; F32-L67 HydrophobicContact CD2-CD1 4.31Å; F32-L67 HydrophobicContact CD2-CG 4.46Å; F32-L67 HydrophobicContact CE2-CB 4.2Å; F32-L67 HydrophobicContact CE2-CD1 4.31Å; F32-L67 HydrophobicContact CE2-CD2 4.2Å; F32-L67 HydrophobicContact CE2-CG 4.48Å; F32-L67 HydrophobicContact CG-CB 4.38Å; F32-L67 HydrophobicContact CG-CD1 4.45Å; F32-L67 HydrophobicContact CZ-CD1 4.48Å |
| 33 | L | 92.7 | Very high | 90.5 | Very high | 100 Ų | 100 | 33.6 Ų | 33.6 | 52% | 0.524 | 18% | 0.175 | S | C | . | . | H | α-helix | trans | -61.9 | -45.5 | -175.3 | -68.1 | 175.4 | 0 | 0 | 0 | 112.1 | Q29 N35 L37 | Q29-L33 WeakPolarHBondContact O-CB 3.44Å; Q29-L33 VanDerWaalsContact O-CG 3.29Å; Q29-L33 WeakPolarHBondContact O-CG 3.49Å; Q29-L33 PolarHBondContact O-N 2.86Å; L33-N35 PolarHBondContact O-N 3.2Å; L33-L37 VanDerWaalsContact O-CB 3.27Å; L33-L37 WeakPolarHBondContact O-CB 3.4Å; L33-L37 PolarHBondContact O-N 3.06Å |
| 34 | S | 92.4 | Very high | 90.6 | Very high | 0 Ų | 0 | 40.2 Ų | 40.2 | 0% | 0 | 20% | 0.197 | C | C | . | . | H | α-helix | trans | -65.3 | -40.1 | -179.2 | 65.1 | 0 | 0 | 0 | 0 | 112.2 | L30 A31 F32 C38 S279 | L30-S34 WeakPolarHBondContact O-CB 3.39Å; L30-S34 PolarHBondContact O-N 3.45Å; L30-S34 PolarHBondContact O-OG 3.45Å; A31-S34 PolarHBondContact O-OG 3.43Å; F32-S34 PolarHBondContact O-N 2.99Å; S34-C38 WeakPolarHBondContact O-CB 3.27Å; S34-C38 PolarHBondContact O-N 3.01Å; S34-S279 WeakPolarHBondContact CB-OG 3.36Å; S34-S279 PolarHBondContact OG-OG 3.37Å |
| 35 | N | 94.2 | Very high | 90.5 | Very high | 0 Ų | 0 | 42 Ų | 42 | 0% | 0 | 20% | 0.203 | C | C | . | . | H | α-helix | trans | -76 | -38.9 | 179.4 | -82.6 | -76.1 | 0 | 0 | 0 | 113.3 | A31 F32 L33 C38 F39 T59 C62 L275 S279 | A31-N35 WeakPolarHBondContact O-CB 3.27Å; A31-N35 PolarHBondContact O-N 3.04Å; A31-N35 VanDerWaalsContact O-N 3.08Å; A31-N35 PolarHBondContact O-ND2 2.8Å; F32-N35 PolarHBondContact O-N 3.43Å; L33-N35 PolarHBondContact O-N 3.2Å; N35-C38 WeakPolarHBondContact O-CB 3.31Å; N35-C38 PolarHBondContact O-N 2.92Å; N35-F39 WeakPolarHBondContact O-CB 3.44Å; N35-F39 PolarHBondContact O-N 3.47Å; N35-T59 WeakPolarHBondContact CB-O 3.48Å; N35-C62 HydrophobicContact CB-CB 4.23Å; N35-C62 VanDerWaalsContact CG-CB 3.49Å; N35-C62 VanDerWaalsContact OD1-CB 3.31Å; N35-C62 WeakPolarHBondContact OD1-CB 3.31Å; N35-L275 PolarHBondContact ND2-O 2.99Å; N35-L275 VanDerWaalsContact ND2-O 3.15Å; N35-S279 WeakPolarHBondContact OD1-CB 3.38Å |
| 36 | I | 93.7 | Very high | 89.9 | Confident | 38 Ų | 38 | 51.7 Ų | 51.7 | 20% | 0.195 | 24% | 0.236 | C | C | . | . | H | α-helix | trans | -66.4 | -40.3 | 175.3 | -67.3 | -59.5 | 0 | 0 | 0 | 111 | F32 C38 F39 I40 F60 | F32-I36 HydrophobicContact CD2-CD1 4.46Å; F32-I36 HydrophobicContact CD2-CG1 3.74Å; F32-I36 HydrophobicContact CE2-CD1 4.04Å; F32-I36 HydrophobicContact CE2-CG1 3.51Å; F32-I36 HydrophobicContact CG-CG1 4.37Å; F32-I36 HydrophobicContact CZ-CG1 3.95Å; F32-I36 WeakPolarHBondContact O-CB 3.47Å; F32-I36 VanDerWaalsContact O-CG1 3.29Å; F32-I36 WeakPolarHBondContact O-CG1 3.2Å; F32-I36 PolarHBondContact O-N 2.93Å; I36-C38 VanDerWaalsContact C-N 3.35Å; I36-C38 PolarHBondContact O-N 3.32Å; I36-F39 WeakPolarHBondContact O-CB 3.45Å; I36-F39 PolarHBondContact O-N 3.49Å; I36-I40 HydrophobicContact CG2-CD1 3.9Å; I36-I40 HydrophobicContact CG2-CG1 4.45Å; I36-I40 VanDerWaalsContact O-CG1 3.27Å; I36-I40 WeakPolarHBondContact O-CG1 3.06Å; I36-I40 PolarHBondContact O-N 3.28Å; I36-F60 HydrophobicContact CD1-CD2 4.19Å |
| 37 | L | 92 | Very high | 89 | Confident | 34 Ų | 34 | 59.4 Ų | 59.4 | 18% | 0.178 | 26% | 0.257 | C | S | . | . | H | α-helix | trans | -59.8 | -47.2 | 172.3 | 179.5 | 60.7 | 0 | 0 | 0 | 111 | L33 F39 I40 L41 M283 F298 | L33-L37 VanDerWaalsContact O-CB 3.27Å; L33-L37 WeakPolarHBondContact O-CB 3.4Å; L33-L37 PolarHBondContact O-N 3.06Å; L37-F39 PolarHBondContact O-N 3.35Å; L37-I40 PolarHBondContact O-N 3.47Å; L37-L41 HydrophobicContact CD1-CD1 4.14Å; L37-L41 HydrophobicContact CD1-CG 4.44Å; L37-L41 HydrophobicContact CG-CD1 3.99Å; L37-L41 WeakPolarHBondContact O-CD1 3.3Å; L37-L41 VanDerWaalsContact O-CG 3.23Å; L37-L41 WeakPolarHBondContact O-CG 3.5Å; L37-L41 PolarHBondContact O-N 2.68Å; L37-M283 HydrophobicContact CD2-SD 4.08Å; L37-M283 HydrophobicContact CG-SD 4.09Å; L37-F298 HydrophobicContact CD2-CB 3.69Å; L37-F298 HydrophobicContact CD2-CD1 4.1Å; L37-F298 HydrophobicContact CD2-CD2 3.62Å; L37-F298 HydrophobicContact CD2-CE2 4.27Å; L37-F298 HydrophobicContact CD2-CG 3.51Å |
| 38 | C | 91.2 | Very high | 88.5 | Confident | 0 Ų | 0 | 61.3 Ų | 61.3 | 0% | 0 | 27% | 0.265 | C | S | . | . | H | α-helix | trans | -59 | -45.9 | 176.1 | -168.8 | 0 | 0 | 0 | 0 | 111.7 | S34 N35 I36 I40 L41 L42 T59 M283 | S34-C38 WeakPolarHBondContact O-CB 3.27Å; S34-C38 PolarHBondContact O-N 3.01Å; N35-C38 WeakPolarHBondContact O-CB 3.31Å; N35-C38 PolarHBondContact O-N 2.92Å; I36-C38 VanDerWaalsContact C-N 3.35Å; I36-C38 PolarHBondContact O-N 3.32Å; C38-I40 PolarHBondContact O-N 2.79Å; C38-L41 PolarHBondContact O-N 2.58Å; C38-L42 VanDerWaalsContact O-CG 3.31Å; C38-L42 WeakPolarHBondContact O-CG 3.45Å; C38-L42 PolarHBondContact O-N 3.42Å; C38-T59 HydrophobicContact CB-CG2 4.32Å; C38-M283 HydrophobicContact CB-CG 4.1Å; C38-M283 HydrophobicContact CB-SD 4.13Å |
| 39 | F | 93.9 | Very high | 88 | Confident | 57 Ų | 57 | 66.4 Ų | 66.4 | 25% | 0.25 | 29% | 0.287 | C | S | . | . | H | α-helix | trans | -56.7 | -50 | 176.3 | 171.1 | -108.9 | 0 | 0 | 0 | 111.9 | N35 I36 L37 L41 L42 V43 A56 F60 | N35-F39 WeakPolarHBondContact O-CB 3.44Å; N35-F39 PolarHBondContact O-N 3.47Å; I36-F39 WeakPolarHBondContact O-CB 3.45Å; I36-F39 PolarHBondContact O-N 3.49Å; L37-F39 PolarHBondContact O-N 3.35Å; F39-L41 VanDerWaalsContact C-N 3.28Å; F39-L41 PolarHBondContact O-N 2.97Å; F39-L42 PolarHBondContact O-N 3.47Å; F39-V43 HydrophobicContact CD1-CG2 4.47Å; F39-V43 HydrophobicContact CD2-CG2 3.83Å; F39-V43 HydrophobicContact CE1-CG2 4.12Å; F39-V43 HydrophobicContact CE2-CG2 3.45Å; F39-V43 VanDerWaalsContact CE2-CG2 3.45Å; F39-V43 HydrophobicContact CG-CG2 4.35Å; F39-V43 HydrophobicContact CZ-CG2 3.62Å; F39-V43 WeakPolarHBondContact O-CB 3Å; F39-V43 WeakPolarHBondContact O-CG2 3.42Å; F39-V43 PolarHBondContact O-N 3.23Å; F39-A56 HydrophobicContact CD2-CB 4.1Å; F39-A56 VanDerWaalsContact CD2-O 3.27Å; F39-A56 WeakPolarHBondContact CD2-O 3.34Å; F39-A56 HydrophobicContact CE2-CB 4.26Å; F39-F60 HydrophobicContact CD1-CD2 4.34Å; F39-F60 HydrophobicContact CD2-CB 3.79Å; F39-F60 HydrophobicContact CE1-CD2 4.23Å; F39-F60 HydrophobicContact CE2-CB 3.92Å; F39-F60 HydrophobicContact CE2-CG 4.42Å; F39-F60 HydrophobicContact CG-CB 4.25Å; F39-F60 HydrophobicContact CZ-CB 4.5Å; F39-F60 HydrophobicContact CZ-CD2 4.3Å |
| 40 | I | 91.5 | Very high | 87.8 | Confident | 61 Ų | 61 | 64.8 Ų | 64.8 | 31% | 0.313 | 28% | 0.279 | S | S | . | . | H | α-helix | trans | -57.7 | -43.9 | 178.1 | -69.2 | 165.1 | 0 | 0 | 0 | 110.6 | I36 L37 C38 V43 R44 | I36-I40 HydrophobicContact CG2-CD1 3.9Å; I36-I40 HydrophobicContact CG2-CG1 4.45Å; I36-I40 VanDerWaalsContact O-CG1 3.27Å; I36-I40 WeakPolarHBondContact O-CG1 3.06Å; I36-I40 PolarHBondContact O-N 3.28Å; L37-I40 PolarHBondContact O-N 3.47Å; C38-I40 PolarHBondContact O-N 2.79Å; I40-V43 PolarHBondContact O-N 3.49Å; I40-R44 HydrophobicContact CG2-CG 4.45Å; I40-R44 WeakPolarHBondContact O-CB 3.27Å; I40-R44 VanDerWaalsContact O-CG 3.31Å; I40-R44 WeakPolarHBondContact O-CG 2.94Å; I40-R44 PolarHBondContact O-N 2.74Å |
| 41 | L | 89.7 | Confident | 87.4 | Confident | 15 Ų | 15 | 64.2 Ų | 64.2 | 8% | 0.079 | 28% | 0.277 | C | S | . | . | H | α-helix | trans | -65.8 | -39 | 179.4 | -66.9 | 165 | 0 | 0 | 0 | 112.1 | L37 C38 F39 M283 I289 V295 | L37-L41 HydrophobicContact CD1-CD1 4.14Å; L37-L41 HydrophobicContact CD1-CG 4.44Å; L37-L41 HydrophobicContact CG-CD1 3.99Å; L37-L41 WeakPolarHBondContact O-CD1 3.3Å; L37-L41 VanDerWaalsContact O-CG 3.23Å; L37-L41 WeakPolarHBondContact O-CG 3.5Å; L37-L41 PolarHBondContact O-N 2.68Å; C38-L41 PolarHBondContact O-N 2.58Å; F39-L41 VanDerWaalsContact C-N 3.28Å; F39-L41 PolarHBondContact O-N 2.97Å; L41-M283 HydrophobicContact CD1-CG 4.44Å; L41-M283 HydrophobicContact CD1-SD 4.05Å; L41-I289 HydrophobicContact CB-CG2 4.11Å; L41-I289 HydrophobicContact CD1-CG2 3.74Å; L41-I289 HydrophobicContact CG-CG2 4.39Å; L41-V295 HydrophobicContact CD1-CG2 3.41Å; L41-V295 VanDerWaalsContact CD1-CG2 3.41Å |
| 42 | L | 88.7 | Confident | 87 | Confident | 4 Ų | 4 | 65.3 Ų | 65.3 | 2% | 0.021 | 28% | 0.281 | C | S | . | . | H | α-helix | trans | -67.9 | -40.8 | 174.5 | -68 | 173 | 0 | 0 | 0 | 111.7 | C38 F39 R45 K48 E55 A56 T59 I289 | C38-L42 VanDerWaalsContact O-CG 3.31Å; C38-L42 WeakPolarHBondContact O-CG 3.45Å; C38-L42 PolarHBondContact O-N 3.42Å; F39-L42 PolarHBondContact O-N 3.47Å; L42-R45 WeakPolarHBondContact O-CB 3.41Å; L42-R45 PolarHBondContact O-N 3.38Å; L42-K48 WeakPolarHBondContact O-CE 3.45Å; L42-E55 HydrophobicContact CD1-CG 3.94Å; L42-A56 HydrophobicContact CB-CB 4.05Å; L42-A56 HydrophobicContact CD1-CB 4.36Å; L42-T59 HydrophobicContact CD1-CG2 3.96Å; L42-I289 HydrophobicContact CD2-CD1 3.88Å |
| 43 | V | 88.5 | Confident | 86.8 | Confident | 60 Ų | 60 | 64.2 Ų | 64.2 | 36% | 0.364 | 28% | 0.277 | S | S | . | . | H | α-helix | trans | -70.4 | -33.7 | -178.8 | 171.3 | 0 | 0 | 0 | 0 | 112.3 | F39 I40 R45 K48 A56 | F39-V43 HydrophobicContact CD1-CG2 4.47Å; F39-V43 HydrophobicContact CD2-CG2 3.83Å; F39-V43 HydrophobicContact CE1-CG2 4.12Å; F39-V43 HydrophobicContact CE2-CG2 3.45Å; F39-V43 VanDerWaalsContact CE2-CG2 3.45Å; F39-V43 HydrophobicContact CG-CG2 4.35Å; F39-V43 HydrophobicContact CZ-CG2 3.62Å; F39-V43 WeakPolarHBondContact O-CB 3Å; F39-V43 WeakPolarHBondContact O-CG2 3.42Å; F39-V43 PolarHBondContact O-N 3.23Å; I40-V43 PolarHBondContact O-N 3.49Å; V43-R45 PolarHBondContact O-N 2.77Å; V43-K48 VanDerWaalsContact CA-NZ 3.33Å; V43-K48 WeakPolarHBondContact O-CE 3.49Å; V43-K48 PolarHBondContact O-NZ 3.29Å; V43-A56 HydrophobicContact CG2-CB 4.36Å |
| 44 | R | 88 | Confident | 86.7 | Confident | 182 Ų | 182 | 59.5 Ų | 59.5 | 69% | 0.687 | 25% | 0.252 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -68.3 | -10.4 | 178.4 | -77.5 | 177.2 | 173.4 | 164.2 | 0.2 | 114.4 | I40 R46 | I40-R44 HydrophobicContact CG2-CG 4.45Å; I40-R44 WeakPolarHBondContact O-CB 3.27Å; I40-R44 VanDerWaalsContact O-CG 3.31Å; I40-R44 WeakPolarHBondContact O-CG 2.94Å; I40-R44 PolarHBondContact O-N 2.74Å; R44-R46 PolarHBondContact O-N 2.92Å |
| 45 | R | 83.2 | Confident | 86.5 | Confident | 49 Ų | 49 | 59.7 Ų | 59.7 | 19% | 0.185 | 25% | 0.253 | C | S | . | . | trans | -67.5 | 131 | 178.1 | -72.8 | -176 | 152.1 | -144.4 | -16.7 | 112.5 | L42 V43 K48 E52 D288 | L42-R45 WeakPolarHBondContact O-CB 3.41Å; L42-R45 PolarHBondContact O-N 3.38Å; V43-R45 PolarHBondContact O-N 2.77Å; R45-K48 HydrophobicContact CB-CG 4.22Å; R45-K48 WeakPolarHBondContact O-CE 3.48Å; R45-E52 IonicContact NH1-OE1 2.87Å; R45-E52 PolarHBondContact NH1-OE1 2.92Å; R45-D288 IonicContact CZ-OD2 3.72Å; R45-D288 IonicContact NH1-OD2 3.97Å; R45-D288 IonicContact NH2-OD2 2.66Å; R45-D288 PolarHBondContact NH2-OD2 2.98Å | ||
| 46 | R | 72.3 | Confident | 86.4 | Confident | 251 Ų | 251 | 60 Ų | 60 | 95% | 0.947 | 26% | 0.256 | S | S | * | . | S | Bend | trans | -66.8 | -38 | 179.8 | -67.7 | -172.1 | -179.9 | -176.7 | 0.3 | 114 | R44 | R44-R46 PolarHBondContact O-N 2.92Š|
| 47 | R | 70.7 | Confident | 86.5 | Confident | 226 Ų | 226 | 58.8 Ų | 58.8 | 85% | 0.853 | 25% | 0.25 | S | S | * | . | S | Bend | trans | -121.6 | 106.7 | -178.7 | -66.4 | -174.2 | -179 | -177.8 | 0.9 | 109.1 | ||
| 48 | K | 78.4 | Confident | 86.5 | Confident | 53 Ų | 53 | 57.2 Ų | 57.2 | 23% | 0.23 | 24% | 0.242 | C | C | . | . | trans | -108 | 131.2 | 178.5 | -54.7 | 173.6 | -169.3 | 166.9 | 0 | 109.6 | L42 V43 R45 E52 Q53 | L42-K48 WeakPolarHBondContact O-CE 3.45Å; V43-K48 VanDerWaalsContact CA-NZ 3.33Å; V43-K48 WeakPolarHBondContact O-CE 3.49Å; V43-K48 PolarHBondContact O-NZ 3.29Å; R45-K48 HydrophobicContact CB-CG 4.22Å; R45-K48 WeakPolarHBondContact O-CE 3.48Å; K48-E52 WeakPolarHBondContact CA-OE2 3.38Å; K48-Q53 HydrophobicContact CB-CG 3.74Å; K48-Q53 HydrophobicContact CD-CG 4.15Å | ||
| 49 | K | 80.7 | Confident | 86.6 | Confident | 106 Ų | 106 | 57.2 Ų | 57.2 | 46% | 0.461 | 24% | 0.242 | S | C | . | . | trans | -83.6 | 161.6 | 165.3 | -64 | -177.8 | -179.9 | -179.3 | 0 | 109.9 | V51 E52 Q53 | K49-V51 VanDerWaalsContact C-N 3.3Å; K49-V51 PolarHBondContact O-N 3.19Å; K49-E52 PolarHBondContact N-OE2 2.86Å; K49-E52 WeakPolarHBondContact O-CB 3.46Å; K49-E52 PolarHBondContact O-N 2.88Å; K49-Q53 PolarHBondContact O-N 2.92Å | ||
| 50 | K | 83.6 | Confident | 86.7 | Confident | 41 Ų | 41 | 57.4 Ų | 57.4 | 18% | 0.178 | 24% | 0.243 | C | C | . | . | H | α-helix | trans | -42.3 | -53 | 173 | -85.8 | 178.2 | 166.4 | 175.5 | 0 | 113.4 | E52 Q53 T54 I118 S131 A132 K133 L134 | K50-E52 VanDerWaalsContact C-N 3.29Å; K50-E52 PolarHBondContact O-N 3.5Å; K50-Q53 WeakPolarHBondContact O-CB 3.34Å; K50-Q53 PolarHBondContact O-N 3.07Å; K50-Q53 VanDerWaalsContact O-N 3.1Å; K50-T54 PolarHBondContact O-N 3.02Å; K50-T54 PolarHBondContact O-OG1 3.44Å; K50-T54 VanDerWaalsContact O-OG1 3.05Å; K50-I118 HydrophobicContact CB-CD1 4.35Å; K50-S131 VanDerWaalsContact CD-O 3.32Å; K50-S131 WeakPolarHBondContact CD-O 3.44Å; K50-S131 WeakPolarHBondContact CE-O 3.4Å; K50-S131 PolarHBondContact NZ-O 3.43Å; K50-A132 PolarHBondContact N-O 3.07Å; K50-K133 VanDerWaalsContact CE-O 3.25Å; K50-K133 WeakPolarHBondContact CE-O 3.46Å; K50-L134 HydrophobicContact CG-CB 4.34Å; K50-L134 HydrophobicContact CG-CD1 4.39Å |
| 51 | V | 83.4 | Confident | 86.9 | Confident | 17 Ų | 17 | 54.5 Ų | 54.5 | 10% | 0.103 | 23% | 0.228 | C | C | . | . | H | α-helix | trans | -57.9 | -38.5 | 179.3 | 178.8 | 0 | 0 | 0 | 0 | 112.7 | K49 T54 E55 I118 L228 | K49-V51 VanDerWaalsContact C-N 3.3Å; K49-V51 PolarHBondContact O-N 3.19Å; V51-T54 PolarHBondContact O-N 3.27Å; V51-E55 VanDerWaalsContact O-CB 3.3Å; V51-E55 WeakPolarHBondContact O-CB 3.35Å; V51-E55 PolarHBondContact O-N 2.93Å; V51-I118 HydrophobicContact CG2-CD1 4.19Å; V51-I118 HydrophobicContact CG2-CG2 4.1Å; V51-L228 HydrophobicContact CB-CD2 4.38Å; V51-L228 HydrophobicContact CG1-CD2 4.44Å |
| 52 | E | 84.4 | Confident | 87.1 | Confident | 22 Ų | 22 | 53.8 Ų | 53.8 | 10% | 0.103 | 22% | 0.224 | C | C | . | . | H | α-helix | trans | -75.1 | -30.6 | 179.4 | -62.3 | 175.9 | 139 | 0 | 0 | 112.2 | R45 K48 K49 K50 A56 | R45-E52 IonicContact NH1-OE1 2.87Å; R45-E52 PolarHBondContact NH1-OE1 2.92Å; K48-E52 WeakPolarHBondContact CA-OE2 3.38Å; K49-E52 PolarHBondContact N-OE2 2.86Å; K49-E52 WeakPolarHBondContact O-CB 3.46Å; K49-E52 PolarHBondContact O-N 2.88Å; K50-E52 VanDerWaalsContact C-N 3.29Å; K50-E52 PolarHBondContact O-N 3.5Å; E52-A56 PolarHBondContact O-N 3.1Å; E52-A56 VanDerWaalsContact O-N 3.07Å |
| 53 | Q | 89.1 | Confident | 87.5 | Confident | 33 Ų | 33 | 53.6 Ų | 53.6 | 15% | 0.154 | 22% | 0.223 | C | C | . | . | H | α-helix | trans | -68.6 | -44.5 | 171.6 | -67.1 | 174.5 | -76.2 | 0 | 0 | 110.6 | K48 K49 K50 E55 A56 V57 L134 | K48-Q53 HydrophobicContact CB-CG 3.74Å; K48-Q53 HydrophobicContact CD-CG 4.15Å; K49-Q53 PolarHBondContact O-N 2.92Å; K50-Q53 WeakPolarHBondContact O-CB 3.34Å; K50-Q53 PolarHBondContact O-N 3.07Å; K50-Q53 VanDerWaalsContact O-N 3.1Å; Q53-E55 VanDerWaalsContact C-N 3.34Å; Q53-E55 PolarHBondContact O-N 3.22Å; Q53-A56 WeakPolarHBondContact O-CB 3.42Å; Q53-A56 PolarHBondContact O-N 2.71Å; Q53-V57 PolarHBondContact O-N 3.1Å; Q53-V57 VanDerWaalsContact O-N 3.07Å; Q53-L134 HydrophobicContact CB-CB 4.44Å; Q53-L134 PolarHBondContact NE2-O 3.35Å |
| 54 | T | 90.6 | Very high | 87.8 | Confident | 0 Ų | 0 | 51.7 Ų | 51.7 | 0% | 0 | 21% | 0.212 | C | C | . | . | H | α-helix | trans | -63.7 | -39.8 | 175.7 | -51 | 0 | 0 | 0 | 0 | 111.8 | K50 V51 A56 V57 Y58 Y114 M115 F143 | K50-T54 PolarHBondContact O-N 3.02Å; K50-T54 PolarHBondContact O-OG1 3.44Å; K50-T54 VanDerWaalsContact O-OG1 3.05Å; V51-T54 PolarHBondContact O-N 3.27Å; T54-A56 VanDerWaalsContact C-N 3.3Å; T54-A56 PolarHBondContact O-N 3.03Å; T54-V57 PolarHBondContact O-N 3.22Å; T54-Y58 WeakPolarHBondContact O-CB 3.42Å; T54-Y58 PolarHBondContact O-N 3.03Å; T54-Y114 HydrophobicContact CG2-CD1 3.84Å; T54-Y114 HydrophobicContact CG2-CG 4.41Å; T54-Y114 WeakPolarHBondContact OG1-CD1 3.42Å; T54-Y114 WeakPolarHBondContact OG1-CE1 3.3Å; T54-M115 HydrophobicContact CG2-CE 4.19Å; T54-M115 HydrophobicContact CG2-CG 3.76Å; T54-F143 HydrophobicContact CG2-CE1 4Å; T54-F143 HydrophobicContact CG2-CZ 4Å |
| 55 | E | 89.6 | Confident | 88.1 | Confident | 4 Ų | 4 | 43 Ų | 43 | 2% | 0.019 | 18% | 0.179 | C | C | . | . | H | α-helix | trans | -62.9 | -36.7 | 173.8 | -175.1 | -175.5 | -155.3 | 0 | 0 | 112.1 | L42 V51 Q53 Y58 T59 T282 R286 | L42-E55 HydrophobicContact CD1-CG 3.94Å; V51-E55 VanDerWaalsContact O-CB 3.3Å; V51-E55 WeakPolarHBondContact O-CB 3.35Å; V51-E55 PolarHBondContact O-N 2.93Å; Q53-E55 VanDerWaalsContact C-N 3.34Å; Q53-E55 PolarHBondContact O-N 3.22Å; E55-Y58 WeakPolarHBondContact O-CB 3.31Å; E55-Y58 PolarHBondContact O-N 3.05Å; E55-T59 WeakPolarHBondContact O-CG2 3.49Å; E55-T59 PolarHBondContact O-N 2.76Å; E55-T59 PolarHBondContact O-OG1 3.38Å; E55-T282 WeakPolarHBondContact OE1-CG2 3.35Å; E55-R286 VanDerWaalsContact CD-CZ 3.45Å; E55-R286 IonicContact OE1-CZ 3.65Å; E55-R286 IonicContact OE1-NE 2.98Å; E55-R286 IonicContact OE1-NH1 3.49Å; E55-R286 PolarHBondContact OE1-NH1 2.98Å; E55-R286 IonicContact OE1-NH2 2.67Å; E55-R286 PolarHBondContact OE1-NH2 3.06Å; E55-R286 IonicContact OE2-CZ 3.08Å; E55-R286 IonicContact OE2-NH1 2.74Å; E55-R286 PolarHBondContact OE2-NH1 2.48Å; E55-R286 IonicContact OE2-NH2 2.68Å; E55-R286 PolarHBondContact OE2-NH2 3.3Å |
| 56 | A | 91.9 | Very high | 88.5 | Confident | 6 Ų | 6 | 40.7 Ų | 40.7 | 5% | 0.05 | 17% | 0.17 | C | C | . | . | H | α-helix | trans | -62.6 | -46.7 | 173.1 | 0 | 0 | 0 | 0 | 0 | 111 | F39 L42 V43 E52 Q53 T54 Y58 T59 F60 | F39-A56 HydrophobicContact CD2-CB 4.1Å; F39-A56 VanDerWaalsContact CD2-O 3.27Å; F39-A56 WeakPolarHBondContact CD2-O 3.34Å; F39-A56 HydrophobicContact CE2-CB 4.26Å; L42-A56 HydrophobicContact CB-CB 4.05Å; L42-A56 HydrophobicContact CD1-CB 4.36Å; V43-A56 HydrophobicContact CG2-CB 4.36Å; E52-A56 PolarHBondContact O-N 3.1Å; E52-A56 VanDerWaalsContact O-N 3.07Å; Q53-A56 WeakPolarHBondContact O-CB 3.42Å; Q53-A56 PolarHBondContact O-N 2.71Å; T54-A56 VanDerWaalsContact C-N 3.3Å; T54-A56 PolarHBondContact O-N 3.03Å; A56-Y58 VanDerWaalsContact C-N 3.31Å; A56-Y58 PolarHBondContact O-N 3.04Å; A56-T59 WeakPolarHBondContact CA-OG1 3.49Å; A56-T59 PolarHBondContact O-N 2.98Å; A56-T59 PolarHBondContact O-OG1 3.42Å; A56-F60 WeakPolarHBondContact O-CB 3.23Å; A56-F60 PolarHBondContact O-N 2.93Å |
| 57 | V | 94.2 | Very high | 89.5 | Confident | 14 Ų | 14 | 31.2 Ų | 31.2 | 9% | 0.085 | 14% | 0.138 | C | C | . | . | H | α-helix | trans | -60.1 | -42.5 | 175.4 | 179.7 | 0 | 0 | 0 | 0 | 111.2 | Q53 T54 F60 G61 L107 I139 F143 | Q53-V57 PolarHBondContact O-N 3.1Å; Q53-V57 VanDerWaalsContact O-N 3.07Å; T54-V57 PolarHBondContact O-N 3.22Å; V57-F60 PolarHBondContact O-N 3.07Å; V57-G61 PolarHBondContact O-N 3.35Å; V57-L107 HydrophobicContact CG1-CB 4.49Å; V57-L107 HydrophobicContact CG1-CD2 4.02Å; V57-I139 HydrophobicContact CG2-CG2 4.29Å; V57-F143 HydrophobicContact CB-CD1 4.33Å; V57-F143 HydrophobicContact CB-CE1 4.49Å; V57-F143 HydrophobicContact CG1-CB 4.09Å; V57-F143 HydrophobicContact CG1-CD1 3.56Å; V57-F143 HydrophobicContact CG1-CE1 4.17Å; V57-F143 HydrophobicContact CG1-CG 3.94Å |
| 58 | Y | 93.6 | Very high | 90.5 | Very high | 1 Ų | 1 | 20.4 Ų | 20.4 | 0% | 0.004 | 10% | 0.097 | C | C | . | . | H | α-helix | trans | -58 | -50.6 | 174.9 | 177.1 | -85.9 | 0 | 0 | 0 | 111.7 | T54 E55 A56 F60 G61 C62 T108 S111 M112 M115 T235 S239 F278 | T54-Y58 WeakPolarHBondContact O-CB 3.42Å; T54-Y58 PolarHBondContact O-N 3.03Å; E55-Y58 WeakPolarHBondContact O-CB 3.31Å; E55-Y58 PolarHBondContact O-N 3.05Å; A56-Y58 VanDerWaalsContact C-N 3.31Å; A56-Y58 PolarHBondContact O-N 3.04Å; Y58-F60 VanDerWaalsContact C-N 3.29Å; Y58-F60 PolarHBondContact O-N 2.89Å; Y58-G61 PolarHBondContact O-N 2.85Å; Y58-C62 WeakPolarHBondContact CE1-SG 3.39Å; Y58-C62 PolarHBondContact O-N 3.05Å; Y58-C62 PolarHBondContact O-SG 2.9Å; Y58-T108 HydrophobicContact CD2-CG2 4.42Å; Y58-T108 HydrophobicContact CE2-CG2 4.35Å; Y58-S111 PolarHBondContact N-OG 3.25Å; Y58-M112 HydrophobicContact CD2-CG 4.26Å; Y58-M112 HydrophobicContact CE2-CG 3.95Å; Y58-M115 HydrophobicContact CD2-CE 4.06Å; Y58-M115 HydrophobicContact CG-CE 4.12Å; Y58-T235 HydrophobicContact CD1-CG2 3.89Å; Y58-T235 HydrophobicContact CD2-CG2 4.03Å; Y58-T235 HydrophobicContact CE1-CG2 3.67Å; Y58-T235 HydrophobicContact CE2-CG2 3.79Å; Y58-T235 HydrophobicContact CG-CG2 4.09Å; Y58-S239 WeakPolarHBondContact CE2-OG 3.36Å; Y58-S239 VanDerWaalsContact CZ-OG 3.27Å; Y58-S239 PolarHBondContact OH-OG 3.15Å; Y58-F278 HydrophobicContact CD1-CD1 4.21Å; Y58-F278 AromaticContact CD1-CE1 3.59Å; Y58-F278 HydrophobicContact CD1-CE1 3.59Å; Y58-F278 HydrophobicContact CD1-CZ 4.08Å; Y58-F278 AromaticContact CE1-CD1 3.5Å; Y58-F278 HydrophobicContact CE1-CD1 3.5Å; Y58-F278 VanDerWaalsContact CE1-CD1 3.5Å; Y58-F278 AromaticContact CE1-CE1 3.3Å; Y58-F278 HydrophobicContact CE1-CE1 3.3Å; Y58-F278 HydrophobicContact CE1-CG 4.19Å; Y58-F278 AromaticContact CE1-CZ 3.86Å; Y58-F278 HydrophobicContact CE1-CZ 3.86Å |
| 59 | T | 93.6 | Very high | 91 | Very high | 0 Ų | 0 | 18 Ų | 18 | 0% | 0 | 9% | 0.087 | C | C | . | . | H | α-helix | trans | -63.2 | -36.6 | 178.3 | 53.1 | 0 | 0 | 0 | 0 | 111.9 | N35 C38 L42 E55 A56 C62 G63 F278 | N35-T59 WeakPolarHBondContact CB-O 3.48Å; C38-T59 HydrophobicContact CB-CG2 4.32Å; L42-T59 HydrophobicContact CD1-CG2 3.96Å; E55-T59 WeakPolarHBondContact O-CG2 3.49Å; E55-T59 PolarHBondContact O-N 2.76Å; E55-T59 PolarHBondContact O-OG1 3.38Å; A56-T59 WeakPolarHBondContact CA-OG1 3.49Å; A56-T59 PolarHBondContact O-N 2.98Å; A56-T59 PolarHBondContact O-OG1 3.42Å; T59-C62 PolarHBondContact O-N 3.19Å; T59-G63 PolarHBondContact O-N 2.89Å; T59-F278 HydrophobicContact CG2-CE1 4Å |
| 60 | F | 95.6 | Very high | 91.3 | Very high | 60 Ų | 60 | 13.3 Ų | 13.3 | 26% | 0.263 | 7% | 0.067 | S | C | . | . | H | α-helix | trans | -63.1 | -47.6 | 174.3 | -179.9 | -107.8 | 0 | 0 | 0 | 111.2 | I36 F39 A56 V57 Y58 C62 G63 V64 L107 F144 | I36-F60 HydrophobicContact CD1-CD2 4.19Å; F39-F60 HydrophobicContact CD1-CD2 4.34Å; F39-F60 HydrophobicContact CD2-CB 3.79Å; F39-F60 HydrophobicContact CE1-CD2 4.23Å; F39-F60 HydrophobicContact CE2-CB 3.92Å; F39-F60 HydrophobicContact CE2-CG 4.42Å; F39-F60 HydrophobicContact CG-CB 4.25Å; F39-F60 HydrophobicContact CZ-CB 4.5Å; F39-F60 HydrophobicContact CZ-CD2 4.3Å; A56-F60 WeakPolarHBondContact O-CB 3.23Å; A56-F60 PolarHBondContact O-N 2.93Å; V57-F60 PolarHBondContact O-N 3.07Å; Y58-F60 VanDerWaalsContact C-N 3.29Å; Y58-F60 PolarHBondContact O-N 2.89Å; F60-C62 VanDerWaalsContact C-N 3.35Å; F60-C62 PolarHBondContact O-N 3.24Å; F60-G63 WeakPolarHBondContact O-CA 3.17Å; F60-G63 PolarHBondContact O-N 2.9Å; F60-G63 VanDerWaalsContact O-N 3.08Å; F60-V64 HydrophobicContact CD1-CG2 4.43Å; F60-V64 HydrophobicContact CE1-CG2 4.03Å; F60-V64 HydrophobicContact CE2-CG2 4.35Å; F60-V64 HydrophobicContact CZ-CG2 3.98Å; F60-V64 WeakPolarHBondContact O-CG2 3.3Å; F60-V64 PolarHBondContact O-N 2.88Å; F60-L107 HydrophobicContact CD1-CD1 3.81Å; F60-L107 HydrophobicContact CE1-CD1 4.01Å; F60-F144 HydrophobicContact CE1-CE1 4.42Å; F60-F144 HydrophobicContact CE1-CZ 4.47Å |
| 61 | G | 95.5 | Very high | 91.3 | Very high | 0 Ų | 0 | 14.5 Ų | 14.5 | 0% | 0 | 7% | 0.073 | C | C | . | . | H | α-helix | trans | -56.5 | -45.5 | 174.7 | 0 | 0 | 0 | 0 | 0 | 112.8 | V57 Y58 G63 V64 V65 G104 | V57-G61 PolarHBondContact O-N 3.35Å; Y58-G61 PolarHBondContact O-N 2.85Å; G61-G63 VanDerWaalsContact C-N 3.29Å; G61-G63 PolarHBondContact O-N 3.2Å; G61-V64 PolarHBondContact O-N 2.94Å; G61-V64 VanDerWaalsContact O-N 3.16Å; G61-V65 WeakPolarHBondContact O-CG2 3.34Å; G61-V65 PolarHBondContact O-N 2.79Å; G61-G104 WeakPolarHBondContact O-CA 3.29Å |
| 62 | C | 94.5 | Very high | 91.3 | Very high | 0 Ų | 0 | 14.3 Ų | 14.3 | 0% | 0 | 7% | 0.07 | C | C | . | . | H | α-helix | trans | -60.5 | -38.4 | 175.2 | -63.5 | 0 | 0 | 0 | 0 | 112.5 | N35 Y58 T59 F60 V65 G66 T108 L275 | N35-C62 HydrophobicContact CB-CB 4.23Å; N35-C62 VanDerWaalsContact CG-CB 3.49Å; N35-C62 VanDerWaalsContact OD1-CB 3.31Å; N35-C62 WeakPolarHBondContact OD1-CB 3.31Å; Y58-C62 WeakPolarHBondContact CE1-SG 3.39Å; Y58-C62 PolarHBondContact O-N 3.05Å; Y58-C62 PolarHBondContact O-SG 2.9Å; T59-C62 PolarHBondContact O-N 3.19Å; F60-C62 VanDerWaalsContact C-N 3.35Å; F60-C62 PolarHBondContact O-N 3.24Å; C62-V65 PolarHBondContact O-N 3.42Å; C62-G66 PolarHBondContact O-N 3.05Å; C62-T108 HydrophobicContact CB-CG2 4.47Å; C62-T108 VanDerWaalsContact SG-CG2 3.52Å; C62-L275 HydrophobicContact CB-CB 4.43Å; C62-L275 HydrophobicContact CB-CD1 4.43Å; C62-L275 HydrophobicContact CB-CD2 4.38Å |
| 63 | G | 95.4 | Very high | 90.9 | Very high | 0 Ų | 0 | 13.4 Ų | 13.4 | 0% | 0 | 7% | 0.067 | C | C | . | . | H | α-helix | trans | -60.9 | -48.9 | 173.4 | 0 | 0 | 0 | 0 | 0 | 111.4 | F32 T59 F60 G61 V65 G66 L67 | F32-G63 WeakPolarHBondContact CD2-O 3.37Å; T59-G63 PolarHBondContact O-N 2.89Å; F60-G63 WeakPolarHBondContact O-CA 3.17Å; F60-G63 PolarHBondContact O-N 2.9Å; F60-G63 VanDerWaalsContact O-N 3.08Å; G61-G63 VanDerWaalsContact C-N 3.29Å; G61-G63 PolarHBondContact O-N 3.2Å; G63-V65 VanDerWaalsContact C-N 3.31Å; G63-V65 PolarHBondContact O-N 3.29Å; G63-G66 PolarHBondContact O-N 2.94Å; G63-G66 VanDerWaalsContact O-N 3.11Å; G63-L67 PolarHBondContact O-N 2.94Å |
| 64 | V | 95.5 | Very high | 90.1 | Very high | 20 Ų | 20 | 13.4 Ų | 13.4 | 12% | 0.121 | 7% | 0.067 | C | C | . | . | H | α-helix | trans | -60.5 | -38.9 | 177.8 | -179.6 | 0 | 0 | 0 | 0 | 111.7 | F60 G61 L67 A68 A100 I103 | F60-V64 HydrophobicContact CD1-CG2 4.43Å; F60-V64 HydrophobicContact CE1-CG2 4.03Å; F60-V64 HydrophobicContact CE2-CG2 4.35Å; F60-V64 HydrophobicContact CZ-CG2 3.98Å; F60-V64 WeakPolarHBondContact O-CG2 3.3Å; F60-V64 PolarHBondContact O-N 2.88Å; G61-V64 PolarHBondContact O-N 2.94Å; G61-V64 VanDerWaalsContact O-N 3.16Å; V64-L67 WeakPolarHBondContact O-CB 3.31Å; V64-L67 PolarHBondContact O-N 2.88Å; V64-A68 PolarHBondContact O-N 3.34Å; V64-A100 HydrophobicContact CG1-CB 3.94Å; V64-A100 VanDerWaalsContact CG1-O 3.31Å; V64-A100 WeakPolarHBondContact CG1-O 3.09Å; V64-I103 HydrophobicContact CG1-CB 4.43Å; V64-I103 HydrophobicContact CG1-CG2 4.38Å |
| 65 | V | 93.8 | Very high | 89 | Confident | 0 Ų | 0 | 16.2 Ų | 16.2 | 0% | 0 | 9% | 0.085 | C | C | . | . | H | α-helix | trans | -62.9 | -45.5 | 172.5 | 176.6 | 0 | 0 | 0 | 0 | 111.4 | G61 C62 G63 L67 A68 F69 Y101 G104 Q105 L275 | G61-V65 WeakPolarHBondContact O-CG2 3.34Å; G61-V65 PolarHBondContact O-N 2.79Å; C62-V65 PolarHBondContact O-N 3.42Å; G63-V65 VanDerWaalsContact C-N 3.31Å; G63-V65 PolarHBondContact O-N 3.29Å; V65-L67 PolarHBondContact O-N 3.5Å; V65-A68 VanDerWaalsContact O-CB 3.3Å; V65-A68 WeakPolarHBondContact O-CB 3.23Å; V65-A68 PolarHBondContact O-N 3.08Å; V65-A68 VanDerWaalsContact O-N 3.08Å; V65-F69 HydrophobicContact CG1-CD2 3.93Å; V65-F69 HydrophobicContact CG1-CE2 3.81Å; V65-F69 WeakPolarHBondContact O-CD2 3.21Å; V65-F69 PolarHBondContact O-N 3.16Å; V65-F69 VanDerWaalsContact O-N 3.11Å; V65-Y101 HydrophobicContact CG1-CD1 4.37Å; V65-Y101 HydrophobicContact CG1-CE1 4.38Å; V65-G104 VanDerWaalsContact CG2-C 3.45Å; V65-Q105 HydrophobicContact CG2-CG 3.79Å; V65-L275 HydrophobicContact CB-CD1 3.94Å; V65-L275 HydrophobicContact CG1-CD1 3.72Å |
| 66 | G | 92.9 | Very high | 87.9 | Confident | 0 Ų | 0 | 17.4 Ų | 17.4 | 0% | 0 | 9% | 0.093 | C | C | . | . | H | α-helix | trans | -59 | -37.2 | 175.1 | 0 | 0 | 0 | 0 | 0 | 112.9 | G28 C62 G63 S70 | G28-G66 CarbonylContact C-O 3.35Å; G28-G66 WeakPolarHBondContact CA-O 3.29Å; G28-G66 CarbonylContact O-C 3.58Å; G28-G66 WeakPolarHBondContact O-CA 2.88Å; G28-G66 VanDerWaalsContact O-O 3.09Å; C62-G66 PolarHBondContact O-N 3.05Å; G63-G66 PolarHBondContact O-N 2.94Å; G63-G66 VanDerWaalsContact O-N 3.11Å; G66-S70 PolarHBondContact O-N 2.99Å; G66-S70 VanDerWaalsContact O-N 3.15Å; G66-S70 PolarHBondContact O-OG 3.21Å |
| 67 | L | 91.8 | Very high | 86.6 | Confident | 52 Ų | 52 | 17.7 Ų | 17.7 | 27% | 0.272 | 9% | 0.094 | S | C | . | . | H | α-helix | trans | -64.6 | -42 | 173.7 | -172.5 | 63.5 | 0 | 0 | 0 | 111.5 | F32 G63 V64 V65 F69 S70 F71 | F32-L67 HydrophobicContact CD2-CB 3.79Å; F32-L67 HydrophobicContact CD2-CD1 4.31Å; F32-L67 HydrophobicContact CD2-CG 4.46Å; F32-L67 HydrophobicContact CE2-CB 4.2Å; F32-L67 HydrophobicContact CE2-CD1 4.31Å; F32-L67 HydrophobicContact CE2-CD2 4.2Å; F32-L67 HydrophobicContact CE2-CG 4.48Å; F32-L67 HydrophobicContact CG-CB 4.38Å; F32-L67 HydrophobicContact CG-CD1 4.45Å; F32-L67 HydrophobicContact CZ-CD1 4.48Å; G63-L67 PolarHBondContact O-N 2.94Å; V64-L67 WeakPolarHBondContact O-CB 3.31Å; V64-L67 PolarHBondContact O-N 2.88Å; V65-L67 PolarHBondContact O-N 3.5Å; L67-F69 PolarHBondContact O-N 3.13Å; L67-S70 VanDerWaalsContact O-CB 3.3Å; L67-S70 WeakPolarHBondContact O-CB 3.39Å; L67-S70 PolarHBondContact O-N 3.21Å; L67-F71 HydrophobicContact CD1-CD2 4.23Å; L67-F71 HydrophobicContact CD1-CE2 3.66Å; L67-F71 HydrophobicContact CD2-CE2 4.31Å; L67-F71 HydrophobicContact CG-CD2 4.08Å; L67-F71 HydrophobicContact CG-CE2 3.73Å; L67-F71 VanDerWaalsContact O-CD2 3.25Å; L67-F71 WeakPolarHBondContact O-CD2 3.35Å; L67-F71 PolarHBondContact O-N 3.03Å |
| 68 | A | 92.1 | Very high | 85.3 | Confident | 0 Ų | 0 | 19.6 Ų | 19.6 | 0% | 0 | 11% | 0.106 | C | C | . | . | H | α-helix | trans | -57.3 | -49 | 176.5 | 0 | 0 | 0 | 0 | 0 | 111.9 | V64 V65 S70 F71 E72 A97 A100 Y101 | V64-A68 PolarHBondContact O-N 3.34Å; V65-A68 VanDerWaalsContact O-CB 3.3Å; V65-A68 WeakPolarHBondContact O-CB 3.23Å; V65-A68 PolarHBondContact O-N 3.08Å; V65-A68 VanDerWaalsContact O-N 3.08Å; A68-S70 PolarHBondContact O-N 3.23Å; A68-F71 PolarHBondContact O-N 3.08Å; A68-E72 PolarHBondContact O-N 2.91Å; A68-A97 WeakPolarHBondContact CB-O 3.4Å; A68-A100 HydrophobicContact CB-CB 3.61Å; A68-Y101 HydrophobicContact CB-CD1 3.51Å; A68-Y101 HydrophobicContact CB-CD2 3.99Å; A68-Y101 HydrophobicContact CB-CE1 3.45Å; A68-Y101 VanDerWaalsContact CB-CE1 3.45Å; A68-Y101 HydrophobicContact CB-CE2 3.93Å; A68-Y101 HydrophobicContact CB-CG 3.77Å |
| 69 | F | 89 | Confident | 84.1 | Confident | 3 Ų | 3 | 26.3 Ų | 26.3 | 1% | 0.013 | 14% | 0.141 | C | C | . | . | H | α-helix | trans | -58.7 | -33 | 174.4 | -84.8 | -77.9 | 0 | 0 | 0 | 113.1 | N24 V65 L67 F71 E72 Y101 W268 Q271 P272 | N24-F69 CarbonylContact C-O 3.6Å; N24-F69 HydrophobicContact CB-CD1 4.49Å; N24-F69 WeakPolarHBondContact OD1-CD1 3.36Å; V65-F69 HydrophobicContact CG1-CD2 3.93Å; V65-F69 HydrophobicContact CG1-CE2 3.81Å; V65-F69 WeakPolarHBondContact O-CD2 3.21Å; V65-F69 PolarHBondContact O-N 3.16Å; V65-F69 VanDerWaalsContact O-N 3.11Å; L67-F69 PolarHBondContact O-N 3.13Å; F69-F71 PolarHBondContact O-N 2.78Å; F69-E72 PolarHBondContact O-N 3.24Å; F69-Y101 WeakPolarHBondContact CA-OH 3.4Å; F69-Y101 WeakPolarHBondContact CD1-OH 3.48Å; F69-Y101 AromaticContact CD2-CE1 3.72Å; F69-Y101 HydrophobicContact CD2-CE1 3.72Å; F69-Y101 AromaticContact CE2-CE1 3.67Å; F69-Y101 HydrophobicContact CE2-CE1 3.67Å; F69-Y101 HydrophobicContact CG-CE1 4.25Å; F69-Y101 WeakPolarHBondContact CG-OH 3.35Å; F69-Y101 HydrophobicContact CZ-CE1 4.19Å; F69-Y101 PolarHBondContact N-OH 3.34Å; F69-W268 HydrophobicContact CE1-CB 4.18Å; F69-W268 HydrophobicContact CE1-CE3 4.48Å; F69-W268 WeakPolarHBondContact CE1-O 3.47Å; F69-W268 HydrophobicContact CZ-CB 4.32Å; F69-W268 AromaticContact CZ-CE3 3.82Å; F69-W268 HydrophobicContact CZ-CE3 3.82Å; F69-W268 WeakPolarHBondContact CZ-O 3.06Å; F69-Q271 HydrophobicContact CE2-CB 3.95Å; F69-Q271 HydrophobicContact CZ-CB 3.9Å; F69-Q271 HydrophobicContact CZ-CG 4.28Å; F69-P272 HydrophobicContact CD1-CG 4.22Å; F69-P272 HydrophobicContact CD2-CB 4.19Å; F69-P272 HydrophobicContact CD2-CG 4.07Å; F69-P272 HydrophobicContact CE1-CG 4.43Å; F69-P272 HydrophobicContact CE2-CG 4.31Å; F69-P272 HydrophobicContact CG-CB 4.41Å; F69-P272 HydrophobicContact CG-CG 4.02Å; F69-P272 HydrophobicContact CZ-CG 4.46Å |
| 70 | S | 86.7 | Confident | 82.8 | Confident | 6 Ų | 6 | 35.2 Ų | 35.2 | 4% | 0.042 | 18% | 0.175 | C | C | . | . | H | α-helix | trans | -68.5 | -22.4 | 178 | -53.6 | 0 | 0 | 0 | 0 | 113.1 | Q29 G66 L67 A68 | Q29-S70 PolarHBondContact N-OG 3.42Å; Q29-S70 VanDerWaalsContact N-OG 3.11Å; Q29-S70 PolarHBondContact NE2-OG 2.97Å; G66-S70 PolarHBondContact O-N 2.99Å; G66-S70 VanDerWaalsContact O-N 3.15Å; G66-S70 PolarHBondContact O-OG 3.21Å; L67-S70 VanDerWaalsContact O-CB 3.3Å; L67-S70 WeakPolarHBondContact O-CB 3.39Å; L67-S70 PolarHBondContact O-N 3.21Å; A68-S70 PolarHBondContact O-N 3.23Å |
| 71 | F | 84.7 | Confident | 81.5 | Confident | 67 Ų | 67 | 36.4 Ų | 36.4 | 29% | 0.294 | 18% | 0.181 | S | C | . | . | H | α-helix | trans | -93.8 | -11.3 | 176.5 | -76.3 | -70.7 | 0 | 0 | 0 | 113.2 | L67 A68 F69 C73 S95 P96 A97 | L67-F71 HydrophobicContact CD1-CD2 4.23Å; L67-F71 HydrophobicContact CD1-CE2 3.66Å; L67-F71 HydrophobicContact CD2-CE2 4.31Å; L67-F71 HydrophobicContact CG-CD2 4.08Å; L67-F71 HydrophobicContact CG-CE2 3.73Å; L67-F71 VanDerWaalsContact O-CD2 3.25Å; L67-F71 WeakPolarHBondContact O-CD2 3.35Å; L67-F71 PolarHBondContact O-N 3.03Å; A68-F71 PolarHBondContact O-N 3.08Å; F69-F71 PolarHBondContact O-N 2.78Å; F71-C73 VanDerWaalsContact C-N 3.26Å; F71-C73 PolarHBondContact O-N 2.78Å; F71-S95 PolarHBondContact O-OG 3.17Å; F71-P96 HydrophobicContact CD2-CG 4.1Å; F71-P96 HydrophobicContact CE2-CG 4.05Å; F71-P96 HydrophobicContact CG-CG 4.45Å; F71-P96 HydrophobicContact CZ-CG 4.36Å; F71-A97 HydrophobicContact CB-CB 4.06Å |
| 72 | E | 82 | Confident | 80.1 | Confident | 13 Ų | 13 | 38.1 Ų | 38.1 | 6% | 0.061 | 20% | 0.199 | C | C | . | . | trans | -82.7 | 69.7 | 172.1 | -66.5 | -67.7 | -161.7 | 0 | 0 | 110.7 | A68 F69 A97 Y101 F172 F173 | A68-E72 PolarHBondContact O-N 2.91Å; F69-E72 PolarHBondContact O-N 3.24Å; E72-A97 HydrophobicContact CG-CB 3.86Å; E72-Y101 HydrophobicContact CG-CE2 3.79Å; E72-Y101 VanDerWaalsContact CG-OH 3.24Å; E72-Y101 WeakPolarHBondContact CG-OH 3.11Å; E72-Y101 WeakPolarHBondContact OE1-CE2 3.4Å; E72-F172 HydrophobicContact CB-CD1 4.11Å; E72-F172 HydrophobicContact CB-CE1 3.93Å; E72-F172 HydrophobicContact CG-CD1 4.48Å; E72-F172 VanDerWaalsContact OE2-CA 3.23Å; E72-F172 WeakPolarHBondContact OE2-CA 3.12Å; E72-F172 WeakPolarHBondContact OE2-CD1 3.44Å; E72-F173 WeakPolarHBondContact OE1-CB 3.29Å; E72-F173 PolarHBondContact OE1-N 3.39Å; E72-F173 PolarHBondContact OE2-N 3.27Å | ||
| 73 | C | 77.4 | Confident | 79 | Confident | 3 Ų | 3 | 45 Ų | 45 | 2% | 0.02 | 24% | 0.235 | C | C | . | . | trans | -148.4 | 110.4 | -177 | 163.8 | 0 | 0 | 0 | 0 | 108.9 | D21 F71 V75 C76 T77 | D21-C73 HydrophobicContact CB-CB 4.39Å; F71-C73 VanDerWaalsContact C-N 3.26Å; F71-C73 PolarHBondContact O-N 2.78Å; C73-V75 VanDerWaalsContact C-N 3.33Å; C73-V75 PolarHBondContact O-N 3.19Å; C73-C76 HydrophobicContact CB-CB 3.61Å; C73-C76 WeakPolarHBondContact CB-SG 3.37Å; C73-C76 WeakPolarHBondContact O-CA 3.49Å; C73-C76 VanDerWaalsContact O-CB 3.27Å; C73-C76 WeakPolarHBondContact O-CB 3.39Å; C73-C76 PolarHBondContact O-N 3.42Å; C73-C76 WeakPolarHBondContact SG-CB 3.18Å; C73-C76 PolarHBondContact SG-N 3.36Å; C73-C76 CovalentContact SG-SG 2.06Å; C73-C76 PolarHBondContact SG-SG 3.15Å; C73-T77 PolarHBondContact O-N 3.38Å | ||
| 74 | D | 71.6 | Confident | 78 | Confident | 32 Ų | 32 | 52.1 Ų | 52.1 | 17% | 0.171 | 27% | 0.269 | C | S | . | . | H | α-helix | trans | -68.8 | -34.8 | -175.6 | -99.5 | 0.2 | 0 | 0 | 0 | 111.5 | D21 C76 T77 T78 S170 F172 | D21-D74 PolarHBondContact OD2-N 3.42Å; D74-C76 PolarHBondContact O-N 3.5Å; D74-T77 WeakPolarHBondContact CA-OG1 3.37Å; D74-T77 PolarHBondContact O-N 3.44Å; D74-T77 PolarHBondContact O-OG1 2.96Å; D74-T78 WeakPolarHBondContact O-CB 3.25Å; D74-T78 PolarHBondContact O-N 3.23Å; D74-T78 PolarHBondContact O-OG1 3.07Å; D74-S170 WeakPolarHBondContact OD1-CB 3.4Å; D74-S170 PolarHBondContact OD1-OG 3.27Å; D74-S170 PolarHBondContact OD2-OG 2.88Å; D74-F172 HydrophobicContact CB-CE2 3.97Å; D74-F172 HydrophobicContact CB-CZ 4.39Å; D74-F172 WeakPolarHBondContact OD1-CD2 3.46Å; D74-F172 WeakPolarHBondContact OD1-CE2 3.34Å; D74-F172 VanDerWaalsContact OD2-CE2 3.27Å; D74-F172 WeakPolarHBondContact OD2-CE2 3.24Å |
| 75 | V | 67.3 | Low | 77.2 | Confident | 60 Ų | 60 | 54.5 Ų | 54.5 | 36% | 0.364 | 29% | 0.285 | S | S | . | . | H | α-helix | trans | -58.4 | -40.8 | 171.1 | 178.1 | 0 | 0 | 0 | 0 | 109.9 | C73 L79 | C73-V75 VanDerWaalsContact C-N 3.33Å; C73-V75 PolarHBondContact O-N 3.19Å; V75-L79 HydrophobicContact CG1-CD1 3.71Å; V75-L79 WeakPolarHBondContact O-CD1 3.42Å; V75-L79 PolarHBondContact O-N 3.21Å |
| 76 | C | 66.8 | Low | 76.6 | Confident | 28 Ų | 28 | 55.5 Ų | 55.5 | 19% | 0.189 | 29% | 0.29 | C | S | . | . | H | α-helix | trans | -68.5 | -49.1 | -178.3 | -53.8 | 0 | 0 | 0 | 0 | 110.6 | C73 D74 T78 L79 W80 | C73-C76 HydrophobicContact CB-CB 3.61Å; C73-C76 WeakPolarHBondContact CB-SG 3.37Å; C73-C76 WeakPolarHBondContact O-CA 3.49Å; C73-C76 VanDerWaalsContact O-CB 3.27Å; C73-C76 WeakPolarHBondContact O-CB 3.39Å; C73-C76 PolarHBondContact O-N 3.42Å; C73-C76 WeakPolarHBondContact SG-CB 3.18Å; C73-C76 PolarHBondContact SG-N 3.36Å; C73-C76 CovalentContact SG-SG 2.06Å; C73-C76 PolarHBondContact SG-SG 3.15Å; D74-C76 PolarHBondContact O-N 3.5Å; C76-T78 VanDerWaalsContact C-N 3.28Å; C76-T78 PolarHBondContact O-N 3.32Å; C76-L79 WeakPolarHBondContact O-CB 3.46Å; C76-L79 PolarHBondContact O-N 3.34Å; C76-L79 VanDerWaalsContact O-N 3.1Å; C76-W80 PolarHBondContact O-N 3.24Å; C76-W80 VanDerWaalsContact O-N 3.14Å |
| 77 | T | 65.1 | Low | 76.2 | Confident | 13 Ų | 13 | 58.3 Ų | 58.3 | 8% | 0.08 | 31% | 0.307 | C | S | . | . | H | α-helix | trans | -57.6 | -42.8 | 177.6 | 52.3 | 0 | 0 | 0 | 0 | 111.6 | C73 D74 L79 W80 H81 C171 | C73-T77 PolarHBondContact O-N 3.38Å; D74-T77 WeakPolarHBondContact CA-OG1 3.37Å; D74-T77 PolarHBondContact O-N 3.44Å; D74-T77 PolarHBondContact O-OG1 2.96Å; T77-L79 PolarHBondContact O-N 3.42Å; T77-W80 PolarHBondContact O-N 2.92Å; T77-W80 VanDerWaalsContact O-N 3.15Å; T77-H81 PolarHBondContact O-N 3.32Å; T77-H81 VanDerWaalsContact O-N 3.16Å; T77-C171 HydrophobicContact CG2-CB 4.17Å |
| 78 | T | 66.9 | Low | 75.9 | Confident | 53 Ų | 53 | 56.4 Ų | 56.4 | 33% | 0.325 | 30% | 0.296 | S | S | . | . | H | α-helix | trans | -62.2 | -39.9 | 175.9 | -50 | 0 | 0 | 0 | 0 | 111.9 | D74 C76 W80 G82 D83 | D74-T78 WeakPolarHBondContact O-CB 3.25Å; D74-T78 PolarHBondContact O-N 3.23Å; D74-T78 PolarHBondContact O-OG1 3.07Å; C76-T78 VanDerWaalsContact C-N 3.28Å; C76-T78 PolarHBondContact O-N 3.32Å; T78-W80 VanDerWaalsContact C-N 3.3Å; T78-W80 PolarHBondContact O-N 2.84Å; T78-G82 WeakPolarHBondContact O-CA 3.49Å; T78-G82 PolarHBondContact O-N 3.41Å; T78-D83 WeakPolarHBondContact CG2-OD1 3.06Å |
| 79 | L | 67.4 | Low | 75.5 | Confident | 142 Ų | 142 | 59 Ų | 59 | 74% | 0.743 | 31% | 0.31 | S | S | * | . | H | α-helix | trans | -64.1 | -33.1 | 175.1 | -97.8 | 90.4 | 0 | 0 | 0 | 113.2 | V75 C76 T77 | V75-L79 HydrophobicContact CG1-CD1 3.71Å; V75-L79 WeakPolarHBondContact O-CD1 3.42Å; V75-L79 PolarHBondContact O-N 3.21Å; C76-L79 WeakPolarHBondContact O-CB 3.46Å; C76-L79 PolarHBondContact O-N 3.34Å; C76-L79 VanDerWaalsContact O-N 3.1Å; T77-L79 PolarHBondContact O-N 3.42Å |
| 80 | W | 66.5 | Low | 75.4 | Confident | 188 Ų | 188 | 62.7 Ų | 62.7 | 71% | 0.712 | 33% | 0.329 | S | S | * | . | H | α-helix | trans | -78.1 | -34.9 | -177.6 | -69 | 109.3 | 0 | 0 | 0 | 112.8 | C76 T77 T78 | C76-W80 PolarHBondContact O-N 3.24Å; C76-W80 VanDerWaalsContact O-N 3.14Å; T77-W80 PolarHBondContact O-N 2.92Å; T77-W80 VanDerWaalsContact O-N 3.15Å; T78-W80 VanDerWaalsContact C-N 3.3Å; T78-W80 PolarHBondContact O-N 2.84Å |
| 81 | H | 68.5 | Low | 75.4 | Confident | 84 Ų | 84 | 62.4 Ų | 62.4 | 39% | 0.389 | 33% | 0.328 | S | S | . | . | H | α-helix | trans | -133 | 1.7 | -168.7 | -70.7 | -14.8 | 0 | 0 | 0 | 115.9 | T77 M86 V94 | T77-H81 PolarHBondContact O-N 3.32Å; T77-H81 VanDerWaalsContact O-N 3.16Å; H81-M86 HydrophobicContact CB-CE 3.18Å; H81-M86 VanDerWaalsContact CD2-CE 3.43Å; H81-M86 WeakPolarHBondContact CD2-CE 3.32Å; H81-V94 WeakPolarHBondContact CD2-CG1 3.33Å; H81-V94 VanDerWaalsContact CD2-CG2 3.45Å; H81-V94 WeakPolarHBondContact CD2-CG2 3.24Å; H81-V94 WeakPolarHBondContact NE2-CG1 3.37Å; H81-V94 WeakPolarHBondContact NE2-CG2 3.19Å |
| 82 | G | 66.5 | Low | 75.4 | Confident | 37 Ų | 37 | 59.5 Ų | 59.5 | 38% | 0.381 | 32% | 0.315 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 70.9 | -168 | -173.8 | 0 | 0 | 0 | 0 | 0 | 112.6 | T78 E84 | T78-G82 WeakPolarHBondContact O-CA 3.49Å; T78-G82 PolarHBondContact O-N 3.41Å; G82-E84 PolarHBondContact O-N 3.35Å |
| 83 | D | 70.6 | Confident | 75.6 | Confident | 143 Ų | 143 | 63.3 Ų | 63.3 | 77% | 0.765 | 34% | 0.339 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -85.6 | 14.8 | -177.5 | -59 | -45.2 | 0 | 0 | 0 | 113 | T78 | T78-D83 WeakPolarHBondContact CG2-OD1 3.06Š|
| 84 | E | 75.9 | Confident | 75.8 | Confident | 150 Ų | 150 | 64.8 Ų | 64.8 | 70% | 0.701 | 35% | 0.348 | S | S | * | . | trans | -75.7 | 128.9 | -178.5 | -69 | -169.2 | 174.2 | 0 | 0 | 111 | G82 | G82-E84 PolarHBondContact O-N 3.35Š| ||
| 85 | P | 78.2 | Confident | 76.3 | Confident | 70 Ų | 70 | 63.5 Ų | 63.5 | 46% | 0.455 | 34% | 0.341 | S | S | . | . | trans | -70.9 | 143.5 | -178.5 | 31.7 | -36.8 | 0 | 0 | 0 | 111.1 | L167 T169 | P85-L167 HydrophobicContact CB-CB 4.05Å; P85-L167 HydrophobicContact CB-CD2 4.11Å; P85-L167 HydrophobicContact CG-CD2 4.31Å; P85-L167 WeakPolarHBondContact O-CD2 3.31Å; P85-T169 HydrophobicContact CB-CG2 4.3Å | ||
| 86 | M | 80.1 | Confident | 77.2 | Confident | 21 Ų | 21 | 62.7 Ų | 62.7 | 10% | 0.103 | 34% | 0.337 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -121.8 | 154.1 | -173 | -66.5 | -179.8 | -143 | 0 | 0 | 112.8 | H81 L90 L167 T168 | H81-M86 HydrophobicContact CB-CE 3.18Å; H81-M86 VanDerWaalsContact CD2-CE 3.43Å; H81-M86 WeakPolarHBondContact CD2-CE 3.32Å; M86-L90 HydrophobicContact CB-CB 4.43Å; M86-L90 HydrophobicContact CB-CD2 4.19Å; M86-L90 HydrophobicContact CG-CD2 3.92Å; M86-L90 HydrophobicContact CG-CG 4.49Å; M86-L90 HydrophobicContact SD-CD2 4.06Å; M86-L90 HydrophobicContact SD-CG 4.17Å; M86-L167 CarbonylContact O-C 3.59Å; M86-L167 WeakPolarHBondContact O-CA 3.31Å; M86-T168 PolarHBondContact N-O 2.89Å; M86-T168 PolarHBondContact O-N 2.86Å |
| 87 | T | 84.7 | Confident | 78.2 | Confident | 59 Ų | 59 | 61.4 Ų | 61.4 | 36% | 0.362 | 33% | 0.328 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -68.1 | 150.1 | 167.2 | 62.5 | 0 | 0 | 0 | 0 | 110.1 | L89 L90 C91 | T87-L89 PolarHBondContact O-N 3Å; T87-L90 PolarHBondContact O-N 3.36Å; T87-L90 WeakPolarHBondContact OG1-CB 3.5Å; T87-L90 PolarHBondContact OG1-N 3.17Å; T87-C91 PolarHBondContact O-N 3.21Å |
| 88 | K | 85.3 | Confident | 79.3 | Confident | 12 Ų | 12 | 61 Ų | 61 | 5% | 0.052 | 33% | 0.327 | C | S | . | . | H | α-helix | trans | -53.2 | -39.3 | 177.9 | -67.3 | -173.1 | 177 | -162.4 | 0 | 113.1 | C91 M92 V158 D163 V176 | K88-C91 WeakPolarHBondContact O-CB 3.21Å; K88-C91 PolarHBondContact O-N 2.89Å; K88-M92 PolarHBondContact O-N 3.27Å; K88-M92 VanDerWaalsContact O-N 3.13Å; K88-V158 HydrophobicContact CB-CG1 3.9Å; K88-D163 WeakPolarHBondContact CE-O 3.38Å; K88-D163 IonicContact NZ-OD1 2.69Å; K88-D163 PolarHBondContact NZ-OD1 3.41Å; K88-D163 IonicContact NZ-OD2 3.65Å; K88-D163 PolarHBondContact NZ-OD2 3.17Å; K88-V176 HydrophobicContact CB-CG1 3.97Å; K88-V176 WeakPolarHBondContact O-CG1 3.37Å |
| 89 | L | 85.3 | Confident | 80.5 | Confident | 55 Ų | 55 | 59.1 Ų | 59.1 | 29% | 0.288 | 32% | 0.315 | S | S | . | . | H | α-helix | trans | -64.2 | -43.8 | 177.7 | -162.3 | 72.6 | 0 | 0 | 0 | 112.2 | T87 C91 M92 V93 W155 V159 F164 | T87-L89 PolarHBondContact O-N 3Å; L89-C91 VanDerWaalsContact C-N 3.32Å; L89-M92 PolarHBondContact O-N 2.96Å; L89-V93 PolarHBondContact O-N 3.12Å; L89-W155 HydrophobicContact CD1-CE3 3.44Å; L89-W155 VanDerWaalsContact CD1-CE3 3.44Å; L89-W155 HydrophobicContact CD1-CH2 4.4Å; L89-W155 HydrophobicContact CD1-CZ3 3.3Å; L89-W155 HydrophobicContact CG-CE3 4.49Å; L89-W155 HydrophobicContact CG-CZ3 3.88Å; L89-V159 HydrophobicContact CD1-CG2 4.04Å; L89-F164 HydrophobicContact CB-CE2 3.89Å; L89-F164 HydrophobicContact CB-CZ 4.07Å; L89-F164 HydrophobicContact CD1-CE2 4.37Å; L89-F164 HydrophobicContact CD2-CZ 4.4Å |
| 90 | L | 86.5 | Confident | 81.7 | Confident | 80 Ų | 80 | 52.9 Ų | 52.9 | 42% | 0.419 | 29% | 0.285 | S | S | . | . | H | α-helix | trans | -64.3 | -42.2 | 178.1 | -175.6 | 61.8 | 0 | 0 | 0 | 110 | M86 T87 M92 V93 V94 | M86-L90 HydrophobicContact CB-CB 4.43Å; M86-L90 HydrophobicContact CB-CD2 4.19Å; M86-L90 HydrophobicContact CG-CD2 3.92Å; M86-L90 HydrophobicContact CG-CG 4.49Å; M86-L90 HydrophobicContact SD-CD2 4.06Å; M86-L90 HydrophobicContact SD-CG 4.17Å; T87-L90 PolarHBondContact O-N 3.36Å; T87-L90 WeakPolarHBondContact OG1-CB 3.5Å; T87-L90 PolarHBondContact OG1-N 3.17Å; L90-M92 VanDerWaalsContact C-N 3.28Å; L90-M92 PolarHBondContact O-N 2.94Å; L90-V93 WeakPolarHBondContact O-CB 3.34Å; L90-V93 PolarHBondContact O-N 2.85Å; L90-V94 HydrophobicContact CD1-CG2 4.06Å; L90-V94 HydrophobicContact CG-CG2 4.13Å; L90-V94 WeakPolarHBondContact O-CB 3.34Å; L90-V94 WeakPolarHBondContact O-CG2 3.44Å; L90-V94 PolarHBondContact O-N 3.48Å |
| 91 | C | 85.7 | Confident | 83 | Confident | 1 Ų | 1 | 44.5 Ų | 44.5 | 1% | 0.007 | 25% | 0.253 | C | S | . | . | H | α-helix | trans | -54.5 | -41.6 | 173 | -89.4 | 0 | 0 | 0 | 0 | 113 | T87 K88 L89 V93 V94 S95 T168 C171 V176 | T87-C91 PolarHBondContact O-N 3.21Å; K88-C91 WeakPolarHBondContact O-CB 3.21Å; K88-C91 PolarHBondContact O-N 2.89Å; L89-C91 VanDerWaalsContact C-N 3.32Å; C91-V93 VanDerWaalsContact C-N 3.31Å; C91-V93 PolarHBondContact O-N 2.95Å; C91-V94 PolarHBondContact O-N 3.31Å; C91-S95 CarbonylContact O-C 3.58Å; C91-S95 WeakPolarHBondContact O-CA 3.31Å; C91-S95 PolarHBondContact O-N 2.99Å; C91-T168 VanDerWaalsContact SG-CG2 3.51Å; C91-C171 WeakPolarHBondContact CA-SG 3.14Å; C91-C171 HydrophobicContact CB-CB 3.54Å; C91-C171 WeakPolarHBondContact CB-SG 3.5Å; C91-C171 VanDerWaalsContact SG-CA 3.52Å; C91-C171 WeakPolarHBondContact SG-CB 3.49Å; C91-C171 CovalentContact SG-SG 2.05Å; C91-C171 PolarHBondContact SG-SG 3.06Å; C91-V176 HydrophobicContact CB-CG1 4.41Å; C91-V176 HydrophobicContact CB-CG2 3.71Å |
| 92 | M | 85.9 | Confident | 84.1 | Confident | 6 Ų | 6 | 40.5 Ų | 40.5 | 3% | 0.03 | 23% | 0.234 | C | C | . | . | H | α-helix | trans | -66.8 | -28.2 | 176.8 | -70.6 | -160.2 | 145.4 | 0 | 0 | 114.3 | K88 L89 L90 P96 C154 W155 V158 V176 | K88-M92 PolarHBondContact O-N 3.27Å; K88-M92 VanDerWaalsContact O-N 3.13Å; L89-M92 PolarHBondContact O-N 2.96Å; L90-M92 VanDerWaalsContact C-N 3.28Å; L90-M92 PolarHBondContact O-N 2.94Å; M92-P96 WeakPolarHBondContact O-CA 3.34Å; M92-C154 WeakPolarHBondContact CE-SG 3.12Å; M92-W155 HydrophobicContact CB-CH2 4.12Å; M92-W155 HydrophobicContact CB-CZ2 3.97Å; M92-W155 HydrophobicContact SD-CD2 4.43Å; M92-V158 HydrophobicContact CE-CG2 3.51Å; M92-V158 HydrophobicContact SD-CB 4.4Å; M92-V158 HydrophobicContact SD-CG2 3.82Å; M92-V176 HydrophobicContact CE-CG1 3.97Å; M92-V176 HydrophobicContact CG-CG1 3.45Å; M92-V176 VanDerWaalsContact CG-CG1 3.45Å; M92-V176 HydrophobicContact SD-CG1 4.31Å |
| 93 | V | 85.6 | Confident | 85.5 | Confident | 93 Ų | 93 | 40.3 Ų | 40.3 | 56% | 0.564 | 22% | 0.224 | S | C | * | . | H | α-helix | trans | -76 | -44.4 | 176.3 | 176.5 | 0 | 0 | 0 | 0 | 110.3 | L89 L90 C91 W155 | L89-V93 PolarHBondContact O-N 3.12Å; L90-V93 WeakPolarHBondContact O-CB 3.34Å; L90-V93 PolarHBondContact O-N 2.85Å; C91-V93 VanDerWaalsContact C-N 3.31Å; C91-V93 PolarHBondContact O-N 2.95Å; V93-W155 HydrophobicContact CG2-CH2 3.68Å; V93-W155 HydrophobicContact CG2-CZ3 4.44Å |
| 94 | V | 81.2 | Confident | 86.7 | Confident | 34 Ų | 34 | 33.5 Ų | 33.5 | 21% | 0.206 | 19% | 0.188 | C | C | . | . | H | α-helix | trans | -74.4 | -51 | -173.7 | 167.7 | 0 | 0 | 0 | 0 | 111.5 | H81 L90 C91 P96 | H81-V94 WeakPolarHBondContact CD2-CG1 3.33Å; H81-V94 VanDerWaalsContact CD2-CG2 3.45Å; H81-V94 WeakPolarHBondContact CD2-CG2 3.24Å; H81-V94 WeakPolarHBondContact NE2-CG1 3.37Å; H81-V94 WeakPolarHBondContact NE2-CG2 3.19Å; L90-V94 HydrophobicContact CD1-CG2 4.06Å; L90-V94 HydrophobicContact CG-CG2 4.13Å; L90-V94 WeakPolarHBondContact O-CB 3.34Å; L90-V94 WeakPolarHBondContact O-CG2 3.44Å; L90-V94 PolarHBondContact O-N 3.48Å; C91-V94 PolarHBondContact O-N 3.31Å; V94-P96 WeakPolarHBondContact O-CD 3.42Å |
| 95 | S | 82.6 | Confident | 87.5 | Confident | 4 Ų | 4 | 26.3 Ų | 26.3 | 3% | 0.028 | 15% | 0.154 | C | C | . | . | S | Bend | trans | -105.5 | 89 | 173 | -174.6 | 0 | 0 | 0 | 0 | 107.5 | F71 C91 A97 | F71-S95 PolarHBondContact O-OG 3.17Å; C91-S95 CarbonylContact O-C 3.58Å; C91-S95 WeakPolarHBondContact O-CA 3.31Å; C91-S95 PolarHBondContact O-N 2.99Å; S95-A97 PolarHBondContact O-N 3.47Å |
| 96 | P | 85.8 | Confident | 88.3 | Confident | 43 Ų | 43 | 23.2 Ų | 23.2 | 28% | 0.279 | 13% | 0.134 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -73.3 | 21.1 | -179.4 | 33.7 | -38.4 | 0 | 0 | 0 | 112.3 | F71 M92 V94 G98 P99 A100 | F71-P96 HydrophobicContact CD2-CG 4.1Å; F71-P96 HydrophobicContact CE2-CG 4.05Å; F71-P96 HydrophobicContact CG-CG 4.45Å; F71-P96 HydrophobicContact CZ-CG 4.36Å; M92-P96 WeakPolarHBondContact O-CA 3.34Å; V94-P96 WeakPolarHBondContact O-CD 3.42Å; P96-G98 PolarHBondContact O-N 3.47Å; P96-P99 WeakPolarHBondContact O-CD 3.48Å; P96-A100 WeakPolarHBondContact O-CB 3.39Å; P96-A100 PolarHBondContact O-N 3.45Å |
| 97 | A | 87.2 | Confident | 89 | Confident | 1 Ų | 1 | 22.2 Ų | 22.2 | 1% | 0.008 | 13% | 0.129 | C | C | . | . | H | α-helix | trans | -54 | -50.8 | 178.9 | 0 | 0 | 0 | 0 | 0 | 111.3 | A68 F71 E72 S95 A100 Y101 | A68-A97 WeakPolarHBondContact CB-O 3.4Å; F71-A97 HydrophobicContact CB-CB 4.06Å; E72-A97 HydrophobicContact CG-CB 3.86Å; S95-A97 PolarHBondContact O-N 3.47Å; A97-A100 PolarHBondContact O-N 2.97Å; A97-Y101 HydrophobicContact CB-CE2 4.18Å; A97-Y101 WeakPolarHBondContact O-CD2 3.46Å; A97-Y101 PolarHBondContact O-N 2.83Å |
| 98 | G | 88.8 | Confident | 89.4 | Confident | 4 Ų | 4 | 19.4 Ų | 19.4 | 4% | 0.041 | 11% | 0.112 | C | C | . | . | H | α-helix | trans | -55 | -61.5 | 177.5 | 0 | 0 | 0 | 0 | 0 | 113.3 | P96 A100 Y101 M102 | P96-G98 PolarHBondContact O-N 3.47Å; G98-A100 VanDerWaalsContact C-N 3.26Å; G98-A100 PolarHBondContact O-N 3.39Å; G98-Y101 WeakPolarHBondContact O-CB 3.32Å; G98-Y101 PolarHBondContact O-N 2.89Å; G98-Y101 VanDerWaalsContact O-N 3.12Å; G98-M102 WeakPolarHBondContact O-CG 3.14Å; G98-M102 PolarHBondContact O-N 3.37Å; G98-M102 VanDerWaalsContact O-N 3.08Å |
| 99 | P | 92.1 | Very high | 89.8 | Confident | 14 Ų | 14 | 18.9 Ų | 18.9 | 9% | 0.091 | 11% | 0.109 | C | C | . | . | H | α-helix | trans | -53.5 | -40.5 | 175.1 | -29.3 | 36.4 | 0 | 0 | 0 | 113.6 | P96 M102 I103 W155 | P96-P99 WeakPolarHBondContact O-CD 3.48Å; P99-M102 PolarHBondContact O-N 3.38Å; P99-I103 VanDerWaalsContact O-CG1 3.32Å; P99-I103 WeakPolarHBondContact O-CG1 3.13Å; P99-I103 PolarHBondContact O-N 2.93Å; P99-W155 HydrophobicContact CG-CZ2 4.34Å |
| 100 | A | 93.3 | Very high | 90.2 | Very high | 12 Ų | 12 | 16.8 Ų | 16.8 | 10% | 0.099 | 10% | 0.1 | C | C | . | . | H | α-helix | trans | -66 | -39 | 178 | 0 | 0 | 0 | 0 | 0 | 112.1 | V64 A68 P96 A97 G98 I103 G104 | V64-A100 HydrophobicContact CG1-CB 3.94Å; V64-A100 VanDerWaalsContact CG1-O 3.31Å; V64-A100 WeakPolarHBondContact CG1-O 3.09Å; A68-A100 HydrophobicContact CB-CB 3.61Å; P96-A100 WeakPolarHBondContact O-CB 3.39Å; P96-A100 PolarHBondContact O-N 3.45Å; A97-A100 PolarHBondContact O-N 2.97Å; G98-A100 VanDerWaalsContact C-N 3.26Å; G98-A100 PolarHBondContact O-N 3.39Å; A100-I103 PolarHBondContact O-N 3.46Å; A100-G104 WeakPolarHBondContact O-CA 3.32Å; A100-G104 PolarHBondContact O-N 2.72Å |
| 101 | Y | 92.2 | Very high | 90.5 | Very high | 11 Ų | 11 | 13 Ų | 13 | 4% | 0.043 | 8% | 0.08 | C | C | . | . | H | α-helix | trans | -61.2 | -46.8 | 171.9 | -74.4 | -54.1 | 0 | 0 | 0 | 112 | V65 A68 F69 E72 A97 G98 I103 Q105 F173 Y185 | V65-Y101 HydrophobicContact CG1-CD1 4.37Å; V65-Y101 HydrophobicContact CG1-CE1 4.38Å; A68-Y101 HydrophobicContact CB-CD1 3.51Å; A68-Y101 HydrophobicContact CB-CD2 3.99Å; A68-Y101 HydrophobicContact CB-CE1 3.45Å; A68-Y101 VanDerWaalsContact CB-CE1 3.45Å; A68-Y101 HydrophobicContact CB-CE2 3.93Å; A68-Y101 HydrophobicContact CB-CG 3.77Å; F69-Y101 WeakPolarHBondContact CA-OH 3.4Å; F69-Y101 WeakPolarHBondContact CD1-OH 3.48Å; F69-Y101 AromaticContact CD2-CE1 3.72Å; F69-Y101 HydrophobicContact CD2-CE1 3.72Å; F69-Y101 AromaticContact CE2-CE1 3.67Å; F69-Y101 HydrophobicContact CE2-CE1 3.67Å; F69-Y101 HydrophobicContact CG-CE1 4.25Å; F69-Y101 WeakPolarHBondContact CG-OH 3.35Å; F69-Y101 HydrophobicContact CZ-CE1 4.19Å; F69-Y101 PolarHBondContact N-OH 3.34Å; E72-Y101 HydrophobicContact CG-CE2 3.79Å; E72-Y101 VanDerWaalsContact CG-OH 3.24Å; E72-Y101 WeakPolarHBondContact CG-OH 3.11Å; E72-Y101 WeakPolarHBondContact OE1-CE2 3.4Å; A97-Y101 HydrophobicContact CB-CE2 4.18Å; A97-Y101 WeakPolarHBondContact O-CD2 3.46Å; A97-Y101 PolarHBondContact O-N 2.83Å; G98-Y101 WeakPolarHBondContact O-CB 3.32Å; G98-Y101 PolarHBondContact O-N 2.89Å; G98-Y101 VanDerWaalsContact O-N 3.12Å; Y101-I103 PolarHBondContact O-N 3.24Å; Y101-Q105 VanDerWaalsContact O-CB 3.24Å; Y101-Q105 WeakPolarHBondContact O-CB 3.41Å; Y101-Q105 WeakPolarHBondContact O-CG 3.43Å; Y101-Q105 PolarHBondContact O-N 2.99Å; Y101-F173 HydrophobicContact CD2-CB 4.45Å; Y101-Y185 PolarHBondContact O-OH 3.43Å |
| 102 | M | 93.6 | Very high | 90.7 | Very high | 0 Ų | 0 | 13 Ų | 13 | 0% | 0 | 8% | 0.079 | C | C | . | . | H | α-helix | trans | -57.9 | -49.9 | 179.2 | -61.5 | -60.4 | 138 | 0 | 0 | 110.9 | G98 P99 M106 M150 C151 C154 F173 F181 Y185 | G98-M102 WeakPolarHBondContact O-CG 3.14Å; G98-M102 PolarHBondContact O-N 3.37Å; G98-M102 VanDerWaalsContact O-N 3.08Å; P99-M102 PolarHBondContact O-N 3.38Å; M102-M106 VanDerWaalsContact O-CB 3.23Å; M102-M106 WeakPolarHBondContact O-CB 3.4Å; M102-M106 WeakPolarHBondContact O-CG 3.33Å; M102-M106 PolarHBondContact O-N 3.35Å; M102-M150 HydrophobicContact CB-CB 4.49Å; M102-C151 HydrophobicContact CB-CB 4.24Å; M102-C154 HydrophobicContact CG-CB 4.24Å; M102-F173 HydrophobicContact CE-CE1 3.99Å; M102-F173 HydrophobicContact CE-CE2 3.69Å; M102-F173 HydrophobicContact CE-CZ 3.22Å; M102-F181 HydrophobicContact CE-CE1 3.81Å; M102-F181 HydrophobicContact CE-CZ 4.44Å; M102-F181 HydrophobicContact SD-CE1 4.06Å; M102-F181 HydrophobicContact SD-CZ 4.09Å; M102-Y185 HydrophobicContact CE-CD1 3.72Å; M102-Y185 HydrophobicContact CE-CD2 3.7Å; M102-Y185 HydrophobicContact CE-CE1 3.61Å; M102-Y185 HydrophobicContact CE-CE2 3.61Å; M102-Y185 HydrophobicContact CE-CG 3.73Å; M102-Y185 HydrophobicContact SD-CD1 4.49Å; M102-Y185 HydrophobicContact SD-CD2 3.36Å; M102-Y185 WeakPolarHBondContact SD-CD2 3.18Å; M102-Y185 HydrophobicContact SD-CE1 4.36Å; M102-Y185 HydrophobicContact SD-CE2 3.2Å; M102-Y185 WeakPolarHBondContact SD-CE2 3.39Å; M102-Y185 HydrophobicContact SD-CG 4.02Å |
| 103 | I | 95.2 | Very high | 91 | Very high | 33 Ų | 33 | 14.4 Ų | 14.4 | 17% | 0.169 | 9% | 0.087 | C | C | . | . | H | α-helix | trans | -68.2 | -52.9 | -178.2 | -65.6 | 167.5 | 0 | 0 | 0 | 110.5 | V64 P99 A100 Y101 M106 L107 M148 C151 | V64-I103 HydrophobicContact CG1-CB 4.43Å; V64-I103 HydrophobicContact CG1-CG2 4.38Å; P99-I103 VanDerWaalsContact O-CG1 3.32Å; P99-I103 WeakPolarHBondContact O-CG1 3.13Å; P99-I103 PolarHBondContact O-N 2.93Å; A100-I103 PolarHBondContact O-N 3.46Å; Y101-I103 PolarHBondContact O-N 3.24Å; I103-M106 PolarHBondContact O-N 2.9Å; I103-L107 HydrophobicContact CG2-CD1 3.82Å; I103-L107 HydrophobicContact CG2-CG 4.41Å; I103-L107 WeakPolarHBondContact O-CB 3.43Å; I103-L107 WeakPolarHBondContact O-CG 3.47Å; I103-L107 PolarHBondContact O-N 3.48Å; I103-M148 HydrophobicContact CD1-CE 4.14Å; I103-M148 HydrophobicContact CG1-CE 4.42Å; I103-C151 HydrophobicContact CG1-CB 4.29Å |
| 104 | G | 94.7 | Very high | 91.3 | Very high | 0 Ų | 0 | 11.8 Ų | 11.8 | 0% | 0 | 7% | 0.067 | C | C | . | . | H | α-helix | trans | -60.9 | -51.8 | -175.1 | 0 | 0 | 0 | 0 | 0 | 112.2 | G61 V65 A100 L107 T108 | G61-G104 WeakPolarHBondContact O-CA 3.29Å; V65-G104 VanDerWaalsContact CG2-C 3.45Å; A100-G104 WeakPolarHBondContact O-CA 3.32Å; A100-G104 PolarHBondContact O-N 2.72Å; G104-L107 PolarHBondContact O-N 2.69Å; G104-T108 WeakPolarHBondContact O-CG2 3.5Å; G104-T108 PolarHBondContact O-N 2.83Å; G104-T108 VanDerWaalsContact O-N 3.07Å |
| 105 | Q | 93.1 | Very high | 91.6 | Very high | 0 Ų | 0 | 10.3 Ų | 10.3 | 0% | 0 | 6% | 0.058 | C | C | . | . | H | α-helix | trans | -64.8 | -44.3 | -178.9 | -65.3 | -162.4 | 43.9 | 0 | 0 | 111.3 | V65 Y101 L107 T108 Y109 Y185 L189 | V65-Q105 HydrophobicContact CG2-CG 3.79Å; Y101-Q105 VanDerWaalsContact O-CB 3.24Å; Y101-Q105 WeakPolarHBondContact O-CB 3.41Å; Y101-Q105 WeakPolarHBondContact O-CG 3.43Å; Y101-Q105 PolarHBondContact O-N 2.99Å; Q105-L107 VanDerWaalsContact C-N 3.34Å; Q105-L107 PolarHBondContact O-N 3.17Å; Q105-T108 WeakPolarHBondContact CA-OG1 3.31Å; Q105-T108 PolarHBondContact O-N 3.24Å; Q105-T108 VanDerWaalsContact O-N 3.08Å; Q105-T108 PolarHBondContact O-OG1 3Å; Q105-Y109 HydrophobicContact CB-CD2 4.36Å; Q105-Y109 HydrophobicContact CB-CE2 4.44Å; Q105-Y109 VanDerWaalsContact O-CD2 3.27Å; Q105-Y109 WeakPolarHBondContact O-CD2 3.38Å; Q105-Y109 PolarHBondContact O-N 3.07Å; Q105-Y185 PolarHBondContact NE2-OH 3.47Å; Q105-L189 HydrophobicContact CB-CD2 4.1Å |
| 106 | M | 94.5 | Very high | 91.8 | Very high | 5 Ų | 5 | 10.1 Ų | 10.1 | 3% | 0.025 | 6% | 0.057 | C | C | . | . | H | α-helix | trans | -59.5 | -44.2 | 177.4 | -73.6 | -61.4 | 125 | 0 | 0 | 112.2 | M102 I103 T108 Y109 C110 A147 M150 Y185 V188 L189 L192 | M102-M106 VanDerWaalsContact O-CB 3.23Å; M102-M106 WeakPolarHBondContact O-CB 3.4Å; M102-M106 WeakPolarHBondContact O-CG 3.33Å; M102-M106 PolarHBondContact O-N 3.35Å; I103-M106 PolarHBondContact O-N 2.9Å; M106-T108 VanDerWaalsContact C-N 3.28Å; M106-T108 PolarHBondContact O-N 3.23Å; M106-Y109 PolarHBondContact O-N 3.36Å; M106-C110 VanDerWaalsContact O-CB 3.3Å; M106-C110 WeakPolarHBondContact O-CB 3.31Å; M106-C110 PolarHBondContact O-N 3.49Å; M106-C110 PolarHBondContact O-SG 3.36Å; M106-A147 HydrophobicContact CB-CB 3.84Å; M106-M150 HydrophobicContact CE-CG 4.26Å; M106-M150 HydrophobicContact CG-CB 4.08Å; M106-M150 HydrophobicContact CG-CG 3.84Å; M106-M150 HydrophobicContact SD-CG 3.84Å; M106-Y185 HydrophobicContact CE-CE2 4.12Å; M106-V188 HydrophobicContact CE-CG1 4.13Å; M106-L189 HydrophobicContact CE-CD2 3.34Å; M106-L189 HydrophobicContact CE-CG 4.36Å; M106-L192 HydrophobicContact CE-CD1 3.95Å; M106-L192 HydrophobicContact SD-CD1 4Å |
| 107 | L | 95.4 | Very high | 91.9 | Very high | 0 Ų | 0 | 9.6 Ų | 9.6 | 0% | 0 | 6% | 0.056 | C | C | . | . | H | α-helix | trans | -59 | -40.3 | 175.5 | -70.4 | 175.1 | 0 | 0 | 0 | 112 | V57 F60 I103 G104 Q105 S111 F143 F144 A147 | V57-L107 HydrophobicContact CG1-CB 4.49Å; V57-L107 HydrophobicContact CG1-CD2 4.02Å; F60-L107 HydrophobicContact CD1-CD1 3.81Å; F60-L107 HydrophobicContact CE1-CD1 4.01Å; I103-L107 HydrophobicContact CG2-CD1 3.82Å; I103-L107 HydrophobicContact CG2-CG 4.41Å; I103-L107 WeakPolarHBondContact O-CB 3.43Å; I103-L107 WeakPolarHBondContact O-CG 3.47Å; I103-L107 PolarHBondContact O-N 3.48Å; G104-L107 PolarHBondContact O-N 2.69Å; Q105-L107 VanDerWaalsContact C-N 3.34Å; Q105-L107 PolarHBondContact O-N 3.17Å; L107-S111 VanDerWaalsContact O-CB 3.26Å; L107-S111 WeakPolarHBondContact O-CB 3.46Å; L107-S111 PolarHBondContact O-N 3.37Å; L107-S111 VanDerWaalsContact O-N 3.09Å; L107-S111 PolarHBondContact O-OG 3.17Å; L107-F143 HydrophobicContact CD2-CB 3.74Å; L107-F144 HydrophobicContact CD1-CE1 4.35Å; L107-F144 HydrophobicContact CD2-CD1 4.31Å; L107-F144 HydrophobicContact CD2-CE1 4.31Å; L107-F144 HydrophobicContact CD2-CG 4.45Å; L107-F144 HydrophobicContact CD2-CZ 4.44Å; L107-A147 HydrophobicContact CG-CB 4.43Å |
| 108 | T | 93.6 | Very high | 91.7 | Very high | 0 Ų | 0 | 11.8 Ų | 11.8 | 0% | 0 | 7% | 0.067 | C | C | . | . | H | α-helix | trans | -67.1 | -47.8 | 176.6 | 62.7 | 0 | 0 | 0 | 0 | 112.7 | Y58 C62 G104 Q105 M106 S111 M112 | Y58-T108 HydrophobicContact CD2-CG2 4.42Å; Y58-T108 HydrophobicContact CE2-CG2 4.35Å; C62-T108 HydrophobicContact CB-CG2 4.47Å; C62-T108 VanDerWaalsContact SG-CG2 3.52Å; G104-T108 WeakPolarHBondContact O-CG2 3.5Å; G104-T108 PolarHBondContact O-N 2.83Å; G104-T108 VanDerWaalsContact O-N 3.07Å; Q105-T108 WeakPolarHBondContact CA-OG1 3.31Å; Q105-T108 PolarHBondContact O-N 3.24Å; Q105-T108 VanDerWaalsContact O-N 3.08Å; Q105-T108 PolarHBondContact O-OG1 3Å; M106-T108 VanDerWaalsContact C-N 3.28Å; M106-T108 PolarHBondContact O-N 3.23Å; T108-S111 WeakPolarHBondContact O-CB 3.19Å; T108-S111 PolarHBondContact O-N 3.11Å; T108-M112 WeakPolarHBondContact O-CG 3.42Å; T108-M112 PolarHBondContact O-N 3.44Å |
| 109 | Y | 92.7 | Very high | 91.4 | Very high | 0 Ų | 0 | 12 Ų | 12 | 0% | 0 | 7% | 0.067 | C | C | . | . | H | α-helix | trans | -64.5 | -47.7 | -179.9 | -82 | -72 | 0 | 0 | 0 | 112.2 | Q105 M106 S111 M112 I113 L189 L192 S193 S247 | Q105-Y109 HydrophobicContact CB-CD2 4.36Å; Q105-Y109 HydrophobicContact CB-CE2 4.44Å; Q105-Y109 VanDerWaalsContact O-CD2 3.27Å; Q105-Y109 WeakPolarHBondContact O-CD2 3.38Å; Q105-Y109 PolarHBondContact O-N 3.07Å; M106-Y109 PolarHBondContact O-N 3.36Å; Y109-S111 PolarHBondContact O-N 2.89Å; Y109-M112 HydrophobicContact CD1-CE 3.4Å; Y109-M112 VanDerWaalsContact CD1-CE 3.4Å; Y109-M112 HydrophobicContact CE1-CE 3.66Å; Y109-M112 HydrophobicContact CG-CE 3.97Å; Y109-M112 PolarHBondContact O-N 3.45Å; Y109-M112 VanDerWaalsContact O-N 3.15Å; Y109-I113 WeakPolarHBondContact O-CG1 3.46Å; Y109-I113 PolarHBondContact O-N 2.59Å; Y109-L189 HydrophobicContact CD2-CD2 3.66Å; Y109-L189 HydrophobicContact CE2-CB 4.28Å; Y109-L189 HydrophobicContact CE2-CD2 3.49Å; Y109-L189 VanDerWaalsContact CE2-CD2 3.49Å; Y109-L189 HydrophobicContact CE2-CG 4.37Å; Y109-L192 HydrophobicContact CD1-CB 3.74Å; Y109-L192 HydrophobicContact CE1-CB 4.39Å; Y109-L192 HydrophobicContact CG-CB 4.03Å; Y109-L192 HydrophobicContact CG-CD1 4.24Å; Y109-S193 WeakPolarHBondContact CE1-OG 3.21Å; Y109-S193 PolarHBondContact OH-OG 2.68Å; Y109-S247 PolarHBondContact OH-OG 3.48Å |
| 110 | C | 94 | Very high | 91 | Very high | 12 Ų | 12 | 12.3 Ų | 12.3 | 8% | 0.081 | 7% | 0.069 | C | C | . | . | H | α-helix | trans | -55.5 | -44 | 173.4 | -70.1 | 0 | 0 | 0 | 0 | 110.6 | M106 M112 I113 Y114 Y142 F143 | M106-C110 VanDerWaalsContact O-CB 3.3Å; M106-C110 WeakPolarHBondContact O-CB 3.31Å; M106-C110 PolarHBondContact O-N 3.49Å; M106-C110 PolarHBondContact O-SG 3.36Å; C110-M112 PolarHBondContact O-N 2.83Å; C110-I113 PolarHBondContact O-N 3.43Å; C110-Y114 WeakPolarHBondContact O-CB 3.38Å; C110-Y114 PolarHBondContact O-N 2.96Å; C110-Y142 HydrophobicContact CB-CD1 4.31Å; C110-Y142 HydrophobicContact CB-CE1 3.92Å; C110-Y142 WeakPolarHBondContact O-CE1 3.48Å; C110-F143 HydrophobicContact CB-CD1 3.94Å; C110-F143 HydrophobicContact CB-CE1 4.46Å |
| 111 | S | 93 | Very high | 90.5 | Very high | 0 Ų | 0 | 14.8 Ų | 14.8 | 0% | 0 | 8% | 0.082 | C | C | . | . | H | α-helix | trans | -62.9 | -40.4 | 177.6 | -60 | 0 | 0 | 0 | 0 | 114 | Y58 L107 T108 Y109 Y114 M115 F143 | Y58-S111 PolarHBondContact N-OG 3.25Å; L107-S111 VanDerWaalsContact O-CB 3.26Å; L107-S111 WeakPolarHBondContact O-CB 3.46Å; L107-S111 PolarHBondContact O-N 3.37Å; L107-S111 VanDerWaalsContact O-N 3.09Å; L107-S111 PolarHBondContact O-OG 3.17Å; T108-S111 WeakPolarHBondContact O-CB 3.19Å; T108-S111 PolarHBondContact O-N 3.11Å; Y109-S111 PolarHBondContact O-N 2.89Å; S111-Y114 PolarHBondContact O-N 3.32Å; S111-M115 WeakPolarHBondContact O-CB 3.45Å; S111-M115 VanDerWaalsContact O-CE 3.32Å; S111-M115 WeakPolarHBondContact O-CE 3.44Å; S111-M115 VanDerWaalsContact O-CG 3.31Å; S111-M115 WeakPolarHBondContact O-CG 3.34Å; S111-M115 PolarHBondContact O-N 3.48Å; S111-F143 WeakPolarHBondContact OG-CE1 3.41Å |
| 112 | M | 91.1 | Very high | 89.6 | Confident | 0 Ų | 0 | 15.6 Ų | 15.6 | 0% | 0 | 9% | 0.094 | C | C | . | . | H | α-helix | trans | -64.2 | -46 | 175 | -70.8 | -170.3 | -76.4 | 0 | 0 | 111.9 | Y58 T108 Y109 C110 Y114 M115 S116 V196 S239 L243 | Y58-M112 HydrophobicContact CD2-CG 4.26Å; Y58-M112 HydrophobicContact CE2-CG 3.95Å; T108-M112 WeakPolarHBondContact O-CG 3.42Å; T108-M112 PolarHBondContact O-N 3.44Å; Y109-M112 HydrophobicContact CD1-CE 3.4Å; Y109-M112 VanDerWaalsContact CD1-CE 3.4Å; Y109-M112 HydrophobicContact CE1-CE 3.66Å; Y109-M112 HydrophobicContact CG-CE 3.97Å; Y109-M112 PolarHBondContact O-N 3.45Å; Y109-M112 VanDerWaalsContact O-N 3.15Å; C110-M112 PolarHBondContact O-N 2.83Å; M112-Y114 VanDerWaalsContact C-N 3.33Å; M112-Y114 PolarHBondContact O-N 3Å; M112-M115 PolarHBondContact O-N 3.03Å; M112-S116 WeakPolarHBondContact O-CB 3.41Å; M112-S116 PolarHBondContact O-N 2.87Å; M112-S116 PolarHBondContact O-OG 3.15Å; M112-V196 HydrophobicContact CB-CB 4.49Å; M112-V196 HydrophobicContact CB-CG1 3.95Å; M112-V196 HydrophobicContact CB-CG2 3.64Å; M112-V196 HydrophobicContact SD-CG1 4.24Å; M112-S239 WeakPolarHBondContact SD-CB 3.36Å; M112-S239 PolarHBondContact SD-OG 3Å; M112-L243 HydrophobicContact CE-CD1 4.44Å |
| 113 | I | 91.6 | Very high | 88.7 | Confident | 37 Ų | 37 | 16.3 Ų | 16.3 | 19% | 0.19 | 10% | 0.098 | C | C | . | . | H | α-helix | trans | -61 | -45.2 | 177.9 | -65.4 | 172.3 | 0 | 0 | 0 | 110.2 | Y109 C110 M115 S116 A117 Y142 L192 V196 | Y109-I113 WeakPolarHBondContact O-CG1 3.46Å; Y109-I113 PolarHBondContact O-N 2.59Å; C110-I113 PolarHBondContact O-N 3.43Å; I113-M115 PolarHBondContact O-N 3.39Å; I113-S116 PolarHBondContact O-N 3.46Å; I113-A117 WeakPolarHBondContact O-CB 3.37Å; I113-A117 PolarHBondContact O-N 2.88Å; I113-Y142 VanDerWaalsContact CG2-OH 3.29Å; I113-Y142 WeakPolarHBondContact CG2-OH 3.25Å; I113-L192 HydrophobicContact CD1-CB 4.41Å; I113-L192 HydrophobicContact CD1-CD2 3.51Å; I113-V196 HydrophobicContact CD1-CG2 4.43Å; I113-V196 HydrophobicContact CG1-CG2 3.45Å; I113-V196 VanDerWaalsContact CG1-CG2 3.45Å |
| 114 | Y | 90.8 | Very high | 87.6 | Confident | 37 Ų | 37 | 16.4 Ų | 16.4 | 15% | 0.145 | 10% | 0.102 | C | C | . | . | H | α-helix | trans | -63 | -43.5 | 178.7 | -165.2 | -98.6 | 0 | 0 | 0 | 112.2 | T54 C110 S111 M112 A117 I118 L134 Y142 F143 | T54-Y114 HydrophobicContact CG2-CD1 3.84Å; T54-Y114 HydrophobicContact CG2-CG 4.41Å; T54-Y114 WeakPolarHBondContact OG1-CD1 3.42Å; T54-Y114 WeakPolarHBondContact OG1-CE1 3.3Å; C110-Y114 WeakPolarHBondContact O-CB 3.38Å; C110-Y114 PolarHBondContact O-N 2.96Å; S111-Y114 PolarHBondContact O-N 3.32Å; M112-Y114 VanDerWaalsContact C-N 3.33Å; M112-Y114 PolarHBondContact O-N 3Å; Y114-A117 PolarHBondContact O-N 3.23Å; Y114-I118 HydrophobicContact CD1-CD1 3.44Å; Y114-I118 VanDerWaalsContact CD1-CD1 3.44Å; Y114-I118 HydrophobicContact CD1-CG1 4.12Å; Y114-I118 HydrophobicContact CE1-CD1 3.22Å; Y114-I118 HydrophobicContact CE1-CG1 3.87Å; Y114-I118 WeakPolarHBondContact O-CG1 3.25Å; Y114-I118 PolarHBondContact O-N 3.38Å; Y114-L134 HydrophobicContact CE1-CD1 3.72Å; Y114-L134 HydrophobicContact CE2-CD1 4.21Å; Y114-L134 WeakPolarHBondContact OH-CD1 3.34Å; Y114-Y142 HydrophobicContact CD2-CD1 4.06Å; Y114-Y142 AromaticContact CD2-CE1 3.79Å; Y114-Y142 HydrophobicContact CD2-CE1 3.79Å; Y114-Y142 HydrophobicContact CD2-CE2 4.34Å; Y114-Y142 HydrophobicContact CD2-CG 4.44Å; Y114-Y142 AromaticContact CD2-CZ 3.93Å; Y114-Y142 HydrophobicContact CG-CE1 4.09Å; Y114-Y142 PolarHBondContact N-OH 2.63Å; Y114-F143 HydrophobicContact CD1-CZ 4.21Å; Y114-F143 HydrophobicContact CD2-CZ 4.44Å; Y114-F143 AromaticContact CG-CZ 4Å; Y114-F143 HydrophobicContact CG-CZ 4Å |
| 115 | M | 88.1 | Confident | 86 | Confident | 3 Ų | 3 | 21.8 Ų | 21.8 | 2% | 0.015 | 14% | 0.139 | C | C | . | . | H | α-helix | trans | -61 | -44.2 | 174.6 | -77.5 | -174 | -93.1 | 0 | 0 | 111.4 | T54 Y58 S111 M112 I113 I118 M119 A232 T235 | T54-M115 HydrophobicContact CG2-CE 4.19Å; T54-M115 HydrophobicContact CG2-CG 3.76Å; Y58-M115 HydrophobicContact CD2-CE 4.06Å; Y58-M115 HydrophobicContact CG-CE 4.12Å; S111-M115 WeakPolarHBondContact O-CB 3.45Å; S111-M115 VanDerWaalsContact O-CE 3.32Å; S111-M115 WeakPolarHBondContact O-CE 3.44Å; S111-M115 VanDerWaalsContact O-CG 3.31Å; S111-M115 WeakPolarHBondContact O-CG 3.34Å; S111-M115 PolarHBondContact O-N 3.48Å; M112-M115 PolarHBondContact O-N 3.03Å; I113-M115 PolarHBondContact O-N 3.39Å; M115-I118 PolarHBondContact O-N 3.16Å; M115-M119 WeakPolarHBondContact O-CG 3.43Å; M115-M119 PolarHBondContact O-N 2.97Å; M115-M119 VanDerWaalsContact O-N 3.07Å; M115-A232 HydrophobicContact CB-CB 4.45Å; M115-T235 HydrophobicContact CE-CG2 3.94Å; M115-T235 HydrophobicContact SD-CG2 4.49Å |
| 116 | S | 88 | Confident | 84.4 | Confident | 0 Ų | 0 | 27.7 Ų | 27.7 | 0% | 0 | 17% | 0.17 | C | C | . | . | H | α-helix | trans | -62.2 | -42.3 | 174.9 | -65.7 | 0 | 0 | 0 | 0 | 112.6 | M112 I113 M119 V120 I236 | M112-S116 WeakPolarHBondContact O-CB 3.41Å; M112-S116 PolarHBondContact O-N 2.87Å; M112-S116 PolarHBondContact O-OG 3.15Å; I113-S116 PolarHBondContact O-N 3.46Å; S116-M119 WeakPolarHBondContact O-CB 3.39Å; S116-M119 PolarHBondContact O-N 3.11Å; S116-V120 WeakPolarHBondContact O-CG2 3.39Å; S116-V120 PolarHBondContact O-N 2.88Å; S116-I236 VanDerWaalsContact OG-CD1 3.29Å; S116-I236 WeakPolarHBondContact OG-CD1 3.5Å |
| 117 | A | 87.5 | Confident | 82.5 | Confident | 33 Ų | 33 | 37.4 Ų | 37.4 | 27% | 0.273 | 21% | 0.212 | S | C | . | . | H | α-helix | trans | -63.8 | -44 | 176.8 | 0 | 0 | 0 | 0 | 0 | 112.1 | I113 Y114 M119 V120 V121 | I113-A117 WeakPolarHBondContact O-CB 3.37Å; I113-A117 PolarHBondContact O-N 2.88Å; Y114-A117 PolarHBondContact O-N 3.23Å; A117-M119 PolarHBondContact O-N 3.38Å; A117-V120 PolarHBondContact O-N 3.37Å; A117-V121 WeakPolarHBondContact O-CG2 3.47Å; A117-V121 PolarHBondContact O-N 2.98Å |
| 118 | I | 83.6 | Confident | 80.5 | Confident | 46 Ų | 46 | 40.5 Ų | 40.5 | 24% | 0.236 | 24% | 0.238 | C | C | . | . | H | α-helix | trans | -57.6 | -42.1 | 174 | -69.8 | 164.3 | 0 | 0 | 0 | 110.6 | K50 V51 Y114 M115 G122 | K50-I118 HydrophobicContact CB-CD1 4.35Å; V51-I118 HydrophobicContact CG2-CD1 4.19Å; V51-I118 HydrophobicContact CG2-CG2 4.1Å; Y114-I118 HydrophobicContact CD1-CD1 3.44Å; Y114-I118 VanDerWaalsContact CD1-CD1 3.44Å; Y114-I118 HydrophobicContact CD1-CG1 4.12Å; Y114-I118 HydrophobicContact CE1-CD1 3.22Å; Y114-I118 HydrophobicContact CE1-CG1 3.87Å; Y114-I118 WeakPolarHBondContact O-CG1 3.25Å; Y114-I118 PolarHBondContact O-N 3.38Å; M115-I118 PolarHBondContact O-N 3.16Å; I118-G122 PolarHBondContact O-N 3.43Å |
| 119 | M | 80.7 | Confident | 78.6 | Confident | 10 Ų | 10 | 44.7 Ų | 44.7 | 5% | 0.049 | 28% | 0.281 | C | S | . | . | H | α-helix | trans | -63.1 | -46.7 | 178.9 | -74.4 | -169.8 | -63.6 | 0 | 0 | 111.6 | M115 S116 A117 G122 L123 F200 A203 Y229 A232 I236 | M115-M119 WeakPolarHBondContact O-CG 3.43Å; M115-M119 PolarHBondContact O-N 2.97Å; M115-M119 VanDerWaalsContact O-N 3.07Å; S116-M119 WeakPolarHBondContact O-CB 3.39Å; S116-M119 PolarHBondContact O-N 3.11Å; A117-M119 PolarHBondContact O-N 3.38Å; M119-G122 PolarHBondContact O-N 2.96Å; M119-L123 WeakPolarHBondContact O-CG 3.39Å; M119-L123 PolarHBondContact O-N 2.9Å; M119-L123 VanDerWaalsContact O-N 3.17Å; M119-F200 HydrophobicContact CE-CD2 3.78Å; M119-F200 HydrophobicContact CE-CE2 4.15Å; M119-A203 HydrophobicContact CB-CB 4.08Å; M119-Y229 HydrophobicContact CB-CD1 3.99Å; M119-Y229 HydrophobicContact CB-CE1 3.59Å; M119-Y229 HydrophobicContact CG-CD1 3.56Å; M119-Y229 HydrophobicContact CG-CE1 3.59Å; M119-Y229 PolarHBondContact O-OH 3.43Å; M119-Y229 HydrophobicContact SD-CD1 3.66Å; M119-Y229 HydrophobicContact SD-CE1 4.27Å; M119-A232 HydrophobicContact CE-CB 4.08Å; M119-A232 HydrophobicContact CG-CB 4.34Å; M119-A232 HydrophobicContact SD-CB 3.58Å; M119-A232 VanDerWaalsContact SD-CB 3.58Å; M119-I236 HydrophobicContact CE-CD1 3.38Å |
| 120 | V | 84 | Confident | 77 | Confident | 20 Ų | 20 | 47.1 Ų | 47.1 | 12% | 0.121 | 31% | 0.306 | C | S | . | . | H | α-helix | trans | -61.8 | -47.9 | 177.8 | 173.3 | 0 | 0 | 0 | 0 | 111.3 | S116 A117 G122 L123 S124 M199 Y202 A203 L206 | S116-V120 WeakPolarHBondContact O-CG2 3.39Å; S116-V120 PolarHBondContact O-N 2.88Å; A117-V120 PolarHBondContact O-N 3.37Å; V120-G122 VanDerWaalsContact C-N 3.31Å; V120-G122 PolarHBondContact O-N 3.41Å; V120-L123 PolarHBondContact O-N 3.18Å; V120-L123 VanDerWaalsContact O-N 3.12Å; V120-S124 WeakPolarHBondContact O-CB 3.29Å; V120-S124 PolarHBondContact O-N 2.89Å; V120-S124 PolarHBondContact O-OG 3.08Å; V120-M199 HydrophobicContact CB-CE 4.41Å; V120-M199 HydrophobicContact CG2-CE 3.94Å; V120-Y202 HydrophobicContact CG1-CD1 3.94Å; V120-Y202 HydrophobicContact CG1-CE1 3.74Å; V120-Y202 HydrophobicContact CG2-CD1 3.87Å; V120-Y202 HydrophobicContact CG2-CE1 4.5Å; V120-A203 HydrophobicContact CG2-CB 3.96Å; V120-L206 HydrophobicContact CG1-CD1 4.1Å |
| 121 | V | 82.2 | Confident | 75.5 | Confident | 63 Ų | 63 | 50.3 Ų | 50.3 | 38% | 0.382 | 33% | 0.328 | S | S | . | . | H | α-helix | trans | -63.2 | -37.7 | 178.9 | 174.2 | 0 | 0 | 0 | 0 | 111.7 | A117 L123 S124 A128 | A117-V121 WeakPolarHBondContact O-CG2 3.47Å; A117-V121 PolarHBondContact O-N 2.98Å; V121-L123 PolarHBondContact O-N 2.92Å; V121-S124 WeakPolarHBondContact CA-OG 3.45Å; V121-S124 PolarHBondContact O-OG 2.9Å; V121-A128 HydrophobicContact CG1-CB 3.73Å |
| 122 | G | 75.2 | Confident | 74.4 | Confident | 28 Ų | 28 | 54 Ų | 54 | 29% | 0.289 | 36% | 0.359 | S | S | . | . | H | α-helix | trans | -67.5 | -22.3 | 176.5 | 0 | 0 | 0 | 0 | 0 | 114.1 | I118 M119 V120 R210 | I118-G122 PolarHBondContact O-N 3.43Å; M119-G122 PolarHBondContact O-N 2.96Å; V120-G122 VanDerWaalsContact C-N 3.31Å; V120-G122 PolarHBondContact O-N 3.41Å; G122-R210 PolarHBondContact O-NH1 3.14Å; G122-R210 VanDerWaalsContact O-NH1 3.1Å |
| 123 | L | 73.6 | Confident | 73.9 | Confident | 15 Ų | 15 | 59.7 Ų | 59.7 | 8% | 0.079 | 38% | 0.384 | C | S | . | . | H | α-helix | trans | -92.8 | -34.1 | 178.4 | -68.9 | 171.2 | 0 | 0 | 0 | 113.4 | M119 V120 V121 S125 A203 L206 T207 Y229 | M119-L123 WeakPolarHBondContact O-CG 3.39Å; M119-L123 PolarHBondContact O-N 2.9Å; M119-L123 VanDerWaalsContact O-N 3.17Å; V120-L123 PolarHBondContact O-N 3.18Å; V120-L123 VanDerWaalsContact O-N 3.12Å; V121-L123 PolarHBondContact O-N 2.92Å; L123-S125 PolarHBondContact O-N 3.21Å; L123-A203 HydrophobicContact CD1-CB 4.38Å; L123-A203 WeakPolarHBondContact CD1-O 3.36Å; L123-L206 HydrophobicContact CB-CB 3.96Å; L123-L206 HydrophobicContact CB-CD1 4.13Å; L123-L206 HydrophobicContact CD1-CB 3.68Å; L123-L206 HydrophobicContact CG-CB 4.4Å; L123-T207 WeakPolarHBondContact CD1-OG1 3.31Å; L123-Y229 HydrophobicContact CD1-CE1 4.02Å; L123-Y229 HydrophobicContact CD2-CE1 4.24Å; L123-Y229 HydrophobicContact CD2-CE2 4Å; L123-Y229 WeakPolarHBondContact CD2-OH 3.49Å; L123-Y229 HydrophobicContact CG-CE1 3.96Å; L123-Y229 VanDerWaalsContact CG-OH 3.24Å; L123-Y229 WeakPolarHBondContact CG-OH 3.2Å |
| 124 | S | 71.3 | Confident | 73.4 | Confident | 36 Ų | 36 | 58.3 Ų | 58.3 | 25% | 0.252 | 38% | 0.377 | S | S | . | . | S | Bend | trans | -73.2 | 11.4 | -169.5 | 57.5 | 0 | 0 | 0 | 0 | 115.2 | V120 V121 L126 | V120-S124 WeakPolarHBondContact O-CB 3.29Å; V120-S124 PolarHBondContact O-N 2.89Å; V120-S124 PolarHBondContact O-OG 3.08Å; V121-S124 WeakPolarHBondContact CA-OG 3.45Å; V121-S124 PolarHBondContact O-OG 2.9Å; S124-L126 PolarHBondContact O-N 2.8Å; S124-L126 WeakPolarHBondContact OG-CD1 3.19Å |
| 125 | S | 62 | Low | 73.1 | Confident | 113 Ų | 113 | 58.2 Ų | 58.2 | 79% | 0.79 | 38% | 0.384 | S | S | * | . | trans | 56.1 | 2.5 | -177.8 | 71 | 0 | 0 | 0 | 0 | 115.6 | L123 K127 | L123-S125 PolarHBondContact O-N 3.21Å; S125-K127 PolarHBondContact O-N 3.31Å | ||
| 126 | L | 59.2 | Low | 72.9 | Confident | 123 Ų | 123 | 62.8 Ų | 62.8 | 64% | 0.644 | 42% | 0.416 | S | S | * | . | trans | -58.9 | 111.7 | 169.9 | -84.4 | 149 | 0 | 0 | 0 | 107.2 | S124 A128 | S124-L126 PolarHBondContact O-N 2.8Å; S124-L126 WeakPolarHBondContact OG-CD1 3.19Å; L126-A128 PolarHBondContact O-N 3.12Å | ||
| 127 | K | 54.5 | Low | 72.8 | Confident | 210 Ų | 210 | 70.6 Ų | 70.6 | 91% | 0.913 | 45% | 0.446 | S | S | * | . | trans | -65.7 | 71.8 | 165 | -75.5 | -177.6 | -179.7 | 173.4 | 0 | 107.7 | S125 G129 | S125-K127 PolarHBondContact O-N 3.31Å; K127-G129 PolarHBondContact O-N 2.99Å | ||
| 128 | A | 54.4 | Low | 72.9 | Confident | 65 Ų | 65 | 71.4 Ų | 71.4 | 54% | 0.537 | 44% | 0.444 | S | S | . | . | trans | -67.9 | 102.7 | 169.2 | 0 | 0 | 0 | 0 | 0 | 106 | V121 L126 G130 | V121-A128 HydrophobicContact CG1-CB 3.73Å; L126-A128 PolarHBondContact O-N 3.12Å; A128-G130 PolarHBondContact O-N 3.38Å | ||
| 129 | G | 53.2 | Low | 73.1 | Confident | 88 Ų | 88 | 71 Ų | 71 | 91% | 0.907 | 44% | 0.441 | S | S | * | . | trans | -66.6 | 33.1 | 174.8 | 0 | 0 | 0 | 0 | 0 | 113.5 | K127 | K127-G129 PolarHBondContact O-N 2.99Š| ||
| 130 | G | 59.9 | Low | 73.5 | Confident | 51 Ų | 51 | 74.2 Ų | 74.2 | 53% | 0.526 | 46% | 0.462 | S | S | . | . | trans | -79.1 | 145.4 | -175.2 | 0 | 0 | 0 | 0 | 0 | 112.1 | A128 | A128-G130 PolarHBondContact O-N 3.38Š| ||
| 131 | S | 61.2 | Low | 73.9 | Confident | 78 Ų | 78 | 78.3 Ų | 78.3 | 55% | 0.545 | 48% | 0.482 | S | S | . | . | trans | -47 | 143 | 170.8 | 170.6 | 0 | 0 | 0 | 0 | 111.8 | K50 K133 | K50-S131 VanDerWaalsContact CD-O 3.32Å; K50-S131 WeakPolarHBondContact CD-O 3.44Å; K50-S131 WeakPolarHBondContact CE-O 3.4Å; K50-S131 PolarHBondContact NZ-O 3.43Å; S131-K133 WeakPolarHBondContact CB-O 3.26Å; S131-K133 PolarHBondContact O-N 2.88Å; S131-K133 PolarHBondContact OG-N 2.95Å; S131-K133 VanDerWaalsContact OG-N 3.11Å; S131-K133 PolarHBondContact OG-O 3.16Å | ||
| 132 | A | 71.1 | Confident | 74.3 | Confident | 79 Ų | 79 | 79.1 Ų | 79.1 | 65% | 0.653 | 48% | 0.479 | S | S | * | . | S | Bend | trans | -70.9 | -11.5 | 174.4 | 0 | 0 | 0 | 0 | 0 | 113.4 | K50 | K50-A132 PolarHBondContact N-O 3.07Š|
| 133 | K | 79.1 | Confident | 75.2 | Confident | 119 Ų | 119 | 77.8 Ų | 77.8 | 52% | 0.517 | 47% | 0.465 | S | S | . | . | S | Bend | trans | -122.3 | 146.9 | -179.1 | -64.9 | -176.8 | -179.3 | 177 | 0 | 110.7 | K50 S131 | K50-K133 VanDerWaalsContact CE-O 3.25Å; K50-K133 WeakPolarHBondContact CE-O 3.46Å; S131-K133 WeakPolarHBondContact CB-O 3.26Å; S131-K133 PolarHBondContact O-N 2.88Å; S131-K133 PolarHBondContact OG-N 2.95Å; S131-K133 VanDerWaalsContact OG-N 3.11Å; S131-K133 PolarHBondContact OG-O 3.16Å |
| 134 | L | 80.9 | Confident | 76.1 | Confident | 7 Ų | 7 | 80.3 Ų | 80.3 | 4% | 0.037 | 48% | 0.476 | C | S | . | . | trans | -75.3 | 124.9 | 169.8 | -149.6 | 68.4 | 0 | 0 | 0 | 108.4 | K50 Q53 Y114 E138 I139 F143 | K50-L134 HydrophobicContact CG-CB 4.34Å; K50-L134 HydrophobicContact CG-CD1 4.39Å; Q53-L134 HydrophobicContact CB-CB 4.44Å; Q53-L134 PolarHBondContact NE2-O 3.35Å; Y114-L134 HydrophobicContact CE1-CD1 3.72Å; Y114-L134 HydrophobicContact CE2-CD1 4.21Å; Y114-L134 WeakPolarHBondContact OH-CD1 3.34Å; L134-E138 WeakPolarHBondContact CA-OE2 3.46Å; L134-E138 HydrophobicContact CD1-CB 4.13Å; L134-E138 WeakPolarHBondContact CD1-OE2 3.37Å; L134-E138 HydrophobicContact CG-CB 4Å; L134-I139 HydrophobicContact CB-CG1 4.34Å; L134-I139 HydrophobicContact CD2-CD1 4.26Å; L134-I139 HydrophobicContact CD2-CG1 3.39Å; L134-I139 HydrophobicContact CG-CG1 3.94Å; L134-F143 HydrophobicContact CD2-CE2 3.69Å; L134-F143 HydrophobicContact CD2-CZ 4.21Å | ||
| 135 | A | 85.8 | Confident | 77.2 | Confident | 35 Ų | 35 | 81.5 Ų | 81.5 | 29% | 0.289 | 48% | 0.481 | S | S | . | . | trans | -70.9 | 150.2 | 173.2 | 0 | 0 | 0 | 0 | 0 | 109.8 | W137 E138 I139 | A135-W137 VanDerWaalsContact CB-CD1 3.49Å; A135-W137 HydrophobicContact CB-CG 4.3Å; A135-W137 VanDerWaalsContact CB-NE1 3.35Å; A135-W137 PolarHBondContact O-N 3.36Å; A135-E138 HydrophobicContact CB-CG 4.12Å; A135-E138 PolarHBondContact N-OE2 3.08Å; A135-E138 WeakPolarHBondContact O-CB 3.5Å; A135-E138 PolarHBondContact O-N 3.02Å; A135-I139 PolarHBondContact O-N 3.07Å; A135-I139 VanDerWaalsContact O-N 3.15Å | ||
| 136 | S | 82.7 | Confident | 78.8 | Confident | 99 Ų | 99 | 78.2 Ų | 78.2 | 69% | 0.692 | 46% | 0.458 | S | S | * | . | H | α-helix | trans | -59.7 | -35.8 | -178.1 | -51.5 | 0 | 0 | 0 | 0 | 112.4 | I139 V140 | S136-I139 WeakPolarHBondContact O-CB 3.31Å; S136-I139 PolarHBondContact O-N 3.34Å; S136-V140 WeakPolarHBondContact O-CG2 3.43Å; S136-V140 PolarHBondContact O-N 3.38Å |
| 137 | W | 87.3 | Confident | 80.5 | Confident | 165 Ų | 165 | 72.4 Ų | 72.4 | 63% | 0.625 | 43% | 0.427 | S | S | * | . | H | α-helix | trans | -67.2 | -34.9 | 176.3 | 71.2 | -98.7 | 0 | 0 | 0 | 112.2 | A135 I139 V140 L141 | A135-W137 VanDerWaalsContact CB-CD1 3.49Å; A135-W137 HydrophobicContact CB-CG 4.3Å; A135-W137 VanDerWaalsContact CB-NE1 3.35Å; A135-W137 PolarHBondContact O-N 3.36Å; W137-I139 VanDerWaalsContact C-N 3.29Å; W137-I139 PolarHBondContact O-N 2.67Å; W137-V140 PolarHBondContact O-N 3.22Å; W137-L141 HydrophobicContact CE3-CD1 3.55Å; W137-L141 HydrophobicContact CE3-CG 4.31Å; W137-L141 HydrophobicContact CZ3-CD1 3.82Å; W137-L141 WeakPolarHBondContact O-CB 3.4Å; W137-L141 WeakPolarHBondContact O-CG 3.41Å; W137-L141 PolarHBondContact O-N 3.31Å |
| 138 | E | 88.8 | Confident | 82.4 | Confident | 50 Ų | 50 | 66.3 Ų | 66.3 | 23% | 0.234 | 40% | 0.403 | C | S | . | . | H | α-helix | trans | -63.8 | -38.5 | 173.6 | -66.9 | 176.1 | 130.7 | 0 | 0 | 110.1 | L134 A135 Y142 | L134-E138 WeakPolarHBondContact CA-OE2 3.46Å; L134-E138 HydrophobicContact CD1-CB 4.13Å; L134-E138 WeakPolarHBondContact CD1-OE2 3.37Å; L134-E138 HydrophobicContact CG-CB 4Å; A135-E138 HydrophobicContact CB-CG 4.12Å; A135-E138 PolarHBondContact N-OE2 3.08Å; A135-E138 WeakPolarHBondContact O-CB 3.5Å; A135-E138 PolarHBondContact O-N 3.02Å; E138-Y142 WeakPolarHBondContact O-CB 3.44Å; E138-Y142 PolarHBondContact O-N 2.93Å |
| 139 | I | 87.7 | Confident | 84.3 | Confident | 36 Ų | 36 | 67.6 Ų | 67.6 | 19% | 0.185 | 40% | 0.404 | C | S | . | . | H | α-helix | trans | -62.2 | -48.3 | 175.3 | -63.6 | 170 | 0 | 0 | 0 | 110.6 | V57 L134 A135 S136 W137 F143 F144 | V57-I139 HydrophobicContact CG2-CG2 4.29Å; L134-I139 HydrophobicContact CB-CG1 4.34Å; L134-I139 HydrophobicContact CD2-CD1 4.26Å; L134-I139 HydrophobicContact CD2-CG1 3.39Å; L134-I139 HydrophobicContact CG-CG1 3.94Å; A135-I139 PolarHBondContact O-N 3.07Å; A135-I139 VanDerWaalsContact O-N 3.15Å; S136-I139 WeakPolarHBondContact O-CB 3.31Å; S136-I139 PolarHBondContact O-N 3.34Å; W137-I139 VanDerWaalsContact C-N 3.29Å; W137-I139 PolarHBondContact O-N 2.67Å; I139-F143 HydrophobicContact CG2-CD2 4.43Å; I139-F143 VanDerWaalsContact O-CB 3.31Å; I139-F143 WeakPolarHBondContact O-CB 3.45Å; I139-F143 VanDerWaalsContact O-CD2 3.31Å; I139-F143 WeakPolarHBondContact O-CD2 3.4Å; I139-F143 PolarHBondContact O-N 3.49Å; I139-F143 VanDerWaalsContact O-N 3.11Å; I139-F144 HydrophobicContact CG2-CD2 4.06Å; I139-F144 HydrophobicContact CG2-CE2 3.84Å |
| 140 | V | 89.3 | Confident | 86.3 | Confident | 79 Ų | 79 | 64.2 Ų | 64.2 | 48% | 0.479 | 37% | 0.365 | S | S | . | . | I | π-helix | trans | -63.6 | -53.7 | -179 | 174.4 | 0 | 0 | 0 | 0 | 110.6 | S136 W137 Y142 F144 T145 | S136-V140 WeakPolarHBondContact O-CG2 3.43Å; S136-V140 PolarHBondContact O-N 3.38Å; W137-V140 PolarHBondContact O-N 3.22Å; V140-Y142 PolarHBondContact O-N 3.09Å; V140-F144 PolarHBondContact O-N 3.45Å; V140-F144 VanDerWaalsContact O-N 3.09Å; V140-T145 PolarHBondContact O-N 3.31Å; V140-T145 PolarHBondContact O-OG1 2.95Å |
| 141 | L | 91.5 | Very high | 87.9 | Confident | 106 Ų | 106 | 62.5 Ų | 62.5 | 56% | 0.555 | 34% | 0.344 | S | S | * | . | I | π-helix | trans | -66.2 | -40.7 | -174.6 | -69.9 | -175.2 | 0 | 0 | 0 | 113.2 | W137 T145 | W137-L141 HydrophobicContact CE3-CD1 3.55Å; W137-L141 HydrophobicContact CE3-CG 4.31Å; W137-L141 HydrophobicContact CZ3-CD1 3.82Å; W137-L141 WeakPolarHBondContact O-CB 3.4Å; W137-L141 WeakPolarHBondContact O-CG 3.41Å; W137-L141 PolarHBondContact O-N 3.31Å; L141-T145 WeakPolarHBondContact O-CB 3.42Å |
| 142 | Y | 91.5 | Very high | 89.5 | Confident | 80 Ų | 80 | 63.7 Ų | 63.7 | 31% | 0.314 | 34% | 0.344 | S | S | . | . | I | π-helix | trans | -86.1 | -31 | -172.8 | -173.9 | -89.7 | 0 | 0 | 0 | 113.2 | C110 I113 Y114 E138 V140 P146 | C110-Y142 HydrophobicContact CB-CD1 4.31Å; C110-Y142 HydrophobicContact CB-CE1 3.92Å; C110-Y142 WeakPolarHBondContact O-CE1 3.48Å; I113-Y142 VanDerWaalsContact CG2-OH 3.29Å; I113-Y142 WeakPolarHBondContact CG2-OH 3.25Å; Y114-Y142 HydrophobicContact CD2-CD1 4.06Å; Y114-Y142 AromaticContact CD2-CE1 3.79Å; Y114-Y142 HydrophobicContact CD2-CE1 3.79Å; Y114-Y142 HydrophobicContact CD2-CE2 4.34Å; Y114-Y142 HydrophobicContact CD2-CG 4.44Å; Y114-Y142 AromaticContact CD2-CZ 3.93Å; Y114-Y142 HydrophobicContact CG-CE1 4.09Å; Y114-Y142 PolarHBondContact N-OH 2.63Å; E138-Y142 WeakPolarHBondContact O-CB 3.44Å; E138-Y142 PolarHBondContact O-N 2.93Å; V140-Y142 PolarHBondContact O-N 3.09Å; Y142-P146 WeakPolarHBondContact O-CG 3.29Å |
| 143 | F | 93.8 | Very high | 90.6 | Very high | 0 Ų | 0 | 61.4 Ų | 61.4 | 0% | 0 | 33% | 0.327 | C | S | . | . | I | π-helix | trans | -108.6 | -51.1 | -172.8 | -58.3 | -96.6 | 0 | 0 | 0 | 112.1 | T54 V57 L107 C110 S111 Y114 L134 I139 A147 | T54-F143 HydrophobicContact CG2-CE1 4Å; T54-F143 HydrophobicContact CG2-CZ 4Å; V57-F143 HydrophobicContact CB-CD1 4.33Å; V57-F143 HydrophobicContact CB-CE1 4.49Å; V57-F143 HydrophobicContact CG1-CB 4.09Å; V57-F143 HydrophobicContact CG1-CD1 3.56Å; V57-F143 HydrophobicContact CG1-CE1 4.17Å; V57-F143 HydrophobicContact CG1-CG 3.94Å; L107-F143 HydrophobicContact CD2-CB 3.74Å; C110-F143 HydrophobicContact CB-CD1 3.94Å; C110-F143 HydrophobicContact CB-CE1 4.46Å; S111-F143 WeakPolarHBondContact OG-CE1 3.41Å; Y114-F143 HydrophobicContact CD1-CZ 4.21Å; Y114-F143 HydrophobicContact CD2-CZ 4.44Å; Y114-F143 AromaticContact CG-CZ 4Å; Y114-F143 HydrophobicContact CG-CZ 4Å; L134-F143 HydrophobicContact CD2-CE2 3.69Å; L134-F143 HydrophobicContact CD2-CZ 4.21Å; I139-F143 HydrophobicContact CG2-CD2 4.43Å; I139-F143 VanDerWaalsContact O-CB 3.31Å; I139-F143 WeakPolarHBondContact O-CB 3.45Å; I139-F143 VanDerWaalsContact O-CD2 3.31Å; I139-F143 WeakPolarHBondContact O-CD2 3.4Å; I139-F143 PolarHBondContact O-N 3.49Å; I139-F143 VanDerWaalsContact O-N 3.11Å; F143-A147 WeakPolarHBondContact O-CB 3.37Å |
| 144 | F | 93.3 | Very high | 91.3 | Very high | 67 Ų | 67 | 55.7 Ų | 55.7 | 29% | 0.294 | 30% | 0.303 | S | S | . | . | I | π-helix | trans | -80.3 | -35.6 | -174.2 | -73.8 | -84.5 | 0 | 0 | 0 | 112.7 | F60 L107 I139 V140 A147 M148 | F60-F144 HydrophobicContact CE1-CE1 4.42Å; F60-F144 HydrophobicContact CE1-CZ 4.47Å; L107-F144 HydrophobicContact CD1-CE1 4.35Å; L107-F144 HydrophobicContact CD2-CD1 4.31Å; L107-F144 HydrophobicContact CD2-CE1 4.31Å; L107-F144 HydrophobicContact CD2-CG 4.45Å; L107-F144 HydrophobicContact CD2-CZ 4.44Å; I139-F144 HydrophobicContact CG2-CD2 4.06Å; I139-F144 HydrophobicContact CG2-CE2 3.84Å; V140-F144 PolarHBondContact O-N 3.45Å; V140-F144 VanDerWaalsContact O-N 3.09Å; F144-A147 PolarHBondContact O-N 2.88Å; F144-M148 WeakPolarHBondContact O-CB 3.28Å; F144-M148 VanDerWaalsContact O-CG 3.25Å; F144-M148 WeakPolarHBondContact O-CG 3.33Å; F144-M148 PolarHBondContact O-N 3.49Å |
| 145 | T | 94.2 | Very high | 91.8 | Very high | 61 Ų | 61 | 59 Ų | 59 | 37% | 0.374 | 32% | 0.315 | S | S | . | . | H | α-helix | trans | -60.8 | -50.3 | 178.7 | -57.6 | 0 | 0 | 0 | 0 | 112.5 | V140 L141 A147 M148 V149 | V140-T145 PolarHBondContact O-N 3.31Å; V140-T145 PolarHBondContact O-OG1 2.95Å; L141-T145 WeakPolarHBondContact O-CB 3.42Å; T145-A147 VanDerWaalsContact C-N 3.32Å; T145-A147 PolarHBondContact O-N 3.47Å; T145-M148 PolarHBondContact O-N 2.96Å; T145-V149 HydrophobicContact CG2-CG2 4.36Å; T145-V149 VanDerWaalsContact O-CG2 3.32Å; T145-V149 WeakPolarHBondContact O-CG2 3.44Å; T145-V149 PolarHBondContact O-N 3.15Å |
| 146 | P | 94.5 | Very high | 92.2 | Very high | 45 Ų | 45 | 60.9 Ų | 60.9 | 29% | 0.292 | 32% | 0.322 | S | S | . | . | H | α-helix | trans | -61.1 | -39.7 | 176.6 | -23.7 | 35.2 | 0 | 0 | 0 | 113 | Y142 M148 V149 M150 | Y142-P146 WeakPolarHBondContact O-CG 3.29Å; P146-M148 PolarHBondContact O-N 3.15Å; P146-V149 PolarHBondContact O-N 2.81Å; P146-M150 WeakPolarHBondContact O-CG 3.36Å; P146-M150 PolarHBondContact O-N 2.99Å |
| 147 | A | 95.3 | Very high | 92.6 | Very high | 0 Ų | 0 | 57.7 Ų | 57.7 | 0% | 0 | 30% | 0.3 | C | S | . | . | H | α-helix | trans | -60.3 | -44.3 | 176 | 0 | 0 | 0 | 0 | 0 | 112.4 | M106 L107 F143 F144 T145 C151 | M106-A147 HydrophobicContact CB-CB 3.84Å; L107-A147 HydrophobicContact CG-CB 4.43Å; F143-A147 WeakPolarHBondContact O-CB 3.37Å; F144-A147 PolarHBondContact O-N 2.88Å; T145-A147 VanDerWaalsContact C-N 3.32Å; T145-A147 PolarHBondContact O-N 3.47Å; A147-C151 WeakPolarHBondContact O-CB 3.29Å; A147-C151 PolarHBondContact O-N 3.32Å |
| 148 | M | 94.4 | Very high | 92.8 | Very high | 82 Ų | 82 | 49.9 Ų | 49.9 | 40% | 0.404 | 27% | 0.27 | S | S | . | . | H | α-helix | trans | -69.7 | -39.7 | 178 | -68.8 | -62 | 151 | 0 | 0 | 112.1 | I103 F144 T145 P146 M150 C151 I152 | I103-M148 HydrophobicContact CD1-CE 4.14Å; I103-M148 HydrophobicContact CG1-CE 4.42Å; F144-M148 WeakPolarHBondContact O-CB 3.28Å; F144-M148 VanDerWaalsContact O-CG 3.25Å; F144-M148 WeakPolarHBondContact O-CG 3.33Å; F144-M148 PolarHBondContact O-N 3.49Å; T145-M148 PolarHBondContact O-N 2.96Å; P146-M148 PolarHBondContact O-N 3.15Å; M148-M150 VanDerWaalsContact C-N 3.34Å; M148-M150 PolarHBondContact O-N 2.89Å; M148-C151 PolarHBondContact O-N 3.25Å; M148-I152 WeakPolarHBondContact O-CB 3.27Å; M148-I152 VanDerWaalsContact O-CG1 3.23Å; M148-I152 WeakPolarHBondContact O-CG1 3.4Å; M148-I152 PolarHBondContact O-N 3.44Å |
| 149 | V | 95.5 | Very high | 92.9 | Very high | 93 Ų | 93 | 50.8 Ų | 50.8 | 56% | 0.564 | 28% | 0.279 | S | S | * | . | H | α-helix | trans | -59.9 | -45.8 | 175.4 | 170 | 0 | 0 | 0 | 0 | 110.8 | T145 P146 I152 G153 | T145-V149 HydrophobicContact CG2-CG2 4.36Å; T145-V149 VanDerWaalsContact O-CG2 3.32Å; T145-V149 WeakPolarHBondContact O-CG2 3.44Å; T145-V149 PolarHBondContact O-N 3.15Å; P146-V149 PolarHBondContact O-N 2.81Å; V149-I152 PolarHBondContact O-N 3.09Å; V149-G153 PolarHBondContact O-N 2.88Å |
| 150 | M | 94.3 | Very high | 93 | Very high | 17 Ų | 17 | 55 Ų | 55 | 8% | 0.084 | 30% | 0.302 | C | S | . | . | H | α-helix | trans | -65 | -41.3 | 176.5 | -71.5 | -56.8 | -65.3 | 0 | 0 | 112.4 | M102 M106 P146 M148 G153 C154 Y184 Y185 | M102-M150 HydrophobicContact CB-CB 4.49Å; M106-M150 HydrophobicContact CE-CG 4.26Å; M106-M150 HydrophobicContact CG-CB 4.08Å; M106-M150 HydrophobicContact CG-CG 3.84Å; M106-M150 HydrophobicContact SD-CG 3.84Å; P146-M150 WeakPolarHBondContact O-CG 3.36Å; P146-M150 PolarHBondContact O-N 2.99Å; M148-M150 VanDerWaalsContact C-N 3.34Å; M148-M150 PolarHBondContact O-N 2.89Å; M150-G153 PolarHBondContact O-N 2.99Å; M150-C154 PolarHBondContact O-N 3.39Å; M150-Y184 HydrophobicContact CE-CD1 4.5Å; M150-Y184 HydrophobicContact CE-CE1 4.18Å; M150-Y184 HydrophobicContact SD-CE1 4.34Å; M150-Y185 HydrophobicContact CE-CD2 3.67Å; M150-Y185 HydrophobicContact CE-CE2 4.44Å |
| 151 | C | 94.6 | Very high | 93 | Very high | 14 Ų | 14 | 52.1 Ų | 52.1 | 10% | 0.095 | 29% | 0.287 | C | S | . | . | H | α-helix | trans | -62.7 | -50.6 | 176.4 | -171.1 | 0 | 0 | 0 | 0 | 111.3 | M102 I103 A147 M148 G153 C154 W155 | M102-C151 HydrophobicContact CB-CB 4.24Å; I103-C151 HydrophobicContact CG1-CB 4.29Å; A147-C151 WeakPolarHBondContact O-CB 3.29Å; A147-C151 PolarHBondContact O-N 3.32Å; M148-C151 PolarHBondContact O-N 3.25Å; C151-G153 VanDerWaalsContact C-N 3.3Å; C151-G153 PolarHBondContact O-N 2.93Å; C151-C154 VanDerWaalsContact O-CB 3.25Å; C151-C154 WeakPolarHBondContact O-CB 3.3Å; C151-C154 PolarHBondContact O-N 3.26Å; C151-C154 VanDerWaalsContact O-N 3.11Å; C151-W155 VanDerWaalsContact O-CD1 3.25Å; C151-W155 PolarHBondContact O-N 3.05Å; C151-W155 VanDerWaalsContact O-N 3.15Å |
| 152 | I | 94.8 | Very high | 92.6 | Very high | 104 Ų | 104 | 57.2 Ų | 57.2 | 53% | 0.533 | 31% | 0.308 | S | S | . | . | H | α-helix | trans | -61.1 | -41.8 | 178.1 | -66.9 | 164.8 | 0 | 0 | 0 | 110.3 | M148 V149 C154 W155 V156 | M148-I152 WeakPolarHBondContact O-CB 3.27Å; M148-I152 VanDerWaalsContact O-CG1 3.23Å; M148-I152 WeakPolarHBondContact O-CG1 3.4Å; M148-I152 PolarHBondContact O-N 3.44Å; V149-I152 PolarHBondContact O-N 3.09Å; I152-C154 VanDerWaalsContact C-N 3.27Å; I152-C154 PolarHBondContact O-N 3.11Å; I152-W155 PolarHBondContact O-N 3.27Å; I152-V156 HydrophobicContact CG2-CG2 4.14Å; I152-V156 VanDerWaalsContact O-CG2 3.31Å; I152-V156 WeakPolarHBondContact O-CG2 3.45Å; I152-V156 PolarHBondContact O-N 3.05Å |
| 153 | G | 93.6 | Very high | 92.2 | Very high | 30 Ų | 30 | 55.9 Ų | 55.9 | 31% | 0.309 | 31% | 0.306 | S | S | . | . | H | α-helix | trans | -57.1 | -39.9 | 174.7 | 0 | 0 | 0 | 0 | 0 | 112.8 | V149 M150 C151 S157 | V149-G153 PolarHBondContact O-N 2.88Å; M150-G153 PolarHBondContact O-N 2.99Å; C151-G153 VanDerWaalsContact C-N 3.3Å; C151-G153 PolarHBondContact O-N 2.93Å; G153-S157 WeakPolarHBondContact O-CB 3.43Å; G153-S157 PolarHBondContact O-N 3.16Å |
| 154 | C | 92.7 | Very high | 91.6 | Very high | 0 Ų | 0 | 58.3 Ų | 58.3 | 0% | 0 | 32% | 0.317 | C | S | . | . | H | α-helix | trans | -61.3 | -50.3 | 174.9 | -169.9 | 0 | 0 | 0 | 0 | 111.8 | M92 M102 M150 C151 I152 V156 S157 V158 F181 | M92-C154 WeakPolarHBondContact CE-SG 3.12Å; M102-C154 HydrophobicContact CG-CB 4.24Å; M150-C154 PolarHBondContact O-N 3.39Å; C151-C154 VanDerWaalsContact O-CB 3.25Å; C151-C154 WeakPolarHBondContact O-CB 3.3Å; C151-C154 PolarHBondContact O-N 3.26Å; C151-C154 VanDerWaalsContact O-N 3.11Å; I152-C154 VanDerWaalsContact C-N 3.27Å; I152-C154 PolarHBondContact O-N 3.11Å; C154-V156 PolarHBondContact O-N 3.48Å; C154-S157 PolarHBondContact O-N 3.36Å; C154-V158 WeakPolarHBondContact O-CG2 3.25Å; C154-V158 PolarHBondContact O-N 3.11Å; C154-F181 HydrophobicContact CB-CD1 4.41Å; C154-F181 HydrophobicContact CB-CE1 3.53Å; C154-F181 HydrophobicContact CB-CE2 4.14Å; C154-F181 HydrophobicContact CB-CZ 3.37Å; C154-F181 WeakPolarHBondContact SG-CE1 3.36Å |
| 155 | W | 92.5 | Very high | 90.8 | Very high | 77 Ų | 77 | 65.8 Ų | 65.8 | 29% | 0.292 | 34% | 0.343 | S | S | . | . | H | α-helix | trans | -60.9 | -46.2 | 178.4 | -80.5 | 74.7 | 0 | 0 | 0 | 112.3 | L89 M92 V93 P99 C151 I152 S157 V158 V159 | L89-W155 HydrophobicContact CD1-CE3 3.44Å; L89-W155 VanDerWaalsContact CD1-CE3 3.44Å; L89-W155 HydrophobicContact CD1-CH2 4.4Å; L89-W155 HydrophobicContact CD1-CZ3 3.3Å; L89-W155 HydrophobicContact CG-CE3 4.49Å; L89-W155 HydrophobicContact CG-CZ3 3.88Å; M92-W155 HydrophobicContact CB-CH2 4.12Å; M92-W155 HydrophobicContact CB-CZ2 3.97Å; M92-W155 HydrophobicContact SD-CD2 4.43Å; V93-W155 HydrophobicContact CG2-CH2 3.68Å; V93-W155 HydrophobicContact CG2-CZ3 4.44Å; P99-W155 HydrophobicContact CG-CZ2 4.34Å; C151-W155 VanDerWaalsContact O-CD1 3.25Å; C151-W155 PolarHBondContact O-N 3.05Å; C151-W155 VanDerWaalsContact O-N 3.15Å; I152-W155 PolarHBondContact O-N 3.27Å; W155-S157 VanDerWaalsContact C-N 3.29Å; W155-S157 PolarHBondContact O-N 3.15Å; W155-V158 PolarHBondContact O-N 2.79Å; W155-V159 WeakPolarHBondContact O-CG2 3.19Å; W155-V159 PolarHBondContact O-N 3.11Å |
| 156 | V | 93.5 | Very high | 90.1 | Very high | 74 Ų | 74 | 68.9 Ų | 68.9 | 45% | 0.448 | 35% | 0.353 | S | S | . | . | H | α-helix | trans | -61.4 | -40.8 | 177.4 | 171.9 | 0 | 0 | 0 | 0 | 110.8 | I152 C154 V158 V159 N160 | I152-V156 HydrophobicContact CG2-CG2 4.14Å; I152-V156 VanDerWaalsContact O-CG2 3.31Å; I152-V156 WeakPolarHBondContact O-CG2 3.45Å; I152-V156 PolarHBondContact O-N 3.05Å; C154-V156 PolarHBondContact O-N 3.48Å; V156-V158 PolarHBondContact O-N 2.84Å; V156-V159 PolarHBondContact O-N 3.06Å; V156-N160 WeakPolarHBondContact CG1-ND2 3.5Å; V156-N160 WeakPolarHBondContact O-CB 3.31Å; V156-N160 PolarHBondContact O-N 3.45Å; V156-N160 VanDerWaalsContact O-N 3.1Å; V156-N160 PolarHBondContact O-ND2 3.32Å |
| 157 | S | 92.6 | Very high | 89.4 | Confident | 32 Ų | 32 | 72.3 Ų | 72.3 | 22% | 0.224 | 37% | 0.368 | C | S | . | . | H | α-helix | trans | -64.2 | -39.9 | 177.6 | -169.4 | 0 | 0 | 0 | 0 | 112.5 | G153 C154 W155 N160 A161 P178 F181 | G153-S157 WeakPolarHBondContact O-CB 3.43Å; G153-S157 PolarHBondContact O-N 3.16Å; C154-S157 PolarHBondContact O-N 3.36Å; W155-S157 VanDerWaalsContact C-N 3.29Å; W155-S157 PolarHBondContact O-N 3.15Å; S157-N160 PolarHBondContact O-N 2.95Å; S157-A161 PolarHBondContact O-N 3.36Å; S157-P178 WeakPolarHBondContact O-CG 3.19Å; S157-F181 WeakPolarHBondContact OG-CB 3.29Å |
| 158 | V | 90.3 | Very high | 88.6 | Confident | 0 Ų | 0 | 73.2 Ų | 73.2 | 0% | 0 | 37% | 0.374 | C | S | . | . | H | α-helix | trans | -64.6 | -46.4 | 176.8 | 170.9 | 0 | 0 | 0 | 0 | 110.9 | K88 M92 C154 W155 V156 N160 A161 F164 | K88-V158 HydrophobicContact CB-CG1 3.9Å; M92-V158 HydrophobicContact CE-CG2 3.51Å; M92-V158 HydrophobicContact SD-CB 4.4Å; M92-V158 HydrophobicContact SD-CG2 3.82Å; C154-V158 WeakPolarHBondContact O-CG2 3.25Å; C154-V158 PolarHBondContact O-N 3.11Å; W155-V158 PolarHBondContact O-N 2.79Å; V156-V158 PolarHBondContact O-N 2.84Å; V158-N160 PolarHBondContact O-N 3.37Å; V158-A161 WeakPolarHBondContact O-CB 3.29Å; V158-A161 PolarHBondContact O-N 2.92Å; V158-F164 HydrophobicContact CG1-CD2 4.02Å; V158-F164 HydrophobicContact CG1-CE2 4.2Å; V158-F164 WeakPolarHBondContact O-CD2 3.13Å |
| 159 | V | 90.9 | Very high | 87.5 | Confident | 69 Ų | 69 | 74.4 Ų | 74.4 | 42% | 0.418 | 39% | 0.386 | S | S | . | . | H | α-helix | trans | -63.4 | -31.8 | -179.1 | 172.7 | 0 | 0 | 0 | 0 | 112.4 | L89 W155 V156 F164 | L89-V159 HydrophobicContact CD1-CG2 4.04Å; W155-V159 WeakPolarHBondContact O-CG2 3.19Å; W155-V159 PolarHBondContact O-N 3.11Å; V156-V159 PolarHBondContact O-N 3.06Å; V159-F164 HydrophobicContact CB-CE2 4.49Å; V159-F164 HydrophobicContact CG2-CE2 4.07Å; V159-F164 HydrophobicContact CG2-CZ 4.43Å |
| 160 | N | 91.1 | Very high | 86.7 | Confident | 124 Ų | 124 | 71.1 Ų | 71.1 | 66% | 0.663 | 37% | 0.367 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -89.6 | -1.1 | -179.4 | -68.9 | -21.5 | 0 | 0 | 0 | 114.1 | V156 S157 V158 | V156-N160 WeakPolarHBondContact CG1-ND2 3.5Å; V156-N160 WeakPolarHBondContact O-CB 3.31Å; V156-N160 PolarHBondContact O-N 3.45Å; V156-N160 VanDerWaalsContact O-N 3.1Å; V156-N160 PolarHBondContact O-ND2 3.32Å; S157-N160 PolarHBondContact O-N 2.95Å; V158-N160 PolarHBondContact O-N 3.37Å |
| 161 | A | 88.7 | Confident | 86.1 | Confident | 19 Ų | 19 | 70.6 Ų | 70.6 | 16% | 0.157 | 37% | 0.365 | C | S | . | . | S | Bend | trans | -72.1 | 142.5 | 179.3 | 0 | 0 | 0 | 0 | 0 | 111.2 | S157 V158 D163 F164 P178 | S157-A161 PolarHBondContact O-N 3.36Å; V158-A161 WeakPolarHBondContact O-CB 3.29Å; V158-A161 PolarHBondContact O-N 2.92Å; A161-D163 VanDerWaalsContact CB-OD1 3.28Å; A161-D163 WeakPolarHBondContact CB-OD1 3.3Å; A161-D163 PolarHBondContact O-N 3.21Å; A161-F164 WeakPolarHBondContact O-CB 3.47Å; A161-F164 PolarHBondContact O-N 3.41Å; A161-F164 VanDerWaalsContact O-N 3.11Å; A161-P178 HydrophobicContact CB-CG 3.71Å |
| 162 | E | 83.4 | Confident | 85.5 | Confident | 213 Ų | 213 | 71.9 Ų | 71.9 | 100% | 0.995 | 37% | 0.369 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -61.3 | -33.6 | 179.6 | -63.3 | -173.6 | 170.6 | 0 | 0 | 112 | F164 | E162-F164 VanDerWaalsContact C-N 3.31Å; E162-F164 PolarHBondContact O-N 3.33Å |
| 163 | D | 83 | Confident | 85 | Confident | 53 Ų | 53 | 67.9 Ų | 67.9 | 28% | 0.283 | 35% | 0.348 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -90.1 | 15.4 | 179.5 | 65.6 | 0 | 0 | 0 | 0 | 113.3 | K88 A161 R165 E166 | K88-D163 WeakPolarHBondContact CE-O 3.38Å; K88-D163 IonicContact NZ-OD1 2.69Å; K88-D163 PolarHBondContact NZ-OD1 3.41Å; K88-D163 IonicContact NZ-OD2 3.65Å; K88-D163 PolarHBondContact NZ-OD2 3.17Å; A161-D163 VanDerWaalsContact CB-OD1 3.28Å; A161-D163 WeakPolarHBondContact CB-OD1 3.3Å; A161-D163 PolarHBondContact O-N 3.21Å; D163-R165 PolarHBondContact O-N 3.01Å; D163-R165 VanDerWaalsContact O-N 3.12Å; D163-E166 HydrophobicContact CB-CB 4.42Å; D163-E166 HydrophobicContact CB-CG 3.96Å; D163-E166 WeakPolarHBondContact O-CB 3.15Å; D163-E166 PolarHBondContact O-N 3.3Å |
| 164 | F | 79.8 | Confident | 84.5 | Confident | 51 Ų | 51 | 70.8 Ų | 70.8 | 22% | 0.224 | 35% | 0.35 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -54.8 | -34.6 | -178.5 | 172.6 | -108.5 | 0 | 0 | 0 | 113.6 | L89 V158 V159 A161 E162 E166 | L89-F164 HydrophobicContact CB-CE2 3.89Å; L89-F164 HydrophobicContact CB-CZ 4.07Å; L89-F164 HydrophobicContact CD1-CE2 4.37Å; L89-F164 HydrophobicContact CD2-CZ 4.4Å; V158-F164 HydrophobicContact CG1-CD2 4.02Å; V158-F164 HydrophobicContact CG1-CE2 4.2Å; V158-F164 WeakPolarHBondContact O-CD2 3.13Å; V159-F164 HydrophobicContact CB-CE2 4.49Å; V159-F164 HydrophobicContact CG2-CE2 4.07Å; V159-F164 HydrophobicContact CG2-CZ 4.43Å; A161-F164 WeakPolarHBondContact O-CB 3.47Å; A161-F164 PolarHBondContact O-N 3.41Å; A161-F164 VanDerWaalsContact O-N 3.11Å; E162-F164 VanDerWaalsContact C-N 3.31Å; E162-F164 PolarHBondContact O-N 3.33Å; F164-E166 VanDerWaalsContact C-N 3.34Å |
| 165 | R | 76.7 | Confident | 84 | Confident | 224 Ų | 224 | 76 Ų | 76 | 85% | 0.845 | 38% | 0.375 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -85.6 | -5.7 | -179.9 | -66 | -173.2 | 179.3 | -168.8 | 0.5 | 113.5 | D163 | D163-R165 PolarHBondContact O-N 3.01Å; D163-R165 VanDerWaalsContact O-N 3.12Å |
| 166 | E | 80 | Confident | 83.6 | Confident | 126 Ų | 126 | 72.5 Ų | 72.5 | 59% | 0.589 | 36% | 0.362 | S | S | * | . | trans | -67.9 | 138.8 | 175.4 | -64.6 | -171.7 | 175 | 0 | 0 | 110.2 | D163 F164 | D163-E166 HydrophobicContact CB-CB 4.42Å; D163-E166 HydrophobicContact CB-CG 3.96Å; D163-E166 WeakPolarHBondContact O-CB 3.15Å; D163-E166 PolarHBondContact O-N 3.3Å; F164-E166 VanDerWaalsContact C-N 3.34Å | ||
| 167 | L | 79.3 | Confident | 83.3 | Confident | 116 Ų | 116 | 69.2 Ų | 69.2 | 61% | 0.607 | 34% | 0.343 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -89.8 | 122.6 | -177.1 | -84.6 | 158.6 | 0 | 0 | 0 | 108 | P85 M86 | P85-L167 HydrophobicContact CB-CB 4.05Å; P85-L167 HydrophobicContact CB-CD2 4.11Å; P85-L167 HydrophobicContact CG-CD2 4.31Å; P85-L167 WeakPolarHBondContact O-CD2 3.31Å; M86-L167 CarbonylContact O-C 3.59Å; M86-L167 WeakPolarHBondContact O-CA 3.31Å |
| 168 | T | 78.3 | Confident | 83 | Confident | 20 Ų | 20 | 68.7 Ų | 68.7 | 12% | 0.123 | 34% | 0.339 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -109.5 | 141.8 | 176.7 | -176.1 | 0 | 0 | 0 | 0 | 110.6 | M86 C91 S170 | M86-T168 PolarHBondContact N-O 2.89Å; M86-T168 PolarHBondContact O-N 2.86Å; C91-T168 VanDerWaalsContact SG-CG2 3.51Å; T168-S170 WeakPolarHBondContact CG2-O 3.41Å; T168-S170 PolarHBondContact OG1-N 3.24Å; T168-S170 PolarHBondContact OG1-O 3.15Å |
| 169 | T | 72.5 | Confident | 82.7 | Confident | 107 Ų | 107 | 71.4 Ų | 71.4 | 66% | 0.656 | 37% | 0.367 | S | S | * | . | S | Bend | trans | -87.5 | -22.9 | 173.1 | 52.1 | 0 | 0 | 0 | 0 | 112.1 | P85 | P85-T169 HydrophobicContact CB-CG2 4.3Š|
| 170 | S | 77.8 | Confident | 82.5 | Confident | 23 Ų | 23 | 75.3 Ų | 75.3 | 16% | 0.161 | 39% | 0.385 | C | S | . | . | trans | -113.9 | 133.6 | 178.6 | -59.6 | 0 | 0 | 0 | 0 | 110.4 | D74 T168 | D74-S170 WeakPolarHBondContact OD1-CB 3.4Å; D74-S170 PolarHBondContact OD1-OG 3.27Å; D74-S170 PolarHBondContact OD2-OG 2.88Å; T168-S170 WeakPolarHBondContact CG2-O 3.41Å; T168-S170 PolarHBondContact OG1-N 3.24Å; T168-S170 PolarHBondContact OG1-O 3.15Å | ||
| 171 | C | 81.3 | Confident | 82.4 | Confident | 6 Ų | 6 | 70.1 Ų | 70.1 | 4% | 0.041 | 36% | 0.357 | C | S | . | . | trans | -99.8 | 24.6 | -178.4 | -62.8 | 0 | 0 | 0 | 0 | 113 | T77 C91 | T77-C171 HydrophobicContact CG2-CB 4.17Å; C91-C171 WeakPolarHBondContact CA-SG 3.14Å; C91-C171 HydrophobicContact CB-CB 3.54Å; C91-C171 WeakPolarHBondContact CB-SG 3.5Å; C91-C171 VanDerWaalsContact SG-CA 3.52Å; C91-C171 WeakPolarHBondContact SG-CB 3.49Å; C91-C171 CovalentContact SG-SG 2.05Å; C91-C171 PolarHBondContact SG-SG 3.06Å | ||
| 172 | F | 83 | Confident | 82.3 | Confident | 41 Ų | 41 | 70.4 Ų | 70.4 | 18% | 0.18 | 36% | 0.356 | C | S | . | . | trans | -59.1 | 141.4 | 174.3 | -80.2 | -77.8 | 0 | 0 | 0 | 111.4 | D21 E72 D74 R174 M175 V176 | D21-F172 WeakPolarHBondContact OD1-CZ 3.27Å; E72-F172 HydrophobicContact CB-CD1 4.11Å; E72-F172 HydrophobicContact CB-CE1 3.93Å; E72-F172 HydrophobicContact CG-CD1 4.48Å; E72-F172 VanDerWaalsContact OE2-CA 3.23Å; E72-F172 WeakPolarHBondContact OE2-CA 3.12Å; E72-F172 WeakPolarHBondContact OE2-CD1 3.44Å; D74-F172 HydrophobicContact CB-CE2 3.97Å; D74-F172 HydrophobicContact CB-CZ 4.39Å; D74-F172 WeakPolarHBondContact OD1-CD2 3.46Å; D74-F172 WeakPolarHBondContact OD1-CE2 3.34Å; D74-F172 VanDerWaalsContact OD2-CE2 3.27Å; D74-F172 WeakPolarHBondContact OD2-CE2 3.24Å; F172-R174 PolarHBondContact O-N 2.96Å; F172-R174 VanDerWaalsContact O-N 3.09Å; F172-M175 HydrophobicContact CB-CG 4.06Å; F172-M175 PolarHBondContact O-N 2.76Å; F172-V176 WeakPolarHBondContact O-CG2 3.39Å; F172-V176 PolarHBondContact O-N 3.38Å | ||
| 173 | F | 84.8 | Confident | 82.4 | Confident | 20 Ų | 20 | 60.5 Ų | 60.5 | 9% | 0.088 | 31% | 0.31 | C | S | . | . | H | α-helix | trans | -53 | -39 | -178.8 | 173 | -114.3 | 0 | 0 | 0 | 113.1 | E72 Y101 M102 M175 V176 A177 F181 I182 | E72-F173 WeakPolarHBondContact OE1-CB 3.29Å; E72-F173 PolarHBondContact OE1-N 3.39Å; E72-F173 PolarHBondContact OE2-N 3.27Å; Y101-F173 HydrophobicContact CD2-CB 4.45Å; M102-F173 HydrophobicContact CE-CE1 3.99Å; M102-F173 HydrophobicContact CE-CE2 3.69Å; M102-F173 HydrophobicContact CE-CZ 3.22Å; F173-M175 VanDerWaalsContact C-N 3.28Å; F173-M175 PolarHBondContact O-N 3.32Å; F173-V176 PolarHBondContact O-N 3.48Å; F173-A177 HydrophobicContact CD2-CB 4.03Å; F173-A177 HydrophobicContact CE2-CB 3.5Å; F173-A177 VanDerWaalsContact CE2-CB 3.5Å; F173-A177 HydrophobicContact CZ-CB 3.81Å; F173-A177 WeakPolarHBondContact O-CB 3.3Å; F173-A177 PolarHBondContact O-N 2.92Å; F173-F181 HydrophobicContact CZ-CE1 4.36Å; F173-I182 HydrophobicContact CE1-CG1 4.06Å; F173-I182 HydrophobicContact CZ-CG1 4.2Å |
| 174 | R | 82.6 | Confident | 82.8 | Confident | 92 Ų | 92 | 64 Ų | 64 | 35% | 0.347 | 32% | 0.32 | S | S | . | . | H | α-helix | trans | -65.3 | -26 | 178.1 | -68.8 | -179 | 176.2 | -176.9 | -7.8 | 114.6 | F172 E250 S264 D265 | F172-R174 PolarHBondContact O-N 2.96Å; F172-R174 VanDerWaalsContact O-N 3.09Å; R174-E250 IonicContact CZ-OE2 3.73Å; R174-E250 IonicContact NH2-OE1 2.58Å; R174-E250 PolarHBondContact NH2-OE1 3.46Å; R174-E250 IonicContact NH2-OE2 2.98Å; R174-E250 PolarHBondContact NH2-OE2 3.21Å; R174-S264 PolarHBondContact NH1-OG 3.17Å; R174-S264 PolarHBondContact NH2-OG 2.9Å; R174-D265 IonicContact CZ-OD1 2.6Å; R174-D265 IonicContact NH1-OD1 2.82Å; R174-D265 PolarHBondContact NH1-OD1 2.96Å |
| 175 | M | 81.3 | Confident | 83.3 | Confident | 109 Ų | 109 | 61.7 Ų | 61.7 | 54% | 0.537 | 31% | 0.31 | S | S | . | . | H | α-helix | trans | -87.7 | -27 | 179.7 | -59.1 | -63.5 | -88.5 | 0 | 0 | 111.5 | F172 F173 | F172-M175 HydrophobicContact CB-CG 4.06Å; F172-M175 PolarHBondContact O-N 2.76Å; F173-M175 VanDerWaalsContact C-N 3.28Å; F173-M175 PolarHBondContact O-N 3.32Å |
| 176 | V | 85.2 | Confident | 83.8 | Confident | 4 Ų | 4 | 51.1 Ų | 51.1 | 2% | 0.024 | 27% | 0.27 | C | S | . | . | H | α-helix | trans | -92.2 | -41.3 | -174.6 | -177.5 | 0 | 0 | 0 | 0 | 111.8 | K88 C91 M92 F172 F173 | K88-V176 HydrophobicContact CB-CG1 3.97Å; K88-V176 WeakPolarHBondContact O-CG1 3.37Å; C91-V176 HydrophobicContact CB-CG1 4.41Å; C91-V176 HydrophobicContact CB-CG2 3.71Å; M92-V176 HydrophobicContact CE-CG1 3.97Å; M92-V176 HydrophobicContact CG-CG1 3.45Å; M92-V176 VanDerWaalsContact CG-CG1 3.45Å; M92-V176 HydrophobicContact SD-CG1 4.31Å; F172-V176 WeakPolarHBondContact O-CG2 3.39Å; F172-V176 PolarHBondContact O-N 3.38Å; F173-V176 PolarHBondContact O-N 3.48Å |
| 177 | A | 86.7 | Confident | 84.3 | Confident | 5 Ų | 5 | 48.3 Ų | 48.3 | 4% | 0.041 | 26% | 0.259 | C | S | . | . | S | Bend | trans | -84.2 | 139.9 | -179.5 | 0 | 0 | 0 | 0 | 0 | 111.8 | F173 F181 I182 | F173-A177 HydrophobicContact CD2-CB 4.03Å; F173-A177 HydrophobicContact CE2-CB 3.5Å; F173-A177 VanDerWaalsContact CE2-CB 3.5Å; F173-A177 HydrophobicContact CZ-CB 3.81Å; F173-A177 WeakPolarHBondContact O-CB 3.3Å; F173-A177 PolarHBondContact O-N 2.92Å; A177-F181 HydrophobicContact CB-CD1 4.35Å; A177-I182 HydrophobicContact CB-CD1 4.12Å; A177-I182 HydrophobicContact CB-CG1 3.91Å |
| 178 | P | 87.1 | Confident | 84.9 | Confident | 21 Ų | 21 | 44.3 Ų | 44.3 | 14% | 0.136 | 24% | 0.24 | C | C | . | . | trans | -59.8 | 142.5 | 175 | -25.2 | 36 | 0 | 0 | 0 | 112 | S157 A161 D180 F181 I182 | S157-P178 WeakPolarHBondContact O-CG 3.19Å; A161-P178 HydrophobicContact CB-CG 3.71Å; P178-D180 VanDerWaalsContact C-N 3.26Å; P178-D180 PolarHBondContact O-N 3.34Å; P178-F181 WeakPolarHBondContact O-CB 3.36Å; P178-F181 PolarHBondContact O-N 3.18Å; P178-I182 PolarHBondContact O-N 3.47Å | ||
| 179 | G | 83.3 | Confident | 85.5 | Confident | 57 Ų | 57 | 43.4 Ų | 43.4 | 59% | 0.588 | 23% | 0.234 | S | C | * | . | H | α-helix | trans | -53.3 | -41.9 | 179.5 | 0 | 0 | 0 | 0 | 0 | 113.2 | F181 I182 G183 | G179-F181 VanDerWaalsContact C-N 3.31Å; G179-F181 PolarHBondContact O-N 3.47Å; G179-I182 PolarHBondContact O-N 3.11Å; G179-G183 PolarHBondContact O-N 2.85Å |
| 180 | D | 86.1 | Confident | 86.3 | Confident | 150 Ų | 150 | 38.9 Ų | 38.9 | 80% | 0.802 | 21% | 0.206 | S | C | * | . | H | α-helix | trans | -60 | -40.2 | 177.3 | -66.7 | -21.2 | 0 | 0 | 0 | 112.5 | P178 G183 Y184 | P178-D180 VanDerWaalsContact C-N 3.26Å; P178-D180 PolarHBondContact O-N 3.34Å; D180-G183 PolarHBondContact O-N 3.33Å; D180-Y184 WeakPolarHBondContact O-CB 3.32Å; D180-Y184 PolarHBondContact O-N 3.29Å |
| 181 | F | 90.2 | Very high | 87 | Confident | 16 Ų | 16 | 41.4 Ų | 41.4 | 7% | 0.07 | 22% | 0.221 | C | C | . | . | H | α-helix | trans | -68.7 | -41.8 | 177 | 179.9 | -93.7 | 0 | 0 | 0 | 111.4 | M102 C154 S157 F173 A177 P178 G179 G183 Y184 Y185 | M102-F181 HydrophobicContact CE-CE1 3.81Å; M102-F181 HydrophobicContact CE-CZ 4.44Å; M102-F181 HydrophobicContact SD-CE1 4.06Å; M102-F181 HydrophobicContact SD-CZ 4.09Å; C154-F181 HydrophobicContact CB-CD1 4.41Å; C154-F181 HydrophobicContact CB-CE1 3.53Å; C154-F181 HydrophobicContact CB-CE2 4.14Å; C154-F181 HydrophobicContact CB-CZ 3.37Å; C154-F181 WeakPolarHBondContact SG-CE1 3.36Å; S157-F181 WeakPolarHBondContact OG-CB 3.29Å; F173-F181 HydrophobicContact CZ-CE1 4.36Å; A177-F181 HydrophobicContact CB-CD1 4.35Å; P178-F181 WeakPolarHBondContact O-CB 3.36Å; P178-F181 PolarHBondContact O-N 3.18Å; G179-F181 VanDerWaalsContact C-N 3.31Å; G179-F181 PolarHBondContact O-N 3.47Å; F181-G183 VanDerWaalsContact C-N 3.31Å; F181-G183 PolarHBondContact O-N 3.32Å; F181-Y184 PolarHBondContact O-N 3.48Å; F181-Y185 VanDerWaalsContact O-CB 3.28Å; F181-Y185 WeakPolarHBondContact O-CB 3.23Å; F181-Y185 PolarHBondContact O-N 3.4Å |
| 182 | I | 87 | Confident | 87.5 | Confident | 25 Ų | 25 | 42.8 Ų | 42.8 | 13% | 0.128 | 23% | 0.227 | C | C | . | . | H | α-helix | trans | -60.5 | -45.2 | 175.5 | -63.2 | 170.4 | 0 | 0 | 0 | 109.7 | F173 A177 P178 G179 Y184 Y185 C186 | F173-I182 HydrophobicContact CE1-CG1 4.06Å; F173-I182 HydrophobicContact CZ-CG1 4.2Å; A177-I182 HydrophobicContact CB-CD1 4.12Å; A177-I182 HydrophobicContact CB-CG1 3.91Å; P178-I182 PolarHBondContact O-N 3.47Å; G179-I182 PolarHBondContact O-N 3.11Å; I182-Y184 PolarHBondContact O-N 3.08Å; I182-Y185 PolarHBondContact O-N 2.97Å; I182-C186 WeakPolarHBondContact O-CB 3.32Å; I182-C186 PolarHBondContact O-N 2.86Å; I182-C186 PolarHBondContact O-SG 3.34Å; I182-C186 VanDerWaalsContact O-SG 3.37Å |
| 183 | G | 85.4 | Confident | 87.8 | Confident | 4 Ų | 4 | 40.9 Ų | 40.9 | 4% | 0.041 | 22% | 0.219 | C | C | . | . | H | α-helix | trans | -58.8 | -46 | 175.7 | 0 | 0 | 0 | 0 | 0 | 112.7 | G179 D180 F181 L187 | G179-G183 PolarHBondContact O-N 2.85Å; D180-G183 PolarHBondContact O-N 3.33Å; F181-G183 VanDerWaalsContact C-N 3.31Å; F181-G183 PolarHBondContact O-N 3.32Å; G183-L187 WeakPolarHBondContact O-CB 3.37Å; G183-L187 PolarHBondContact O-N 3.11Å |
| 184 | Y | 89.8 | Confident | 88.1 | Confident | 127 Ų | 127 | 44 Ų | 44 | 50% | 0.498 | 24% | 0.236 | S | C | . | . | H | α-helix | trans | -62.7 | -44.9 | 174.6 | 174.8 | -99.7 | 0 | 0 | 0 | 112.3 | M150 D180 F181 I182 L187 V188 | M150-Y184 HydrophobicContact CE-CD1 4.5Å; M150-Y184 HydrophobicContact CE-CE1 4.18Å; M150-Y184 HydrophobicContact SD-CE1 4.34Å; D180-Y184 WeakPolarHBondContact O-CB 3.32Å; D180-Y184 PolarHBondContact O-N 3.29Å; F181-Y184 PolarHBondContact O-N 3.48Å; I182-Y184 PolarHBondContact O-N 3.08Å; Y184-L187 WeakPolarHBondContact O-CB 3.12Å; Y184-L187 PolarHBondContact O-N 2.68Å; Y184-V188 HydrophobicContact CD1-CG2 4.3Å; Y184-V188 HydrophobicContact CE1-CG2 3.81Å; Y184-V188 HydrophobicContact CE2-CG2 4.06Å; Y184-V188 WeakPolarHBondContact O-CG2 3.23Å; Y184-V188 PolarHBondContact O-N 3.46Å |
| 185 | Y | 90.6 | Very high | 88.6 | Confident | 2 Ų | 2 | 41.8 Ų | 41.8 | 1% | 0.008 | 24% | 0.235 | C | C | . | . | H | α-helix | trans | -59 | -49.9 | 177.4 | 173.8 | -117.3 | 0 | 0 | 0 | 111.2 | Y101 M102 Q105 M106 M150 F181 I182 L187 V188 L189 | Y101-Y185 PolarHBondContact O-OH 3.43Å; M102-Y185 HydrophobicContact CE-CD1 3.72Å; M102-Y185 HydrophobicContact CE-CD2 3.7Å; M102-Y185 HydrophobicContact CE-CE1 3.61Å; M102-Y185 HydrophobicContact CE-CE2 3.61Å; M102-Y185 HydrophobicContact CE-CG 3.73Å; M102-Y185 HydrophobicContact SD-CD1 4.49Å; M102-Y185 HydrophobicContact SD-CD2 3.36Å; M102-Y185 WeakPolarHBondContact SD-CD2 3.18Å; M102-Y185 HydrophobicContact SD-CE1 4.36Å; M102-Y185 HydrophobicContact SD-CE2 3.2Å; M102-Y185 WeakPolarHBondContact SD-CE2 3.39Å; M102-Y185 HydrophobicContact SD-CG 4.02Å; Q105-Y185 PolarHBondContact NE2-OH 3.47Å; M106-Y185 HydrophobicContact CE-CE2 4.12Å; M150-Y185 HydrophobicContact CE-CD2 3.67Å; M150-Y185 HydrophobicContact CE-CE2 4.44Å; F181-Y185 VanDerWaalsContact O-CB 3.28Å; F181-Y185 WeakPolarHBondContact O-CB 3.23Å; F181-Y185 PolarHBondContact O-N 3.4Å; I182-Y185 PolarHBondContact O-N 2.97Å; Y185-L187 VanDerWaalsContact C-N 3.31Å; Y185-L187 PolarHBondContact O-N 3.49Å; Y185-V188 PolarHBondContact O-N 2.88Å; Y185-L189 HydrophobicContact CD1-CD1 3.93Å; Y185-L189 HydrophobicContact CD2-CD1 4.37Å; Y185-L189 HydrophobicContact CD2-CG 4.28Å; Y185-L189 HydrophobicContact CE1-CD1 3.47Å; Y185-L189 VanDerWaalsContact CE1-CD1 3.47Å; Y185-L189 HydrophobicContact CE1-CG 4.36Å; Y185-L189 HydrophobicContact CE2-CD1 3.96Å; Y185-L189 HydrophobicContact CE2-CD2 3.94Å; Y185-L189 HydrophobicContact CE2-CG 3.99Å; Y185-L189 HydrophobicContact CG-CD1 4.38Å; Y185-L189 WeakPolarHBondContact O-CG 3.3Å; Y185-L189 PolarHBondContact O-N 2.89Å |
| 186 | C | 88 | Confident | 89 | Confident | 2 Ų | 2 | 36.6 Ų | 36.6 | 1% | 0.014 | 21% | 0.209 | C | C | . | . | H | α-helix | trans | -61.1 | -37.5 | 176.7 | -72 | 0 | 0 | 0 | 0 | 112.5 | I182 L189 T190 F251 | I182-C186 WeakPolarHBondContact O-CB 3.32Å; I182-C186 PolarHBondContact O-N 2.86Å; I182-C186 PolarHBondContact O-SG 3.34Å; I182-C186 VanDerWaalsContact O-SG 3.37Å; C186-L189 PolarHBondContact O-N 3.32Å; C186-T190 WeakPolarHBondContact O-CB 3Å; C186-T190 PolarHBondContact O-N 3.24Å; C186-T190 PolarHBondContact O-OG1 3.44Å; C186-F251 HydrophobicContact CB-CB 4.3Å |
| 187 | L | 89.8 | Confident | 89.2 | Confident | 68 Ų | 68 | 39.1 Ų | 39.1 | 36% | 0.356 | 22% | 0.222 | S | C | . | . | H | α-helix | trans | -61.7 | -48.6 | 173.3 | 177.3 | 66.1 | 0 | 0 | 0 | 111.3 | G183 Y184 Y185 L189 T190 V191 F251 | G183-L187 WeakPolarHBondContact O-CB 3.37Å; G183-L187 PolarHBondContact O-N 3.11Å; Y184-L187 WeakPolarHBondContact O-CB 3.12Å; Y184-L187 PolarHBondContact O-N 2.68Å; Y185-L187 VanDerWaalsContact C-N 3.31Å; Y185-L187 PolarHBondContact O-N 3.49Å; L187-L189 PolarHBondContact O-N 2.95Å; L187-T190 PolarHBondContact O-N 3.44Å; L187-V191 HydrophobicContact CD1-CG2 4.34Å; L187-V191 WeakPolarHBondContact O-CG2 3.18Å; L187-V191 PolarHBondContact O-N 3.24Å; L187-F251 HydrophobicContact CB-CD2 4.08Å; L187-F251 HydrophobicContact CB-CE2 3.81Å; L187-F251 HydrophobicContact CD1-CD2 4.33Å; L187-F251 HydrophobicContact CD1-CE2 3.53Å; L187-F251 HydrophobicContact CD1-CZ 3.75Å; L187-F251 HydrophobicContact CG-CE2 4.24Å |
| 188 | V | 92.6 | Very high | 89.4 | Confident | 32 Ų | 32 | 44.5 Ų | 44.5 | 19% | 0.194 | 25% | 0.249 | C | C | . | . | H | α-helix | trans | -58.8 | -48.3 | 177.9 | 171.3 | 0 | 0 | 0 | 0 | 110.6 | M106 Y184 Y185 T190 V191 L192 | M106-V188 HydrophobicContact CE-CG1 4.13Å; Y184-V188 HydrophobicContact CD1-CG2 4.3Å; Y184-V188 HydrophobicContact CE1-CG2 3.81Å; Y184-V188 HydrophobicContact CE2-CG2 4.06Å; Y184-V188 WeakPolarHBondContact O-CG2 3.23Å; Y184-V188 PolarHBondContact O-N 3.46Å; Y185-V188 PolarHBondContact O-N 2.88Å; V188-T190 VanDerWaalsContact C-N 3.29Å; V188-T190 PolarHBondContact O-N 2.79Å; V188-V191 PolarHBondContact O-N 2.9Å; V188-L192 HydrophobicContact CG1-CD1 3.9Å; V188-L192 HydrophobicContact CG1-CG 4.37Å; V188-L192 VanDerWaalsContact O-CG 3.25Å; V188-L192 WeakPolarHBondContact O-CG 3.24Å; V188-L192 PolarHBondContact O-N 3.49Å |
| 189 | L | 91.1 | Very high | 89.6 | Confident | 0 Ų | 0 | 46.5 Ų | 46.5 | 0% | 0 | 26% | 0.257 | C | S | . | . | H | α-helix | trans | -59.9 | -39.4 | 177.4 | -63.8 | 176.9 | 0 | 0 | 0 | 112.3 | Q105 M106 Y109 Y185 C186 L187 L192 S193 | Q105-L189 HydrophobicContact CB-CD2 4.1Å; M106-L189 HydrophobicContact CE-CD2 3.34Å; M106-L189 HydrophobicContact CE-CG 4.36Å; Y109-L189 HydrophobicContact CD2-CD2 3.66Å; Y109-L189 HydrophobicContact CE2-CB 4.28Å; Y109-L189 HydrophobicContact CE2-CD2 3.49Å; Y109-L189 VanDerWaalsContact CE2-CD2 3.49Å; Y109-L189 HydrophobicContact CE2-CG 4.37Å; Y185-L189 HydrophobicContact CD1-CD1 3.93Å; Y185-L189 HydrophobicContact CD2-CD1 4.37Å; Y185-L189 HydrophobicContact CD2-CG 4.28Å; Y185-L189 HydrophobicContact CE1-CD1 3.47Å; Y185-L189 VanDerWaalsContact CE1-CD1 3.47Å; Y185-L189 HydrophobicContact CE1-CG 4.36Å; Y185-L189 HydrophobicContact CE2-CD1 3.96Å; Y185-L189 HydrophobicContact CE2-CD2 3.94Å; Y185-L189 HydrophobicContact CE2-CG 3.99Å; Y185-L189 HydrophobicContact CG-CD1 4.38Å; Y185-L189 WeakPolarHBondContact O-CG 3.3Å; Y185-L189 PolarHBondContact O-N 2.89Å; C186-L189 PolarHBondContact O-N 3.32Å; L187-L189 PolarHBondContact O-N 2.95Å; L189-L192 PolarHBondContact O-N 2.88Å; L189-S193 WeakPolarHBondContact O-CB 3.43Å; L189-S193 PolarHBondContact O-N 3.27Å; L189-S193 PolarHBondContact O-OG 3.33Å |
| 190 | T | 88.8 | Confident | 89.8 | Confident | 12 Ų | 12 | 45.4 Ų | 45.4 | 7% | 0.074 | 24% | 0.236 | C | C | . | . | H | α-helix | trans | -66.1 | -45.2 | 177.8 | -62.1 | 0 | 0 | 0 | 0 | 111.3 | C186 L187 V188 L192 S193 L194 I248 F251 | C186-T190 WeakPolarHBondContact O-CB 3Å; C186-T190 PolarHBondContact O-N 3.24Å; C186-T190 PolarHBondContact O-OG1 3.44Å; L187-T190 PolarHBondContact O-N 3.44Å; V188-T190 VanDerWaalsContact C-N 3.29Å; V188-T190 PolarHBondContact O-N 2.79Å; T190-L192 VanDerWaalsContact C-N 3.34Å; T190-L192 PolarHBondContact O-N 3.49Å; T190-S193 WeakPolarHBondContact O-CB 3.23Å; T190-S193 PolarHBondContact O-N 2.9Å; T190-L194 HydrophobicContact CG2-CD1 4.21Å; T190-L194 WeakPolarHBondContact O-CG 3.27Å; T190-L194 PolarHBondContact O-N 3.29Å; T190-I248 HydrophobicContact CG2-CG1 4.17Å; T190-F251 HydrophobicContact CG2-CD1 4.45Å; T190-F251 WeakPolarHBondContact OG1-CB 3.23Å |
| 191 | V | 92.3 | Very high | 89.8 | Confident | 77 Ų | 77 | 42.3 Ų | 42.3 | 47% | 0.467 | 22% | 0.223 | S | C | . | . | H | α-helix | trans | -61.5 | -43 | 175.9 | 171.4 | 0 | 0 | 0 | 0 | 111 | L187 V188 L194 S195 | L187-V191 HydrophobicContact CD1-CG2 4.34Å; L187-V191 WeakPolarHBondContact O-CG2 3.18Å; L187-V191 PolarHBondContact O-N 3.24Å; V188-V191 PolarHBondContact O-N 2.9Å; V191-L194 PolarHBondContact O-N 2.84Å; V191-S195 WeakPolarHBondContact O-CB 3.5Å; V191-S195 PolarHBondContact O-N 3.12Å; V191-S195 PolarHBondContact O-OG 2.82Å |
| 192 | L | 92.9 | Very high | 89.8 | Confident | 35 Ų | 35 | 47 Ų | 47 | 18% | 0.183 | 24% | 0.241 | C | C | . | . | H | α-helix | trans | -64.1 | -41.8 | 175.5 | -65.8 | 172 | 0 | 0 | 0 | 111.4 | M106 Y109 I113 V188 L189 T190 S195 V196 | M106-L192 HydrophobicContact CE-CD1 3.95Å; M106-L192 HydrophobicContact SD-CD1 4Å; Y109-L192 HydrophobicContact CD1-CB 3.74Å; Y109-L192 HydrophobicContact CE1-CB 4.39Å; Y109-L192 HydrophobicContact CG-CB 4.03Å; Y109-L192 HydrophobicContact CG-CD1 4.24Å; I113-L192 HydrophobicContact CD1-CB 4.41Å; I113-L192 HydrophobicContact CD1-CD2 3.51Å; V188-L192 HydrophobicContact CG1-CD1 3.9Å; V188-L192 HydrophobicContact CG1-CG 4.37Å; V188-L192 VanDerWaalsContact O-CG 3.25Å; V188-L192 WeakPolarHBondContact O-CG 3.24Å; V188-L192 PolarHBondContact O-N 3.49Å; L189-L192 PolarHBondContact O-N 2.88Å; T190-L192 VanDerWaalsContact C-N 3.34Å; T190-L192 PolarHBondContact O-N 3.49Å; L192-S195 WeakPolarHBondContact O-CB 3.41Å; L192-S195 PolarHBondContact O-N 3.21Å; L192-V196 WeakPolarHBondContact O-CG2 3.02Å; L192-V196 PolarHBondContact O-N 3.42Å |
| 193 | S | 89.6 | Confident | 89.7 | Confident | 0 Ų | 0 | 45.9 Ų | 45.9 | 0% | 0 | 24% | 0.236 | C | C | . | . | H | α-helix | trans | -57.4 | -51.6 | 175.6 | -63.5 | 0 | 0 | 0 | 0 | 112 | Y109 L189 T190 S195 V196 I197 C244 | Y109-S193 WeakPolarHBondContact CE1-OG 3.21Å; Y109-S193 PolarHBondContact OH-OG 2.68Å; L189-S193 WeakPolarHBondContact O-CB 3.43Å; L189-S193 PolarHBondContact O-N 3.27Å; L189-S193 PolarHBondContact O-OG 3.33Å; T190-S193 WeakPolarHBondContact O-CB 3.23Å; T190-S193 PolarHBondContact O-N 2.9Å; S193-S195 VanDerWaalsContact C-N 3.32Å; S193-S195 PolarHBondContact O-N 2.89Å; S193-V196 PolarHBondContact O-N 3.25Å; S193-I197 WeakPolarHBondContact O-CG1 3.27Å; S193-I197 PolarHBondContact O-N 3.19Å; S193-C244 VanDerWaalsContact CB-SG 3.54Å; S193-C244 PolarHBondContact OG-SG 3.37Å |
| 194 | L | 90.3 | Very high | 89.5 | Confident | 85 Ų | 85 | 49.4 Ų | 49.4 | 45% | 0.445 | 26% | 0.256 | S | S | . | . | H | α-helix | trans | -63.2 | -40.5 | 178.6 | -67.5 | 174.6 | 0 | 0 | 0 | 111.1 | T190 V191 V196 I197 I198 | T190-L194 HydrophobicContact CG2-CD1 4.21Å; T190-L194 WeakPolarHBondContact O-CG 3.27Å; T190-L194 PolarHBondContact O-N 3.29Å; V191-L194 PolarHBondContact O-N 2.84Å; L194-V196 VanDerWaalsContact C-N 3.33Å; L194-V196 PolarHBondContact O-N 2.95Å; L194-I197 PolarHBondContact O-N 2.98Å; L194-I198 WeakPolarHBondContact O-CB 3.47Å; L194-I198 VanDerWaalsContact O-CG1 3.26Å; L194-I198 WeakPolarHBondContact O-CG1 3.19Å; L194-I198 PolarHBondContact O-N 3.38Å |
| 195 | S | 92.1 | Very high | 89.2 | Confident | 47 Ų | 47 | 48.4 Ų | 48.4 | 33% | 0.329 | 25% | 0.252 | S | S | . | . | H | α-helix | trans | -59.8 | -42.6 | 176 | -60.4 | 0 | 0 | 0 | 0 | 111.9 | V191 L192 S193 M199 | V191-S195 WeakPolarHBondContact O-CB 3.5Å; V191-S195 PolarHBondContact O-N 3.12Å; V191-S195 PolarHBondContact O-OG 2.82Å; L192-S195 WeakPolarHBondContact O-CB 3.41Å; L192-S195 PolarHBondContact O-N 3.21Å; S193-S195 VanDerWaalsContact C-N 3.32Å; S193-S195 PolarHBondContact O-N 2.89Å; S195-M199 VanDerWaalsContact O-CB 3.29Å; S195-M199 WeakPolarHBondContact O-CB 3.09Å; S195-M199 WeakPolarHBondContact O-CG 3.45Å; S195-M199 PolarHBondContact O-N 3.46Å |
| 196 | V | 90.6 | Very high | 88.8 | Confident | 0 Ų | 0 | 49.8 Ų | 49.8 | 0% | 0 | 26% | 0.26 | C | S | . | . | H | α-helix | trans | -62.9 | -46.3 | 174.7 | 171.1 | 0 | 0 | 0 | 0 | 111 | M112 I113 L192 S193 L194 M199 F200 I236 | M112-V196 HydrophobicContact CB-CB 4.49Å; M112-V196 HydrophobicContact CB-CG1 3.95Å; M112-V196 HydrophobicContact CB-CG2 3.64Å; M112-V196 HydrophobicContact SD-CG1 4.24Å; I113-V196 HydrophobicContact CD1-CG2 4.43Å; I113-V196 HydrophobicContact CG1-CG2 3.45Å; I113-V196 VanDerWaalsContact CG1-CG2 3.45Å; L192-V196 WeakPolarHBondContact O-CG2 3.02Å; L192-V196 PolarHBondContact O-N 3.42Å; S193-V196 PolarHBondContact O-N 3.25Å; L194-V196 VanDerWaalsContact C-N 3.33Å; L194-V196 PolarHBondContact O-N 2.95Å; V196-M199 PolarHBondContact O-N 3Å; V196-F200 WeakPolarHBondContact O-CB 3.42Å; V196-F200 PolarHBondContact O-N 3.41Å; V196-I236 HydrophobicContact CG1-CG1 4.45Å; V196-I236 HydrophobicContact CG1-CG2 3.77Å |
| 197 | I | 89 | Confident | 88.2 | Confident | 56 Ų | 56 | 52.4 Ų | 52.4 | 29% | 0.287 | 28% | 0.275 | S | S | . | . | H | α-helix | trans | -62.5 | -45.8 | -179.3 | -67.3 | 165.7 | 0 | 0 | 0 | 110.9 | S193 L194 F200 T201 V240 | S193-I197 WeakPolarHBondContact O-CG1 3.27Å; S193-I197 PolarHBondContact O-N 3.19Å; L194-I197 PolarHBondContact O-N 2.98Å; I197-F200 PolarHBondContact O-N 2.99Å; I197-T201 VanDerWaalsContact O-CB 3.31Å; I197-T201 WeakPolarHBondContact O-CB 3.45Å; I197-T201 PolarHBondContact O-N 3.39Å; I197-T201 PolarHBondContact O-OG1 2.81Å; I197-V240 HydrophobicContact CD1-CG1 4.39Å; I197-V240 HydrophobicContact CG1-CG2 4.04Å |
| 198 | I | 92 | Very high | 87.5 | Confident | 118 Ų | 118 | 53 Ų | 53 | 61% | 0.605 | 29% | 0.285 | S | S | * | . | H | α-helix | trans | -62.5 | -50.1 | 178.7 | -68.4 | 165.6 | 0 | 0 | 0 | 110.1 | L194 F200 T201 Y202 | L194-I198 WeakPolarHBondContact O-CB 3.47Å; L194-I198 VanDerWaalsContact O-CG1 3.26Å; L194-I198 WeakPolarHBondContact O-CG1 3.19Å; L194-I198 PolarHBondContact O-N 3.38Å; I198-F200 VanDerWaalsContact C-N 3.32Å; I198-F200 PolarHBondContact O-N 3.34Å; I198-T201 PolarHBondContact O-N 2.92Å; I198-Y202 WeakPolarHBondContact O-CB 3.46Å; I198-Y202 PolarHBondContact O-N 3.48Å |
| 199 | M | 90.4 | Very high | 86.7 | Confident | 63 Ų | 63 | 60 Ų | 60 | 31% | 0.31 | 31% | 0.308 | S | S | . | . | H | α-helix | trans | -63.3 | -38.9 | 179.9 | -73.2 | -68.2 | -71 | 0 | 0 | 112.2 | V120 S195 V196 Y202 A203 | V120-M199 HydrophobicContact CB-CE 4.41Å; V120-M199 HydrophobicContact CG2-CE 3.94Å; S195-M199 VanDerWaalsContact O-CB 3.29Å; S195-M199 WeakPolarHBondContact O-CB 3.09Å; S195-M199 WeakPolarHBondContact O-CG 3.45Å; S195-M199 PolarHBondContact O-N 3.46Å; V196-M199 PolarHBondContact O-N 3Å; M199-Y202 PolarHBondContact O-N 3.49Å; M199-A203 WeakPolarHBondContact O-CB 3.17Å; M199-A203 PolarHBondContact O-N 3.01Å |
| 200 | F | 86.6 | Confident | 85.6 | Confident | 35 Ų | 35 | 64.1 Ų | 64.1 | 15% | 0.154 | 32% | 0.324 | C | S | . | . | H | α-helix | trans | -68 | -45.3 | 177.2 | -178.8 | -109.8 | 0 | 0 | 0 | 111.8 | M119 V196 I197 I198 Y202 A203 V204 I236 I237 | M119-F200 HydrophobicContact CE-CD2 3.78Å; M119-F200 HydrophobicContact CE-CE2 4.15Å; V196-F200 WeakPolarHBondContact O-CB 3.42Å; V196-F200 PolarHBondContact O-N 3.41Å; I197-F200 PolarHBondContact O-N 2.99Å; I198-F200 VanDerWaalsContact C-N 3.32Å; I198-F200 PolarHBondContact O-N 3.34Å; F200-Y202 VanDerWaalsContact C-N 3.28Å; F200-Y202 PolarHBondContact O-N 3.25Å; F200-A203 WeakPolarHBondContact O-CB 3.39Å; F200-A203 PolarHBondContact O-N 3.28Å; F200-A203 VanDerWaalsContact O-N 3.11Å; F200-V204 HydrophobicContact CD1-CG2 4.39Å; F200-V204 HydrophobicContact CE1-CG2 3.95Å; F200-V204 HydrophobicContact CE2-CG2 4.21Å; F200-V204 HydrophobicContact CZ-CG2 3.84Å; F200-V204 WeakPolarHBondContact O-CG2 3.31Å; F200-V204 PolarHBondContact O-N 3.02Å; F200-I236 HydrophobicContact CB-CG2 4.14Å; F200-I236 HydrophobicContact CD1-CG2 4.18Å; F200-I236 HydrophobicContact CD2-CB 4.34Å; F200-I236 HydrophobicContact CD2-CD1 3.59Å; F200-I236 HydrophobicContact CD2-CG2 4.11Å; F200-I236 HydrophobicContact CE2-CD1 4.16Å; F200-I236 HydrophobicContact CG-CD1 4.29Å; F200-I236 HydrophobicContact CG-CG2 3.86Å; F200-I237 HydrophobicContact CE1-CG1 4.36Å; F200-I237 HydrophobicContact CZ-CG1 4.45Å |
| 201 | T | 87.6 | Confident | 84 | Confident | 85 Ų | 85 | 70 Ų | 70 | 52% | 0.521 | 36% | 0.355 | S | S | . | . | H | α-helix | trans | -59.6 | -42.1 | 175.3 | -56 | 0 | 0 | 0 | 0 | 110.7 | I197 I198 V204 Y205 | I197-T201 VanDerWaalsContact O-CB 3.31Å; I197-T201 WeakPolarHBondContact O-CB 3.45Å; I197-T201 PolarHBondContact O-N 3.39Å; I197-T201 PolarHBondContact O-OG1 2.81Å; I198-T201 PolarHBondContact O-N 2.92Å; T201-V204 PolarHBondContact O-N 3.43Å; T201-Y205 WeakPolarHBondContact O-CB 3.3Å; T201-Y205 PolarHBondContact O-N 3.39Å |
| 202 | Y | 89.5 | Confident | 82.1 | Confident | 114 Ų | 114 | 72.2 Ų | 72.2 | 45% | 0.447 | 37% | 0.369 | S | S | . | . | H | α-helix | trans | -62.8 | -41.2 | 174.2 | -174.8 | -112.1 | 0 | 0 | 0 | 112.4 | V120 I198 M199 F200 Y205 L206 | V120-Y202 HydrophobicContact CG1-CD1 3.94Å; V120-Y202 HydrophobicContact CG1-CE1 3.74Å; V120-Y202 HydrophobicContact CG2-CD1 3.87Å; V120-Y202 HydrophobicContact CG2-CE1 4.5Å; I198-Y202 WeakPolarHBondContact O-CB 3.46Å; I198-Y202 PolarHBondContact O-N 3.48Å; M199-Y202 PolarHBondContact O-N 3.49Å; F200-Y202 VanDerWaalsContact C-N 3.28Å; F200-Y202 PolarHBondContact O-N 3.25Å; Y202-Y205 HydrophobicContact CD2-CD1 4.45Å; Y202-Y205 HydrophobicContact CE2-CD1 4.5Å; Y202-Y205 WeakPolarHBondContact O-CB 3.39Å; Y202-Y205 PolarHBondContact O-N 3.47Å; Y202-L206 HydrophobicContact CD1-CD1 3.92Å; Y202-L206 HydrophobicContact CD1-CG 4.41Å; Y202-L206 HydrophobicContact CE1-CD1 3.47Å; Y202-L206 VanDerWaalsContact CE1-CD1 3.47Å; Y202-L206 HydrophobicContact CE1-CG 4.06Å; Y202-L206 HydrophobicContact CE2-CG 4.42Å; Y202-L206 WeakPolarHBondContact O-CG 3.34Å; Y202-L206 PolarHBondContact O-N 2.83Å |
| 203 | A | 83.9 | Confident | 80.2 | Confident | 2 Ų | 2 | 77.1 Ų | 77.1 | 2% | 0.017 | 40% | 0.4 | C | S | . | . | H | α-helix | trans | -64.4 | -40 | 175.1 | 0 | 0 | 0 | 0 | 0 | 112.5 | M119 V120 L123 M199 F200 L206 T207 | M119-A203 HydrophobicContact CB-CB 4.08Å; V120-A203 HydrophobicContact CG2-CB 3.96Å; L123-A203 HydrophobicContact CD1-CB 4.38Å; L123-A203 WeakPolarHBondContact CD1-O 3.36Å; M199-A203 WeakPolarHBondContact O-CB 3.17Å; M199-A203 PolarHBondContact O-N 3.01Å; F200-A203 WeakPolarHBondContact O-CB 3.39Å; F200-A203 PolarHBondContact O-N 3.28Å; F200-A203 VanDerWaalsContact O-N 3.11Å; A203-L206 PolarHBondContact O-N 3.16Å; A203-T207 PolarHBondContact O-N 3.48Å; A203-T207 PolarHBondContact O-OG1 3.1Å |
| 204 | V | 81.7 | Confident | 78.5 | Confident | 77 Ų | 77 | 79.5 Ų | 79.5 | 47% | 0.467 | 42% | 0.419 | S | S | . | . | H | α-helix | trans | -63.7 | -43.8 | 174.2 | 172.5 | 0 | 0 | 0 | 0 | 110.6 | F200 T201 T207 S208 | F200-V204 HydrophobicContact CD1-CG2 4.39Å; F200-V204 HydrophobicContact CE1-CG2 3.95Å; F200-V204 HydrophobicContact CE2-CG2 4.21Å; F200-V204 HydrophobicContact CZ-CG2 3.84Å; F200-V204 WeakPolarHBondContact O-CG2 3.31Å; F200-V204 PolarHBondContact O-N 3.02Å; T201-V204 PolarHBondContact O-N 3.43Å; V204-T207 WeakPolarHBondContact O-CB 3.4Å; V204-T207 PolarHBondContact O-N 3.35Å; V204-T207 VanDerWaalsContact O-N 3.12Å; V204-S208 PolarHBondContact O-N 2.86Å |
| 205 | Y | 84.9 | Confident | 76.8 | Confident | 107 Ų | 107 | 80.8 Ų | 80.8 | 42% | 0.42 | 43% | 0.43 | S | S | . | . | H | α-helix | trans | -61.1 | -43.5 | 175.5 | 173.1 | -101.9 | 0 | 0 | 0 | 112.9 | T201 Y202 T207 S208 R209 | T201-Y205 WeakPolarHBondContact O-CB 3.3Å; T201-Y205 PolarHBondContact O-N 3.39Å; Y202-Y205 HydrophobicContact CD2-CD1 4.45Å; Y202-Y205 HydrophobicContact CE2-CD1 4.5Å; Y202-Y205 WeakPolarHBondContact O-CB 3.39Å; Y202-Y205 PolarHBondContact O-N 3.47Å; Y205-T207 PolarHBondContact O-N 3.03Å; Y205-S208 PolarHBondContact O-N 3.01Å; Y205-S208 PolarHBondContact O-OG 3.39Å; Y205-R209 PolarHBondContact O-N 3Å; Y205-R209 VanDerWaalsContact O-N 3.16Å; Y205-R209 PolarHBondContact OH-NE 3.41Å; Y205-R209 PolarHBondContact OH-NH2 3.46Å |
| 206 | L | 81.2 | Confident | 75.1 | Confident | 31 Ų | 31 | 86.5 Ų | 86.5 | 16% | 0.162 | 45% | 0.452 | C | S | . | . | H | α-helix | trans | -63.4 | -34 | 174 | -74.4 | 177.6 | 0 | 0 | 0 | 111.9 | V120 L123 Y202 A203 R210 | V120-L206 HydrophobicContact CG1-CD1 4.1Å; L123-L206 HydrophobicContact CB-CB 3.96Å; L123-L206 HydrophobicContact CB-CD1 4.13Å; L123-L206 HydrophobicContact CD1-CB 3.68Å; L123-L206 HydrophobicContact CG-CB 4.4Å; Y202-L206 HydrophobicContact CD1-CD1 3.92Å; Y202-L206 HydrophobicContact CD1-CG 4.41Å; Y202-L206 HydrophobicContact CE1-CD1 3.47Å; Y202-L206 VanDerWaalsContact CE1-CD1 3.47Å; Y202-L206 HydrophobicContact CE1-CG 4.06Å; Y202-L206 HydrophobicContact CE2-CG 4.42Å; Y202-L206 WeakPolarHBondContact O-CG 3.34Å; Y202-L206 PolarHBondContact O-N 2.83Å; A203-L206 PolarHBondContact O-N 3.16Å; L206-R210 PolarHBondContact O-N 2.06Å |
| 207 | T | 75.2 | Confident | 73.3 | Confident | 56 Ų | 56 | 94.7 Ų | 94.7 | 34% | 0.344 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -68.3 | -43 | 177.2 | -56.3 | 0 | 0 | 0 | 0 | 111.3 | L123 A203 V204 Y205 R209 R210 | L123-T207 WeakPolarHBondContact CD1-OG1 3.31Å; A203-T207 PolarHBondContact O-N 3.48Å; A203-T207 PolarHBondContact O-OG1 3.1Å; V204-T207 WeakPolarHBondContact O-CB 3.4Å; V204-T207 PolarHBondContact O-N 3.35Å; V204-T207 VanDerWaalsContact O-N 3.12Å; Y205-T207 PolarHBondContact O-N 3.03Å; T207-R209 VanDerWaalsContact C-N 3.31Å; T207-R209 PolarHBondContact O-N 3.45Å; T207-R210 PolarHBondContact O-N 3.36Å; T207-R210 VanDerWaalsContact O-N 3.15Å |
| 208 | S | 76.2 | Confident | 71.8 | Confident | 81 Ų | 81 | 96 Ų | 96 | 57% | 0.566 | 50% | 0.499 | S | S | * | . | H | α-helix | trans | -65.5 | -34.4 | 178.7 | 65.9 | 0 | 0 | 0 | 0 | 112.3 | V204 Y205 R210 | V204-S208 PolarHBondContact O-N 2.86Å; Y205-S208 PolarHBondContact O-N 3.01Å; Y205-S208 PolarHBondContact O-OG 3.39Å; S208-R210 VanDerWaalsContact C-N 3.27Å; S208-R210 PolarHBondContact O-N 2.79Å |
| 209 | R | 75.8 | Confident | 70.1 | Confident | 180 Ų | 180 | 94 Ų | 94 | 68% | 0.679 | 49% | 0.492 | S | S | * | . | H | α-helix | trans | -68.5 | -20.8 | 173.7 | -82.6 | -161.2 | 163 | -154.8 | -2 | 114.6 | Y205 T207 N211 | Y205-R209 PolarHBondContact O-N 3Å; Y205-R209 VanDerWaalsContact O-N 3.16Å; Y205-R209 PolarHBondContact OH-NE 3.41Å; Y205-R209 PolarHBondContact OH-NH2 3.46Å; T207-R209 VanDerWaalsContact C-N 3.31Å; T207-R209 PolarHBondContact O-N 3.45Å; R209-N211 PolarHBondContact O-N 3.03Å |
| 210 | R | 66.9 | Low | 68.5 | Low | 86 Ų | 86 | 96.6 Ų | 96.6 | 33% | 0.325 | 51% | 0.506 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -81.2 | 5.9 | -171 | -162.6 | 165.9 | 154.9 | 179.8 | -15.3 | 114.1 | G122 L206 T207 S208 | G122-R210 PolarHBondContact O-NH1 3.14Å; G122-R210 VanDerWaalsContact O-NH1 3.1Å; L206-R210 PolarHBondContact O-N 2.06Å; T207-R210 PolarHBondContact O-N 3.36Å; T207-R210 VanDerWaalsContact O-N 3.15Å; S208-R210 VanDerWaalsContact C-N 3.27Å; S208-R210 PolarHBondContact O-N 2.79Å |
| 211 | N | 55.3 | Low | 67.2 | Low | 135 Ų | 135 | 101.4 Ų | 101.4 | 72% | 0.722 | 53% | 0.529 | S | S | * | . | trans | -111.7 | 66.6 | -170.5 | -82.2 | -11.7 | 0 | 0 | 0 | 115.8 | R209 | R209-N211 PolarHBondContact O-N 3.03Š| ||
| 212 | T | 51.8 | Low | 66 | Low | 124 Ų | 124 | 99.6 Ų | 99.6 | 76% | 0.761 | 52% | 0.52 | S | S | * | . | S | Bend | trans | -149.5 | -19.3 | 157.4 | 28.1 | 0 | 0 | 0 | 0 | 116.1 | ||
| 213 | V | 53.1 | Low | 64.9 | Low | 138 Ų | 138 | 104 Ų | 104 | 84% | 0.836 | 54% | 0.536 | S | S | * | . | S | Bend | trans | -118.5 | -8.2 | -159.7 | -175.3 | 0 | 0 | 0 | 0 | 116.3 | ||
| 214 | A | 53.4 | Low | 63.9 | Low | 49 Ų | 49 | 111.9 Ų | 111.9 | 41% | 0.405 | 57% | 0.565 | S | S | . | * | trans | -129.5 | 48.3 | -168.2 | 0 | 0 | 0 | 0 | 0 | 115.1 | ||||
| 215 | V | 56 | Low | 63.2 | Low | 112 Ų | 112 | 111.1 Ų | 111.1 | 68% | 0.679 | 56% | 0.556 | S | S | * | * | trans | -80.5 | -22.9 | -159.4 | 177.1 | 0 | 0 | 0 | 0 | 116.1 | T219 | V215-T219 WeakPolarHBondContact O-CG2 3.47Š| ||
| 216 | E | 55.2 | Low | 62.4 | Low | 168 Ų | 168 | 109 Ų | 109 | 79% | 0.785 | 56% | 0.555 | S | S | * | * | S | Bend | trans | -110.9 | -41.7 | -171 | -76.5 | -175 | 144.9 | 0 | 0 | 116.7 | T219 | E216-T219 WeakPolarHBondContact O-CG2 3.22Å; E216-T219 PolarHBondContact O-OG1 3.33Å |
| 217 | I | 53.1 | Low | 61.9 | Low | 171 Ų | 171 | 112.4 Ų | 112.4 | 88% | 0.877 | 57% | 0.572 | S | S | * | * | S | Bend | trans | -91.3 | -18.1 | -174.2 | -59.2 | 174.3 | 0 | 0 | 0 | 112.6 | ||
| 218 | Q | 57.8 | Low | 61.6 | Low | 84 Ų | 84 | 111.7 Ų | 111.7 | 39% | 0.393 | 57% | 0.566 | S | S | . | * | S | Bend | trans | -91.7 | -0.2 | 176.8 | -74 | -172.6 | -1.5 | 0 | 0 | 114.3 | I220 Q221 S222 | Q218-I220 PolarHBondContact O-N 3.16Å; Q218-Q221 PolarHBondContact O-N 3.46Å; Q218-S222 WeakPolarHBondContact O-CA 3.29Å; Q218-S222 WeakPolarHBondContact O-CB 3.24Å; Q218-S222 PolarHBondContact O-N 3.27Å |
| 219 | T | 56.4 | Low | 61.5 | Low | 75 Ų | 75 | 109.6 Ų | 109.6 | 46% | 0.46 | 55% | 0.546 | S | S | . | . | H | α-helix | trans | -55.4 | -45.3 | -171.1 | 52.3 | 0 | 0 | 0 | 0 | 113.6 | V215 E216 R223 | V215-T219 WeakPolarHBondContact O-CG2 3.47Å; E216-T219 WeakPolarHBondContact O-CG2 3.22Å; E216-T219 PolarHBondContact O-OG1 3.33Å; T219-R223 WeakPolarHBondContact O-CB 3.15Å; T219-R223 PolarHBondContact O-N 3.44Å |
| 220 | I | 57.3 | Low | 61.6 | Low | 118 Ų | 118 | 107.8 Ų | 107.8 | 61% | 0.605 | 54% | 0.543 | S | S | * | . | H | α-helix | trans | -73 | -42 | -178.1 | -60.5 | 175.9 | 0 | 0 | 0 | 111.8 | Q218 R224 | Q218-I220 PolarHBondContact O-N 3.16Å; I220-R224 WeakPolarHBondContact O-CG 2.91Å; I220-R224 PolarHBondContact O-N 3.21Å |
| 221 | Q | 59.2 | Low | 62 | Low | 137 Ų | 137 | 105.5 Ų | 105.5 | 64% | 0.64 | 54% | 0.536 | S | S | * | . | H | α-helix | trans | -69.4 | -40.8 | 177.8 | -70.3 | -173.7 | -11 | 0 | 0 | 111.1 | Q218 R224 Q225 | Q218-Q221 PolarHBondContact O-N 3.46Å; Q221-R224 PolarHBondContact O-N 3.16Å; Q221-Q225 WeakPolarHBondContact O-CG 3.41Å; Q221-Q225 PolarHBondContact O-N 3.06Å |
| 222 | S | 61.2 | Low | 63.1 | Low | 47 Ų | 47 | 99.3 Ų | 99.3 | 33% | 0.329 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -58 | -50.8 | 173.2 | -176.7 | 0 | 0 | 0 | 0 | 110.6 | Q218 R224 Q225 T226 | Q218-S222 WeakPolarHBondContact O-CA 3.29Å; Q218-S222 WeakPolarHBondContact O-CB 3.24Å; Q218-S222 PolarHBondContact O-N 3.27Å; S222-R224 VanDerWaalsContact C-N 3.3Å; S222-R224 PolarHBondContact O-N 3.15Å; S222-Q225 CarbonylContact O-C 3.53Å; S222-Q225 WeakPolarHBondContact O-CA 3.38Å; S222-Q225 WeakPolarHBondContact O-CB 3.08Å; S222-Q225 PolarHBondContact O-N 2.94Å; S222-T226 PolarHBondContact O-N 3.25Å; S222-T226 PolarHBondContact O-OG1 3.18Å |
| 223 | R | 66.7 | Low | 64.4 | Low | 207 Ų | 207 | 94.8 Ų | 94.8 | 78% | 0.781 | 48% | 0.477 | S | S | * | . | H | α-helix | trans | -57.4 | -39.8 | 178.5 | -170.5 | 175.1 | -178.8 | -179.7 | 1.5 | 113.1 | T219 L227 | T219-R223 WeakPolarHBondContact O-CB 3.15Å; T219-R223 PolarHBondContact O-N 3.44Å; R223-L227 PolarHBondContact O-N 3.14Å; R223-L227 VanDerWaalsContact O-N 3.13Å |
| 224 | R | 64.6 | Low | 65.7 | Low | 166 Ų | 166 | 90 Ų | 90 | 63% | 0.626 | 44% | 0.443 | S | S | * | . | H | α-helix | trans | -67.1 | -38.4 | 175.7 | -73.1 | 177.6 | 178.2 | -177.6 | 1.9 | 112 | I220 Q221 S222 L228 | I220-R224 WeakPolarHBondContact O-CG 2.91Å; I220-R224 PolarHBondContact O-N 3.21Å; Q221-R224 PolarHBondContact O-N 3.16Å; S222-R224 VanDerWaalsContact C-N 3.3Å; S222-R224 PolarHBondContact O-N 3.15Å; R224-L228 WeakPolarHBondContact O-CG 3.36Å; R224-L228 PolarHBondContact O-N 3.43Å |
| 225 | Q | 65.4 | Low | 67 | Low | 62 Ų | 62 | 87.8 Ų | 87.8 | 29% | 0.29 | 43% | 0.425 | S | S | . | . | H | α-helix | trans | -69.3 | -45 | 175.2 | -71.1 | -175.9 | -21.4 | 0 | 0 | 111.1 | Q221 S222 L227 L228 Y229 | Q221-Q225 WeakPolarHBondContact O-CG 3.41Å; Q221-Q225 PolarHBondContact O-N 3.06Å; S222-Q225 CarbonylContact O-C 3.53Å; S222-Q225 WeakPolarHBondContact O-CA 3.38Å; S222-Q225 WeakPolarHBondContact O-CB 3.08Å; S222-Q225 PolarHBondContact O-N 2.94Å; Q225-L227 VanDerWaalsContact C-N 3.3Å; Q225-L227 PolarHBondContact O-N 3.04Å; Q225-L228 CarbonylContact O-C 3.21Å; Q225-L228 WeakPolarHBondContact O-CA 3.43Å; Q225-L228 WeakPolarHBondContact O-CB 3.45Å; Q225-L228 PolarHBondContact O-N 2.74Å; Q225-Y229 VanDerWaalsContact C-CD2 3.4Å; Q225-Y229 HydrophobicContact CB-CD2 4.22Å; Q225-Y229 HydrophobicContact CB-CE2 3.79Å; Q225-Y229 WeakPolarHBondContact O-CD2 3.07Å; Q225-Y229 PolarHBondContact O-N 3.16Å |
| 226 | T | 68.2 | Low | 68.2 | Low | 62 Ų | 62 | 82.5 Ų | 82.5 | 38% | 0.38 | 39% | 0.393 | S | S | . | . | H | α-helix | trans | -56.7 | -40.5 | 176.8 | -48.4 | 0 | 0 | 0 | 0 | 112.4 | S222 L228 Y229 K230 | S222-T226 PolarHBondContact O-N 3.25Å; S222-T226 PolarHBondContact O-OG1 3.18Å; T226-L228 VanDerWaalsContact C-N 3.32Å; T226-L228 PolarHBondContact O-N 3.2Å; T226-Y229 PolarHBondContact O-N 3.17Å; T226-K230 WeakPolarHBondContact O-CG 3.41Å; T226-K230 PolarHBondContact O-N 3.07Å |
| 227 | L | 70.7 | Confident | 69.5 | Low | 102 Ų | 102 | 78.3 Ų | 78.3 | 53% | 0.534 | 38% | 0.375 | S | S | . | . | H | α-helix | trans | -63.3 | -39.3 | 175.2 | -168 | 93.7 | 0 | 0 | 0 | 111.9 | R223 Q225 K231 | R223-L227 PolarHBondContact O-N 3.14Å; R223-L227 VanDerWaalsContact O-N 3.13Å; Q225-L227 VanDerWaalsContact C-N 3.3Å; Q225-L227 PolarHBondContact O-N 3.04Å; L227-K231 VanDerWaalsContact O-CG 3.31Å; L227-K231 WeakPolarHBondContact O-CG 3.49Å; L227-K231 PolarHBondContact O-N 2.98Å |
| 228 | L | 70.2 | Confident | 70.9 | Confident | 41 Ų | 41 | 73.2 Ų | 73.2 | 22% | 0.215 | 35% | 0.346 | C | S | . | . | H | α-helix | trans | -68.8 | -42.2 | 176.6 | -68.3 | 170.1 | 0 | 0 | 0 | 111.3 | V51 R224 Q225 T226 K231 A232 | V51-L228 HydrophobicContact CB-CD2 4.38Å; V51-L228 HydrophobicContact CG1-CD2 4.44Å; R224-L228 WeakPolarHBondContact O-CG 3.36Å; R224-L228 PolarHBondContact O-N 3.43Å; Q225-L228 CarbonylContact O-C 3.21Å; Q225-L228 WeakPolarHBondContact O-CA 3.43Å; Q225-L228 WeakPolarHBondContact O-CB 3.45Å; Q225-L228 PolarHBondContact O-N 2.74Å; T226-L228 VanDerWaalsContact C-N 3.32Å; T226-L228 PolarHBondContact O-N 3.2Å; L228-K231 PolarHBondContact O-N 3.41Å; L228-A232 PolarHBondContact O-N 3.34Å |
| 229 | Y | 73 | Confident | 72.1 | Confident | 37 Ų | 37 | 69.2 Ų | 69.2 | 15% | 0.145 | 33% | 0.328 | C | S | . | . | H | α-helix | trans | -58.3 | -49.9 | 174 | -72.8 | -67.9 | 0 | 0 | 0 | 111.4 | M119 L123 Q225 T226 K231 A232 S233 | M119-Y229 HydrophobicContact CB-CD1 3.99Å; M119-Y229 HydrophobicContact CB-CE1 3.59Å; M119-Y229 HydrophobicContact CG-CD1 3.56Å; M119-Y229 HydrophobicContact CG-CE1 3.59Å; M119-Y229 PolarHBondContact O-OH 3.43Å; M119-Y229 HydrophobicContact SD-CD1 3.66Å; M119-Y229 HydrophobicContact SD-CE1 4.27Å; L123-Y229 HydrophobicContact CD1-CE1 4.02Å; L123-Y229 HydrophobicContact CD2-CE1 4.24Å; L123-Y229 HydrophobicContact CD2-CE2 4Å; L123-Y229 WeakPolarHBondContact CD2-OH 3.49Å; L123-Y229 HydrophobicContact CG-CE1 3.96Å; L123-Y229 VanDerWaalsContact CG-OH 3.24Å; L123-Y229 WeakPolarHBondContact CG-OH 3.2Å; Q225-Y229 VanDerWaalsContact C-CD2 3.4Å; Q225-Y229 HydrophobicContact CB-CD2 4.22Å; Q225-Y229 HydrophobicContact CB-CE2 3.79Å; Q225-Y229 WeakPolarHBondContact O-CD2 3.07Å; Q225-Y229 PolarHBondContact O-N 3.16Å; T226-Y229 PolarHBondContact O-N 3.17Å; Y229-K231 PolarHBondContact O-N 2.86Å; Y229-A232 PolarHBondContact O-N 2.84Å; Y229-S233 VanDerWaalsContact O-CB 3.25Å; Y229-S233 WeakPolarHBondContact O-CB 3.18Å; Y229-S233 PolarHBondContact O-N 3.03Å; Y229-S233 PolarHBondContact O-OG 2.73Å; Y229-S233 VanDerWaalsContact O-OG 3.08Å |
| 230 | K | 77.8 | Confident | 73.2 | Confident | 143 Ų | 143 | 67.1 Ų | 67.1 | 62% | 0.622 | 32% | 0.315 | S | S | * | . | H | α-helix | trans | -57.8 | -34.8 | 178.3 | -75.9 | -174.5 | 177.1 | -170.9 | 0 | 112.8 | T226 S233 R234 | T226-K230 WeakPolarHBondContact O-CG 3.41Å; T226-K230 PolarHBondContact O-N 3.07Å; K230-S233 WeakPolarHBondContact CA-OG 3.47Å; K230-S233 PolarHBondContact O-OG 2.83Å; K230-R234 WeakPolarHBondContact O-CB 3.34Å; K230-R234 PolarHBondContact O-N 2.97Å |
| 231 | K | 76.2 | Confident | 74.4 | Confident | 38 Ų | 38 | 68.1 Ų | 68.1 | 17% | 0.165 | 32% | 0.315 | C | S | . | . | H | α-helix | trans | -70.8 | -51.9 | 176.9 | -73.9 | 170.7 | 173.5 | -168.7 | 0 | 111.4 | L227 L228 Y229 R234 T235 | L227-K231 VanDerWaalsContact O-CG 3.31Å; L227-K231 WeakPolarHBondContact O-CG 3.49Å; L227-K231 PolarHBondContact O-N 2.98Å; L228-K231 PolarHBondContact O-N 3.41Å; Y229-K231 PolarHBondContact O-N 2.86Å; K231-R234 PolarHBondContact O-N 3.41Å; K231-T235 PolarHBondContact O-N 3.08Å; K231-T235 VanDerWaalsContact O-N 3.13Å; K231-T235 PolarHBondContact O-OG1 2.93Å |
| 232 | A | 78.3 | Confident | 75.5 | Confident | 4 Ų | 4 | 62 Ų | 62 | 3% | 0.033 | 29% | 0.288 | C | S | . | . | H | α-helix | trans | -64.4 | -40.6 | -179.9 | 0 | 0 | 0 | 0 | 0 | 112 | M115 M119 L228 Y229 R234 T235 I236 | M115-A232 HydrophobicContact CB-CB 4.45Å; M119-A232 HydrophobicContact CE-CB 4.08Å; M119-A232 HydrophobicContact CG-CB 4.34Å; M119-A232 HydrophobicContact SD-CB 3.58Å; M119-A232 VanDerWaalsContact SD-CB 3.58Å; L228-A232 PolarHBondContact O-N 3.34Å; Y229-A232 PolarHBondContact O-N 2.84Å; A232-R234 VanDerWaalsContact C-N 3.34Å; A232-R234 PolarHBondContact O-N 3.49Å; A232-T235 WeakPolarHBondContact O-CB 3.33Å; A232-T235 PolarHBondContact O-N 3.3Å; A232-I236 WeakPolarHBondContact O-CG1 3.48Å; A232-I236 PolarHBondContact O-N 2.87Å |
| 233 | S | 79.4 | Confident | 76.6 | Confident | 30 Ų | 30 | 59.7 Ų | 59.7 | 21% | 0.21 | 27% | 0.272 | C | S | . | . | H | α-helix | trans | -61 | -43.2 | 176 | 68.5 | 0 | 0 | 0 | 0 | 111.6 | Y229 K230 T235 I236 I237 | Y229-S233 VanDerWaalsContact O-CB 3.25Å; Y229-S233 WeakPolarHBondContact O-CB 3.18Å; Y229-S233 PolarHBondContact O-N 3.03Å; Y229-S233 PolarHBondContact O-OG 2.73Å; Y229-S233 VanDerWaalsContact O-OG 3.08Å; K230-S233 WeakPolarHBondContact CA-OG 3.47Å; K230-S233 PolarHBondContact O-OG 2.83Å; S233-T235 PolarHBondContact O-N 3.44Å; S233-I236 PolarHBondContact O-N 3.02Å; S233-I237 WeakPolarHBondContact O-CB 3.33Å; S233-I237 WeakPolarHBondContact O-CD1 3.46Å; S233-I237 WeakPolarHBondContact O-CG1 3.2Å; S233-I237 PolarHBondContact O-N 3.44Å |
| 234 | R | 79.7 | Confident | 77.4 | Confident | 37 Ų | 37 | 49.9 Ų | 49.9 | 14% | 0.14 | 24% | 0.235 | C | C | . | . | H | α-helix | trans | -58.7 | -48.6 | 175 | -172.8 | -176.2 | 71.9 | -151.5 | 1.6 | 110.6 | K230 K231 A232 I236 I237 F238 T282 | K230-R234 WeakPolarHBondContact O-CB 3.34Å; K230-R234 PolarHBondContact O-N 2.97Å; K231-R234 PolarHBondContact O-N 3.41Å; A232-R234 VanDerWaalsContact C-N 3.34Å; A232-R234 PolarHBondContact O-N 3.49Å; R234-I236 VanDerWaalsContact C-N 3.35Å; R234-I236 PolarHBondContact O-N 3.28Å; R234-I237 PolarHBondContact O-N 2.92Å; R234-F238 HydrophobicContact CG-CD2 3.71Å; R234-F238 HydrophobicContact CG-CE2 3.7Å; R234-F238 VanDerWaalsContact O-CD2 3.31Å; R234-F238 WeakPolarHBondContact O-CD2 3.25Å; R234-F238 PolarHBondContact O-N 3.45Å; R234-T282 PolarHBondContact NH2-OG1 3.21Å |
| 235 | T | 81.3 | Confident | 78.2 | Confident | 2 Ų | 2 | 45.7 Ų | 45.7 | 1% | 0.012 | 22% | 0.224 | C | C | . | . | H | α-helix | trans | -56.4 | -48.6 | 177.2 | -51.6 | 0 | 0 | 0 | 0 | 111.9 | Y58 M115 K231 A232 S233 S239 F278 | Y58-T235 HydrophobicContact CD1-CG2 3.89Å; Y58-T235 HydrophobicContact CD2-CG2 4.03Å; Y58-T235 HydrophobicContact CE1-CG2 3.67Å; Y58-T235 HydrophobicContact CE2-CG2 3.79Å; Y58-T235 HydrophobicContact CG-CG2 4.09Å; M115-T235 HydrophobicContact CE-CG2 3.94Å; M115-T235 HydrophobicContact SD-CG2 4.49Å; K231-T235 PolarHBondContact O-N 3.08Å; K231-T235 VanDerWaalsContact O-N 3.13Å; K231-T235 PolarHBondContact O-OG1 2.93Å; A232-T235 WeakPolarHBondContact O-CB 3.33Å; A232-T235 PolarHBondContact O-N 3.3Å; S233-T235 PolarHBondContact O-N 3.44Å; T235-S239 WeakPolarHBondContact O-CB 3.46Å; T235-S239 PolarHBondContact O-N 2.94Å; T235-S239 PolarHBondContact O-OG 2.72Å; T235-F278 VanDerWaalsContact CA-CE2 3.49Å; T235-F278 HydrophobicContact CG2-CD2 4.4Å; T235-F278 HydrophobicContact CG2-CE1 4.42Å; T235-F278 HydrophobicContact CG2-CE2 3.65Å; T235-F278 HydrophobicContact CG2-CZ 3.65Å; T235-F278 WeakPolarHBondContact OG1-CE2 3.32Å; T235-F278 WeakPolarHBondContact OG1-CZ 3.37Å |
| 236 | I | 81.1 | Confident | 79 | Confident | 1 Ų | 1 | 43 Ų | 43 | 1% | 0.005 | 21% | 0.212 | C | C | . | . | H | α-helix | trans | -64.6 | -46.3 | -178.4 | -68.5 | 160.7 | 0 | 0 | 0 | 110.8 | S116 M119 V196 F200 A232 S233 R234 F238 S239 V240 | S116-I236 VanDerWaalsContact OG-CD1 3.29Å; S116-I236 WeakPolarHBondContact OG-CD1 3.5Å; M119-I236 HydrophobicContact CE-CD1 3.38Å; V196-I236 HydrophobicContact CG1-CG1 4.45Å; V196-I236 HydrophobicContact CG1-CG2 3.77Å; F200-I236 HydrophobicContact CB-CG2 4.14Å; F200-I236 HydrophobicContact CD1-CG2 4.18Å; F200-I236 HydrophobicContact CD2-CB 4.34Å; F200-I236 HydrophobicContact CD2-CD1 3.59Å; F200-I236 HydrophobicContact CD2-CG2 4.11Å; F200-I236 HydrophobicContact CE2-CD1 4.16Å; F200-I236 HydrophobicContact CG-CD1 4.29Å; F200-I236 HydrophobicContact CG-CG2 3.86Å; A232-I236 WeakPolarHBondContact O-CG1 3.48Å; A232-I236 PolarHBondContact O-N 2.87Å; S233-I236 PolarHBondContact O-N 3.02Å; R234-I236 VanDerWaalsContact C-N 3.35Å; R234-I236 PolarHBondContact O-N 3.28Å; I236-F238 PolarHBondContact O-N 3.22Å; I236-S239 PolarHBondContact O-N 3.48Å; I236-V240 HydrophobicContact CG2-CG2 4.21Å; I236-V240 VanDerWaalsContact O-CG2 3.29Å; I236-V240 WeakPolarHBondContact O-CG2 3.26Å; I236-V240 PolarHBondContact O-N 3.43Å |
| 237 | I | 82.9 | Confident | 79.6 | Confident | 80 Ų | 80 | 40 Ų | 40 | 41% | 0.41 | 19% | 0.194 | S | C | . | . | H | α-helix | trans | -59.5 | -50.5 | 180 | -68.8 | 165.3 | 0 | 0 | 0 | 110.7 | F200 S233 R234 S239 V240 F241 | F200-I237 HydrophobicContact CE1-CG1 4.36Å; F200-I237 HydrophobicContact CZ-CG1 4.45Å; S233-I237 WeakPolarHBondContact O-CB 3.33Å; S233-I237 WeakPolarHBondContact O-CD1 3.46Å; S233-I237 WeakPolarHBondContact O-CG1 3.2Å; S233-I237 PolarHBondContact O-N 3.44Å; R234-I237 PolarHBondContact O-N 2.92Å; I237-S239 VanDerWaalsContact C-N 3.27Å; I237-S239 PolarHBondContact O-N 3.21Å; I237-V240 PolarHBondContact O-N 2.87Å; I237-F241 HydrophobicContact CG2-CD2 4.15Å; I237-F241 HydrophobicContact CG2-CE2 3.9Å; I237-F241 WeakPolarHBondContact O-CD2 3.39Å; I237-F241 PolarHBondContact O-N 3.26Å |
| 238 | F | 81 | Confident | 80.1 | Confident | 64 Ų | 64 | 38.3 Ų | 38.3 | 28% | 0.281 | 19% | 0.185 | S | C | . | . | H | α-helix | trans | -59.4 | -40.3 | 177.5 | -88 | -77.7 | 0 | 0 | 0 | 111.9 | R234 I236 F241 A242 L277 F278 | R234-F238 HydrophobicContact CG-CD2 3.71Å; R234-F238 HydrophobicContact CG-CE2 3.7Å; R234-F238 VanDerWaalsContact O-CD2 3.31Å; R234-F238 WeakPolarHBondContact O-CD2 3.25Å; R234-F238 PolarHBondContact O-N 3.45Å; I236-F238 PolarHBondContact O-N 3.22Å; F238-F241 PolarHBondContact O-N 3.13Å; F238-A242 WeakPolarHBondContact O-CB 3.44Å; F238-A242 PolarHBondContact O-N 2.9Å; F238-L277 HydrophobicContact CE1-CB 4.47Å; F238-F278 HydrophobicContact CB-CB 4.3Å; F238-F278 HydrophobicContact CB-CD2 4.25Å |
| 239 | S | 83 | Confident | 80.6 | Confident | 0 Ų | 0 | 38 Ų | 38 | 0% | 0 | 18% | 0.184 | C | C | . | . | H | α-helix | trans | -68.6 | -34.3 | 178.9 | -51.7 | 0 | 0 | 0 | 0 | 113.1 | Y58 M112 T235 I236 I237 F241 A242 L243 C244 | Y58-S239 WeakPolarHBondContact CE2-OG 3.36Å; Y58-S239 VanDerWaalsContact CZ-OG 3.27Å; Y58-S239 PolarHBondContact OH-OG 3.15Å; M112-S239 WeakPolarHBondContact SD-CB 3.36Å; M112-S239 PolarHBondContact SD-OG 3Å; T235-S239 WeakPolarHBondContact O-CB 3.46Å; T235-S239 PolarHBondContact O-N 2.94Å; T235-S239 PolarHBondContact O-OG 2.72Å; I236-S239 PolarHBondContact O-N 3.48Å; I237-S239 VanDerWaalsContact C-N 3.27Å; I237-S239 PolarHBondContact O-N 3.21Å; S239-F241 VanDerWaalsContact C-N 3.32Å; S239-F241 PolarHBondContact O-N 3.15Å; S239-A242 PolarHBondContact O-N 3.35Å; S239-L243 WeakPolarHBondContact O-CA 3.44Å; S239-L243 VanDerWaalsContact O-CB 3.31Å; S239-L243 WeakPolarHBondContact O-CB 3.25Å; S239-L243 PolarHBondContact O-N 3.11Å; S239-C244 PolarHBondContact O-N 3.4Å |
| 240 | V | 80.8 | Confident | 80.8 | Confident | 31 Ų | 31 | 36.8 Ų | 36.8 | 19% | 0.188 | 18% | 0.18 | C | C | . | . | I | π-helix | trans | -62.6 | -44.1 | 177.9 | 167.6 | 0 | 0 | 0 | 0 | 110.2 | I197 I236 I237 C244 I245 | I197-V240 HydrophobicContact CD1-CG1 4.39Å; I197-V240 HydrophobicContact CG1-CG2 4.04Å; I236-V240 HydrophobicContact CG2-CG2 4.21Å; I236-V240 VanDerWaalsContact O-CG2 3.29Å; I236-V240 WeakPolarHBondContact O-CG2 3.26Å; I236-V240 PolarHBondContact O-N 3.43Å; I237-V240 PolarHBondContact O-N 2.87Å; V240-C244 HydrophobicContact CG1-CB 4.32Å; V240-C244 VanDerWaalsContact O-CB 3.29Å; V240-C244 WeakPolarHBondContact O-CB 3.31Å; V240-C244 PolarHBondContact O-N 3.5Å; V240-I245 PolarHBondContact O-N 2.98Å; V240-I245 VanDerWaalsContact O-N 3.14Å |
| 241 | F | 81.6 | Confident | 80.9 | Confident | 140 Ų | 140 | 32.5 Ų | 32.5 | 61% | 0.614 | 16% | 0.161 | S | C | * | . | I | π-helix | trans | -70.5 | -42.5 | 175.6 | -70.4 | -72.1 | 0 | 0 | 0 | 112.5 | I237 F238 S239 I245 | I237-F241 HydrophobicContact CG2-CD2 4.15Å; I237-F241 HydrophobicContact CG2-CE2 3.9Å; I237-F241 WeakPolarHBondContact O-CD2 3.39Å; I237-F241 PolarHBondContact O-N 3.26Å; F238-F241 PolarHBondContact O-N 3.13Å; S239-F241 VanDerWaalsContact C-N 3.32Å; S239-F241 PolarHBondContact O-N 3.15Å; F241-I245 HydrophobicContact CD1-CD1 3.64Å; F241-I245 HydrophobicContact CE1-CD1 4.24Å |
| 242 | A | 83.2 | Confident | 81.1 | Confident | 7 Ų | 7 | 32 Ų | 32 | 6% | 0.058 | 16% | 0.164 | C | C | . | . | I | π-helix | trans | -78.9 | -28.9 | -173.6 | 0 | 0 | 0 | 0 | 0 | 114.1 | F238 S239 Q271 L275 | F238-A242 WeakPolarHBondContact O-CB 3.44Å; F238-A242 PolarHBondContact O-N 2.9Å; S239-A242 PolarHBondContact O-N 3.35Å; A242-Q271 WeakPolarHBondContact O-CA 3.33Å; A242-Q271 WeakPolarHBondContact O-CB 3.35Å; A242-Q271 WeakPolarHBondContact O-CG 3.2Å; A242-L275 HydrophobicContact CB-CD2 4.37Å |
| 243 | L | 83.3 | Confident | 81 | Confident | 0 Ų | 0 | 33.5 Ų | 33.5 | 0% | 0 | 17% | 0.17 | C | C | . | . | I | π-helix | trans | -122.3 | -51 | -173 | -63.9 | 174 | 0 | 0 | 0 | 112 | M112 S239 I245 P246 S247 L275 | M112-L243 HydrophobicContact CE-CD1 4.44Å; S239-L243 WeakPolarHBondContact O-CA 3.44Å; S239-L243 VanDerWaalsContact O-CB 3.31Å; S239-L243 WeakPolarHBondContact O-CB 3.25Å; S239-L243 PolarHBondContact O-N 3.11Å; L243-I245 PolarHBondContact O-N 3.38Å; L243-P246 WeakPolarHBondContact O-CD 3.33Å; L243-S247 PolarHBondContact O-N 3.44Å; L243-S247 PolarHBondContact O-OG 3.44Å; L243-S247 VanDerWaalsContact O-OG 3.07Å; L243-L275 HydrophobicContact CD1-CD2 4.04Å; L243-L275 HydrophobicContact CD2-CD1 4.23Å; L243-L275 HydrophobicContact CD2-CD2 4.07Å; L243-L275 HydrophobicContact CD2-CG 4.42Å; L243-L275 HydrophobicContact CG-CD2 3.99Å |
| 244 | C | 82.9 | Confident | 80.6 | Confident | 1 Ų | 1 | 34.7 Ų | 34.7 | 1% | 0.007 | 18% | 0.182 | C | C | . | . | I | π-helix | trans | -65.6 | -42.1 | -171.7 | -58.1 | 0 | 0 | 0 | 0 | 112.2 | S193 S239 V240 S247 I248 | S193-C244 VanDerWaalsContact CB-SG 3.54Å; S193-C244 PolarHBondContact OG-SG 3.37Å; S239-C244 PolarHBondContact O-N 3.4Å; V240-C244 HydrophobicContact CG1-CB 4.32Å; V240-C244 VanDerWaalsContact O-CB 3.29Å; V240-C244 WeakPolarHBondContact O-CB 3.31Å; V240-C244 PolarHBondContact O-N 3.5Å; C244-S247 PolarHBondContact O-N 3.02Å; C244-I248 WeakPolarHBondContact O-CB 3.5Å; C244-I248 WeakPolarHBondContact O-CD1 3.16Å; C244-I248 VanDerWaalsContact O-CG1 3.22Å; C244-I248 WeakPolarHBondContact O-CG1 3.46Å; C244-I248 PolarHBondContact O-N 3.21Å |
| 245 | I | 82.3 | Confident | 80.3 | Confident | 77 Ų | 77 | 40.5 Ų | 40.5 | 40% | 0.395 | 20% | 0.204 | S | C | . | . | H | α-helix | trans | -60.5 | -53.9 | 179.5 | -67.3 | 174.5 | 0 | 0 | 0 | 110.8 | V240 F241 L243 S247 I248 V249 | V240-I245 PolarHBondContact O-N 2.98Å; V240-I245 VanDerWaalsContact O-N 3.14Å; F241-I245 HydrophobicContact CD1-CD1 3.64Å; F241-I245 HydrophobicContact CE1-CD1 4.24Å; L243-I245 PolarHBondContact O-N 3.38Å; I245-S247 VanDerWaalsContact C-N 3.34Å; I245-S247 PolarHBondContact O-N 3.5Å; I245-I248 PolarHBondContact O-N 2.89Å; I245-V249 HydrophobicContact CG2-CG2 4.28Å; I245-V249 WeakPolarHBondContact O-CB 3.05Å; I245-V249 VanDerWaalsContact O-CG2 3.22Å; I245-V249 WeakPolarHBondContact O-CG2 3.11Å; I245-V249 PolarHBondContact O-N 3.24Å |
| 246 | P | 83.2 | Confident | 79.9 | Confident | 6 Ų | 6 | 46 Ų | 46 | 4% | 0.039 | 23% | 0.232 | C | C | . | . | H | α-helix | trans | -57.7 | -42.1 | 175.6 | -30.7 | 39.6 | 0 | 0 | 0 | 113.7 | L243 I248 V249 E250 I267 Q271 | L243-P246 WeakPolarHBondContact O-CD 3.33Å; P246-I248 PolarHBondContact O-N 2.7Å; P246-V249 PolarHBondContact O-N 3.33Å; P246-E250 VanDerWaalsContact O-CG 3.29Å; P246-E250 WeakPolarHBondContact O-CG 3.37Å; P246-E250 PolarHBondContact O-N 2.71Å; P246-I267 HydrophobicContact CB-CG2 3.82Å; P246-I267 HydrophobicContact CG-CG2 3.82Å; P246-Q271 HydrophobicContact CB-CG 3.91Å; P246-Q271 HydrophobicContact CG-CG 3.77Å |
| 247 | S | 79.8 | Confident | 79.1 | Confident | 0 Ų | 0 | 53.6 Ų | 53.6 | 0% | 0 | 27% | 0.273 | C | S | . | . | H | α-helix | trans | -62.4 | -40.9 | 178.4 | -62.2 | 0 | 0 | 0 | 0 | 113.1 | Y109 L243 C244 I245 F251 | Y109-S247 PolarHBondContact OH-OG 3.48Å; L243-S247 PolarHBondContact O-N 3.44Å; L243-S247 PolarHBondContact O-OG 3.44Å; L243-S247 VanDerWaalsContact O-OG 3.07Å; C244-S247 PolarHBondContact O-N 3.02Å; I245-S247 VanDerWaalsContact C-N 3.34Å; I245-S247 PolarHBondContact O-N 3.5Å; S247-F251 WeakPolarHBondContact O-CB 3.42Å; S247-F251 PolarHBondContact O-N 3.07Å |
| 248 | I | 81.1 | Confident | 78.2 | Confident | 66 Ų | 66 | 55.7 Ų | 55.7 | 34% | 0.338 | 28% | 0.279 | S | S | . | . | H | α-helix | trans | -66.7 | -43 | 177.1 | -69.5 | 164.4 | 0 | 0 | 0 | 110.6 | T190 C244 I245 P246 E250 F251 A252 | T190-I248 HydrophobicContact CG2-CG1 4.17Å; C244-I248 WeakPolarHBondContact O-CB 3.5Å; C244-I248 WeakPolarHBondContact O-CD1 3.16Å; C244-I248 VanDerWaalsContact O-CG1 3.22Å; C244-I248 WeakPolarHBondContact O-CG1 3.46Å; C244-I248 PolarHBondContact O-N 3.21Å; I245-I248 PolarHBondContact O-N 2.89Å; P246-I248 PolarHBondContact O-N 2.7Å; I248-E250 VanDerWaalsContact C-N 3.3Å; I248-E250 PolarHBondContact O-N 2.83Å; I248-F251 PolarHBondContact O-N 3.08Å; I248-A252 PolarHBondContact O-N 3.38Å |
| 249 | V | 81 | Confident | 77.1 | Confident | 34 Ų | 34 | 59.5 Ų | 59.5 | 21% | 0.206 | 30% | 0.302 | C | S | . | . | H | α-helix | trans | -61.6 | -41.5 | 179.6 | 167.8 | 0 | 0 | 0 | 0 | 110.8 | I245 P246 A252 F253 I267 | I245-V249 HydrophobicContact CG2-CG2 4.28Å; I245-V249 WeakPolarHBondContact O-CB 3.05Å; I245-V249 VanDerWaalsContact O-CG2 3.22Å; I245-V249 WeakPolarHBondContact O-CG2 3.11Å; I245-V249 PolarHBondContact O-N 3.24Å; P246-V249 PolarHBondContact O-N 3.33Å; V249-A252 WeakPolarHBondContact O-CB 3.11Å; V249-A252 PolarHBondContact O-N 3.34Å; V249-F253 HydrophobicContact CG1-CD2 4.1Å; V249-F253 HydrophobicContact CG1-CE1 3.83Å; V249-F253 HydrophobicContact CG1-CE2 3.23Å; V249-F253 HydrophobicContact CG1-CZ 3.09Å; V249-F253 WeakPolarHBondContact O-CD1 3.33Å; V249-F253 WeakPolarHBondContact O-CD2 3.35Å; V249-F253 VanDerWaalsContact O-CG 3.28Å; V249-F253 WeakPolarHBondContact O-CG 3.27Å; V249-F253 PolarHBondContact O-N 3Å; V249-I267 HydrophobicContact CG1-CD1 3.8Å; V249-I267 HydrophobicContact CG1-CG2 4.49Å |
| 250 | E | 77.5 | Confident | 75.8 | Confident | 12 Ų | 12 | 61.5 Ų | 61.5 | 6% | 0.056 | 32% | 0.315 | C | S | . | . | H | α-helix | trans | -67.2 | -41.9 | 175 | -74.1 | -64.8 | 134.4 | 0 | 0 | 114.7 | R174 P246 I248 A252 F253 A254 S264 W268 | R174-E250 IonicContact CZ-OE2 3.73Å; R174-E250 IonicContact NH2-OE1 2.58Å; R174-E250 PolarHBondContact NH2-OE1 3.46Å; R174-E250 IonicContact NH2-OE2 2.98Å; R174-E250 PolarHBondContact NH2-OE2 3.21Å; P246-E250 VanDerWaalsContact O-CG 3.29Å; P246-E250 WeakPolarHBondContact O-CG 3.37Å; P246-E250 PolarHBondContact O-N 2.71Å; I248-E250 VanDerWaalsContact C-N 3.3Å; I248-E250 PolarHBondContact O-N 2.83Å; E250-A252 PolarHBondContact O-N 2.93Å; E250-F253 PolarHBondContact O-N 3.14Å; E250-F253 VanDerWaalsContact O-N 3.08Å; E250-F253 WeakPolarHBondContact OE1-CD2 2.94Å; E250-A254 WeakPolarHBondContact O-CB 3.37Å; E250-A254 PolarHBondContact O-N 3.3Å; E250-S264 WeakPolarHBondContact OE1-CB 3.29Å; E250-S264 PolarHBondContact OE1-OG 3.09Å; E250-W268 HydrophobicContact CB-CZ2 4.47Å; E250-W268 HydrophobicContact CG-CZ2 3.64Å; E250-W268 PolarHBondContact OE1-NE1 2.9Å; E250-W268 PolarHBondContact OE2-NE1 3.28Å |
| 251 | F | 80.3 | Confident | 75 | Confident | 52 Ų | 52 | 62 Ų | 62 | 23% | 0.228 | 33% | 0.327 | C | S | . | . | H | α-helix | trans | -59 | -39.5 | 174.4 | 177.2 | -102.3 | 0 | 0 | 0 | 110.4 | C186 L187 T190 S247 I248 A254 W255 | C186-F251 HydrophobicContact CB-CB 4.3Å; L187-F251 HydrophobicContact CB-CD2 4.08Å; L187-F251 HydrophobicContact CB-CE2 3.81Å; L187-F251 HydrophobicContact CD1-CD2 4.33Å; L187-F251 HydrophobicContact CD1-CE2 3.53Å; L187-F251 HydrophobicContact CD1-CZ 3.75Å; L187-F251 HydrophobicContact CG-CE2 4.24Å; T190-F251 HydrophobicContact CG2-CD1 4.45Å; T190-F251 WeakPolarHBondContact OG1-CB 3.23Å; S247-F251 WeakPolarHBondContact O-CB 3.42Å; S247-F251 PolarHBondContact O-N 3.07Å; I248-F251 PolarHBondContact O-N 3.08Å; F251-A254 PolarHBondContact O-N 2.99Å; F251-W255 AromaticContact CD2-CD1 3.51Å; F251-W255 HydrophobicContact CD2-CG 4.43Å; F251-W255 AromaticContact CD2-NE1 3.93Å; F251-W255 AromaticContact CE2-CD1 3.27Å; F251-W255 AromaticContact CE2-CG 3.9Å; F251-W255 HydrophobicContact CE2-CG 3.9Å; F251-W255 AromaticContact CE2-NE1 3.54Å; F251-W255 HydrophobicContact CZ-CG 4.23Å; F251-W255 PolarHBondContact O-N 3.28Å |
| 252 | A | 80.1 | Confident | 74.3 | Confident | 27 Ų | 27 | 59 Ų | 59 | 22% | 0.223 | 31% | 0.314 | C | S | . | . | H | α-helix | trans | -63.6 | -39.7 | 173.2 | 0 | 0 | 0 | 0 | 0 | 112.4 | I248 V249 E250 I256 | I248-A252 PolarHBondContact O-N 3.38Å; V249-A252 WeakPolarHBondContact O-CB 3.11Å; V249-A252 PolarHBondContact O-N 3.34Å; E250-A252 PolarHBondContact O-N 2.93Å; A252-I256 HydrophobicContact CB-CD1 3.98Å; A252-I256 WeakPolarHBondContact O-CA 3.22Å; A252-I256 WeakPolarHBondContact O-CB 3.07Å; A252-I256 WeakPolarHBondContact O-CG1 3.43Å; A252-I256 PolarHBondContact O-N 3.42Å |
| 253 | F | 76 | Confident | 73.8 | Confident | 36 Ų | 36 | 62.9 Ų | 62.9 | 16% | 0.158 | 33% | 0.333 | C | S | . | . | H | α-helix | trans | -67.5 | -42.4 | 176.5 | -59 | -24.6 | 0 | 0 | 0 | 112.9 | V249 E250 W255 F258 P260 S264 | V249-F253 HydrophobicContact CG1-CD2 4.1Å; V249-F253 HydrophobicContact CG1-CE1 3.83Å; V249-F253 HydrophobicContact CG1-CE2 3.23Å; V249-F253 HydrophobicContact CG1-CZ 3.09Å; V249-F253 WeakPolarHBondContact O-CD1 3.33Å; V249-F253 WeakPolarHBondContact O-CD2 3.35Å; V249-F253 VanDerWaalsContact O-CG 3.28Å; V249-F253 WeakPolarHBondContact O-CG 3.27Å; V249-F253 PolarHBondContact O-N 3Å; E250-F253 PolarHBondContact O-N 3.14Å; E250-F253 VanDerWaalsContact O-N 3.08Å; E250-F253 WeakPolarHBondContact OE1-CD2 2.94Å; F253-W255 VanDerWaalsContact C-N 3.31Å; F253-W255 PolarHBondContact O-N 3.44Å; F253-F258 HydrophobicContact CD1-CB 4.4Å; F253-F258 AromaticContact CD1-CD1 3.69Å; F253-F258 HydrophobicContact CD1-CD1 3.69Å; F253-F258 VanDerWaalsContact CD1-O 3.27Å; F253-F258 WeakPolarHBondContact CD1-O 3.23Å; F253-F258 AromaticContact CE1-CD1 3.44Å; F253-F258 HydrophobicContact CE1-CD1 3.44Å; F253-F258 VanDerWaalsContact CE1-CD1 3.44Å; F253-F258 AromaticContact CE1-CE1 3.86Å; F253-F258 HydrophobicContact CE1-CE1 3.86Å; F253-P260 HydrophobicContact CD1-CG 3.88Å; F253-P260 HydrophobicContact CE1-CG 3.27Å; F253-P260 HydrophobicContact CE2-CG 4.05Å; F253-P260 HydrophobicContact CZ-CG 3.31Å; F253-S264 VanDerWaalsContact CE2-CB 3.4Å |
| 254 | A | 71.2 | Confident | 73.4 | Confident | 55 Ų | 55 | 63.2 Ų | 63.2 | 46% | 0.455 | 34% | 0.335 | S | S | . | . | H | α-helix | trans | -69.3 | -27 | -177.5 | 0 | 0 | 0 | 0 | 0 | 113.2 | E250 F251 | E250-A254 WeakPolarHBondContact O-CB 3.37Å; E250-A254 PolarHBondContact O-N 3.3Å; F251-A254 PolarHBondContact O-N 2.99Å |
| 255 | W | 73.2 | Confident | 73 | Confident | 160 Ų | 160 | 65.5 Ų | 65.5 | 61% | 0.606 | 35% | 0.348 | S | S | * | . | H | α-helix | trans | -120.7 | -15.7 | -171.3 | -72 | 90.9 | 0 | 0 | 0 | 115.8 | F251 F253 | F251-W255 AromaticContact CD2-CD1 3.51Å; F251-W255 HydrophobicContact CD2-CG 4.43Å; F251-W255 AromaticContact CD2-NE1 3.93Å; F251-W255 AromaticContact CE2-CD1 3.27Å; F251-W255 AromaticContact CE2-CG 3.9Å; F251-W255 HydrophobicContact CE2-CG 3.9Å; F251-W255 AromaticContact CE2-NE1 3.54Å; F251-W255 HydrophobicContact CZ-CG 4.23Å; F251-W255 PolarHBondContact O-N 3.28Å; F253-W255 VanDerWaalsContact C-N 3.31Å; F253-W255 PolarHBondContact O-N 3.44Å |
| 256 | I | 71.7 | Confident | 72.8 | Confident | 117 Ų | 117 | 66.2 Ų | 66.2 | 60% | 0.6 | 35% | 0.346 | S | S | * | . | S | Bend | trans | -109.7 | 11.1 | -172 | -50.2 | 179.1 | 0 | 0 | 0 | 112.2 | A252 F258 | A252-I256 HydrophobicContact CB-CD1 3.98Å; A252-I256 WeakPolarHBondContact O-CA 3.22Å; A252-I256 WeakPolarHBondContact O-CB 3.07Å; A252-I256 WeakPolarHBondContact O-CG1 3.43Å; A252-I256 PolarHBondContact O-N 3.42Å; I256-F258 PolarHBondContact O-N 3.03Å |
| 257 | D | 64.8 | Low | 72.7 | Confident | 161 Ų | 161 | 67.8 Ų | 67.8 | 86% | 0.861 | 35% | 0.354 | S | S | * | . | trans | 49.3 | 23.4 | -173.7 | -73.5 | -31 | 0 | 0 | 0 | 113.2 | N259 | D257-N259 PolarHBondContact O-N 3.43Š| ||
| 258 | F | 63.4 | Low | 72.7 | Confident | 124 Ų | 124 | 69.3 Ų | 69.3 | 54% | 0.544 | 36% | 0.359 | S | S | . | . | trans | -83.8 | 101.6 | 177 | -170.9 | -93.2 | 0 | 0 | 0 | 106.7 | F253 I256 P260 | F253-F258 HydrophobicContact CD1-CB 4.4Å; F253-F258 AromaticContact CD1-CD1 3.69Å; F253-F258 HydrophobicContact CD1-CD1 3.69Å; F253-F258 VanDerWaalsContact CD1-O 3.27Å; F253-F258 WeakPolarHBondContact CD1-O 3.23Å; F253-F258 AromaticContact CE1-CD1 3.44Å; F253-F258 HydrophobicContact CE1-CD1 3.44Å; F253-F258 VanDerWaalsContact CE1-CD1 3.44Å; F253-F258 AromaticContact CE1-CE1 3.86Å; F253-F258 HydrophobicContact CE1-CE1 3.86Å; I256-F258 PolarHBondContact O-N 3.03Å; F258-P260 VanDerWaalsContact C-CD 3.44Å; F258-P260 HydrophobicContact CD1-CB 4.34Å; F258-P260 HydrophobicContact CD1-CG 3.98Å; F258-P260 HydrophobicContact CE1-CB 3.82Å; F258-P260 HydrophobicContact CE1-CG 3.86Å; F258-P260 WeakPolarHBondContact O-CD 3.48Å | ||
| 259 | N | 58.4 | Low | 72.7 | Confident | 144 Ų | 144 | 66.2 Ų | 66.2 | 77% | 0.77 | 34% | 0.343 | S | S | * | . | trans | -104.6 | 83.7 | -177.5 | -168.4 | -1.7 | 0 | 0 | 0 | 111 | D257 G261 | D257-N259 PolarHBondContact O-N 3.43Å; N259-G261 PolarHBondContact O-N 2.92Å; N259-G261 PolarHBondContact OD1-N 3.43Å | ||
| 260 | P | 56.2 | Low | 72.7 | Confident | 41 Ų | 41 | 69.7 Ų | 69.7 | 27% | 0.266 | 36% | 0.359 | S | S | . | . | trans | -81.4 | 17.5 | 175.2 | 36.3 | -36.4 | 0 | 0 | 0 | 112.2 | F253 F258 K262 L263 | F253-P260 HydrophobicContact CD1-CG 3.88Å; F253-P260 HydrophobicContact CE1-CG 3.27Å; F253-P260 HydrophobicContact CE2-CG 4.05Å; F253-P260 HydrophobicContact CZ-CG 3.31Å; F258-P260 VanDerWaalsContact C-CD 3.44Å; F258-P260 HydrophobicContact CD1-CB 4.34Å; F258-P260 HydrophobicContact CD1-CG 3.98Å; F258-P260 HydrophobicContact CE1-CB 3.82Å; F258-P260 HydrophobicContact CE1-CG 3.86Å; F258-P260 WeakPolarHBondContact O-CD 3.48Å; P260-K262 PolarHBondContact O-N 2.95Å; P260-L263 HydrophobicContact CB-CB 3.89Å; P260-L263 HydrophobicContact CB-CD2 3.9Å; P260-L263 HydrophobicContact CG-CB 4.08Å; P260-L263 HydrophobicContact CG-CD2 4.29Å; P260-L263 PolarHBondContact O-N 2.96Å | ||
| 261 | G | 63.4 | Low | 73.2 | Confident | 43 Ų | 43 | 69.1 Ų | 69.1 | 44% | 0.443 | 36% | 0.356 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 59.8 | -130.5 | -177 | 0 | 0 | 0 | 0 | 0 | 112 | N259 L263 | N259-G261 PolarHBondContact O-N 2.92Å; N259-G261 PolarHBondContact OD1-N 3.43Å; G261-L263 PolarHBondContact O-N 3.3Å; G261-L263 VanDerWaalsContact O-N 3.07Å |
| 262 | K | 67.1 | Low | 73.6 | Confident | 76 Ų | 76 | 66.7 Ų | 66.7 | 33% | 0.33 | 35% | 0.345 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -67.1 | -6.8 | -174.2 | -59.8 | -170.9 | 176.2 | -165.1 | 0 | 115 | P260 S264 D265 Y266 | P260-K262 PolarHBondContact O-N 2.95Å; K262-S264 PolarHBondContact O-N 3.04Å; K262-D265 PolarHBondContact O-N 3.36Å; K262-Y266 HydrophobicContact CB-CD2 4.45Å; K262-Y266 HydrophobicContact CB-CE2 4.11Å; K262-Y266 WeakPolarHBondContact O-CD2 3.44Å; K262-Y266 PolarHBondContact O-N 3.32Å |
| 263 | L | 73 | Confident | 73.8 | Confident | 88 Ų | 88 | 66.6 Ų | 66.6 | 46% | 0.461 | 34% | 0.341 | S | S | . | . | H | α-helix | trans | -58.7 | -37 | -177.9 | -177.1 | 65.8 | 0 | 0 | 0 | 112.1 | P260 G261 D265 Y266 I267 | P260-L263 HydrophobicContact CB-CB 3.89Å; P260-L263 HydrophobicContact CB-CD2 3.9Å; P260-L263 HydrophobicContact CG-CB 4.08Å; P260-L263 HydrophobicContact CG-CD2 4.29Å; P260-L263 PolarHBondContact O-N 2.96Å; G261-L263 PolarHBondContact O-N 3.3Å; G261-L263 VanDerWaalsContact O-N 3.07Å; L263-D265 PolarHBondContact O-N 2.05Å; L263-Y266 PolarHBondContact O-N 3.37Å; L263-I267 HydrophobicContact CD1-CD1 4.31Å; L263-I267 HydrophobicContact CD1-CG1 4.48Å; L263-I267 HydrophobicContact CD2-CD1 4.25Å; L263-I267 HydrophobicContact CG-CD1 3.82Å; L263-I267 HydrophobicContact CG-CG1 4.37Å; L263-I267 WeakPolarHBondContact O-CG1 3.22Å; L263-I267 PolarHBondContact O-N 3.19Å |
| 264 | S | 74.1 | Confident | 74.3 | Confident | 8 Ų | 8 | 65.6 Ų | 65.6 | 6% | 0.056 | 34% | 0.341 | C | S | . | . | H | α-helix | trans | -51.9 | -54.1 | 174.7 | 167.1 | 0 | 0 | 0 | 0 | 111.9 | R174 E250 F253 K262 Y266 I267 W268 | R174-S264 PolarHBondContact NH1-OG 3.17Å; R174-S264 PolarHBondContact NH2-OG 2.9Å; E250-S264 WeakPolarHBondContact OE1-CB 3.29Å; E250-S264 PolarHBondContact OE1-OG 3.09Å; F253-S264 VanDerWaalsContact CE2-CB 3.4Å; K262-S264 PolarHBondContact O-N 3.04Å; S264-Y266 VanDerWaalsContact C-N 3.3Å; S264-Y266 PolarHBondContact O-N 2.87Å; S264-I267 PolarHBondContact O-N 3.36Å; S264-I267 VanDerWaalsContact O-N 3.07Å; S264-W268 VanDerWaalsContact O-CD1 3.29Å; S264-W268 PolarHBondContact O-N 3.46Å; S264-W268 VanDerWaalsContact O-N 3.08Å |
| 265 | D | 75.5 | Confident | 75.1 | Confident | 49 Ų | 49 | 63 Ų | 63 | 26% | 0.262 | 32% | 0.319 | S | S | . | . | H | α-helix | trans | -60 | -42.3 | -176.6 | -58.5 | -39.8 | 0 | 0 | 0 | 111.6 | L20 R174 K262 L263 I267 W268 T269 | L20-D265 HydrophobicContact CD1-CB 3.96Å; L20-D265 HydrophobicContact CD2-CB 3.67Å; L20-D265 HydrophobicContact CG-CB 4.49Å; R174-D265 IonicContact CZ-OD1 2.6Å; R174-D265 IonicContact NH1-OD1 2.82Å; R174-D265 PolarHBondContact NH1-OD1 2.96Å; K262-D265 PolarHBondContact O-N 3.36Å; L263-D265 PolarHBondContact O-N 2.05Å; D265-I267 PolarHBondContact O-N 3.49Å; D265-W268 PolarHBondContact O-N 3.36Å; D265-T269 WeakPolarHBondContact O-CG2 3.45Å; D265-T269 PolarHBondContact O-N 3Å; D265-T269 VanDerWaalsContact O-N 3.14Å |
| 266 | Y | 77.3 | Confident | 75.8 | Confident | 91 Ų | 91 | 55.5 Ų | 55.5 | 36% | 0.357 | 29% | 0.291 | S | S | . | . | H | α-helix | trans | -64.7 | -39.3 | 176.2 | -70.9 | -71.4 | 0 | 0 | 0 | 112.9 | L20 K262 L263 S264 W268 T269 M270 | L20-Y266 HydrophobicContact CD1-CD1 4.09Å; L20-Y266 HydrophobicContact CD1-CE1 4.21Å; K262-Y266 HydrophobicContact CB-CD2 4.45Å; K262-Y266 HydrophobicContact CB-CE2 4.11Å; K262-Y266 WeakPolarHBondContact O-CD2 3.44Å; K262-Y266 PolarHBondContact O-N 3.32Å; L263-Y266 PolarHBondContact O-N 3.37Å; S264-Y266 VanDerWaalsContact C-N 3.3Å; S264-Y266 PolarHBondContact O-N 2.87Å; Y266-W268 VanDerWaalsContact C-N 3.29Å; Y266-W268 PolarHBondContact O-N 2.8Å; Y266-T269 PolarHBondContact O-N 2.94Å; Y266-T269 PolarHBondContact O-OG1 3.36Å; Y266-M270 PolarHBondContact O-N 3.45Å |
| 267 | I | 81.3 | Confident | 76.5 | Confident | 40 Ų | 40 | 51.3 Ų | 51.3 | 21% | 0.205 | 27% | 0.27 | C | S | . | . | H | α-helix | trans | -64 | -37.3 | 177.8 | -70.9 | 172.8 | 0 | 0 | 0 | 110.7 | P246 V249 L263 S264 D265 M270 | P246-I267 HydrophobicContact CB-CG2 3.82Å; P246-I267 HydrophobicContact CG-CG2 3.82Å; V249-I267 HydrophobicContact CG1-CD1 3.8Å; V249-I267 HydrophobicContact CG1-CG2 4.49Å; L263-I267 HydrophobicContact CD1-CD1 4.31Å; L263-I267 HydrophobicContact CD1-CG1 4.48Å; L263-I267 HydrophobicContact CD2-CD1 4.25Å; L263-I267 HydrophobicContact CG-CD1 3.82Å; L263-I267 HydrophobicContact CG-CG1 4.37Å; L263-I267 WeakPolarHBondContact O-CG1 3.22Å; L263-I267 PolarHBondContact O-N 3.19Å; S264-I267 PolarHBondContact O-N 3.36Å; S264-I267 VanDerWaalsContact O-N 3.07Å; D265-I267 PolarHBondContact O-N 3.49Å; I267-M270 PolarHBondContact O-N 3.04Å |
| 268 | W | 79.9 | Confident | 77.4 | Confident | 31 Ų | 31 | 43.7 Ų | 43.7 | 12% | 0.117 | 23% | 0.229 | C | C | . | . | H | α-helix | trans | -63.2 | -42.5 | 173.1 | -84 | 87.8 | 0 | 0 | 0 | 112.7 | F69 E250 S264 D265 Y266 M270 Q271 P272 | F69-W268 HydrophobicContact CE1-CB 4.18Å; F69-W268 HydrophobicContact CE1-CE3 4.48Å; F69-W268 WeakPolarHBondContact CE1-O 3.47Å; F69-W268 HydrophobicContact CZ-CB 4.32Å; F69-W268 AromaticContact CZ-CE3 3.82Å; F69-W268 HydrophobicContact CZ-CE3 3.82Å; F69-W268 WeakPolarHBondContact CZ-O 3.06Å; E250-W268 HydrophobicContact CB-CZ2 4.47Å; E250-W268 HydrophobicContact CG-CZ2 3.64Å; E250-W268 PolarHBondContact OE1-NE1 2.9Å; E250-W268 PolarHBondContact OE2-NE1 3.28Å; S264-W268 VanDerWaalsContact O-CD1 3.29Å; S264-W268 PolarHBondContact O-N 3.46Å; S264-W268 VanDerWaalsContact O-N 3.08Å; D265-W268 PolarHBondContact O-N 3.36Å; Y266-W268 VanDerWaalsContact C-N 3.29Å; Y266-W268 PolarHBondContact O-N 2.8Å; W268-M270 PolarHBondContact O-N 3.19Å; W268-Q271 VanDerWaalsContact CE3-OE1 3.25Å; W268-Q271 VanDerWaalsContact O-CB 3.3Å; W268-Q271 WeakPolarHBondContact O-CB 3.46Å; W268-Q271 VanDerWaalsContact O-CG 3.31Å; W268-Q271 WeakPolarHBondContact O-CG 3.12Å; W268-Q271 PolarHBondContact O-N 2.95Å; W268-P272 WeakPolarHBondContact O-CD 3.46Å |
| 269 | T | 80.4 | Confident | 78.5 | Confident | 1 Ų | 1 | 37.8 Ų | 37.8 | 1% | 0.006 | 20% | 0.203 | C | C | . | . | H | α-helix | trans | -61.4 | -19.6 | -179.1 | 71.5 | 0 | 0 | 0 | 0 | 113.5 | L20 N24 F27 D265 Y266 P272 | L20-T269 HydrophobicContact CD1-CG2 3.26Å; L20-T269 HydrophobicContact CG-CG2 4.07Å; N24-T269 WeakPolarHBondContact OD1-CG2 3.42Å; F27-T269 WeakPolarHBondContact CD2-O 3.43Å; D265-T269 WeakPolarHBondContact O-CG2 3.45Å; D265-T269 PolarHBondContact O-N 3Å; D265-T269 VanDerWaalsContact O-N 3.14Å; Y266-T269 PolarHBondContact O-N 2.94Å; Y266-T269 PolarHBondContact O-OG1 3.36Å; T269-P272 VanDerWaalsContact O-CD 3.24Å; T269-P272 WeakPolarHBondContact O-CD 3.45Å; T269-P272 VanDerWaalsContact O-CG 3.23Å; T269-P272 WeakPolarHBondContact O-CG 3.42Å |
| 270 | M | 82 | Confident | 79.8 | Confident | 108 Ų | 108 | 31.5 Ų | 31.5 | 53% | 0.532 | 17% | 0.17 | S | C | . | . | H | α-helix | trans | -77.5 | -20.4 | 176.1 | -65.4 | -65.8 | 174.3 | 0 | 0 | 113.3 | Y266 I267 W268 L273 G274 | Y266-M270 PolarHBondContact O-N 3.45Å; I267-M270 PolarHBondContact O-N 3.04Å; W268-M270 PolarHBondContact O-N 3.19Å; M270-L273 WeakPolarHBondContact O-CB 3.44Å; M270-L273 PolarHBondContact O-N 3.38Å; M270-L273 HydrophobicContact SD-CD2 4.36Å; M270-G274 PolarHBondContact O-N 3.25Å; M270-G274 VanDerWaalsContact O-N 3.11Å |
| 271 | Q | 88.7 | Confident | 81.1 | Confident | 0 Ų | 0 | 30.2 Ų | 30.2 | 0% | 0 | 16% | 0.162 | C | C | . | . | H | α-helix | trans | -55.3 | -57.1 | 176.4 | -61.7 | -165.9 | -30.4 | 0 | 0 | 112.7 | F69 A242 P246 W268 L273 G274 L275 | F69-Q271 HydrophobicContact CE2-CB 3.95Å; F69-Q271 HydrophobicContact CZ-CB 3.9Å; F69-Q271 HydrophobicContact CZ-CG 4.28Å; A242-Q271 WeakPolarHBondContact O-CA 3.33Å; A242-Q271 WeakPolarHBondContact O-CB 3.35Å; A242-Q271 WeakPolarHBondContact O-CG 3.2Å; P246-Q271 HydrophobicContact CB-CG 3.91Å; P246-Q271 HydrophobicContact CG-CG 3.77Å; W268-Q271 VanDerWaalsContact CE3-OE1 3.25Å; W268-Q271 VanDerWaalsContact O-CB 3.3Å; W268-Q271 WeakPolarHBondContact O-CB 3.46Å; W268-Q271 VanDerWaalsContact O-CG 3.31Å; W268-Q271 WeakPolarHBondContact O-CG 3.12Å; W268-Q271 PolarHBondContact O-N 2.95Å; Q271-L273 PolarHBondContact O-N 2.8Å; Q271-G274 PolarHBondContact O-N 3.31Å; Q271-L275 WeakPolarHBondContact O-CG 3.28Å; Q271-L275 PolarHBondContact O-N 3.49Å |
| 272 | P | 87.3 | Confident | 82 | Confident | 0 Ų | 0 | 28.2 Ų | 28.2 | 0% | 0 | 14% | 0.14 | C | C | . | . | H | α-helix | trans | -60.5 | -33.2 | -177.6 | 23.8 | -35.5 | 0 | 0 | 0 | 112.1 | F27 A31 F69 W268 T269 L275 S276 | F27-P272 HydrophobicContact CB-CB 3.95Å; F27-P272 HydrophobicContact CB-CG 3.64Å; A31-P272 HydrophobicContact CB-CB 3.82Å; A31-P272 WeakPolarHBondContact CB-O 3.45Å; F69-P272 HydrophobicContact CD1-CG 4.22Å; F69-P272 HydrophobicContact CD2-CB 4.19Å; F69-P272 HydrophobicContact CD2-CG 4.07Å; F69-P272 HydrophobicContact CE1-CG 4.43Å; F69-P272 HydrophobicContact CE2-CG 4.31Å; F69-P272 HydrophobicContact CG-CB 4.41Å; F69-P272 HydrophobicContact CG-CG 4.02Å; F69-P272 HydrophobicContact CZ-CG 4.46Å; W268-P272 WeakPolarHBondContact O-CD 3.46Å; T269-P272 VanDerWaalsContact O-CD 3.24Å; T269-P272 WeakPolarHBondContact O-CD 3.45Å; T269-P272 VanDerWaalsContact O-CG 3.23Å; T269-P272 WeakPolarHBondContact O-CG 3.42Å; P272-L275 PolarHBondContact O-N 3.18Å; P272-S276 WeakPolarHBondContact O-CB 3.43Å; P272-S276 PolarHBondContact O-N 3.41Å; P272-S276 PolarHBondContact O-OG 3.02Å |
| 273 | L | 84.8 | Confident | 82.8 | Confident | 26 Ų | 26 | 24.7 Ų | 24.7 | 14% | 0.136 | 13% | 0.125 | C | C | . | . | H | α-helix | trans | -59.4 | -54.7 | 173 | -170.4 | 66.5 | 0 | 0 | 0 | 110.5 | F27 M270 Q271 L275 S276 L277 F312 L315 | F27-L273 HydrophobicContact CD1-CD1 4.38Å; F27-L273 HydrophobicContact CE1-CD1 4.35Å; M270-L273 WeakPolarHBondContact O-CB 3.44Å; M270-L273 PolarHBondContact O-N 3.38Å; M270-L273 HydrophobicContact SD-CD2 4.36Å; Q271-L273 PolarHBondContact O-N 2.8Å; L273-L275 VanDerWaalsContact C-N 3.31Å; L273-L275 PolarHBondContact O-N 2.95Å; L273-S276 PolarHBondContact O-N 3.05Å; L273-S276 VanDerWaalsContact O-N 3.11Å; L273-S276 PolarHBondContact O-OG 3.49Å; L273-L277 WeakPolarHBondContact O-CG 3.4Å; L273-L277 PolarHBondContact O-N 3.43Å; L273-F312 HydrophobicContact CD1-CE1 4.08Å; L273-L315 HydrophobicContact CD1-CD2 3.73Å; L273-L315 HydrophobicContact CD2-CD1 4.41Å; L273-L315 HydrophobicContact CD2-CD2 4.46Å; L273-L315 HydrophobicContact CG-CD2 4.33Å |
| 274 | G | 86 | Confident | 83.1 | Confident | 14 Ų | 14 | 22.6 Ų | 22.6 | 14% | 0.144 | 11% | 0.114 | C | C | . | . | H | α-helix | trans | -57.7 | -40.1 | 178 | 0 | 0 | 0 | 0 | 0 | 113.7 | M270 Q271 L277 F278 | M270-G274 PolarHBondContact O-N 3.25Å; M270-G274 VanDerWaalsContact O-N 3.11Å; Q271-G274 PolarHBondContact O-N 3.31Å; G274-L277 PolarHBondContact O-N 3.23Å; G274-F278 PolarHBondContact O-N 2.91Å |
| 275 | L | 88.9 | Confident | 83.2 | Confident | 1 Ų | 1 | 28 Ų | 28 | 1% | 0.005 | 14% | 0.139 | C | C | . | . | H | α-helix | trans | -66.5 | -36.9 | 176.2 | -63.6 | -179.1 | 0 | 0 | 0 | 112.9 | N35 C62 V65 A242 L243 Q271 P272 L273 S279 | N35-L275 PolarHBondContact ND2-O 2.99Å; N35-L275 VanDerWaalsContact ND2-O 3.15Å; C62-L275 HydrophobicContact CB-CB 4.43Å; C62-L275 HydrophobicContact CB-CD1 4.43Å; C62-L275 HydrophobicContact CB-CD2 4.38Å; V65-L275 HydrophobicContact CB-CD1 3.94Å; V65-L275 HydrophobicContact CG1-CD1 3.72Å; A242-L275 HydrophobicContact CB-CD2 4.37Å; L243-L275 HydrophobicContact CD1-CD2 4.04Å; L243-L275 HydrophobicContact CD2-CD1 4.23Å; L243-L275 HydrophobicContact CD2-CD2 4.07Å; L243-L275 HydrophobicContact CD2-CG 4.42Å; L243-L275 HydrophobicContact CG-CD2 3.99Å; Q271-L275 WeakPolarHBondContact O-CG 3.28Å; Q271-L275 PolarHBondContact O-N 3.49Å; P272-L275 PolarHBondContact O-N 3.18Å; L273-L275 VanDerWaalsContact C-N 3.31Å; L273-L275 PolarHBondContact O-N 2.95Å; L275-S279 PolarHBondContact O-N 3.1Å |
| 276 | S | 88.2 | Confident | 83.2 | Confident | 3 Ų | 3 | 26.2 Ų | 26.2 | 2% | 0.021 | 13% | 0.128 | C | C | . | . | H | α-helix | trans | -67.9 | -40 | 174.8 | 76.8 | 0 | 0 | 0 | 0 | 111.6 | P272 L273 F278 S279 V280 | P272-S276 WeakPolarHBondContact O-CB 3.43Å; P272-S276 PolarHBondContact O-N 3.41Å; P272-S276 PolarHBondContact O-OG 3.02Å; L273-S276 PolarHBondContact O-N 3.05Å; L273-S276 VanDerWaalsContact O-N 3.11Å; L273-S276 PolarHBondContact O-OG 3.49Å; S276-F278 VanDerWaalsContact C-N 3.31Å; S276-F278 PolarHBondContact O-N 3.26Å; S276-S279 PolarHBondContact O-N 3.05Å; S276-S279 PolarHBondContact O-OG 2.89Å; S276-V280 WeakPolarHBondContact O-CB 3.34Å; S276-V280 VanDerWaalsContact O-CG2 3.29Å; S276-V280 WeakPolarHBondContact O-CG2 3.49Å; S276-V280 PolarHBondContact O-N 3.22Å |
| 277 | L | 85.2 | Confident | 82.7 | Confident | 28 Ų | 28 | 25.9 Ų | 25.9 | 15% | 0.147 | 14% | 0.136 | C | C | . | . | H | α-helix | trans | -61.6 | -40 | 178.1 | -67.6 | -173.5 | 0 | 0 | 0 | 112.3 | F238 L273 G274 T281 L315 L319 | F238-L277 HydrophobicContact CE1-CB 4.47Å; L273-L277 WeakPolarHBondContact O-CG 3.4Å; L273-L277 PolarHBondContact O-N 3.43Å; G274-L277 PolarHBondContact O-N 3.23Å; L277-T281 VanDerWaalsContact O-CB 3.23Å; L277-T281 WeakPolarHBondContact O-CB 3.43Å; L277-T281 PolarHBondContact O-N 3.34Å; L277-T281 PolarHBondContact O-OG1 3.21Å; L277-L315 HydrophobicContact CD1-CD1 4.34Å; L277-L315 HydrophobicContact CD1-CD2 4.44Å; L277-L315 HydrophobicContact CD2-CD2 3.76Å; L277-L315 HydrophobicContact CD2-CG 4.28Å; L277-L315 HydrophobicContact CG-CD2 4.48Å; L277-L319 HydrophobicContact CD2-CD1 3.2Å; L277-L319 HydrophobicContact CD2-CD2 4.04Å; L277-L319 HydrophobicContact CD2-CG 4.2Å; L277-L319 HydrophobicContact CG-CD1 4.47Å |
| 278 | F | 85 | Confident | 82.1 | Confident | 1 Ų | 1 | 29 Ų | 29 | 0% | 0.004 | 15% | 0.153 | C | C | . | . | H | α-helix | trans | -59.3 | -48.1 | 175.6 | 169.4 | -97.6 | 0 | 0 | 0 | 112.3 | Y58 T59 T235 F238 G274 S276 T282 | Y58-F278 HydrophobicContact CD1-CD1 4.21Å; Y58-F278 AromaticContact CD1-CE1 3.59Å; Y58-F278 HydrophobicContact CD1-CE1 3.59Å; Y58-F278 HydrophobicContact CD1-CZ 4.08Å; Y58-F278 AromaticContact CE1-CD1 3.5Å; Y58-F278 HydrophobicContact CE1-CD1 3.5Å; Y58-F278 VanDerWaalsContact CE1-CD1 3.5Å; Y58-F278 AromaticContact CE1-CE1 3.3Å; Y58-F278 HydrophobicContact CE1-CE1 3.3Å; Y58-F278 HydrophobicContact CE1-CG 4.19Å; Y58-F278 AromaticContact CE1-CZ 3.86Å; Y58-F278 HydrophobicContact CE1-CZ 3.86Å; T59-F278 HydrophobicContact CG2-CE1 4Å; T235-F278 VanDerWaalsContact CA-CE2 3.49Å; T235-F278 HydrophobicContact CG2-CD2 4.4Å; T235-F278 HydrophobicContact CG2-CE1 4.42Å; T235-F278 HydrophobicContact CG2-CE2 3.65Å; T235-F278 HydrophobicContact CG2-CZ 3.65Å; T235-F278 WeakPolarHBondContact OG1-CE2 3.32Å; T235-F278 WeakPolarHBondContact OG1-CZ 3.37Å; F238-F278 HydrophobicContact CB-CB 4.3Å; F238-F278 HydrophobicContact CB-CD2 4.25Å; G274-F278 PolarHBondContact O-N 2.91Å; S276-F278 VanDerWaalsContact C-N 3.31Å; S276-F278 PolarHBondContact O-N 3.26Å; F278-T282 WeakPolarHBondContact CZ-OG1 3.33Å; F278-T282 VanDerWaalsContact O-CB 3.31Å; F278-T282 WeakPolarHBondContact O-CB 3.29Å; F278-T282 PolarHBondContact O-N 3.42Å; F278-T282 PolarHBondContact O-OG1 3.32Å |
| 279 | S | 86.3 | Confident | 81.7 | Confident | 0 Ų | 0 | 27.7 Ų | 27.7 | 0% | 0 | 15% | 0.148 | C | C | . | . | H | α-helix | trans | -66.7 | -45 | -176.2 | 76.1 | 0 | 0 | 0 | 0 | 110.9 | S34 N35 L275 S276 T282 M283 | S34-S279 WeakPolarHBondContact CB-OG 3.36Å; S34-S279 PolarHBondContact OG-OG 3.37Å; N35-S279 WeakPolarHBondContact OD1-CB 3.38Å; L275-S279 PolarHBondContact O-N 3.1Å; S276-S279 PolarHBondContact O-N 3.05Å; S276-S279 PolarHBondContact O-OG 2.89Å; S279-T282 PolarHBondContact O-N 3.35Å; S279-M283 WeakPolarHBondContact O-CG 3.44Å; S279-M283 PolarHBondContact O-N 3.35Å |
| 280 | V | 84.7 | Confident | 81 | Confident | 12 Ų | 12 | 34.4 Ų | 34.4 | 7% | 0.073 | 17% | 0.174 | C | C | . | . | H | α-helix | trans | -59.4 | -51.2 | 176.6 | 171.8 | 0 | 0 | 0 | 0 | 110.4 | S276 T282 M283 L284 F298 L302 F320 | S276-V280 WeakPolarHBondContact O-CB 3.34Å; S276-V280 VanDerWaalsContact O-CG2 3.29Å; S276-V280 WeakPolarHBondContact O-CG2 3.49Å; S276-V280 PolarHBondContact O-N 3.22Å; V280-T282 VanDerWaalsContact C-N 3.26Å; V280-T282 PolarHBondContact O-N 3.31Å; V280-M283 HydrophobicContact CG2-CE 4.38Å; V280-M283 PolarHBondContact O-N 3.19Å; V280-L284 HydrophobicContact CG1-CD1 3.62Å; V280-L284 HydrophobicContact CG1-CG 4.49Å; V280-L284 VanDerWaalsContact O-CD1 3.3Å; V280-L284 WeakPolarHBondContact O-CD1 3.44Å; V280-L284 WeakPolarHBondContact O-CG 3.46Å; V280-L284 PolarHBondContact O-N 3.27Å; V280-F298 HydrophobicContact CG2-CE1 4.29Å; V280-L302 HydrophobicContact CG1-CD2 4.21Å; V280-L302 HydrophobicContact CG2-CD2 4.37Å; V280-F320 HydrophobicContact CG1-CE1 4.4Å; V280-F320 HydrophobicContact CG1-CE2 4.32Å; V280-F320 HydrophobicContact CG1-CZ 3.57Å |
| 281 | T | 82.9 | Confident | 80.4 | Confident | 15 Ų | 15 | 33.8 Ų | 33.8 | 9% | 0.092 | 18% | 0.176 | C | C | . | . | H | α-helix | trans | -58.5 | -40.1 | 177.4 | -58.4 | 0 | 0 | 0 | 0 | 111.5 | L277 L284 Q285 | L277-T281 VanDerWaalsContact O-CB 3.23Å; L277-T281 WeakPolarHBondContact O-CB 3.43Å; L277-T281 PolarHBondContact O-N 3.34Å; L277-T281 PolarHBondContact O-OG1 3.21Å; T281-L284 PolarHBondContact O-N 3.48Å; T281-Q285 HydrophobicContact CG2-CG 4.19Å; T281-Q285 WeakPolarHBondContact O-CB 3.45Å; T281-Q285 WeakPolarHBondContact O-CG 3.39Å; T281-Q285 PolarHBondContact O-N 2.69Å |
| 282 | T | 82.5 | Confident | 79.7 | Confident | 0 Ų | 0 | 35.3 Ų | 35.3 | 0% | 0 | 19% | 0.187 | C | C | . | . | H | α-helix | trans | -66.8 | -41.3 | 179.2 | -65.9 | 0 | 0 | 0 | 0 | 112.5 | E55 R234 F278 S279 V280 R286 | E55-T282 WeakPolarHBondContact OE1-CG2 3.35Å; R234-T282 PolarHBondContact NH2-OG1 3.21Å; F278-T282 WeakPolarHBondContact CZ-OG1 3.33Å; F278-T282 VanDerWaalsContact O-CB 3.31Å; F278-T282 WeakPolarHBondContact O-CB 3.29Å; F278-T282 PolarHBondContact O-N 3.42Å; F278-T282 PolarHBondContact O-OG1 3.32Å; S279-T282 PolarHBondContact O-N 3.35Å; V280-T282 VanDerWaalsContact C-N 3.26Å; V280-T282 PolarHBondContact O-N 3.31Å; T282-R286 WeakPolarHBondContact O-CB 3.28Å; T282-R286 WeakPolarHBondContact O-CG 3.16Å; T282-R286 PolarHBondContact O-N 2.78Å |
| 283 | M | 83.8 | Confident | 79.2 | Confident | 3 Ų | 3 | 40.8 Ų | 40.8 | 2% | 0.015 | 22% | 0.22 | C | C | . | . | H | α-helix | trans | -65 | -38.9 | 176.3 | -71.2 | -174 | -74.5 | 0 | 0 | 112.1 | L37 C38 L41 S279 V280 I289 V295 F298 | L37-M283 HydrophobicContact CD2-SD 4.08Å; L37-M283 HydrophobicContact CG-SD 4.09Å; C38-M283 HydrophobicContact CB-CG 4.1Å; C38-M283 HydrophobicContact CB-SD 4.13Å; L41-M283 HydrophobicContact CD1-CG 4.44Å; L41-M283 HydrophobicContact CD1-SD 4.05Å; S279-M283 WeakPolarHBondContact O-CG 3.44Å; S279-M283 PolarHBondContact O-N 3.35Å; V280-M283 HydrophobicContact CG2-CE 4.38Å; V280-M283 PolarHBondContact O-N 3.19Å; M283-I289 HydrophobicContact CB-CG2 4.36Å; M283-I289 HydrophobicContact CG-CG2 4.3Å; M283-V295 HydrophobicContact CB-CG1 4.45Å; M283-F298 HydrophobicContact CE-CD1 4.24Å; M283-F298 HydrophobicContact CE-CE1 3.86Å |
| 284 | L | 79.9 | Confident | 78.8 | Confident | 43 Ų | 43 | 41.7 Ų | 41.7 | 23% | 0.225 | 23% | 0.229 | C | C | . | . | H | α-helix | trans | -77.1 | -40.2 | -176.8 | -64.5 | 160.5 | 0 | 0 | 0 | 113.3 | V280 T281 R286 R290 F320 | V280-L284 HydrophobicContact CG1-CD1 3.62Å; V280-L284 HydrophobicContact CG1-CG 4.49Å; V280-L284 VanDerWaalsContact O-CD1 3.3Å; V280-L284 WeakPolarHBondContact O-CD1 3.44Å; V280-L284 WeakPolarHBondContact O-CG 3.46Å; V280-L284 PolarHBondContact O-N 3.27Å; T281-L284 PolarHBondContact O-N 3.48Å; L284-R286 VanDerWaalsContact C-N 3.3Å; L284-R286 PolarHBondContact O-N 2.82Å; L284-R290 WeakPolarHBondContact O-CD 3.41Å; L284-F320 HydrophobicContact CD1-CD1 3.84Å; L284-F320 HydrophobicContact CD1-CE1 3.03Å; L284-F320 HydrophobicContact CD1-CZ 3.53Å; L284-F320 HydrophobicContact CD2-CE1 3.88Å; L284-F320 HydrophobicContact CG-CE1 4.05Å |
| 285 | Q | 77.2 | Confident | 78.2 | Confident | 123 Ų | 123 | 41.3 Ų | 41.3 | 58% | 0.575 | 22% | 0.223 | S | C | * | . | H | α-helix | trans | -78.6 | -14.2 | -176.2 | -68.5 | -175.7 | -4.8 | 0 | 0 | 112.9 | T281 | T281-Q285 HydrophobicContact CG2-CG 4.19Å; T281-Q285 WeakPolarHBondContact O-CB 3.45Å; T281-Q285 WeakPolarHBondContact O-CG 3.39Å; T281-Q285 PolarHBondContact O-N 2.69Å |
| 286 | R | 74.3 | Confident | 77.6 | Confident | 11 Ų | 11 | 47.9 Ų | 47.9 | 4% | 0.042 | 25% | 0.252 | C | S | . | . | trans | -93.5 | 105.5 | 177 | -74.2 | -177.2 | 174.5 | -160.1 | -0.1 | 110.5 | E55 T282 L284 D288 I289 R290 | E55-R286 VanDerWaalsContact CD-CZ 3.45Å; E55-R286 IonicContact OE1-CZ 3.65Å; E55-R286 IonicContact OE1-NE 2.98Å; E55-R286 IonicContact OE1-NH1 3.49Å; E55-R286 PolarHBondContact OE1-NH1 2.98Å; E55-R286 IonicContact OE1-NH2 2.67Å; E55-R286 PolarHBondContact OE1-NH2 3.06Å; E55-R286 IonicContact OE2-CZ 3.08Å; E55-R286 IonicContact OE2-NH1 2.74Å; E55-R286 PolarHBondContact OE2-NH1 2.48Å; E55-R286 IonicContact OE2-NH2 2.68Å; E55-R286 PolarHBondContact OE2-NH2 3.3Å; T282-R286 WeakPolarHBondContact O-CB 3.28Å; T282-R286 WeakPolarHBondContact O-CG 3.16Å; T282-R286 PolarHBondContact O-N 2.78Å; L284-R286 VanDerWaalsContact C-N 3.3Å; L284-R286 PolarHBondContact O-N 2.82Å; R286-D288 PolarHBondContact O-N 2.67Å; R286-D288 VanDerWaalsContact O-N 3.13Å; R286-I289 HydrophobicContact CB-CB 3.94Å; R286-I289 HydrophobicContact CB-CD1 4.03Å; R286-I289 HydrophobicContact CB-CG1 3.96Å; R286-I289 VanDerWaalsContact CD-CD1 3.5Å; R286-I289 HydrophobicContact CG-CD1 4.4Å; R286-I289 PolarHBondContact O-N 2.98Å; R286-R290 VanDerWaalsContact O-CB 3.31Å; R286-R290 WeakPolarHBondContact O-CB 3.33Å; R286-R290 PolarHBondContact O-N 3.08Å | ||
| 287 | T | 66.9 | Low | 77.2 | Confident | 84 Ų | 84 | 54.6 Ų | 54.6 | 52% | 0.515 | 28% | 0.281 | S | S | . | . | H | α-helix | trans | -46.4 | -44.7 | 176.6 | 45.7 | 0 | 0 | 0 | 0 | 113.3 | I289 T291 | T287-I289 VanDerWaalsContact C-N 3.26Å; T287-I289 PolarHBondContact O-N 2.85Å; T287-T291 WeakPolarHBondContact O-CG2 3.4Å; T287-T291 PolarHBondContact O-N 3.36Å; T287-T291 PolarHBondContact O-OG1 2.97Å; T287-T291 VanDerWaalsContact O-OG1 3.13Å |
| 288 | D | 70.2 | Confident | 76.7 | Confident | 104 Ų | 104 | 55.1 Ų | 55.1 | 56% | 0.556 | 28% | 0.282 | S | S | * | . | H | α-helix | trans | -71.4 | -21.1 | -175.9 | -47.7 | -17.5 | 0 | 0 | 0 | 113.1 | R45 R286 | R45-D288 IonicContact CZ-OD2 3.72Å; R45-D288 IonicContact NH1-OD2 3.97Å; R45-D288 IonicContact NH2-OD2 2.66Å; R45-D288 PolarHBondContact NH2-OD2 2.98Å; R286-D288 PolarHBondContact O-N 2.67Å; R286-D288 VanDerWaalsContact O-N 3.13Å |
| 289 | I | 70.4 | Confident | 76.2 | Confident | 5 Ų | 5 | 59.6 Ų | 59.6 | 3% | 0.026 | 30% | 0.301 | C | S | . | . | H | α-helix | trans | -98 | -41.6 | 178.4 | -61.4 | -175.6 | 0 | 0 | 0 | 109.5 | L41 L42 M283 R286 T287 T291 S292 V295 | L41-I289 HydrophobicContact CB-CG2 4.11Å; L41-I289 HydrophobicContact CD1-CG2 3.74Å; L41-I289 HydrophobicContact CG-CG2 4.39Å; L42-I289 HydrophobicContact CD2-CD1 3.88Å; M283-I289 HydrophobicContact CB-CG2 4.36Å; M283-I289 HydrophobicContact CG-CG2 4.3Å; R286-I289 HydrophobicContact CB-CB 3.94Å; R286-I289 HydrophobicContact CB-CD1 4.03Å; R286-I289 HydrophobicContact CB-CG1 3.96Å; R286-I289 VanDerWaalsContact CD-CD1 3.5Å; R286-I289 HydrophobicContact CG-CD1 4.4Å; R286-I289 PolarHBondContact O-N 2.98Å; T287-I289 VanDerWaalsContact C-N 3.26Å; T287-I289 PolarHBondContact O-N 2.85Å; I289-T291 PolarHBondContact O-N 3.27Å; I289-T291 VanDerWaalsContact O-N 3.16Å; I289-S292 WeakPolarHBondContact O-CB 3.47Å; I289-S292 PolarHBondContact O-N 3.33Å; I289-V295 HydrophobicContact CG2-CG2 3.96Å; I289-V295 WeakPolarHBondContact O-CG2 3.41Å |
| 290 | R | 66.2 | Low | 75.7 | Confident | 142 Ų | 142 | 61.3 Ų | 61.3 | 54% | 0.536 | 32% | 0.319 | S | S | . | . | H | α-helix | trans | -53.9 | -33.5 | 178.8 | -172 | 179.9 | 76.6 | 167.6 | 4.2 | 113.4 | L284 R286 S292 | L284-R290 WeakPolarHBondContact O-CD 3.41Å; R286-R290 VanDerWaalsContact O-CB 3.31Å; R286-R290 WeakPolarHBondContact O-CB 3.33Å; R286-R290 PolarHBondContact O-N 3.08Å; R290-S292 VanDerWaalsContact C-N 3.29Å |
| 291 | T | 68.4 | Low | 75.4 | Confident | 95 Ų | 95 | 65.1 Ų | 65.1 | 58% | 0.583 | 34% | 0.339 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -78.3 | -11.4 | -179.9 | 47.7 | 0 | 0 | 0 | 0 | 113.8 | T287 I289 T293 | T287-T291 WeakPolarHBondContact O-CG2 3.4Å; T287-T291 PolarHBondContact O-N 3.36Å; T287-T291 PolarHBondContact O-OG1 2.97Å; T287-T291 VanDerWaalsContact O-OG1 3.13Å; I289-T291 PolarHBondContact O-N 3.27Å; I289-T291 VanDerWaalsContact O-N 3.16Å; T291-T293 PolarHBondContact O-N 2.91Å |
| 292 | S | 75.2 | Confident | 74.7 | Confident | 32 Ų | 32 | 65.4 Ų | 65.4 | 22% | 0.224 | 34% | 0.34 | C | S | . | . | S | Bend | trans | -61.3 | 132.7 | 175.5 | -178.9 | 0 | 0 | 0 | 0 | 110.8 | I289 R290 S294 V295 K296 | I289-S292 WeakPolarHBondContact O-CB 3.47Å; I289-S292 PolarHBondContact O-N 3.33Å; R290-S292 VanDerWaalsContact C-N 3.29Å; S292-S294 PolarHBondContact O-N 3.45Å; S292-V295 PolarHBondContact O-N 3Å; S292-K296 PolarHBondContact O-N 3.47Å; S292-K296 VanDerWaalsContact O-N 3.13Å |
| 293 | T | 77.1 | Confident | 74.1 | Confident | 115 Ų | 115 | 68.4 Ų | 68.4 | 71% | 0.706 | 35% | 0.353 | S | S | * | . | H | α-helix | trans | -55.2 | -36.6 | 176.6 | 47.2 | 0 | 0 | 0 | 0 | 111.8 | T291 V295 K296 K297 | T291-T293 PolarHBondContact O-N 2.91Å; T293-V295 VanDerWaalsContact C-N 3.32Å; T293-V295 PolarHBondContact O-N 2.76Å; T293-K296 PolarHBondContact O-N 3.27Å; T293-K297 PolarHBondContact O-N 2.6Å |
| 294 | S | 75.2 | Confident | 73.5 | Confident | 45 Ų | 45 | 73 Ų | 73 | 32% | 0.315 | 38% | 0.376 | S | S | . | . | H | α-helix | trans | -61.8 | -37.2 | 175.5 | -51.6 | 0 | 0 | 0 | 0 | 112.8 | S292 F298 | S292-S294 PolarHBondContact O-N 3.45Å; S294-F298 VanDerWaalsContact O-CB 3.25Å; S294-F298 WeakPolarHBondContact O-CB 3.44Å; S294-F298 PolarHBondContact O-N 2.86Å |
| 295 | V | 73.3 | Confident | 72.9 | Confident | 5 Ų | 5 | 74.9 Ų | 74.9 | 3% | 0.03 | 38% | 0.382 | C | S | . | . | H | α-helix | trans | -75.4 | -36.3 | 179.2 | 177.3 | 0 | 0 | 0 | 0 | 111 | L41 M283 I289 S292 T293 F298 K299 | L41-V295 HydrophobicContact CD1-CG2 3.41Å; L41-V295 VanDerWaalsContact CD1-CG2 3.41Å; M283-V295 HydrophobicContact CB-CG1 4.45Å; I289-V295 HydrophobicContact CG2-CG2 3.96Å; I289-V295 WeakPolarHBondContact O-CG2 3.41Å; S292-V295 PolarHBondContact O-N 3Å; T293-V295 VanDerWaalsContact C-N 3.32Å; T293-V295 PolarHBondContact O-N 2.76Å; V295-F298 PolarHBondContact O-N 2.82Å; V295-K299 VanDerWaalsContact O-CB 3.31Å; V295-K299 WeakPolarHBondContact O-CB 3.45Å; V295-K299 PolarHBondContact O-N 3.19Å |
| 296 | K | 75.9 | Confident | 72.2 | Confident | 140 Ų | 140 | 69.6 Ų | 69.6 | 61% | 0.609 | 36% | 0.358 | S | S | * | . | H | α-helix | trans | -62.3 | -45.3 | 172.7 | -67.4 | -171.5 | 179.2 | -173 | 0 | 111.5 | S292 T293 K299 G300 | S292-K296 PolarHBondContact O-N 3.47Å; S292-K296 VanDerWaalsContact O-N 3.13Å; T293-K296 PolarHBondContact O-N 3.27Å; K296-K299 PolarHBondContact O-N 3.18Å; K296-G300 PolarHBondContact O-N 3.47Å |
| 297 | K | 80 | Confident | 71.6 | Confident | 143 Ų | 143 | 74.5 Ų | 74.5 | 62% | 0.622 | 38% | 0.382 | S | S | * | . | H | α-helix | trans | -61.8 | -49.9 | 175.1 | -171.1 | -179.2 | 177.6 | -177.9 | 0 | 111 | T293 K299 G300 D301 | T293-K297 PolarHBondContact O-N 2.6Å; K297-K299 VanDerWaalsContact C-N 3.32Å; K297-K299 PolarHBondContact O-N 3.06Å; K297-G300 WeakPolarHBondContact O-CA 3.18Å; K297-G300 PolarHBondContact O-N 3Å; K297-D301 PolarHBondContact O-N 3.44Å |
| 298 | F | 76.3 | Confident | 71.6 | Confident | 40 Ų | 40 | 78.5 Ų | 78.5 | 18% | 0.175 | 39% | 0.392 | C | S | . | . | H | α-helix | trans | -59.2 | -39.4 | 177 | -178.2 | -98 | 0 | 0 | 0 | 112.8 | L37 V280 M283 S294 V295 G300 D301 L302 | L37-F298 HydrophobicContact CD2-CB 3.69Å; L37-F298 HydrophobicContact CD2-CD1 4.1Å; L37-F298 HydrophobicContact CD2-CD2 3.62Å; L37-F298 HydrophobicContact CD2-CE2 4.27Å; L37-F298 HydrophobicContact CD2-CG 3.51Å; V280-F298 HydrophobicContact CG2-CE1 4.29Å; M283-F298 HydrophobicContact CE-CD1 4.24Å; M283-F298 HydrophobicContact CE-CE1 3.86Å; S294-F298 VanDerWaalsContact O-CB 3.25Å; S294-F298 WeakPolarHBondContact O-CB 3.44Å; S294-F298 PolarHBondContact O-N 2.86Å; V295-F298 PolarHBondContact O-N 2.82Å; F298-G300 VanDerWaalsContact C-N 3.33Å; F298-G300 PolarHBondContact O-N 3.23Å; F298-D301 PolarHBondContact O-N 3.12Å; F298-L302 HydrophobicContact CE1-CB 4.46Å; F298-L302 HydrophobicContact CE1-CD2 4.18Å; F298-L302 WeakPolarHBondContact O-CB 3.48Å; F298-L302 PolarHBondContact O-N 3.11Å |
| 299 | K | 73.9 | Confident | 70.9 | Confident | 94 Ų | 94 | 75.6 Ų | 75.6 | 41% | 0.409 | 38% | 0.379 | S | S | . | . | H | α-helix | trans | -60.3 | -43.7 | 173.4 | -176.3 | -170.6 | 174.8 | -166.9 | 0 | 110.9 | V295 K296 K297 F303 | V295-K299 VanDerWaalsContact O-CB 3.31Å; V295-K299 WeakPolarHBondContact O-CB 3.45Å; V295-K299 PolarHBondContact O-N 3.19Å; K296-K299 PolarHBondContact O-N 3.18Å; K297-K299 VanDerWaalsContact C-N 3.32Å; K297-K299 PolarHBondContact O-N 3.06Å; K299-F303 VanDerWaalsContact O-CB 3.27Å; K299-F303 WeakPolarHBondContact O-CB 3.19Å; K299-F303 PolarHBondContact O-N 3.37Å |
| 300 | G | 75.2 | Confident | 70.2 | Confident | 36 Ų | 36 | 80.2 Ų | 80.2 | 37% | 0.371 | 41% | 0.41 | S | S | . | . | H | α-helix | trans | -62.6 | -48 | 175.4 | 0 | 0 | 0 | 0 | 0 | 112.5 | K296 K297 F298 F303 M304 | K296-G300 PolarHBondContact O-N 3.47Å; K297-G300 WeakPolarHBondContact O-CA 3.18Å; K297-G300 PolarHBondContact O-N 3Å; F298-G300 VanDerWaalsContact C-N 3.33Å; F298-G300 PolarHBondContact O-N 3.23Å; G300-F303 PolarHBondContact O-N 2.86Å; G300-M304 WeakPolarHBondContact O-CG 3.5Å; G300-M304 PolarHBondContact O-N 2.94Å |
| 301 | D | 77.9 | Confident | 69.4 | Low | 92 Ų | 92 | 79.7 Ų | 79.7 | 49% | 0.492 | 42% | 0.417 | S | S | . | . | H | α-helix | trans | -65.3 | -41.4 | 179.4 | -63.5 | -21.2 | 0 | 0 | 0 | 111.4 | K297 F298 M304 F305 | K297-D301 PolarHBondContact O-N 3.44Å; F298-D301 PolarHBondContact O-N 3.12Å; D301-M304 PolarHBondContact O-N 3.26Å; D301-F305 WeakPolarHBondContact O-CB 3.39Å; D301-F305 PolarHBondContact O-N 2.97Å |
| 302 | L | 69.7 | Low | 68.7 | Low | 21 Ų | 21 | 76 Ų | 76 | 11% | 0.11 | 39% | 0.393 | C | S | . | . | H | α-helix | trans | -64.4 | -42.3 | 175.3 | -176.3 | 68.9 | 0 | 0 | 0 | 111.2 | L30 V280 F298 M304 F305 V306 F320 | L30-L302 HydrophobicContact CD1-CD1 4.08Å; V280-L302 HydrophobicContact CG1-CD2 4.21Å; V280-L302 HydrophobicContact CG2-CD2 4.37Å; F298-L302 HydrophobicContact CE1-CB 4.46Å; F298-L302 HydrophobicContact CE1-CD2 4.18Å; F298-L302 WeakPolarHBondContact O-CB 3.48Å; F298-L302 PolarHBondContact O-N 3.11Å; L302-M304 VanDerWaalsContact C-N 3.34Å; L302-F305 PolarHBondContact O-N 2.89Å; L302-V306 HydrophobicContact CD1-CG2 4.46Å; L302-V306 HydrophobicContact CG-CG2 4.38Å; L302-V306 WeakPolarHBondContact O-CB 3.49Å; L302-V306 VanDerWaalsContact O-CG2 3.23Å; L302-V306 WeakPolarHBondContact O-CG2 3.28Å; L302-V306 PolarHBondContact O-N 3.46Å; L302-F320 HydrophobicContact CD2-CZ 4.12Å |
| 303 | F | 69.5 | Low | 67.2 | Low | 63 Ų | 63 | 80.3 Ų | 80.3 | 28% | 0.276 | 41% | 0.407 | S | S | . | . | H | α-helix | trans | -60.9 | -45.3 | 175.6 | -177.9 | -103 | 0 | 0 | 0 | 111.3 | K299 G300 F305 V306 Q307 Y316 V324 | K299-F303 VanDerWaalsContact O-CB 3.27Å; K299-F303 WeakPolarHBondContact O-CB 3.19Å; K299-F303 PolarHBondContact O-N 3.37Å; G300-F303 PolarHBondContact O-N 2.86Å; F303-F305 VanDerWaalsContact C-N 3.31Å; F303-F305 PolarHBondContact O-N 3.28Å; F303-V306 PolarHBondContact O-N 3.31Å; F303-Q307 WeakPolarHBondContact O-CB 3.19Å; F303-Q307 PolarHBondContact O-N 3.21Å; F303-Y316 AromaticContact CD2-CE1 3.93Å; F303-Y316 HydrophobicContact CD2-CE1 3.93Å; F303-Y316 HydrophobicContact CD2-CE2 4.04Å; F303-Y316 AromaticContact CD2-CZ 3.51Å; F303-Y316 VanDerWaalsContact CD2-OH 3.3Å; F303-Y316 WeakPolarHBondContact CD2-OH 3.37Å; F303-Y316 AromaticContact CE2-CE1 4Å; F303-Y316 HydrophobicContact CE2-CE1 4Å; F303-V324 HydrophobicContact CE2-CG1 4.49Å; F303-V324 HydrophobicContact CE2-CG2 3.99Å; F303-V324 HydrophobicContact CZ-CG1 4.13Å; F303-V324 HydrophobicContact CZ-CG2 4.44Å |
| 304 | M | 70.8 | Confident | 65.6 | Low | 101 Ų | 101 | 79 Ų | 79 | 50% | 0.498 | 40% | 0.4 | S | S | . | . | H | α-helix | trans | -60.9 | -40 | 174.8 | -72.4 | -66.3 | -66.2 | 0 | 0 | 112.2 | G300 D301 L302 K308 | G300-M304 WeakPolarHBondContact O-CG 3.5Å; G300-M304 PolarHBondContact O-N 2.94Å; D301-M304 PolarHBondContact O-N 3.26Å; L302-M304 VanDerWaalsContact C-N 3.34Å; M304-K308 WeakPolarHBondContact O-CG 3.26Å; M304-K308 PolarHBondContact O-N 3.49Å |
| 305 | F | 66.3 | Low | 63.9 | Low | 82 Ų | 82 | 79.2 Ų | 79.2 | 36% | 0.36 | 40% | 0.398 | S | S | . | . | H | α-helix | trans | -65.5 | -48.7 | 176.6 | -176.2 | -98.8 | 0 | 0 | 0 | 112 | D301 L302 F303 Q307 K308 C309 F312 | D301-F305 WeakPolarHBondContact O-CB 3.39Å; D301-F305 PolarHBondContact O-N 2.97Å; L302-F305 PolarHBondContact O-N 2.89Å; F303-F305 VanDerWaalsContact C-N 3.31Å; F303-F305 PolarHBondContact O-N 3.28Å; F305-Q307 VanDerWaalsContact C-N 3.29Å; F305-Q307 PolarHBondContact O-N 3.07Å; F305-K308 PolarHBondContact O-N 3.42Å; F305-K308 VanDerWaalsContact O-N 3.17Å; F305-C309 PolarHBondContact O-N 3.07Å; F305-F312 HydrophobicContact CD1-CE2 4.48Å; F305-F312 HydrophobicContact CE1-CD2 4.08Å; F305-F312 AromaticContact CE1-CE2 3.58Å; F305-F312 HydrophobicContact CE1-CE2 3.58Å; F305-F312 HydrophobicContact CE1-CZ 4Å; F305-F312 HydrophobicContact CZ-CE2 4.22Å |
| 306 | V | 62.6 | Low | 62.5 | Low | 12 Ų | 12 | 80.3 Ų | 80.3 | 7% | 0.073 | 40% | 0.402 | C | S | . | . | H | α-helix | trans | -60.7 | -38.3 | 176.4 | 168.3 | 0 | 0 | 0 | 0 | 111.5 | L302 F303 K308 C309 F312 Y316 | L302-V306 HydrophobicContact CD1-CG2 4.46Å; L302-V306 HydrophobicContact CG-CG2 4.38Å; L302-V306 WeakPolarHBondContact O-CB 3.49Å; L302-V306 VanDerWaalsContact O-CG2 3.23Å; L302-V306 WeakPolarHBondContact O-CG2 3.28Å; L302-V306 PolarHBondContact O-N 3.46Å; F303-V306 PolarHBondContact O-N 3.31Å; V306-K308 VanDerWaalsContact C-N 3.3Å; V306-K308 PolarHBondContact O-N 2.9Å; V306-C309 CarbonylContact O-C 3.59Å; V306-C309 PolarHBondContact O-N 3.18Å; V306-F312 HydrophobicContact CB-CB 4.3Å; V306-F312 HydrophobicContact CG1-CB 4.06Å; V306-F312 HydrophobicContact CG2-CB 3.98Å; V306-Y316 HydrophobicContact CB-CD2 4.33Å; V306-Y316 VanDerWaalsContact CG1-CB 3.45Å; V306-Y316 HydrophobicContact CG1-CD2 4.04Å; V306-Y316 HydrophobicContact CG1-CG 3.76Å; V306-Y316 HydrophobicContact CG2-CD2 4.02Å |
| 307 | Q | 62.2 | Low | 61 | Low | 114 Ų | 114 | 79.7 Ų | 79.7 | 53% | 0.533 | 40% | 0.399 | S | S | . | . | H | α-helix | trans | -67.1 | -34 | 178.9 | -169.5 | 177.2 | -10.6 | 0 | 0 | 112 | F303 F305 | F303-Q307 WeakPolarHBondContact O-CB 3.19Å; F303-Q307 PolarHBondContact O-N 3.21Å; F305-Q307 VanDerWaalsContact C-N 3.29Å; F305-Q307 PolarHBondContact O-N 3.07Å |
| 308 | K | 67.5 | Low | 59.1 | Low | 168 Ų | 168 | 78.1 Ų | 78.1 | 73% | 0.73 | 41% | 0.405 | S | S | * | . | H | α-helix | trans | -78.9 | -28.7 | 177.4 | -74.2 | -177.2 | 176.7 | -174.3 | 0 | 113.6 | M304 F305 V306 P310 | M304-K308 WeakPolarHBondContact O-CG 3.26Å; M304-K308 PolarHBondContact O-N 3.49Å; F305-K308 PolarHBondContact O-N 3.42Å; F305-K308 VanDerWaalsContact O-N 3.17Å; V306-K308 VanDerWaalsContact C-N 3.3Å; V306-K308 PolarHBondContact O-N 2.9Å; K308-P310 WeakPolarHBondContact O-CD 3.32Å |
| 309 | C | 55.9 | Low | 57.3 | Low | 43 Ų | 43 | 79.1 Ų | 79.1 | 29% | 0.291 | 41% | 0.412 | S | S | . | . | trans | -105.2 | 102.8 | 178.5 | -76.6 | 0 | 0 | 0 | 0 | 111.4 | F305 V306 L311 F312 | F305-C309 PolarHBondContact O-N 3.07Å; V306-C309 CarbonylContact O-C 3.59Å; V306-C309 PolarHBondContact O-N 3.18Å; C309-L311 PolarHBondContact O-N 3.22Å; C309-F312 HydrophobicContact CB-CD2 3.51Å; C309-F312 HydrophobicContact CB-CE2 3.96Å; C309-F312 PolarHBondContact O-N 3.48Å | ||
| 310 | P | 56.1 | Low | 56 | Low | 102 Ų | 102 | 76.8 Ų | 76.8 | 66% | 0.662 | 40% | 0.402 | S | S | * | . | G | 310 helix | trans | -59.7 | -24 | -175.6 | 22.1 | -31.9 | 0 | 0 | 0 | 113.8 | K308 F312 K313 | K308-P310 WeakPolarHBondContact O-CD 3.32Å; P310-F312 PolarHBondContact O-N 3.43Å; P310-K313 PolarHBondContact O-N 3.18Å |
| 311 | L | 49.2 | Very low | 54.3 | Low | 130 Ų | 130 | 76.7 Ų | 76.7 | 68% | 0.681 | 40% | 0.401 | S | S | * | . | G | 310 helix | trans | -59.7 | -29.4 | 175.9 | -124.2 | 97.9 | 0 | 0 | 0 | 113.5 | C309 | C309-L311 PolarHBondContact O-N 3.22Š|
| 312 | F | 52.8 | Low | 52.3 | Low | 19 Ų | 19 | 77 Ų | 77 | 8% | 0.083 | 41% | 0.411 | C | S | . | . | G | 310 helix | trans | -93.9 | -10.3 | -175.1 | -66.3 | -81.1 | 0 | 0 | 0 | 114.2 | F27 L30 L273 F305 V306 C309 P310 L315 Y316 | F27-F312 HydrophobicContact CD1-CE1 4.23Å; F27-F312 AromaticContact CD1-CZ 3.91Å; F27-F312 HydrophobicContact CD1-CZ 3.91Å; F27-F312 AromaticContact CE1-CE1 3.78Å; F27-F312 HydrophobicContact CE1-CE1 3.78Å; F27-F312 HydrophobicContact CE1-CE2 4.48Å; F27-F312 AromaticContact CE1-CZ 3.49Å; F27-F312 HydrophobicContact CE1-CZ 3.49Å; F27-F312 VanDerWaalsContact CE1-CZ 3.49Å; L30-F312 HydrophobicContact CD2-CE1 4.1Å; L30-F312 HydrophobicContact CD2-CZ 4.4Å; L273-F312 HydrophobicContact CD1-CE1 4.08Å; F305-F312 HydrophobicContact CD1-CE2 4.48Å; F305-F312 HydrophobicContact CE1-CD2 4.08Å; F305-F312 AromaticContact CE1-CE2 3.58Å; F305-F312 HydrophobicContact CE1-CE2 3.58Å; F305-F312 HydrophobicContact CE1-CZ 4Å; F305-F312 HydrophobicContact CZ-CE2 4.22Å; V306-F312 HydrophobicContact CB-CB 4.3Å; V306-F312 HydrophobicContact CG1-CB 4.06Å; V306-F312 HydrophobicContact CG2-CB 3.98Å; C309-F312 HydrophobicContact CB-CD2 3.51Å; C309-F312 HydrophobicContact CB-CE2 3.96Å; C309-F312 PolarHBondContact O-N 3.48Å; P310-F312 PolarHBondContact O-N 3.43Å; F312-L315 HydrophobicContact CD1-CD2 4.1Å; F312-L315 WeakPolarHBondContact O-CB 3Å; F312-L315 PolarHBondContact O-N 2.94Å; F312-L315 VanDerWaalsContact O-N 3.16Å; F312-Y316 WeakPolarHBondContact O-CB 3.16Å; F312-Y316 PolarHBondContact O-N 3.1Å |
| 313 | K | 43.8 | Very low | 50.7 | Low | 122 Ų | 122 | 80.1 Ų | 80.1 | 53% | 0.53 | 43% | 0.434 | S | S | . | . | H | α-helix | trans | -56.6 | -44.8 | 179.3 | -82.3 | -178.1 | 176.8 | 175.8 | 0 | 113.4 | P310 L315 Y316 F317 | P310-K313 PolarHBondContact O-N 3.18Å; K313-L315 VanDerWaalsContact C-N 3.33Å; K313-L315 PolarHBondContact O-N 3.41Å; K313-Y316 PolarHBondContact O-N 2.92Å; K313-F317 WeakPolarHBondContact O-CB 3.44Å; K313-F317 PolarHBondContact O-N 3.41Å |
| 314 | P | 43.4 | Very low | 49.2 | Very low | 86 Ų | 86 | 81.1 Ų | 81.1 | 56% | 0.558 | 45% | 0.445 | S | S | * | . | H | α-helix | trans | -63.4 | -41.3 | 176.3 | -18.2 | 30.7 | 0 | 0 | 0 | 111.6 | F317 C318 | P314-F317 PolarHBondContact O-N 3.37Å; P314-C318 WeakPolarHBondContact O-CB 3.48Å; P314-C318 PolarHBondContact O-N 3.25Å; P314-C318 PolarHBondContact O-SG 2.8Å; P314-C318 VanDerWaalsContact O-SG 3.36Å |
| 315 | L | 39.8 | Very low | 47.4 | Very low | 50 Ų | 50 | 82.9 Ų | 82.9 | 26% | 0.262 | 46% | 0.456 | S | S | . | . | H | α-helix | trans | -63.7 | -45.5 | 179.7 | -153 | 83 | 0 | 0 | 0 | 111.1 | L273 L277 F312 K313 C318 L319 | L273-L315 HydrophobicContact CD1-CD2 3.73Å; L273-L315 HydrophobicContact CD2-CD1 4.41Å; L273-L315 HydrophobicContact CD2-CD2 4.46Å; L273-L315 HydrophobicContact CG-CD2 4.33Å; L277-L315 HydrophobicContact CD1-CD1 4.34Å; L277-L315 HydrophobicContact CD1-CD2 4.44Å; L277-L315 HydrophobicContact CD2-CD2 3.76Å; L277-L315 HydrophobicContact CD2-CG 4.28Å; L277-L315 HydrophobicContact CG-CD2 4.48Å; F312-L315 HydrophobicContact CD1-CD2 4.1Å; F312-L315 WeakPolarHBondContact O-CB 3Å; F312-L315 PolarHBondContact O-N 2.94Å; F312-L315 VanDerWaalsContact O-N 3.16Å; K313-L315 VanDerWaalsContact C-N 3.33Å; K313-L315 PolarHBondContact O-N 3.41Å; L315-C318 PolarHBondContact O-N 3.5Å; L315-L319 HydrophobicContact CD2-CD1 4.34Å; L315-L319 HydrophobicContact CG-CD1 4Å; L315-L319 WeakPolarHBondContact O-CB 3.32Å; L315-L319 WeakPolarHBondContact O-CD1 3.45Å; L315-L319 WeakPolarHBondContact O-CG 3.27Å; L315-L319 PolarHBondContact O-N 3.2Å |
| 316 | Y | 43 | Very low | 45.9 | Very low | 29 Ų | 29 | 85.5 Ų | 85.5 | 11% | 0.114 | 47% | 0.474 | C | S | . | . | H | α-helix | trans | -64.8 | -43.6 | 176.9 | -175.4 | -88.4 | 0 | 0 | 0 | 111.8 | F303 V306 F312 K313 C318 L319 F320 | F303-Y316 AromaticContact CD2-CE1 3.93Å; F303-Y316 HydrophobicContact CD2-CE1 3.93Å; F303-Y316 HydrophobicContact CD2-CE2 4.04Å; F303-Y316 AromaticContact CD2-CZ 3.51Å; F303-Y316 VanDerWaalsContact CD2-OH 3.3Å; F303-Y316 WeakPolarHBondContact CD2-OH 3.37Å; F303-Y316 AromaticContact CE2-CE1 4Å; F303-Y316 HydrophobicContact CE2-CE1 4Å; V306-Y316 HydrophobicContact CB-CD2 4.33Å; V306-Y316 VanDerWaalsContact CG1-CB 3.45Å; V306-Y316 HydrophobicContact CG1-CD2 4.04Å; V306-Y316 HydrophobicContact CG1-CG 3.76Å; V306-Y316 HydrophobicContact CG2-CD2 4.02Å; F312-Y316 WeakPolarHBondContact O-CB 3.16Å; F312-Y316 PolarHBondContact O-N 3.1Å; K313-Y316 PolarHBondContact O-N 2.92Å; Y316-C318 VanDerWaalsContact C-N 3.33Å; Y316-C318 PolarHBondContact O-N 2.96Å; Y316-L319 PolarHBondContact O-N 2.91Å; Y316-F320 HydrophobicContact CD1-CB 4.38Å; Y316-F320 HydrophobicContact CD1-CD2 4.28Å; Y316-F320 AromaticContact CD2-CD2 3.28Å; Y316-F320 HydrophobicContact CD2-CD2 3.28Å; Y316-F320 AromaticContact CD2-CE2 3.46Å; Y316-F320 HydrophobicContact CD2-CE2 3.46Å; Y316-F320 VanDerWaalsContact CD2-CE2 3.46Å; Y316-F320 HydrophobicContact CD2-CG 4.07Å; Y316-F320 HydrophobicContact CD2-CZ 4.3Å; Y316-F320 HydrophobicContact CE1-CB 4.07Å; Y316-F320 HydrophobicContact CE1-CD2 4.41Å; Y316-F320 HydrophobicContact CE1-CG 4.38Å; Y316-F320 HydrophobicContact CE2-CB 4.35Å; Y316-F320 HydrophobicContact CE2-CD1 4.26Å; Y316-F320 AromaticContact CE2-CD2 3.45Å; Y316-F320 HydrophobicContact CE2-CD2 3.45Å; Y316-F320 VanDerWaalsContact CE2-CD2 3.45Å; Y316-F320 HydrophobicContact CE2-CE1 4.34Å; Y316-F320 AromaticContact CE2-CE2 3.66Å; Y316-F320 HydrophobicContact CE2-CE2 3.66Å; Y316-F320 AromaticContact CE2-CG 3.79Å; Y316-F320 HydrophobicContact CE2-CG 3.79Å; Y316-F320 HydrophobicContact CE2-CZ 4.1Å; Y316-F320 AromaticContact CG-CD2 3.72Å; Y316-F320 HydrophobicContact CG-CD2 3.72Å; Y316-F320 HydrophobicContact CG-CE2 4.27Å; Y316-F320 HydrophobicContact CG-CG 4.47Å; Y316-F320 AromaticContact CZ-CG 3.94Å; Y316-F320 WeakPolarHBondContact O-CB 3.21Å; Y316-F320 VanDerWaalsContact O-CD2 3.31Å; Y316-F320 WeakPolarHBondContact O-CD2 3.46Å; Y316-F320 PolarHBondContact O-N 3.13Å |
| 317 | F | 46 | Very low | 44.5 | Very low | 127 Ų | 127 | 93.9 Ų | 93.9 | 56% | 0.557 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -61.4 | -42.7 | 176.4 | -167.1 | -95.3 | 0 | 0 | 0 | 111.7 | K313 P314 L319 G321 | K313-F317 WeakPolarHBondContact O-CB 3.44Å; K313-F317 PolarHBondContact O-N 3.41Å; P314-F317 PolarHBondContact O-N 3.37Å; F317-L319 PolarHBondContact O-N 3.03Å; F317-G321 WeakPolarHBondContact O-CA 3.36Å; F317-G321 PolarHBondContact O-N 3.04Å |
| 318 | C | 39.1 | Very low | 43.1 | Very low | 110 Ų | 110 | 94.7 Ų | 94.7 | 74% | 0.743 | 53% | 0.526 | S | S | * | . | H | α-helix | trans | -64.1 | -34.5 | 175.6 | -77.4 | 0 | 0 | 0 | 0 | 113.7 | P314 L315 Y316 | P314-C318 WeakPolarHBondContact O-CB 3.48Å; P314-C318 PolarHBondContact O-N 3.25Å; P314-C318 PolarHBondContact O-SG 2.8Å; P314-C318 VanDerWaalsContact O-SG 3.36Å; L315-C318 PolarHBondContact O-N 3.5Å; Y316-C318 VanDerWaalsContact C-N 3.33Å; Y316-C318 PolarHBondContact O-N 2.96Å |
| 319 | L | 37.6 | Very low | 41.4 | Very low | 61 Ų | 61 | 93 Ų | 93 | 32% | 0.319 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -88.8 | -32.7 | -175.3 | -68 | 160.8 | 0 | 0 | 0 | 113.9 | L277 L315 Y316 F317 | L277-L319 HydrophobicContact CD2-CD1 3.2Å; L277-L319 HydrophobicContact CD2-CD2 4.04Å; L277-L319 HydrophobicContact CD2-CG 4.2Å; L277-L319 HydrophobicContact CG-CD1 4.47Å; L315-L319 HydrophobicContact CD2-CD1 4.34Å; L315-L319 HydrophobicContact CG-CD1 4Å; L315-L319 WeakPolarHBondContact O-CB 3.32Å; L315-L319 WeakPolarHBondContact O-CD1 3.45Å; L315-L319 WeakPolarHBondContact O-CG 3.27Å; L315-L319 PolarHBondContact O-N 3.2Å; Y316-L319 PolarHBondContact O-N 2.91Å; F317-L319 PolarHBondContact O-N 3.03Å |
| 320 | F | 46.8 | Very low | 40.2 | Very low | 44 Ų | 44 | 98.1 Ų | 98.1 | 19% | 0.193 | 55% | 0.553 | C | S | . | * | H | α-helix | trans | -113.4 | -15.8 | -168.2 | -65.5 | -89.5 | 0 | 0 | 0 | 113.8 | V280 L284 L302 Y316 | V280-F320 HydrophobicContact CG1-CE1 4.4Å; V280-F320 HydrophobicContact CG1-CE2 4.32Å; V280-F320 HydrophobicContact CG1-CZ 3.57Å; L284-F320 HydrophobicContact CD1-CD1 3.84Å; L284-F320 HydrophobicContact CD1-CE1 3.03Å; L284-F320 HydrophobicContact CD1-CZ 3.53Å; L284-F320 HydrophobicContact CD2-CE1 3.88Å; L284-F320 HydrophobicContact CG-CE1 4.05Å; L302-F320 HydrophobicContact CD2-CZ 4.12Å; Y316-F320 HydrophobicContact CD1-CB 4.38Å; Y316-F320 HydrophobicContact CD1-CD2 4.28Å; Y316-F320 AromaticContact CD2-CD2 3.28Å; Y316-F320 HydrophobicContact CD2-CD2 3.28Å; Y316-F320 AromaticContact CD2-CE2 3.46Å; Y316-F320 HydrophobicContact CD2-CE2 3.46Å; Y316-F320 VanDerWaalsContact CD2-CE2 3.46Å; Y316-F320 HydrophobicContact CD2-CG 4.07Å; Y316-F320 HydrophobicContact CD2-CZ 4.3Å; Y316-F320 HydrophobicContact CE1-CB 4.07Å; Y316-F320 HydrophobicContact CE1-CD2 4.41Å; Y316-F320 HydrophobicContact CE1-CG 4.38Å; Y316-F320 HydrophobicContact CE2-CB 4.35Å; Y316-F320 HydrophobicContact CE2-CD1 4.26Å; Y316-F320 AromaticContact CE2-CD2 3.45Å; Y316-F320 HydrophobicContact CE2-CD2 3.45Å; Y316-F320 VanDerWaalsContact CE2-CD2 3.45Å; Y316-F320 HydrophobicContact CE2-CE1 4.34Å; Y316-F320 AromaticContact CE2-CE2 3.66Å; Y316-F320 HydrophobicContact CE2-CE2 3.66Å; Y316-F320 AromaticContact CE2-CG 3.79Å; Y316-F320 HydrophobicContact CE2-CG 3.79Å; Y316-F320 HydrophobicContact CE2-CZ 4.1Å; Y316-F320 AromaticContact CG-CD2 3.72Å; Y316-F320 HydrophobicContact CG-CD2 3.72Å; Y316-F320 HydrophobicContact CG-CE2 4.27Å; Y316-F320 HydrophobicContact CG-CG 4.47Å; Y316-F320 AromaticContact CZ-CG 3.94Å; Y316-F320 WeakPolarHBondContact O-CB 3.21Å; Y316-F320 VanDerWaalsContact O-CD2 3.31Å; Y316-F320 WeakPolarHBondContact O-CD2 3.46Å; Y316-F320 PolarHBondContact O-N 3.13Å |
| 321 | G | 40.6 | Very low | 38.9 | Very low | 35 Ų | 35 | 99.5 Ų | 99.5 | 36% | 0.361 | 56% | 0.555 | S | S | . | * | trans | 63.5 | 168.9 | -173.3 | 0 | 0 | 0 | 0 | 0 | 112.5 | F317 S323 | F317-G321 WeakPolarHBondContact O-CA 3.36Å; F317-G321 PolarHBondContact O-N 3.04Å; G321-S323 PolarHBondContact O-N 3.21Å | ||
| 322 | S | 35.7 | Very low | 38.1 | Very low | 99 Ų | 99 | 99.7 Ų | 99.7 | 69% | 0.692 | 56% | 0.562 | S | S | * | * | S | Bend | trans | -77.1 | 33.8 | -171.6 | -163.7 | 0 | 0 | 0 | 0 | 115 | V324 | S322-V324 VanDerWaalsContact C-N 3.28Å; S322-V324 PolarHBondContact O-N 3.42Å |
| 323 | S | 36.1 | Very low | 37 | Very low | 85 Ų | 85 | 104.5 Ų | 104.5 | 59% | 0.594 | 60% | 0.597 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -87.3 | 28.4 | -171.7 | 91.3 | 0 | 0 | 0 | 0 | 115.1 | G321 N325 | G321-S323 PolarHBondContact O-N 3.21Å; S323-N325 VanDerWaalsContact C-N 3.27Å; S323-N325 PolarHBondContact O-N 2.81Å |
| 324 | V | 38.3 | Very low | 36.3 | Very low | 84 Ų | 84 | 103 Ų | 103 | 51% | 0.509 | 61% | 0.608 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -80.7 | -1 | -179.8 | 174.5 | 0 | 0 | 0 | 0 | 113.1 | F303 S322 | F303-V324 HydrophobicContact CE2-CG1 4.49Å; F303-V324 HydrophobicContact CE2-CG2 3.99Å; F303-V324 HydrophobicContact CZ-CG1 4.13Å; F303-V324 HydrophobicContact CZ-CG2 4.44Å; S322-V324 VanDerWaalsContact C-N 3.28Å; S322-V324 PolarHBondContact O-N 3.42Å |
| 325 | N | 33 | Very low | 35.9 | Very low | 138 Ų | 138 | 104.1 Ų | 104.1 | 74% | 0.738 | 62% | 0.616 | S | S | * | * | S | Bend | trans | -114 | 0.9 | -177 | -82.9 | 3.2 | 0 | 0 | 0 | 117.8 | S323 | S323-N325 VanDerWaalsContact C-N 3.27Å; S323-N325 PolarHBondContact O-N 2.81Å |
| 326 | D | 34.1 | Very low | 35.3 | Very low | 137 Ų | 137 | 106.1 Ų | 106.1 | 73% | 0.733 | 63% | 0.633 | S | S | * | * | S | Bend | trans | -107.9 | 11.4 | -171.2 | -76.7 | -21.6 | 0 | 0 | 0 | 116.5 | ||
| 327 | E | 32.7 | Very low | 34.8 | Very low | 188 Ų | 188 | 111.6 Ų | 111.6 | 88% | 0.879 | 67% | 0.665 | S | S | * | * | S | Bend | trans | -105.1 | 24.1 | 179.2 | -96.2 | -178.8 | 154.1 | 0 | 0 | 114.6 | ||
| 328 | T | 33.5 | Very low | 34.2 | Very low | 132 Ų | 132 | 112.2 Ų | 112.2 | 81% | 0.81 | 68% | 0.678 | S | S | * | * | trans | -119.8 | 7.3 | 176.7 | 41.6 | 0 | 0 | 0 | 0 | 116.9 | ||||
| 329 | T | 31.6 | Very low | 34 | Very low | 131 Ų | 131 | 113.7 Ų | 113.7 | 80% | 0.804 | 68% | 0.684 | S | S | * | * | trans | -107.8 | 78.7 | 168.3 | 41.8 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 330 | L | 31.1 | Very low | 33.7 | Very low | 152 Ų | 152 | 116 Ų | 116 | 80% | 0.796 | 71% | 0.705 | S | S | * | * | trans | -61.8 | 147.8 | 150 | -138.7 | 85.6 | 0 | 0 | 0 | 107.8 | ||||
| 331 | D | 28.7 | Very low | 33.1 | Very low | 131 Ų | 131 | 119.9 Ų | 119.9 | 70% | 0.701 | 73% | 0.732 | S | S | * | * | trans | 94.5 | 119.1 | 162.3 | -56.9 | -26.5 | 0 | 0 | 0 | 118.8 | ||||
| 332 | T | 31.8 | Very low | 32.7 | Very low | 134 Ų | 134 | 127 Ų | 127 | 82% | 0.822 | 76% | 0.761 | S | S | * | * | trans | 93.1 | 120.4 | 154.8 | 64.8 | 0 | 0 | 0 | 0 | 119.6 | ||||
| 333 | S | 30.6 | Very low | 32.5 | Very low | 119 Ų | 119 | 127.8 Ų | 127.8 | 83% | 0.832 | 77% | 0.767 | S | S | * | * | trans | 83.2 | 100.8 | 159.8 | 72.1 | 0 | 0 | 0 | 0 | 118.8 | ||||
| 334 | A | 29.3 | Very low | 32.3 | Very low | 92 Ų | 92 | 135.2 Ų | 135.2 | 76% | 0.76 | 78% | 0.781 | S | S | * | * | trans | -69.8 | 153.2 | 140 | 0 | 0 | 0 | 0 | 0 | 107.5 | ||||
| 335 | P | 33.5 | Very low | 32.3 | Very low | 109 Ų | 109 | 137.4 Ų | 137.4 | 71% | 0.708 | 80% | 0.799 | S | S | * | * | -154 | 166 | 66.6 | 37.7 | -16.2 | 0 | 0 | 0 | 117 | |||||
| 336 | S | 28.8 | Very low | 32.5 | Very low | 91 Ų | 91 | 143.8 Ų | 143.8 | 64% | 0.636 | 82% | 0.824 | S | S | * | * | trans | 64.7 | 136.6 | 139.6 | 67.6 | 0 | 0 | 0 | 0 | 121.1 | ||||
| 337 | N | 30.9 | Very low | 32.4 | Very low | 145 Ų | 145 | 144.1 Ų | 144.1 | 78% | 0.775 | 83% | 0.829 | S | S | * | * | trans | 82.9 | 75.9 | 153.1 | -51.2 | -25.5 | 0 | 0 | 0 | 118.5 | ||||
| 338 | V | 34.6 | Very low | 32.4 | Very low | 139 Ų | 139 | 141.8 Ų | 141.8 | 84% | 0.842 | 83% | 0.826 | S | S | * | * | trans | -139.1 | 71.3 | 145.7 | -168.7 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 339 | V | 34.1 | Very low | 32.3 | Very low | 142 Ų | 142 | 142.3 Ų | 142.3 | 86% | 0.861 | 83% | 0.827 | S | S | * | * | trans | -121.8 | 91.1 | 161.3 | 173.4 | 0 | 0 | 0 | 0 | 104.9 | ||||
| 340 | S | 31 | Very low | 32.4 | Very low | 110 Ų | 110 | 143 Ų | 143 | 77% | 0.769 | 83% | 0.829 | S | S | * | * | trans | 157.3 | 70 | 159.7 | 59.9 | 0 | 0 | 0 | 0 | 113.5 | ||||
| 341 | V | 35.1 | Very low | 32.4 | Very low | 125 Ų | 125 | 142.4 Ų | 142.4 | 76% | 0.758 | 83% | 0.831 | S | S | * | * | S | Bend | trans | -142.4 | 9.6 | 168.4 | -164.4 | 0 | 0 | 0 | 0 | 115.2 | ||
| 342 | L | 33.1 | Very low | 32.7 | Very low | 185 Ų | 185 | 143.2 Ų | 143.2 | 97% | 0.969 | 84% | 0.839 | S | S | * | * | S | Bend | trans | -127.1 | 33.9 | -178.5 | -81.8 | 164.9 | 0 | 0 | 0 | 115.4 | ||
| 343 | S | 30.1 | Very low | 32.8 | Very low | 115 Ų | 115 | 143.9 Ų | 143.9 | 80% | 0.804 | 84% | 0.841 | S | S | * | * | S | Bend | trans | -113.6 | 29.3 | 171.2 | 72.1 | 0 | 0 | 0 | 0 | 114.2 | ||
| 344 | R | 32.7 | Very low | 32.9 | Very low | 240 Ų | 240 | 145.8 Ų | 145.8 | 91% | 0.906 | 84% | 0.841 | S | S | * | * | trans | -140 | 91.6 | 170.5 | -87.1 | -172.6 | -172 | 174.5 | 2.9 | 110 | ||||
| 345 | C | 37 | Very low | 33.2 | Very low | 130 Ų | 130 | 150.3 Ų | 150.3 | 88% | 0.878 | 85% | 0.848 | S | S | * | * | trans | -162.5 | 108.5 | 139.5 | -99.8 | 0 | 0 | 0 | 0 | 105.7 | ||||
| 346 | E | 37.6 | Very low | 33.2 | Very low | 272 Ų | 272 | 154 Ų | 154 | 100% | 1.271 | 86% | 0.861 | S | S | * | * | trans | -52.7 | 0 | 157.2 | -69.3 | 171.3 | 138.7 | 0 | 0 | 111.7 |
Retrieved 346 of 346 residues in 156.9 ms
(Link to these results)