| 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 | 43.1 | Very low | 61.9 | Low | 200 Ų | 200 | 114.1 Ų | 114.1 | 99% | 0.985 | 61% | 0.607 | S | S | * | * | 0 | -50.2 | 0 | -80.1 | -159.7 | -159.4 | 0 | 0 | 114.1 | A3 L4 C5 | M1-A3 VanDerWaalsContact C-N 3.27Å; M1-A3 PolarHBondContact O-N 3.24Å; M1-L4 PolarHBondContact O-N 3.26Å; M1-C5 PolarHBondContact O-N 3.49Å; M1-C5 VanDerWaalsContact O-N 3.16Å | |||
| 2 | K | 42.5 | Very low | 64.4 | Low | 199 Ų | 199 | 118.8 Ų | 118.8 | 87% | 0.865 | 61% | 0.61 | S | S | * | * | H | α-helix | trans | -57.3 | -34 | 178 | -81.3 | -176.6 | 174.7 | -179.8 | 0 | 114.3 | C5 | K2-C5 PolarHBondContact O-N 3.17Å |
| 3 | A | 46.9 | Very low | 66.5 | Low | 77 Ų | 77 | 110.7 Ų | 110.7 | 64% | 0.636 | 57% | 0.57 | S | S | * | * | H | α-helix | trans | -72 | -22.7 | 174 | 0 | 0 | 0 | 0 | 0 | 114.8 | M1 S6 | M1-A3 VanDerWaalsContact C-N 3.27Å; M1-A3 PolarHBondContact O-N 3.24Å; A3-S6 PolarHBondContact O-OG 3.48Å; A3-S6 VanDerWaalsContact O-OG 3.06Å |
| 4 | L | 47 | Very low | 68.5 | Low | 126 Ų | 126 | 107.1 Ų | 107.1 | 66% | 0.66 | 56% | 0.56 | S | S | * | * | H | α-helix | trans | -83.3 | -27 | 174 | -92.3 | 131.5 | 0 | 0 | 0 | 112 | M1 S6 | M1-L4 PolarHBondContact O-N 3.26Å; L4-S6 VanDerWaalsContact C-N 3.35Å |
| 5 | C | 48.6 | Very low | 70.2 | Confident | 99 Ų | 99 | 105.1 Ų | 105.1 | 67% | 0.669 | 56% | 0.558 | S | S | * | * | H | α-helix | trans | -73.9 | -22.6 | 175.2 | -78.3 | 0 | 0 | 0 | 0 | 113.4 | M1 K2 P9 | M1-C5 PolarHBondContact O-N 3.49Å; M1-C5 VanDerWaalsContact O-N 3.16Å; K2-C5 PolarHBondContact O-N 3.17Å; C5-P9 WeakPolarHBondContact O-CD 3.32Å |
| 6 | S | 55.6 | Low | 71.8 | Confident | 73 Ų | 73 | 100.1 Ų | 100.1 | 51% | 0.51 | 53% | 0.531 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -82.5 | -16.8 | 179.1 | 52.5 | 0 | 0 | 0 | 0 | 114.6 | A3 L4 | A3-S6 PolarHBondContact O-OG 3.48Å; A3-S6 VanDerWaalsContact O-OG 3.06Å; L4-S6 VanDerWaalsContact C-N 3.35Å |
| 7 | Q | 63.3 | Low | 73.2 | Confident | 115 Ų | 115 | 95.1 Ų | 95.1 | 54% | 0.537 | 50% | 0.504 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -83.7 | -38.5 | -178.9 | -90 | -178.1 | -25.4 | 0 | 0 | 113.8 | L10 E11 | Q7-L10 WeakPolarHBondContact O-CB 3.12Å; Q7-L10 PolarHBondContact O-N 3.25Å; Q7-E11 PolarHBondContact O-N 2.7Å; Q7-E11 VanDerWaalsContact O-N 3.12Å |
| 8 | K | 79.5 | Confident | 74.5 | Confident | 123 Ų | 123 | 92.1 Ų | 92.1 | 54% | 0.535 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -54.3 | -43 | -177.8 | -78.4 | -166.6 | 173.5 | -171.5 | 0 | 114.5 | L10 E11 W12 | K8-L10 VanDerWaalsContact C-N 3.27Å; K8-L10 PolarHBondContact O-N 3.26Å; K8-E11 PolarHBondContact O-N 3.42Å; K8-W12 HydrophobicContact CB-CZ2 4.29Å; K8-W12 HydrophobicContact CD-CZ2 4.42Å; K8-W12 VanDerWaalsContact O-CG 3.26Å; K8-W12 PolarHBondContact O-N 2.87Å |
| 9 | P | 80.1 | Confident | 75.6 | Confident | 57 Ų | 57 | 93.4 Ų | 93.4 | 37% | 0.37 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -60.2 | -36.8 | 177.3 | -24.7 | 35 | 0 | 0 | 0 | 112.8 | C5 W12 V13 | C5-P9 WeakPolarHBondContact O-CD 3.32Å; P9-W12 PolarHBondContact O-N 3.32Å; P9-V13 WeakPolarHBondContact O-CG2 3.35Å; P9-V13 PolarHBondContact O-N 2.94Å; P9-V13 VanDerWaalsContact O-N 3.13Å |
| 10 | L | 85.6 | Confident | 76.6 | Confident | 73 Ų | 73 | 88.8 Ų | 88.8 | 38% | 0.382 | 47% | 0.468 | S | S | . | . | H | α-helix | trans | -68.5 | -41.6 | 177.2 | -64.8 | 165.6 | 0 | 0 | 0 | 110.9 | Q7 K8 W12 V13 S14 M56 | Q7-L10 WeakPolarHBondContact O-CB 3.12Å; Q7-L10 PolarHBondContact O-N 3.25Å; K8-L10 VanDerWaalsContact C-N 3.27Å; K8-L10 PolarHBondContact O-N 3.26Å; L10-W12 VanDerWaalsContact C-N 3.3Å; L10-W12 PolarHBondContact O-N 3.15Å; L10-V13 PolarHBondContact O-N 3.16Å; L10-S14 PolarHBondContact O-N 3.38Å; L10-S14 PolarHBondContact O-OG 2.96Å; L10-M56 HydrophobicContact CB-CE 4.38Å; L10-M56 HydrophobicContact CB-SD 4.44Å; L10-M56 HydrophobicContact CD2-SD 3.54Å; L10-M56 VanDerWaalsContact CD2-SD 3.54Å; L10-M56 WeakPolarHBondContact O-CE 3.37Å |
| 11 | E | 88.6 | Confident | 77.5 | Confident | 113 Ų | 113 | 87 Ų | 87 | 53% | 0.528 | 46% | 0.457 | S | S | . | . | H | α-helix | trans | -59.2 | -41.6 | 174 | -70.1 | 177.8 | 167.7 | 0 | 0 | 111.7 | Q7 K8 V13 S14 S15 | Q7-E11 PolarHBondContact O-N 2.7Å; Q7-E11 VanDerWaalsContact O-N 3.12Å; K8-E11 PolarHBondContact O-N 3.42Å; E11-V13 PolarHBondContact O-N 3.01Å; E11-S14 WeakPolarHBondContact O-CB 3.39Å; E11-S14 PolarHBondContact O-N 3.37Å; E11-S15 PolarHBondContact O-N 3.17Å; E11-S15 PolarHBondContact O-OG 3.18Å |
| 12 | W | 92.1 | Very high | 80 | Confident | 170 Ų | 170 | 83.7 Ų | 83.7 | 64% | 0.644 | 44% | 0.439 | S | S | * | . | H | α-helix | trans | -64 | -39.3 | 177.2 | -61.2 | -17.8 | 0 | 0 | 0 | 112.9 | K8 P9 L10 S15 L16 | K8-W12 HydrophobicContact CB-CZ2 4.29Å; K8-W12 HydrophobicContact CD-CZ2 4.42Å; K8-W12 VanDerWaalsContact O-CG 3.26Å; K8-W12 PolarHBondContact O-N 2.87Å; P9-W12 PolarHBondContact O-N 3.32Å; L10-W12 VanDerWaalsContact C-N 3.3Å; L10-W12 PolarHBondContact O-N 3.15Å; W12-S15 PolarHBondContact O-N 3.02Å; W12-L16 WeakPolarHBondContact O-CB 3.39Å; W12-L16 PolarHBondContact O-N 3.12Å |
| 13 | V | 92 | Very high | 82.4 | Confident | 14 Ų | 14 | 75.6 Ų | 75.6 | 9% | 0.085 | 41% | 0.405 | C | S | . | . | H | α-helix | trans | -63.6 | -43.4 | 174.1 | 178.1 | 0 | 0 | 0 | 0 | 110.6 | P9 L10 E11 L16 I17 V49 M56 V57 | P9-V13 WeakPolarHBondContact O-CG2 3.35Å; P9-V13 PolarHBondContact O-N 2.94Å; P9-V13 VanDerWaalsContact O-N 3.13Å; L10-V13 PolarHBondContact O-N 3.16Å; E11-V13 PolarHBondContact O-N 3.01Å; V13-L16 PolarHBondContact O-N 3.15Å; V13-I17 HydrophobicContact CG1-CD1 4.05Å; V13-I17 WeakPolarHBondContact O-CG1 3.39Å; V13-I17 PolarHBondContact O-N 3.33Å; V13-V49 HydrophobicContact CB-CG1 4.49Å; V13-V49 HydrophobicContact CG1-CG1 4.07Å; V13-V49 HydrophobicContact CG2-CG1 3.62Å; V13-M56 HydrophobicContact CB-CE 3.9Å; V13-M56 HydrophobicContact CB-SD 3.97Å; V13-M56 HydrophobicContact CG1-CE 3.99Å; V13-M56 HydrophobicContact CG1-CG 4.04Å; V13-M56 HydrophobicContact CG1-SD 3.83Å; V13-V57 HydrophobicContact CG1-CG2 3.91Å |
| 14 | S | 93.6 | Very high | 84.7 | Confident | 61 Ų | 61 | 71.9 Ų | 71.9 | 43% | 0.427 | 37% | 0.374 | S | S | . | . | H | α-helix | trans | -61.4 | -43.9 | 174.9 | -65.6 | 0 | 0 | 0 | 0 | 112.3 | L10 E11 L16 I17 A18 M56 | L10-S14 PolarHBondContact O-N 3.38Å; L10-S14 PolarHBondContact O-OG 2.96Å; E11-S14 WeakPolarHBondContact O-CB 3.39Å; E11-S14 PolarHBondContact O-N 3.37Å; S14-L16 VanDerWaalsContact C-N 3.3Å; S14-L16 PolarHBondContact O-N 3.28Å; S14-I17 PolarHBondContact O-N 3.14Å; S14-A18 PolarHBondContact O-N 2.86Å; S14-M56 WeakPolarHBondContact OG-CE 3.48Å |
| 15 | S | 94.3 | Very high | 86.8 | Confident | 77 Ų | 77 | 66 Ų | 66 | 54% | 0.538 | 34% | 0.343 | S | S | . | . | H | α-helix | trans | -63.3 | -36.2 | 175.9 | -64.6 | 0 | 0 | 0 | 0 | 112.3 | E11 W12 A18 R19 | E11-S15 PolarHBondContact O-N 3.17Å; E11-S15 PolarHBondContact O-OG 3.18Å; W12-S15 PolarHBondContact O-N 3.02Å; S15-A18 PolarHBondContact O-N 3.44Å; S15-R19 WeakPolarHBondContact O-CB 3.03Å; S15-R19 PolarHBondContact O-N 3.49Å |
| 16 | L | 95.4 | Very high | 88.9 | Confident | 25 Ų | 25 | 62.2 Ų | 62.2 | 13% | 0.131 | 32% | 0.317 | C | S | . | . | H | α-helix | trans | -66.4 | -41.9 | 176 | -177.7 | 64.8 | 0 | 0 | 0 | 111.6 | W12 V13 S14 R19 F20 C45 L46 V49 | W12-L16 WeakPolarHBondContact O-CB 3.39Å; W12-L16 PolarHBondContact O-N 3.12Å; V13-L16 PolarHBondContact O-N 3.15Å; S14-L16 VanDerWaalsContact C-N 3.3Å; S14-L16 PolarHBondContact O-N 3.28Å; L16-R19 PolarHBondContact O-N 3.03Å; L16-F20 PolarHBondContact O-N 3Å; L16-C45 HydrophobicContact CD1-CB 4.21Å; L16-C45 HydrophobicContact CD2-CB 4.04Å; L16-C45 VanDerWaalsContact CD2-SG 3.55Å; L16-L46 HydrophobicContact CB-CD2 4.47Å; L16-L46 HydrophobicContact CD2-CD2 3.76Å; L16-L46 HydrophobicContact CD2-CG 3.94Å; L16-L46 HydrophobicContact CG-CD2 3.81Å; L16-L46 HydrophobicContact CG-CG 3.95Å; L16-V49 HydrophobicContact CD2-CG2 4.11Å |
| 17 | I | 96.3 | Very high | 90.6 | Very high | 14 Ų | 14 | 63.2 Ų | 63.2 | 7% | 0.072 | 31% | 0.312 | C | S | . | . | H | α-helix | trans | -62.8 | -45.1 | 175.1 | -65.2 | 158.4 | 0 | 0 | 0 | 110.4 | V13 S14 R19 F20 E21 L46 V64 | V13-I17 HydrophobicContact CG1-CD1 4.05Å; V13-I17 WeakPolarHBondContact O-CG1 3.39Å; V13-I17 PolarHBondContact O-N 3.33Å; S14-I17 PolarHBondContact O-N 3.14Å; I17-R19 VanDerWaalsContact C-N 3.35Å; I17-R19 PolarHBondContact O-N 3.39Å; I17-F20 PolarHBondContact O-N 3.12Å; I17-E21 PolarHBondContact O-N 3.4Å; I17-L46 HydrophobicContact CG1-CD2 3.75Å; I17-V64 HydrophobicContact CG2-CG2 4.01Å |
| 18 | A | 95.8 | Very high | 91.8 | Very high | 41 Ų | 41 | 60.7 Ų | 60.7 | 34% | 0.339 | 31% | 0.305 | S | S | . | . | H | α-helix | trans | -62.3 | -41.3 | 177.2 | 0 | 0 | 0 | 0 | 0 | 112.1 | S14 S15 E21 E22 | S14-A18 PolarHBondContact O-N 2.86Å; S15-A18 PolarHBondContact O-N 3.44Å; A18-E21 WeakPolarHBondContact O-CB 3.31Å; A18-E21 PolarHBondContact O-N 3.37Å; A18-E22 WeakPolarHBondContact O-CG 3.38Å; A18-E22 PolarHBondContact O-N 3Å |
| 19 | R | 95.2 | Very high | 91.9 | Very high | 118 Ų | 118 | 55.7 Ų | 55.7 | 45% | 0.445 | 29% | 0.288 | S | S | . | . | H | α-helix | trans | -61.8 | -44.1 | 175.1 | -179.2 | 180 | 178.9 | 179.6 | -0.3 | 111.7 | S15 L16 I17 E21 E22 Q23 | S15-R19 WeakPolarHBondContact O-CB 3.03Å; S15-R19 PolarHBondContact O-N 3.49Å; L16-R19 PolarHBondContact O-N 3.03Å; I17-R19 VanDerWaalsContact C-N 3.35Å; I17-R19 PolarHBondContact O-N 3.39Å; R19-E21 VanDerWaalsContact C-N 3.33Å; R19-E22 PolarHBondContact O-N 3.05Å; R19-Q23 WeakPolarHBondContact O-CB 3.25Å; R19-Q23 VanDerWaalsContact O-CG 3.23Å; R19-Q23 WeakPolarHBondContact O-CG 3.48Å; R19-Q23 PolarHBondContact O-N 3.32Å; R19-Q23 VanDerWaalsContact O-N 3.14Å |
| 20 | F | 96.8 | Very high | 91.7 | Very high | 0 Ų | 0 | 58 Ų | 58 | 0% | 0 | 30% | 0.303 | C | S | . | . | H | α-helix | trans | -60.4 | -44.6 | 176.1 | 178 | -99.4 | 0 | 0 | 0 | 111 | L16 I17 E22 Q23 L24 L39 Q43 L46 L61 I86 | L16-F20 PolarHBondContact O-N 3Å; I17-F20 PolarHBondContact O-N 3.12Å; F20-E22 PolarHBondContact O-N 2.9Å; F20-Q23 PolarHBondContact O-N 3.25Å; F20-L24 HydrophobicContact CE1-CD2 4.2Å; F20-L24 HydrophobicContact CZ-CD2 4.16Å; F20-L24 PolarHBondContact O-N 3.03Å; F20-L39 HydrophobicContact CD2-CD1 3.68Å; F20-L39 HydrophobicContact CE2-CD1 3.6Å; F20-L39 HydrophobicContact CZ-CD1 4.42Å; F20-Q43 HydrophobicContact CE2-CB 4.09Å; F20-L46 HydrophobicContact CB-CD1 3.57Å; F20-L46 HydrophobicContact CD1-CD1 3.98Å; F20-L46 HydrophobicContact CD2-CD1 3.82Å; F20-L46 HydrophobicContact CG-CD1 3.51Å; F20-L61 HydrophobicContact CD1-CD2 4.08Å; F20-L61 HydrophobicContact CE1-CD2 3.86Å; F20-I86 HydrophobicContact CE1-CG1 4.05Å; F20-I86 HydrophobicContact CZ-CG1 4.48Å |
| 21 | E | 95.6 | Very high | 91.1 | Very high | 51 Ų | 51 | 56.5 Ų | 56.5 | 24% | 0.238 | 30% | 0.295 | C | S | . | . | H | α-helix | trans | -59.4 | -44 | 175.8 | -173.9 | -168.8 | 139 | 0 | 0 | 112.7 | I17 A18 R19 Q23 L24 K27 V64 M67 | I17-E21 PolarHBondContact O-N 3.4Å; A18-E21 WeakPolarHBondContact O-CB 3.31Å; A18-E21 PolarHBondContact O-N 3.37Å; R19-E21 VanDerWaalsContact C-N 3.33Å; E21-Q23 PolarHBondContact O-N 3.41Å; E21-L24 PolarHBondContact O-N 3.26Å; E21-K27 IonicContact OE1-NZ 3.19Å; E21-K27 PolarHBondContact OE1-NZ 3.48Å; E21-V64 HydrophobicContact CB-CG1 4.32Å; E21-V64 HydrophobicContact CB-CG2 4.07Å; E21-V64 HydrophobicContact CG-CG1 4.18Å; E21-V64 HydrophobicContact CG-CG2 4.24Å; E21-M67 HydrophobicContact CG-SD 4.48Å |
| 22 | E | 94.4 | Very high | 90.5 | Very high | 131 Ų | 131 | 58.8 Ų | 58.8 | 61% | 0.612 | 30% | 0.304 | S | S | * | . | H | α-helix | trans | -65.6 | -24.7 | 178 | -76 | -178.8 | 175.6 | 0 | 0 | 113.8 | A18 R19 F20 T28 | A18-E22 WeakPolarHBondContact O-CG 3.38Å; A18-E22 PolarHBondContact O-N 3Å; R19-E22 PolarHBondContact O-N 3.05Å; F20-E22 PolarHBondContact O-N 2.9Å; E22-T28 VanDerWaalsContact O-CG2 3.26Å; E22-T28 WeakPolarHBondContact O-CG2 3.37Å |
| 23 | Q | 94.3 | Very high | 89.4 | Confident | 29 Ų | 29 | 57 Ų | 57 | 14% | 0.136 | 31% | 0.307 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -90.3 | -3.9 | -178.3 | -71.7 | 175.3 | -25.5 | 0 | 0 | 113.9 | R19 F20 E21 L38 L39 S42 | R19-Q23 WeakPolarHBondContact O-CB 3.25Å; R19-Q23 VanDerWaalsContact O-CG 3.23Å; R19-Q23 WeakPolarHBondContact O-CG 3.48Å; R19-Q23 PolarHBondContact O-N 3.32Å; R19-Q23 VanDerWaalsContact O-N 3.14Å; F20-Q23 PolarHBondContact O-N 3.25Å; E21-Q23 PolarHBondContact O-N 3.41Å; Q23-L38 PolarHBondContact OE1-O 3.44Å; Q23-L39 HydrophobicContact CB-CB 4.45Å; Q23-L39 HydrophobicContact CB-CD1 3.87Å; Q23-S42 PolarHBondContact OE1-OG 3.34Å |
| 24 | L | 94.5 | Very high | 88.5 | Confident | 0 Ų | 0 | 62.5 Ų | 62.5 | 0% | 0 | 33% | 0.332 | C | S | . | . | S | Bend | trans | -71 | 144.4 | -180 | -70.9 | 169.8 | 0 | 0 | 0 | 111.9 | F20 E21 V26 K27 T28 L39 V64 V68 F85 I86 | F20-L24 HydrophobicContact CE1-CD2 4.2Å; F20-L24 HydrophobicContact CZ-CD2 4.16Å; F20-L24 PolarHBondContact O-N 3.03Å; E21-L24 PolarHBondContact O-N 3.26Å; L24-V26 HydrophobicContact CB-CG2 4.03Å; L24-V26 PolarHBondContact O-N 3.04Å; L24-V26 VanDerWaalsContact O-N 3.07Å; L24-K27 PolarHBondContact O-N 2.82Å; L24-T28 PolarHBondContact O-N 3.1Å; L24-T28 PolarHBondContact O-OG1 3.26Å; L24-L39 HydrophobicContact CD2-CD1 4.25Å; L24-V64 HydrophobicContact CD1-CG1 3.69Å; L24-V68 HydrophobicContact CD1-CG2 3.97Å; L24-F85 HydrophobicContact CD2-CB 4.27Å; L24-I86 HydrophobicContact CD1-CD1 3.86Å; L24-I86 HydrophobicContact CD1-CG1 4.17Å; L24-I86 HydrophobicContact CD2-CG1 4.26Å |
| 25 | P | 91.9 | Very high | 87.8 | Confident | 1 Ų | 1 | 61.9 Ų | 61.9 | 1% | 0.006 | 33% | 0.325 | C | S | . | . | H | α-helix | trans | -50.3 | -34.9 | 178.6 | -19.4 | 17.6 | 0 | 0 | 0 | 114.8 | K27 T28 G29 L31 D78 D81 S82 | P25-K27 PolarHBondContact O-N 3.38Å; P25-K27 VanDerWaalsContact O-N 3.09Å; P25-T28 PolarHBondContact O-N 3.37Å; P25-G29 WeakPolarHBondContact CA-O 3.35Å; P25-G29 VanDerWaalsContact O-CA 3.26Å; P25-G29 WeakPolarHBondContact O-CA 3.26Å; P25-G29 PolarHBondContact O-N 3.19Å; P25-L31 HydrophobicContact CB-CG 4.48Å; P25-L31 HydrophobicContact CG-CD1 3.76Å; P25-L31 HydrophobicContact CG-CD2 4.42Å; P25-L31 HydrophobicContact CG-CG 3.88Å; P25-D78 HydrophobicContact CB-CB 3.92Å; P25-D81 HydrophobicContact CB-CB 4.46Å; P25-D81 HydrophobicContact CG-CB 3.86Å; P25-S82 WeakPolarHBondContact CB-OG 3.41Å; P25-S82 WeakPolarHBondContact CD-OG 3.47Å; P25-S82 WeakPolarHBondContact CG-OG 3.48Å |
| 26 | V | 92.3 | Very high | 87.4 | Confident | 21 Ų | 21 | 63.8 Ų | 63.8 | 13% | 0.127 | 32% | 0.321 | C | S | . | . | H | α-helix | trans | -60.2 | -21.5 | 176.5 | -72.1 | 0 | 0 | 0 | 0 | 114.2 | L24 V68 M71 C74 L79 S82 | L24-V26 HydrophobicContact CB-CG2 4.03Å; L24-V26 PolarHBondContact O-N 3.04Å; L24-V26 VanDerWaalsContact O-N 3.07Å; V26-V68 HydrophobicContact CG1-CG1 4.28Å; V26-V68 HydrophobicContact CG2-CG1 4.5Å; V26-V68 HydrophobicContact CG2-CG2 4.03Å; V26-M71 HydrophobicContact CB-SD 3.93Å; V26-M71 HydrophobicContact CG2-SD 4Å; V26-C74 HydrophobicContact CB-CB 4.29Å; V26-C74 HydrophobicContact CG1-CB 4.04Å; V26-L79 HydrophobicContact CG1-CB 4.34Å; V26-L79 HydrophobicContact CG1-CD1 4.12Å; V26-S82 WeakPolarHBondContact CG1-OG 3.25Å; V26-S82 PolarHBondContact N-OG 3.2Å |
| 27 | K | 90.3 | Very high | 86.9 | Confident | 93 Ų | 93 | 67.2 Ų | 67.2 | 40% | 0.404 | 34% | 0.339 | S | S | . | . | H | α-helix | trans | -105.3 | -36.3 | 175.7 | -69.4 | -166.9 | -178.8 | -178 | 0 | 112.9 | E21 L24 P25 | E21-K27 IonicContact OE1-NZ 3.19Å; E21-K27 PolarHBondContact OE1-NZ 3.48Å; L24-K27 PolarHBondContact O-N 2.82Å; P25-K27 PolarHBondContact O-N 3.38Å; P25-K27 VanDerWaalsContact O-N 3.09Å |
| 28 | T | 88.4 | Confident | 86.6 | Confident | 63 Ų | 63 | 69.7 Ų | 69.7 | 39% | 0.387 | 35% | 0.352 | S | S | . | . | H | α-helix | trans | -90.1 | -18 | -176.6 | 58.2 | 0 | 0 | 0 | 0 | 114.2 | E22 L24 P25 | E22-T28 VanDerWaalsContact O-CG2 3.26Å; E22-T28 WeakPolarHBondContact O-CG2 3.37Å; L24-T28 PolarHBondContact O-N 3.1Å; L24-T28 PolarHBondContact O-OG1 3.26Å; P25-T28 PolarHBondContact O-N 3.37Å |
| 29 | G | 83.6 | Confident | 86.5 | Confident | 18 Ų | 18 | 67.8 Ų | 67.8 | 19% | 0.186 | 34% | 0.335 | C | S | . | . | trans | 77.8 | -161.9 | -164.7 | 0 | 0 | 0 | 0 | 0 | 112.5 | P25 L31 | P25-G29 WeakPolarHBondContact CA-O 3.35Å; P25-G29 VanDerWaalsContact O-CA 3.26Å; P25-G29 WeakPolarHBondContact O-CA 3.26Å; P25-G29 PolarHBondContact O-N 3.19Å; G29-L31 PolarHBondContact O-N 3.04Å | ||
| 30 | P | 75.6 | Confident | 86.4 | Confident | 105 Ų | 105 | 65.7 Ų | 65.7 | 68% | 0.682 | 33% | 0.331 | S | S | * | . | S | Bend | trans | -55.1 | 127.5 | -175.8 | -21.6 | 28.7 | 0 | 0 | 0 | 111.9 | K32 | P30-K32 PolarHBondContact O-N 3.18Š|
| 31 | L | 73.3 | Confident | 86.3 | Confident | 41 Ų | 41 | 70.8 Ų | 70.8 | 22% | 0.215 | 36% | 0.355 | C | S | . | . | P | Polyproline II helix | trans | -66.6 | 117.1 | -177.5 | -74.2 | 168.3 | 0 | 0 | 0 | 111.2 | P25 G29 R36 L39 F85 | P25-L31 HydrophobicContact CB-CG 4.48Å; P25-L31 HydrophobicContact CG-CD1 3.76Å; P25-L31 HydrophobicContact CG-CD2 4.42Å; P25-L31 HydrophobicContact CG-CG 3.88Å; G29-L31 PolarHBondContact O-N 3.04Å; L31-R36 HydrophobicContact CB-CB 4.35Å; L31-L39 HydrophobicContact CD1-CD2 4.19Å; L31-L39 HydrophobicContact CD2-CD2 4.17Å; L31-F85 HydrophobicContact CD1-CE2 3.86Å |
| 32 | K | 74.5 | Confident | 86.3 | Confident | 162 Ų | 162 | 68.5 Ų | 68.5 | 70% | 0.704 | 35% | 0.345 | S | S | * | . | P | Polyproline II helix | trans | -80.3 | 160.7 | 162.8 | -59.7 | -179.8 | -178.1 | 179 | 0 | 109.9 | P30 E34 T35 R36 | P30-K32 PolarHBondContact O-N 3.18Å; K32-E34 VanDerWaalsContact C-N 3.32Å; K32-E34 PolarHBondContact O-N 3.32Å; K32-T35 WeakPolarHBondContact CA-OG1 3.26Å; K32-T35 PolarHBondContact N-OG1 3.43Å; K32-T35 PolarHBondContact O-N 3.04Å; K32-T35 VanDerWaalsContact O-N 3.15Å; K32-T35 PolarHBondContact O-OG1 3.26Å; K32-R36 WeakPolarHBondContact O-CB 3.48Å; K32-R36 PolarHBondContact O-N 3.19Å |
| 33 | N | 69.8 | Low | 86.3 | Confident | 132 Ų | 132 | 63.1 Ų | 63.1 | 71% | 0.706 | 32% | 0.319 | S | S | * | . | H | α-helix | trans | -51.1 | -46.2 | -178.3 | -72.7 | -15 | 0 | 0 | 0 | 113.4 | R36 L37 | N33-R36 PolarHBondContact O-N 3.16Å; N33-L37 PolarHBondContact O-N 3.08Å |
| 34 | E | 72.6 | Confident | 86.3 | Confident | 130 Ų | 130 | 64 Ų | 64 | 61% | 0.607 | 33% | 0.332 | S | S | * | . | H | α-helix | trans | -65.7 | -45.5 | 179.4 | -71.1 | -178.4 | 163.6 | 0 | 0 | 112.7 | K32 R36 L37 L38 | K32-E34 VanDerWaalsContact C-N 3.32Å; K32-E34 PolarHBondContact O-N 3.32Å; E34-R36 VanDerWaalsContact C-N 3.29Å; E34-R36 PolarHBondContact O-N 3.48Å; E34-L37 PolarHBondContact O-N 3.07Å; E34-L38 WeakPolarHBondContact O-CG 3.45Å; E34-L38 PolarHBondContact O-N 3.09Å |
| 35 | T | 79.6 | Confident | 86.4 | Confident | 48 Ų | 48 | 66.8 Ų | 66.8 | 29% | 0.294 | 35% | 0.35 | S | S | . | . | H | α-helix | trans | -63.7 | -36.7 | 177.3 | 37.2 | 0 | 0 | 0 | 0 | 111.8 | K32 L38 L39 | K32-T35 WeakPolarHBondContact CA-OG1 3.26Å; K32-T35 PolarHBondContact N-OG1 3.43Å; K32-T35 PolarHBondContact O-N 3.04Å; K32-T35 VanDerWaalsContact O-N 3.15Å; K32-T35 PolarHBondContact O-OG1 3.26Å; T35-L38 PolarHBondContact O-N 3.5Å; T35-L39 WeakPolarHBondContact O-CB 3.39Å; T35-L39 PolarHBondContact O-N 2.88Å |
| 36 | R | 85.7 | Confident | 86.5 | Confident | 117 Ų | 117 | 66.7 Ų | 66.7 | 44% | 0.442 | 35% | 0.35 | S | S | . | . | H | α-helix | trans | -64.6 | -47.2 | 174.9 | -173.6 | 177.7 | 179.6 | 112.6 | 3.9 | 111.3 | L31 K32 N33 E34 L38 L39 E40 | L31-R36 HydrophobicContact CB-CB 4.35Å; K32-R36 WeakPolarHBondContact O-CB 3.48Å; K32-R36 PolarHBondContact O-N 3.19Å; N33-R36 PolarHBondContact O-N 3.16Å; E34-R36 VanDerWaalsContact C-N 3.29Å; E34-R36 PolarHBondContact O-N 3.48Å; R36-L38 VanDerWaalsContact C-N 3.3Å; R36-L38 PolarHBondContact O-N 2.95Å; R36-L39 WeakPolarHBondContact O-CB 3.43Å; R36-L39 PolarHBondContact O-N 2.88Å; R36-L39 VanDerWaalsContact O-N 3.14Å; R36-E40 HydrophobicContact CG-CG 4.44Å; R36-E40 IonicContact CZ-OE1 2.75Å; R36-E40 IonicContact NE-OE1 2.81Å; R36-E40 PolarHBondContact NE-OE1 3.46Å; R36-E40 IonicContact NH2-OE1 2.89Å; R36-E40 WeakPolarHBondContact O-CG 3.48Å; R36-E40 PolarHBondContact O-N 2.89Å |
| 37 | L | 85.3 | Confident | 86.5 | Confident | 97 Ų | 97 | 66.6 Ų | 66.6 | 51% | 0.508 | 35% | 0.349 | S | S | . | . | H | α-helix | trans | -59.2 | -43.2 | 177.5 | -168.3 | 82.2 | 0 | 0 | 0 | 111.5 | N33 E34 L39 E40 Q41 | N33-L37 PolarHBondContact O-N 3.08Å; E34-L37 PolarHBondContact O-N 3.07Å; L37-L39 VanDerWaalsContact C-N 3.34Å; L37-L39 PolarHBondContact O-N 2.89Å; L37-E40 PolarHBondContact O-N 3.01Å; L37-Q41 WeakPolarHBondContact O-CB 3.28Å; L37-Q41 VanDerWaalsContact O-CG 3.3Å; L37-Q41 WeakPolarHBondContact O-CG 3.3Å; L37-Q41 PolarHBondContact O-N 3.35Å |
| 38 | L | 89.4 | Confident | 86.6 | Confident | 66 Ų | 66 | 66.6 Ų | 66.6 | 35% | 0.346 | 35% | 0.354 | S | S | . | . | H | α-helix | trans | -64.3 | -38.1 | 176.9 | -75 | 168.2 | 0 | 0 | 0 | 112.4 | Q23 E34 T35 R36 S42 | Q23-L38 PolarHBondContact OE1-O 3.44Å; E34-L38 WeakPolarHBondContact O-CG 3.45Å; E34-L38 PolarHBondContact O-N 3.09Å; T35-L38 PolarHBondContact O-N 3.5Å; R36-L38 VanDerWaalsContact C-N 3.3Å; R36-L38 PolarHBondContact O-N 2.95Å; L38-S42 PolarHBondContact O-N 3.3Å; L38-S42 PolarHBondContact O-OG 3.11Å |
| 39 | L | 93.9 | Very high | 86.7 | Confident | 0 Ų | 0 | 65.3 Ų | 65.3 | 0% | 0 | 35% | 0.346 | C | S | . | . | H | α-helix | trans | -67.4 | -45.4 | 175.9 | -179.8 | 61.5 | 0 | 0 | 0 | 111.3 | F20 Q23 L24 L31 T35 R36 L37 Q41 S42 Q43 F85 | F20-L39 HydrophobicContact CD2-CD1 3.68Å; F20-L39 HydrophobicContact CE2-CD1 3.6Å; F20-L39 HydrophobicContact CZ-CD1 4.42Å; Q23-L39 HydrophobicContact CB-CB 4.45Å; Q23-L39 HydrophobicContact CB-CD1 3.87Å; L24-L39 HydrophobicContact CD2-CD1 4.25Å; L31-L39 HydrophobicContact CD1-CD2 4.19Å; L31-L39 HydrophobicContact CD2-CD2 4.17Å; T35-L39 WeakPolarHBondContact O-CB 3.39Å; T35-L39 PolarHBondContact O-N 2.88Å; R36-L39 WeakPolarHBondContact O-CB 3.43Å; R36-L39 PolarHBondContact O-N 2.88Å; R36-L39 VanDerWaalsContact O-N 3.14Å; L37-L39 VanDerWaalsContact C-N 3.34Å; L37-L39 PolarHBondContact O-N 2.89Å; L39-Q41 VanDerWaalsContact C-N 3.32Å; L39-Q41 PolarHBondContact O-N 3.39Å; L39-S42 PolarHBondContact O-N 3.34Å; L39-Q43 WeakPolarHBondContact O-CB 3.1Å; L39-Q43 PolarHBondContact O-N 2.81Å; L39-F85 HydrophobicContact CD2-CD1 3.99Å; L39-F85 HydrophobicContact CD2-CD2 3.74Å; L39-F85 HydrophobicContact CD2-CE1 4.02Å; L39-F85 HydrophobicContact CD2-CE2 3.77Å; L39-F85 HydrophobicContact CD2-CG 3.86Å; L39-F85 HydrophobicContact CD2-CZ 3.91Å; L39-F85 HydrophobicContact CG-CD1 4.12Å; L39-F85 HydrophobicContact CG-CE1 4.1Å; L39-F85 HydrophobicContact CG-CG 4.43Å; L39-F85 HydrophobicContact CG-CZ 4.4Å |
| 40 | E | 93 | Very high | 87 | Confident | 75 Ų | 75 | 64.6 Ų | 64.6 | 35% | 0.35 | 34% | 0.338 | S | S | . | . | H | α-helix | trans | -61.8 | -38.2 | 175.9 | -73.4 | 172.5 | 179.9 | 0 | 0 | 111.6 | R36 L37 Q43 A44 F85 | R36-E40 HydrophobicContact CG-CG 4.44Å; R36-E40 IonicContact CZ-OE1 2.75Å; R36-E40 IonicContact NE-OE1 2.81Å; R36-E40 PolarHBondContact NE-OE1 3.46Å; R36-E40 IonicContact NH2-OE1 2.89Å; R36-E40 WeakPolarHBondContact O-CG 3.48Å; R36-E40 PolarHBondContact O-N 2.89Å; L37-E40 PolarHBondContact O-N 3.01Å; E40-Q43 WeakPolarHBondContact O-CB 3.14Å; E40-Q43 PolarHBondContact O-N 3.04Å; E40-A44 WeakPolarHBondContact O-CB 3.32Å; E40-A44 PolarHBondContact O-N 3.23Å; E40-F85 HydrophobicContact CG-CE1 3.97Å; E40-F85 HydrophobicContact CG-CZ 4.2Å |
| 41 | Q | 93.6 | Very high | 87.5 | Confident | 106 Ų | 106 | 64.2 Ų | 64.2 | 50% | 0.495 | 33% | 0.326 | S | S | . | . | H | α-helix | trans | -64.3 | -44.4 | 172.5 | -76.6 | 177.3 | -0.6 | 0 | 0 | 112.4 | L37 L39 Q43 A44 C45 | L37-Q41 WeakPolarHBondContact O-CB 3.28Å; L37-Q41 VanDerWaalsContact O-CG 3.3Å; L37-Q41 WeakPolarHBondContact O-CG 3.3Å; L37-Q41 PolarHBondContact O-N 3.35Å; L39-Q41 VanDerWaalsContact C-N 3.32Å; L39-Q41 PolarHBondContact O-N 3.39Å; Q41-Q43 VanDerWaalsContact C-N 3.34Å; Q41-A44 PolarHBondContact O-N 3.12Å; Q41-C45 WeakPolarHBondContact O-CB 3.08Å; Q41-C45 PolarHBondContact O-N 3.06Å |
| 42 | S | 95.3 | Very high | 88 | Confident | 4 Ų | 4 | 69 Ų | 69 | 3% | 0.028 | 35% | 0.351 | C | S | . | . | H | α-helix | trans | -62.8 | -41.4 | 175.7 | -68.4 | 0 | 0 | 0 | 0 | 111.5 | Q23 L38 L39 C45 L46 | Q23-S42 PolarHBondContact OE1-OG 3.34Å; L38-S42 PolarHBondContact O-N 3.3Å; L38-S42 PolarHBondContact O-OG 3.11Å; L39-S42 PolarHBondContact O-N 3.34Å; S42-C45 PolarHBondContact O-N 3.3Å; S42-L46 WeakPolarHBondContact O-CG 3.33Å; S42-L46 PolarHBondContact O-N 2.72Å |
| 43 | Q | 95.7 | Very high | 88.6 | Confident | 17 Ų | 17 | 66.2 Ų | 66.2 | 8% | 0.079 | 34% | 0.338 | C | S | . | . | H | α-helix | trans | -58.1 | -54 | 173.8 | 172.6 | 175.6 | 20.8 | 0 | 0 | 111.3 | F20 L39 E40 Q41 C45 L46 V47 T89 | F20-Q43 HydrophobicContact CE2-CB 4.09Å; L39-Q43 WeakPolarHBondContact O-CB 3.1Å; L39-Q43 PolarHBondContact O-N 2.81Å; E40-Q43 WeakPolarHBondContact O-CB 3.14Å; E40-Q43 PolarHBondContact O-N 3.04Å; Q41-Q43 VanDerWaalsContact C-N 3.34Å; Q43-C45 PolarHBondContact O-N 2.92Å; Q43-L46 PolarHBondContact O-N 2.99Å; Q43-L46 VanDerWaalsContact O-N 3.14Å; Q43-V47 WeakPolarHBondContact O-CG2 3.48Å; Q43-V47 PolarHBondContact O-N 3.44Å; Q43-T89 HydrophobicContact CG-CG2 4.22Å; Q43-T89 WeakPolarHBondContact CG-OG1 3.45Å; Q43-T89 PolarHBondContact NE2-OG1 3.03Å |
| 44 | A | 94.7 | Very high | 89.3 | Confident | 49 Ų | 49 | 61.4 Ų | 61.4 | 41% | 0.405 | 31% | 0.311 | S | S | . | . | H | α-helix | trans | -59.8 | -36.6 | 179.9 | 0 | 0 | 0 | 0 | 0 | 112.2 | E40 Q41 N48 | E40-A44 WeakPolarHBondContact O-CB 3.32Å; E40-A44 PolarHBondContact O-N 3.23Å; Q41-A44 PolarHBondContact O-N 3.12Å; A44-N48 PolarHBondContact O-N 3.15Å; A44-N48 VanDerWaalsContact O-N 3.1Å; A44-N48 PolarHBondContact O-ND2 2.97Å |
| 45 | C | 94.9 | Very high | 89.9 | Confident | 57 Ų | 57 | 56.1 Ų | 56.1 | 39% | 0.385 | 29% | 0.289 | S | S | . | . | H | α-helix | trans | -65.2 | -47.2 | 175 | -165.7 | 0 | 0 | 0 | 0 | 111.6 | L16 Q41 S42 Q43 V47 N48 V49 | L16-C45 HydrophobicContact CD1-CB 4.21Å; L16-C45 HydrophobicContact CD2-CB 4.04Å; L16-C45 VanDerWaalsContact CD2-SG 3.55Å; Q41-C45 WeakPolarHBondContact O-CB 3.08Å; Q41-C45 PolarHBondContact O-N 3.06Å; S42-C45 PolarHBondContact O-N 3.3Å; Q43-C45 PolarHBondContact O-N 2.92Å; C45-V47 VanDerWaalsContact C-N 3.34Å; C45-V47 PolarHBondContact O-N 3.33Å; C45-N48 PolarHBondContact O-N 3.04Å; C45-N48 VanDerWaalsContact O-N 3.17Å; C45-V49 VanDerWaalsContact O-CG2 3.3Å; C45-V49 WeakPolarHBondContact O-CG2 3.33Å; C45-V49 PolarHBondContact O-N 3.44Å |
| 46 | L | 94.8 | Very high | 90.2 | Very high | 0 Ų | 0 | 56.1 Ų | 56.1 | 0% | 0 | 29% | 0.286 | C | S | . | . | H | α-helix | trans | -59.4 | -43.4 | 176.6 | -78.1 | 168.5 | 0 | 0 | 0 | 112.2 | L16 I17 F20 S42 Q43 N48 V49 S50 V57 L61 T89 | L16-L46 HydrophobicContact CB-CD2 4.47Å; L16-L46 HydrophobicContact CD2-CD2 3.76Å; L16-L46 HydrophobicContact CD2-CG 3.94Å; L16-L46 HydrophobicContact CG-CD2 3.81Å; L16-L46 HydrophobicContact CG-CG 3.95Å; I17-L46 HydrophobicContact CG1-CD2 3.75Å; F20-L46 HydrophobicContact CB-CD1 3.57Å; F20-L46 HydrophobicContact CD1-CD1 3.98Å; F20-L46 HydrophobicContact CD2-CD1 3.82Å; F20-L46 HydrophobicContact CG-CD1 3.51Å; S42-L46 WeakPolarHBondContact O-CG 3.33Å; S42-L46 PolarHBondContact O-N 2.72Å; Q43-L46 PolarHBondContact O-N 2.99Å; Q43-L46 VanDerWaalsContact O-N 3.14Å; L46-N48 VanDerWaalsContact C-N 3.29Å; L46-N48 PolarHBondContact O-N 2.72Å; L46-V49 PolarHBondContact O-N 3.46Å; L46-S50 WeakPolarHBondContact O-CB 3.47Å; L46-S50 PolarHBondContact O-N 3.43Å; L46-V57 HydrophobicContact CB-CG1 4.43Å; L46-V57 HydrophobicContact CD2-CG1 4.1Å; L46-L61 HydrophobicContact CD1-CD2 4.27Å; L46-T89 HydrophobicContact CB-CG2 4.4Å |
| 47 | V | 93 | Very high | 90.5 | Very high | 18 Ų | 18 | 50.5 Ų | 50.5 | 11% | 0.109 | 27% | 0.265 | C | S | . | . | H | α-helix | trans | -62.6 | -35.4 | 176.9 | 173.1 | 0 | 0 | 0 | 0 | 111.8 | Q43 C45 S50 T89 Q92 | Q43-V47 WeakPolarHBondContact O-CG2 3.48Å; Q43-V47 PolarHBondContact O-N 3.44Å; C45-V47 VanDerWaalsContact C-N 3.34Å; C45-V47 PolarHBondContact O-N 3.33Å; V47-S50 PolarHBondContact O-OG 3.39Å; V47-T89 HydrophobicContact CG2-CG2 4.14Å; V47-Q92 HydrophobicContact CG1-CB 3.95Å; V47-Q92 HydrophobicContact CG2-CB 3.72Å |
| 48 | N | 91.6 | Very high | 90.7 | Very high | 94 Ų | 94 | 46.2 Ų | 46.2 | 50% | 0.503 | 24% | 0.243 | S | C | . | . | H | α-helix | trans | -75.4 | -38.4 | 175 | -82.3 | -35 | 0 | 0 | 0 | 112.8 | A44 C45 L46 S50 K51 | A44-N48 PolarHBondContact O-N 3.15Å; A44-N48 VanDerWaalsContact O-N 3.1Å; A44-N48 PolarHBondContact O-ND2 2.97Å; C45-N48 PolarHBondContact O-N 3.04Å; C45-N48 VanDerWaalsContact O-N 3.17Å; L46-N48 VanDerWaalsContact C-N 3.29Å; L46-N48 PolarHBondContact O-N 2.72Å; N48-S50 VanDerWaalsContact C-N 3.31Å; N48-S50 PolarHBondContact O-N 2.87Å; N48-K51 WeakPolarHBondContact O-CB 3.28Å; N48-K51 PolarHBondContact O-N 3.24Å; N48-K51 PolarHBondContact OD1-NZ 3.38Å |
| 49 | V | 91.1 | Very high | 90.8 | Very high | 36 Ų | 36 | 43.4 Ų | 43.4 | 22% | 0.218 | 23% | 0.229 | C | C | . | . | H | α-helix | trans | -66.4 | -34.3 | 177 | 172 | 0 | 0 | 0 | 0 | 111.4 | V13 L16 C45 L46 K51 L52 K53 V57 | V13-V49 HydrophobicContact CB-CG1 4.49Å; V13-V49 HydrophobicContact CG1-CG1 4.07Å; V13-V49 HydrophobicContact CG2-CG1 3.62Å; L16-V49 HydrophobicContact CD2-CG2 4.11Å; C45-V49 VanDerWaalsContact O-CG2 3.3Å; C45-V49 WeakPolarHBondContact O-CG2 3.33Å; C45-V49 PolarHBondContact O-N 3.44Å; L46-V49 PolarHBondContact O-N 3.46Å; V49-K51 PolarHBondContact O-N 3.48Å; V49-L52 PolarHBondContact O-N 2.91Å; V49-K53 HydrophobicContact CG1-CB 4.38Å; V49-K53 PolarHBondContact O-N 3.09Å; V49-V57 HydrophobicContact CB-CG2 4.35Å; V49-V57 HydrophobicContact CG1-CG2 3.75Å |
| 50 | S | 89.1 | Confident | 90.7 | Very high | 3 Ų | 3 | 43.4 Ų | 43.4 | 2% | 0.021 | 23% | 0.23 | C | C | . | . | H | α-helix | trans | -61.3 | -27 | -180 | 71.4 | 0 | 0 | 0 | 0 | 112.9 | L46 V47 N48 L52 F54 C93 | L46-S50 WeakPolarHBondContact O-CB 3.47Å; L46-S50 PolarHBondContact O-N 3.43Å; V47-S50 PolarHBondContact O-OG 3.39Å; N48-S50 VanDerWaalsContact C-N 3.31Å; N48-S50 PolarHBondContact O-N 2.87Å; S50-L52 PolarHBondContact O-N 3.39Å; S50-F54 WeakPolarHBondContact O-CA 3.48Å; S50-F54 VanDerWaalsContact O-CB 3.31Å; S50-F54 WeakPolarHBondContact O-CB 3.4Å; S50-F54 PolarHBondContact O-N 2.77Å; S50-C93 PolarHBondContact OG-SG 3.07Å; S50-C93 VanDerWaalsContact OG-SG 3.39Å |
| 51 | K | 86.4 | Confident | 90.8 | Very high | 97 Ų | 97 | 39.9 Ų | 39.9 | 42% | 0.422 | 21% | 0.213 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -60.4 | -24.9 | 173.6 | -61.8 | 172.3 | -178.4 | 166.3 | 0 | 113.7 | N48 V49 | N48-K51 WeakPolarHBondContact O-CB 3.28Å; N48-K51 PolarHBondContact O-N 3.24Å; N48-K51 PolarHBondContact OD1-NZ 3.38Å; V49-K51 PolarHBondContact O-N 3.48Å |
| 52 | L | 84.5 | Confident | 90.9 | Very high | 141 Ų | 141 | 35 Ų | 35 | 74% | 0.738 | 19% | 0.19 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -111.1 | -28.6 | -179.2 | -63.6 | 171.3 | 0 | 0 | 0 | 112.9 | V49 S50 | V49-L52 PolarHBondContact O-N 2.91Å; S50-L52 PolarHBondContact O-N 3.39Å |
| 53 | K | 86.1 | Confident | 90.9 | Very high | 103 Ų | 103 | 42.7 Ų | 42.7 | 45% | 0.448 | 22% | 0.219 | S | C | . | . | S | Bend | trans | -131.5 | 49.8 | -174.8 | -64.3 | -64.2 | 178.8 | -169.2 | 0 | 111.4 | V49 S55 M56 V57 | V49-K53 HydrophobicContact CG1-CB 4.38Å; V49-K53 PolarHBondContact O-N 3.09Å; K53-S55 PolarHBondContact O-N 3.4Å; K53-M56 HydrophobicContact CB-CB 4.5Å; K53-M56 PolarHBondContact O-N 2.89Å; K53-V57 PolarHBondContact O-N 2.92Å; K53-V57 VanDerWaalsContact O-N 3.1Å |
| 54 | F | 85.2 | Confident | 90.9 | Very high | 32 Ų | 32 | 42 Ų | 42 | 14% | 0.14 | 22% | 0.216 | C | C | . | . | H | α-helix | trans | -50.6 | -58.9 | -171.9 | -176 | -101.7 | 0 | 0 | 0 | 113.5 | S50 M56 V57 V58 L94 E106 | S50-F54 WeakPolarHBondContact O-CA 3.48Å; S50-F54 VanDerWaalsContact O-CB 3.31Å; S50-F54 WeakPolarHBondContact O-CB 3.4Å; S50-F54 PolarHBondContact O-N 2.77Å; F54-M56 VanDerWaalsContact C-N 3.29Å; F54-M56 PolarHBondContact O-N 3.32Å; F54-V57 PolarHBondContact O-N 3.46Å; F54-V58 HydrophobicContact CD1-CG2 4.45Å; F54-V58 HydrophobicContact CD2-CG2 4.01Å; F54-V58 HydrophobicContact CE1-CG2 4.15Å; F54-V58 HydrophobicContact CE2-CG2 3.68Å; F54-V58 HydrophobicContact CG-CG2 4.38Å; F54-V58 HydrophobicContact CZ-CG2 3.75Å; F54-V58 WeakPolarHBondContact O-CG2 3.33Å; F54-V58 PolarHBondContact O-N 2.86Å; F54-L94 HydrophobicContact CE2-CD2 4.35Å; F54-L94 HydrophobicContact CZ-CD2 3.79Å; F54-E106 HydrophobicContact CD1-CG 4.36Å; F54-E106 HydrophobicContact CE1-CG 4.45Å |
| 55 | S | 84.2 | Confident | 91 | Very high | 19 Ų | 19 | 39.8 Ų | 39.8 | 13% | 0.133 | 20% | 0.197 | C | C | . | . | H | α-helix | trans | -58 | -38.5 | -177.1 | 178.1 | 0 | 0 | 0 | 0 | 113.4 | K53 G59 D105 N109 | K53-S55 PolarHBondContact O-N 3.4Å; S55-G59 PolarHBondContact O-N 2.99Å; S55-D105 WeakPolarHBondContact OG-CB 3.22Å; S55-N109 PolarHBondContact O-ND2 2.82Å; S55-N109 PolarHBondContact OG-ND2 3.45Å |
| 56 | M | 87.5 | Confident | 91 | Very high | 47 Ų | 47 | 40.1 Ų | 40.1 | 23% | 0.232 | 19% | 0.193 | C | C | . | . | H | α-helix | trans | -69.9 | -43.5 | 179.8 | -175.4 | 174.4 | -179.6 | 0 | 0 | 112.2 | L10 V13 S14 K53 F54 G60 | L10-M56 HydrophobicContact CB-CE 4.38Å; L10-M56 HydrophobicContact CB-SD 4.44Å; L10-M56 HydrophobicContact CD2-SD 3.54Å; L10-M56 VanDerWaalsContact CD2-SD 3.54Å; L10-M56 WeakPolarHBondContact O-CE 3.37Å; V13-M56 HydrophobicContact CB-CE 3.9Å; V13-M56 HydrophobicContact CB-SD 3.97Å; V13-M56 HydrophobicContact CG1-CE 3.99Å; V13-M56 HydrophobicContact CG1-CG 4.04Å; V13-M56 HydrophobicContact CG1-SD 3.83Å; S14-M56 WeakPolarHBondContact OG-CE 3.48Å; K53-M56 HydrophobicContact CB-CB 4.5Å; K53-M56 PolarHBondContact O-N 2.89Å; F54-M56 VanDerWaalsContact C-N 3.29Å; F54-M56 PolarHBondContact O-N 3.32Å; M56-G60 PolarHBondContact O-N 3.19Å |
| 57 | V | 90.7 | Very high | 91 | Very high | 0 Ų | 0 | 42.3 Ų | 42.3 | 0% | 0 | 20% | 0.203 | C | C | . | . | H | α-helix | trans | -69.1 | -49.6 | 179.9 | 175.1 | 0 | 0 | 0 | 0 | 110.6 | V13 L46 V49 K53 F54 G60 L61 | V13-V57 HydrophobicContact CG1-CG2 3.91Å; L46-V57 HydrophobicContact CB-CG1 4.43Å; L46-V57 HydrophobicContact CD2-CG1 4.1Å; V49-V57 HydrophobicContact CB-CG2 4.35Å; V49-V57 HydrophobicContact CG1-CG2 3.75Å; K53-V57 PolarHBondContact O-N 2.92Å; K53-V57 VanDerWaalsContact O-N 3.1Å; F54-V57 PolarHBondContact O-N 3.46Å; V57-G60 WeakPolarHBondContact O-CA 3.12Å; V57-G60 PolarHBondContact O-N 3.14Å; V57-G60 VanDerWaalsContact O-N 3.14Å; V57-L61 HydrophobicContact CG1-CD1 3.96Å; V57-L61 HydrophobicContact CG1-CG 4.43Å; V57-L61 WeakPolarHBondContact O-CG 3.37Å; V57-L61 PolarHBondContact O-N 3.25Å |
| 58 | V | 89.8 | Confident | 91 | Very high | 7 Ų | 7 | 41.4 Ų | 41.4 | 4% | 0.042 | 20% | 0.198 | C | C | . | . | H | α-helix | trans | -64 | -44.9 | -179.9 | 175.9 | 0 | 0 | 0 | 0 | 110.9 | F54 G60 L61 I62 L90 C93 I113 | F54-V58 HydrophobicContact CD1-CG2 4.45Å; F54-V58 HydrophobicContact CD2-CG2 4.01Å; F54-V58 HydrophobicContact CE1-CG2 4.15Å; F54-V58 HydrophobicContact CE2-CG2 3.68Å; F54-V58 HydrophobicContact CG-CG2 4.38Å; F54-V58 HydrophobicContact CZ-CG2 3.75Å; F54-V58 WeakPolarHBondContact O-CG2 3.33Å; F54-V58 PolarHBondContact O-N 2.86Å; V58-G60 VanDerWaalsContact C-N 3.25Å; V58-G60 PolarHBondContact O-N 3.21Å; V58-L61 PolarHBondContact O-N 3.24Å; V58-I62 HydrophobicContact CG1-CD1 3.9Å; V58-I62 HydrophobicContact CG1-CG1 4.38Å; V58-I62 VanDerWaalsContact O-CG1 3.25Å; V58-I62 WeakPolarHBondContact O-CG1 3.47Å; V58-I62 PolarHBondContact O-N 3.12Å; V58-L90 HydrophobicContact CG1-CD2 4.24Å; V58-C93 HydrophobicContact CG2-CB 4.45Å; V58-I113 HydrophobicContact CG1-CD1 4.43Å |
| 59 | G | 90.7 | Very high | 91 | Very high | 6 Ų | 6 | 39.3 Ų | 39.3 | 6% | 0.062 | 19% | 0.187 | C | C | . | . | H | α-helix | trans | -60.3 | -35 | 174 | 0 | 0 | 0 | 0 | 0 | 112.9 | S55 R63 | S55-G59 PolarHBondContact O-N 2.99Å; G59-R63 WeakPolarHBondContact O-CG 3.46Å; G59-R63 PolarHBondContact O-N 3.21Å |
| 60 | G | 93.5 | Very high | 91 | Very high | 1 Ų | 1 | 41.5 Ų | 41.5 | 1% | 0.01 | 20% | 0.204 | C | C | . | . | H | α-helix | trans | -63.3 | -51.8 | 171.2 | 0 | 0 | 0 | 0 | 0 | 113.1 | M56 V57 V58 I62 R63 V64 | M56-G60 PolarHBondContact O-N 3.19Å; V57-G60 WeakPolarHBondContact O-CA 3.12Å; V57-G60 PolarHBondContact O-N 3.14Å; V57-G60 VanDerWaalsContact O-N 3.14Å; V58-G60 VanDerWaalsContact C-N 3.25Å; V58-G60 PolarHBondContact O-N 3.21Å; G60-I62 VanDerWaalsContact C-N 3.34Å; G60-I62 PolarHBondContact O-N 3.19Å; G60-R63 WeakPolarHBondContact O-CB 3.36Å; G60-R63 PolarHBondContact O-N 3.1Å; G60-R63 VanDerWaalsContact O-N 3.14Å; G60-V64 WeakPolarHBondContact O-CG2 3.43Å; G60-V64 PolarHBondContact O-N 3.1Å |
| 61 | L | 95.2 | Very high | 90.9 | Very high | 0 Ų | 0 | 44.1 Ų | 44.1 | 0% | 0 | 22% | 0.216 | C | C | . | . | H | α-helix | trans | -62.9 | -36.7 | -179.8 | -71.6 | 171.1 | 0 | 0 | 0 | 112.7 | F20 L46 V57 V58 R63 V64 L65 T89 L90 | F20-L61 HydrophobicContact CD1-CD2 4.08Å; F20-L61 HydrophobicContact CE1-CD2 3.86Å; L46-L61 HydrophobicContact CD1-CD2 4.27Å; V57-L61 HydrophobicContact CG1-CD1 3.96Å; V57-L61 HydrophobicContact CG1-CG 4.43Å; V57-L61 WeakPolarHBondContact O-CG 3.37Å; V57-L61 PolarHBondContact O-N 3.25Å; V58-L61 PolarHBondContact O-N 3.24Å; L61-R63 VanDerWaalsContact C-N 3.33Å; L61-R63 PolarHBondContact O-N 3.15Å; L61-V64 PolarHBondContact O-N 3.06Å; L61-L65 WeakPolarHBondContact O-CB 3.48Å; L61-L65 PolarHBondContact O-N 3.38Å; L61-T89 HydrophobicContact CD1-CG2 3.75Å; L61-T89 HydrophobicContact CD2-CG2 4.16Å; L61-L90 HydrophobicContact CB-CD2 3.69Å; L61-L90 HydrophobicContact CB-CG 4.16Å; L61-L90 HydrophobicContact CD1-CD2 3.93Å; L61-L90 HydrophobicContact CD1-CG 4.3Å; L61-L90 HydrophobicContact CG-CD2 4.48Å |
| 62 | I | 94.2 | Very high | 90.5 | Very high | 3 Ų | 3 | 49 Ų | 49 | 2% | 0.015 | 24% | 0.238 | C | C | . | . | H | α-helix | trans | -60.1 | -44.7 | 173.5 | -67.5 | 163.1 | 0 | 0 | 0 | 110.4 | V58 G60 V64 L65 Q66 N109 L112 I113 | V58-I62 HydrophobicContact CG1-CD1 3.9Å; V58-I62 HydrophobicContact CG1-CG1 4.38Å; V58-I62 VanDerWaalsContact O-CG1 3.25Å; V58-I62 WeakPolarHBondContact O-CG1 3.47Å; V58-I62 PolarHBondContact O-N 3.12Å; G60-I62 VanDerWaalsContact C-N 3.34Å; G60-I62 PolarHBondContact O-N 3.19Å; I62-V64 PolarHBondContact O-N 2.97Å; I62-L65 PolarHBondContact O-N 3.09Å; I62-Q66 WeakPolarHBondContact O-CG 3.47Å; I62-Q66 PolarHBondContact O-N 2.95Å; I62-N109 HydrophobicContact CD1-CB 3.99Å; I62-N109 WeakPolarHBondContact CD1-O 3.37Å; I62-L112 HydrophobicContact CG2-CB 4.01Å; I62-I113 HydrophobicContact CD1-CB 3.82Å; I62-I113 HydrophobicContact CD1-CD1 4.48Å; I62-I113 HydrophobicContact CD1-CG1 4.45Å; I62-I113 HydrophobicContact CG1-CB 4.03Å; I62-I113 HydrophobicContact CG1-CD1 4.27Å; I62-I113 HydrophobicContact CG1-CG1 4.2Å |
| 63 | R | 95.3 | Very high | 90.3 | Very high | 167 Ų | 167 | 49 Ų | 49 | 63% | 0.63 | 24% | 0.244 | S | C | * | . | H | α-helix | trans | -64 | -40.8 | 177.4 | -72.4 | -175.2 | -67.8 | -126.4 | -0.3 | 112 | G59 G60 L61 Q66 M67 | G59-R63 WeakPolarHBondContact O-CG 3.46Å; G59-R63 PolarHBondContact O-N 3.21Å; G60-R63 WeakPolarHBondContact O-CB 3.36Å; G60-R63 PolarHBondContact O-N 3.1Å; G60-R63 VanDerWaalsContact O-N 3.14Å; L61-R63 VanDerWaalsContact C-N 3.33Å; L61-R63 PolarHBondContact O-N 3.15Å; R63-Q66 PolarHBondContact O-N 2.7Å; R63-M67 WeakPolarHBondContact O-CB 3.18Å; R63-M67 PolarHBondContact O-N 2.74Å |
| 64 | V | 96.3 | Very high | 90 | Very high | 3 Ų | 3 | 45.8 Ų | 45.8 | 2% | 0.018 | 23% | 0.234 | C | C | . | . | H | α-helix | trans | -61.2 | -46.4 | 174.5 | 174.4 | 0 | 0 | 0 | 0 | 110.3 | I17 E21 L24 G60 L61 I62 Q66 M67 V68 I86 | I17-V64 HydrophobicContact CG2-CG2 4.01Å; E21-V64 HydrophobicContact CB-CG1 4.32Å; E21-V64 HydrophobicContact CB-CG2 4.07Å; E21-V64 HydrophobicContact CG-CG1 4.18Å; E21-V64 HydrophobicContact CG-CG2 4.24Å; L24-V64 HydrophobicContact CD1-CG1 3.69Å; G60-V64 WeakPolarHBondContact O-CG2 3.43Å; G60-V64 PolarHBondContact O-N 3.1Å; L61-V64 PolarHBondContact O-N 3.06Å; I62-V64 PolarHBondContact O-N 2.97Å; V64-Q66 PolarHBondContact O-N 2.91Å; V64-M67 WeakPolarHBondContact O-CB 3.24Å; V64-M67 PolarHBondContact O-N 3.47Å; V64-V68 HydrophobicContact CG1-CG2 4.4Å; V64-V68 WeakPolarHBondContact O-CG2 3.3Å; V64-V68 PolarHBondContact O-N 3.07Å; V64-I86 HydrophobicContact CG1-CD1 3.93Å; V64-I86 HydrophobicContact CG1-CG1 4.33Å |
| 65 | L | 96.1 | Very high | 89.9 | Confident | 1 Ų | 1 | 46.9 Ų | 46.9 | 1% | 0.005 | 25% | 0.245 | C | C | . | . | H | α-helix | trans | -59.5 | -45.1 | 177.4 | -173 | 58 | 0 | 0 | 0 | 112.4 | L61 I62 M67 V68 N69 I86 L87 L90 E116 M117 F120 | L61-L65 WeakPolarHBondContact O-CB 3.48Å; L61-L65 PolarHBondContact O-N 3.38Å; I62-L65 PolarHBondContact O-N 3.09Å; L65-M67 VanDerWaalsContact C-N 3.32Å; L65-M67 PolarHBondContact O-N 3.18Å; L65-V68 PolarHBondContact O-N 3.47Å; L65-N69 WeakPolarHBondContact O-CB 3.48Å; L65-N69 VanDerWaalsContact O-CG 3.28Å; L65-N69 PolarHBondContact O-N 3.25Å; L65-I86 HydrophobicContact CB-CG2 3.92Å; L65-I86 HydrophobicContact CD1-CB 4.3Å; L65-I86 HydrophobicContact CD1-CD1 4.22Å; L65-I86 HydrophobicContact CD1-CG2 3.96Å; L65-I86 HydrophobicContact CG-CG2 4.36Å; L65-L87 HydrophobicContact CD2-CD2 4.35Å; L65-L90 HydrophobicContact CD2-CD1 4.19Å; L65-E116 HydrophobicContact CD2-CB 4.16Å; L65-M117 HydrophobicContact CD2-CE 3.65Å; L65-F120 HydrophobicContact CD1-CE2 4.25Å; L65-F120 HydrophobicContact CD1-CZ 4.04Å; L65-F120 HydrophobicContact CD2-CE2 4.16Å; L65-F120 HydrophobicContact CG-CE2 4.49Å |
| 66 | Q | 95.1 | Very high | 90 | Very high | 64 Ų | 64 | 53.6 Ų | 53.6 | 30% | 0.299 | 28% | 0.275 | S | S | . | . | H | α-helix | trans | -62 | -41.1 | 177 | -75.1 | 178.7 | -27.1 | 0 | 0 | 111.9 | I62 R63 V64 S70 E116 | I62-Q66 WeakPolarHBondContact O-CG 3.47Å; I62-Q66 PolarHBondContact O-N 2.95Å; R63-Q66 PolarHBondContact O-N 2.7Å; V64-Q66 PolarHBondContact O-N 2.91Å; Q66-S70 WeakPolarHBondContact O-CB 3.25Å; Q66-S70 PolarHBondContact O-N 3.46Å; Q66-E116 HydrophobicContact CG-CG 3.94Å; Q66-E116 WeakPolarHBondContact CG-OE1 3.33Å; Q66-E116 PolarHBondContact NE2-OE1 3.12Å |
| 67 | M | 94.4 | Very high | 89.9 | Confident | 46 Ų | 46 | 55.6 Ų | 55.6 | 23% | 0.227 | 28% | 0.283 | C | S | . | . | H | α-helix | trans | -61.3 | -49.5 | 174.3 | -171.9 | -120.9 | 68.3 | 0 | 0 | 110.6 | E21 R63 V64 L65 N69 S70 M71 | E21-M67 HydrophobicContact CG-SD 4.48Å; R63-M67 WeakPolarHBondContact O-CB 3.18Å; R63-M67 PolarHBondContact O-N 2.74Å; V64-M67 WeakPolarHBondContact O-CB 3.24Å; V64-M67 PolarHBondContact O-N 3.47Å; L65-M67 VanDerWaalsContact C-N 3.32Å; L65-M67 PolarHBondContact O-N 3.18Å; M67-N69 PolarHBondContact O-N 3.3Å; M67-S70 PolarHBondContact O-N 3.28Å; M67-S70 PolarHBondContact O-OG 2.97Å; M67-M71 HydrophobicContact CE-CE 3.13Å; M67-M71 HydrophobicContact CE-CG 3.86Å; M67-M71 HydrophobicContact CE-SD 3.37Å; M67-M71 WeakPolarHBondContact CE-SD 3.04Å; M67-M71 PolarHBondContact O-N 2.6Å; M67-M71 HydrophobicContact SD-CE 3.67Å |
| 68 | V | 94.1 | Very high | 89.8 | Confident | 0 Ų | 0 | 56.6 Ų | 56.6 | 0% | 0 | 29% | 0.289 | C | S | . | . | H | α-helix | trans | -61.7 | -45.6 | -178.2 | 171.3 | 0 | 0 | 0 | 0 | 110.8 | L24 V26 V64 L65 S70 M71 L79 Q83 I86 | L24-V68 HydrophobicContact CD1-CG2 3.97Å; V26-V68 HydrophobicContact CG1-CG1 4.28Å; V26-V68 HydrophobicContact CG2-CG1 4.5Å; V26-V68 HydrophobicContact CG2-CG2 4.03Å; V64-V68 HydrophobicContact CG1-CG2 4.4Å; V64-V68 WeakPolarHBondContact O-CG2 3.3Å; V64-V68 PolarHBondContact O-N 3.07Å; L65-V68 PolarHBondContact O-N 3.47Å; V68-S70 PolarHBondContact O-N 3.37Å; V68-S70 VanDerWaalsContact O-N 3.14Å; V68-M71 PolarHBondContact O-N 2.81Å; V68-M71 VanDerWaalsContact O-N 3.13Å; V68-L79 HydrophobicContact CG1-CD1 3.64Å; V68-L79 WeakPolarHBondContact O-CD1 3.42Å; V68-Q83 HydrophobicContact CG1-CG 4.14Å; V68-I86 HydrophobicContact CB-CD1 4.16Å; V68-I86 HydrophobicContact CG1-CD1 4.44Å; V68-I86 HydrophobicContact CG2-CD1 3.74Å |
| 69 | N | 91.5 | Very high | 89.9 | Confident | 49 Ų | 49 | 58.2 Ų | 58.2 | 26% | 0.262 | 30% | 0.297 | S | S | . | . | H | α-helix | trans | -62.4 | -21.2 | 177.1 | -73.8 | -12.1 | 0 | 0 | 0 | 113.6 | L65 M67 Q83 E116 | L65-N69 WeakPolarHBondContact O-CB 3.48Å; L65-N69 VanDerWaalsContact O-CG 3.28Å; L65-N69 PolarHBondContact O-N 3.25Å; M67-N69 PolarHBondContact O-N 3.3Å; N69-Q83 PolarHBondContact OD1-NE2 3.36Å; N69-E116 PolarHBondContact ND2-OE2 2.96Å |
| 70 | S | 90.4 | Very high | 90 | Very high | 83 Ų | 83 | 58.7 Ų | 58.7 | 58% | 0.58 | 30% | 0.298 | S | S | * | . | H | α-helix | trans | -89.8 | -10.2 | 179 | 75.5 | 0 | 0 | 0 | 0 | 114.2 | Q66 M67 V68 | Q66-S70 WeakPolarHBondContact O-CB 3.25Å; Q66-S70 PolarHBondContact O-N 3.46Å; M67-S70 PolarHBondContact O-N 3.28Å; M67-S70 PolarHBondContact O-OG 2.97Å; V68-S70 PolarHBondContact O-N 3.37Å; V68-S70 VanDerWaalsContact O-N 3.14Å |
| 71 | M | 87.5 | Confident | 89.9 | Confident | 57 Ų | 57 | 61 Ų | 61 | 28% | 0.281 | 31% | 0.309 | S | S | . | . | trans | -73.5 | 128.5 | -179.1 | -75.6 | -172.4 | 161.3 | 0 | 0 | 111.6 | V26 M67 V68 | V26-M71 HydrophobicContact CB-SD 3.93Å; V26-M71 HydrophobicContact CG2-SD 4Å; M67-M71 HydrophobicContact CE-CE 3.13Å; M67-M71 HydrophobicContact CE-CG 3.86Å; M67-M71 HydrophobicContact CE-SD 3.37Å; M67-M71 WeakPolarHBondContact CE-SD 3.04Å; M67-M71 PolarHBondContact O-N 2.6Å; M67-M71 HydrophobicContact SD-CE 3.67Å; V68-M71 PolarHBondContact O-N 2.81Å; V68-M71 VanDerWaalsContact O-N 3.13Å | ||
| 72 | K | 78.9 | Confident | 89.9 | Confident | 200 Ų | 200 | 61 Ų | 61 | 87% | 0.87 | 31% | 0.309 | S | S | * | . | trans | -106.9 | -10.3 | 179.7 | -65.4 | -173.5 | 179 | -176.9 | 0 | 114.5 | ||||
| 73 | T | 78.7 | Confident | 89.9 | Confident | 142 Ų | 142 | 61.8 Ų | 61.8 | 87% | 0.871 | 31% | 0.313 | S | S | * | . | S | Bend | trans | -107.5 | 0.7 | -167.3 | 53.2 | 0 | 0 | 0 | 0 | 114.4 | ||
| 74 | C | 80.6 | Confident | 89.9 | Confident | 34 Ų | 34 | 54.4 Ų | 54.4 | 23% | 0.23 | 29% | 0.287 | C | S | . | . | S | Bend | trans | -89.9 | 163.3 | 178.4 | 54.9 | 0 | 0 | 0 | 0 | 111.8 | V26 | V26-C74 HydrophobicContact CB-CB 4.29Å; V26-C74 HydrophobicContact CG1-CB 4.04Å |
| 75 | S | 84.2 | Confident | 89.8 | Confident | 55 Ų | 55 | 55.1 Ų | 55.1 | 39% | 0.385 | 29% | 0.29 | S | S | . | . | trans | -69.1 | 153.2 | 171.5 | 84.7 | 0 | 0 | 0 | 0 | 110.8 | Q77 D78 L79 | S75-Q77 VanDerWaalsContact C-N 3.28Å; S75-Q77 PolarHBondContact O-N 3.29Å; S75-D78 WeakPolarHBondContact CB-OD2 3.03Å; S75-D78 PolarHBondContact O-N 3.14Å; S75-D78 WeakPolarHBondContact OG-CB 3.47Å; S75-D78 PolarHBondContact OG-N 3.08Å; S75-D78 VanDerWaalsContact OG-N 3.14Å; S75-D78 PolarHBondContact OG-OD2 3.48Å; S75-L79 WeakPolarHBondContact O-CB 3.29Å; S75-L79 PolarHBondContact O-N 3.39Å | ||
| 76 | E | 85.2 | Confident | 89.9 | Confident | 160 Ų | 160 | 55.1 Ų | 55.1 | 75% | 0.748 | 29% | 0.29 | S | S | * | . | H | α-helix | trans | -60.7 | -38 | 177.9 | -73.5 | -178.1 | 161.8 | 0 | 0 | 112.2 | L79 F80 | E76-L79 PolarHBondContact O-N 3.32Å; E76-F80 WeakPolarHBondContact O-CB 3.5Å; E76-F80 PolarHBondContact O-N 3.03Å |
| 77 | Q | 85.8 | Confident | 90 | Very high | 89 Ų | 89 | 52 Ų | 52 | 42% | 0.416 | 28% | 0.275 | S | S | . | . | H | α-helix | trans | -67.3 | -45.5 | 178.8 | -175.1 | 60.8 | 36 | 0 | 0 | 111.7 | S75 L79 F80 D81 | S75-Q77 VanDerWaalsContact C-N 3.28Å; S75-Q77 PolarHBondContact O-N 3.29Å; Q77-L79 VanDerWaalsContact C-N 3.28Å; Q77-L79 PolarHBondContact O-N 3.05Å; Q77-F80 PolarHBondContact O-N 2.65Å; Q77-D81 VanDerWaalsContact NE2-CG 3.3Å; Q77-D81 PolarHBondContact NE2-OD1 3.33Å; Q77-D81 PolarHBondContact NE2-OD2 3.26Å; Q77-D81 PolarHBondContact O-N 3.35Å |
| 78 | D | 88.6 | Confident | 90 | Very high | 21 Ų | 21 | 51.7 Ų | 51.7 | 11% | 0.112 | 28% | 0.275 | C | S | . | . | H | α-helix | trans | -64.2 | -36.8 | 178.8 | -61.7 | -40 | 0 | 0 | 0 | 111.3 | P25 S75 S82 | P25-D78 HydrophobicContact CB-CB 3.92Å; S75-D78 WeakPolarHBondContact CB-OD2 3.03Å; S75-D78 PolarHBondContact O-N 3.14Å; S75-D78 WeakPolarHBondContact OG-CB 3.47Å; S75-D78 PolarHBondContact OG-N 3.08Å; S75-D78 VanDerWaalsContact OG-N 3.14Å; S75-D78 PolarHBondContact OG-OD2 3.48Å; D78-S82 VanDerWaalsContact O-CB 3.28Å; D78-S82 WeakPolarHBondContact O-CB 3.42Å; D78-S82 PolarHBondContact O-N 3.26Å; D78-S82 PolarHBondContact O-OG 2.92Å |
| 79 | L | 92.6 | Very high | 90.1 | Very high | 41 Ų | 41 | 51.7 Ų | 51.7 | 22% | 0.215 | 28% | 0.275 | C | S | . | . | H | α-helix | trans | -62.9 | -49.6 | 174.1 | -177.7 | 65.4 | 0 | 0 | 0 | 111.1 | V26 V68 S75 E76 Q77 S82 Q83 | V26-L79 HydrophobicContact CG1-CB 4.34Å; V26-L79 HydrophobicContact CG1-CD1 4.12Å; V68-L79 HydrophobicContact CG1-CD1 3.64Å; V68-L79 WeakPolarHBondContact O-CD1 3.42Å; S75-L79 WeakPolarHBondContact O-CB 3.29Å; S75-L79 PolarHBondContact O-N 3.39Å; E76-L79 PolarHBondContact O-N 3.32Å; Q77-L79 VanDerWaalsContact C-N 3.28Å; Q77-L79 PolarHBondContact O-N 3.05Å; L79-S82 PolarHBondContact O-N 3.13Å; L79-Q83 HydrophobicContact CD1-CG 4.48Å; L79-Q83 WeakPolarHBondContact O-CB 3.49Å; L79-Q83 VanDerWaalsContact O-CG 3.3Å; L79-Q83 WeakPolarHBondContact O-CG 3.41Å; L79-Q83 PolarHBondContact O-N 3.13Å |
| 80 | F | 91.8 | Very high | 90.2 | Very high | 17 Ų | 17 | 49.4 Ų | 49.4 | 8% | 0.075 | 26% | 0.262 | C | S | . | . | H | α-helix | trans | -58.7 | -49.1 | 178.6 | 167.1 | -101 | 0 | 0 | 0 | 112.2 | E76 Q77 S82 Q83 C84 Q129 Q132 L133 | E76-F80 WeakPolarHBondContact O-CB 3.5Å; E76-F80 PolarHBondContact O-N 3.03Å; Q77-F80 PolarHBondContact O-N 2.65Å; F80-S82 VanDerWaalsContact C-N 3.32Å; F80-S82 PolarHBondContact O-N 3.29Å; F80-Q83 PolarHBondContact O-N 3.14Å; F80-C84 VanDerWaalsContact CE2-SG 3.51Å; F80-C84 VanDerWaalsContact CZ-SG 3.53Å; F80-C84 PolarHBondContact O-N 2.93Å; F80-C84 PolarHBondContact O-SG 3.49Å; F80-C84 VanDerWaalsContact O-SG 3.39Å; F80-Q129 HydrophobicContact CB-CG 4.44Å; F80-Q129 HydrophobicContact CD1-CG 4.03Å; F80-Q129 HydrophobicContact CD2-CB 3.48Å; F80-Q129 VanDerWaalsContact CD2-CB 3.48Å; F80-Q129 HydrophobicContact CD2-CG 3.61Å; F80-Q129 HydrophobicContact CE1-CG 4.19Å; F80-Q129 VanDerWaalsContact CE2-CA 3.48Å; F80-Q129 HydrophobicContact CE2-CB 3.63Å; F80-Q129 HydrophobicContact CE2-CG 3.78Å; F80-Q129 HydrophobicContact CG-CB 4.1Å; F80-Q129 HydrophobicContact CG-CG 3.74Å; F80-Q129 HydrophobicContact CZ-CB 4.36Å; F80-Q129 HydrophobicContact CZ-CG 4.06Å; F80-Q132 HydrophobicContact CE2-CB 4.21Å; F80-Q132 HydrophobicContact CZ-CB 4.29Å; F80-L133 HydrophobicContact CD2-CD1 4.01Å; F80-L133 HydrophobicContact CD2-CD2 4.23Å; F80-L133 HydrophobicContact CD2-CG 3.93Å; F80-L133 HydrophobicContact CE2-CD2 4.35Å; F80-L133 HydrophobicContact CE2-CG 4Å |
| 81 | D | 90.8 | Very high | 90.3 | Very high | 48 Ų | 48 | 48 Ų | 48 | 26% | 0.257 | 25% | 0.246 | S | C | . | . | H | α-helix | trans | -63.4 | -40.8 | -179.6 | -71.7 | -28.8 | 0 | 0 | 0 | 110.9 | P25 Q77 C84 F85 | P25-D81 HydrophobicContact CB-CB 4.46Å; P25-D81 HydrophobicContact CG-CB 3.86Å; Q77-D81 VanDerWaalsContact NE2-CG 3.3Å; Q77-D81 PolarHBondContact NE2-OD1 3.33Å; Q77-D81 PolarHBondContact NE2-OD2 3.26Å; Q77-D81 PolarHBondContact O-N 3.35Å; D81-C84 PolarHBondContact O-N 2.95Å; D81-F85 WeakPolarHBondContact O-CD2 3.39Å; D81-F85 PolarHBondContact O-N 3.18Å |
| 82 | S | 95.2 | Very high | 90.5 | Very high | 0 Ų | 0 | 49.6 Ų | 49.6 | 0% | 0 | 25% | 0.253 | C | S | . | . | H | α-helix | trans | -64.1 | -44.1 | 176.6 | -58 | 0 | 0 | 0 | 0 | 112.1 | P25 V26 D78 L79 F80 F85 I86 | P25-S82 WeakPolarHBondContact CB-OG 3.41Å; P25-S82 WeakPolarHBondContact CD-OG 3.47Å; P25-S82 WeakPolarHBondContact CG-OG 3.48Å; V26-S82 WeakPolarHBondContact CG1-OG 3.25Å; V26-S82 PolarHBondContact N-OG 3.2Å; D78-S82 VanDerWaalsContact O-CB 3.28Å; D78-S82 WeakPolarHBondContact O-CB 3.42Å; D78-S82 PolarHBondContact O-N 3.26Å; D78-S82 PolarHBondContact O-OG 2.92Å; L79-S82 PolarHBondContact O-N 3.13Å; F80-S82 VanDerWaalsContact C-N 3.32Å; F80-S82 PolarHBondContact O-N 3.29Å; S82-F85 PolarHBondContact O-N 3.48Å; S82-I86 WeakPolarHBondContact O-CD1 3.15Å; S82-I86 VanDerWaalsContact O-CG1 3.26Å; S82-I86 WeakPolarHBondContact O-CG1 3.39Å; S82-I86 PolarHBondContact O-N 3.34Å; S82-I86 VanDerWaalsContact O-N 3.11Å |
| 83 | Q | 95.7 | Very high | 91.1 | Very high | 20 Ų | 20 | 40.1 Ų | 40.1 | 9% | 0.093 | 21% | 0.212 | C | C | . | . | H | α-helix | trans | -62.5 | -42.9 | 176.4 | -74.1 | 171.9 | -25.9 | 0 | 0 | 111.3 | V68 N69 L79 F80 F85 I86 L87 F120 L133 | V68-Q83 HydrophobicContact CG1-CG 4.14Å; N69-Q83 PolarHBondContact OD1-NE2 3.36Å; L79-Q83 HydrophobicContact CD1-CG 4.48Å; L79-Q83 WeakPolarHBondContact O-CB 3.49Å; L79-Q83 VanDerWaalsContact O-CG 3.3Å; L79-Q83 WeakPolarHBondContact O-CG 3.41Å; L79-Q83 PolarHBondContact O-N 3.13Å; F80-Q83 PolarHBondContact O-N 3.14Å; Q83-F85 PolarHBondContact O-N 2.99Å; Q83-I86 PolarHBondContact O-N 3.45Å; Q83-L87 WeakPolarHBondContact O-CB 3.31Å; Q83-L87 VanDerWaalsContact O-CG 3.25Å; Q83-L87 WeakPolarHBondContact O-CG 3.33Å; Q83-L87 PolarHBondContact O-N 2.91Å; Q83-F120 HydrophobicContact CG-CE1 4.39Å; Q83-F120 HydrophobicContact CG-CZ 4.42Å; Q83-L133 HydrophobicContact CB-CD2 3.66Å; Q83-L133 VanDerWaalsContact OE1-CD1 3.31Å |
| 84 | C | 94.5 | Very high | 91.4 | Very high | 12 Ų | 12 | 33.8 Ų | 33.8 | 8% | 0.081 | 17% | 0.173 | C | C | . | . | H | α-helix | trans | -58.8 | -48.7 | 176.4 | -75.1 | 0 | 0 | 0 | 0 | 112 | F80 D81 I86 L87 D88 K136 | F80-C84 VanDerWaalsContact CE2-SG 3.51Å; F80-C84 VanDerWaalsContact CZ-SG 3.53Å; F80-C84 PolarHBondContact O-N 2.93Å; F80-C84 PolarHBondContact O-SG 3.49Å; F80-C84 VanDerWaalsContact O-SG 3.39Å; D81-C84 PolarHBondContact O-N 2.95Å; C84-I86 VanDerWaalsContact C-N 3.34Å; C84-I86 PolarHBondContact O-N 3.26Å; C84-L87 PolarHBondContact O-N 3.45Å; C84-D88 WeakPolarHBondContact O-CB 3.43Å; C84-D88 VanDerWaalsContact O-CG 3.26Å; C84-D88 PolarHBondContact O-N 3.15Å; C84-K136 HydrophobicContact CB-CD 4.14Å |
| 85 | F | 95.2 | Very high | 91.6 | Very high | 19 Ų | 19 | 36.2 Ų | 36.2 | 8% | 0.083 | 20% | 0.196 | C | C | . | . | H | α-helix | trans | -59.1 | -43.4 | 177.7 | -95.4 | -76 | 0 | 0 | 0 | 112.5 | L24 L31 L39 E40 D81 S82 Q83 T89 | L24-F85 HydrophobicContact CD2-CB 4.27Å; L31-F85 HydrophobicContact CD1-CE2 3.86Å; L39-F85 HydrophobicContact CD2-CD1 3.99Å; L39-F85 HydrophobicContact CD2-CD2 3.74Å; L39-F85 HydrophobicContact CD2-CE1 4.02Å; L39-F85 HydrophobicContact CD2-CE2 3.77Å; L39-F85 HydrophobicContact CD2-CG 3.86Å; L39-F85 HydrophobicContact CD2-CZ 3.91Å; L39-F85 HydrophobicContact CG-CD1 4.12Å; L39-F85 HydrophobicContact CG-CE1 4.1Å; L39-F85 HydrophobicContact CG-CG 4.43Å; L39-F85 HydrophobicContact CG-CZ 4.4Å; E40-F85 HydrophobicContact CG-CE1 3.97Å; E40-F85 HydrophobicContact CG-CZ 4.2Å; D81-F85 WeakPolarHBondContact O-CD2 3.39Å; D81-F85 PolarHBondContact O-N 3.18Å; S82-F85 PolarHBondContact O-N 3.48Å; Q83-F85 PolarHBondContact O-N 2.99Å; F85-T89 WeakPolarHBondContact O-CB 3.29Å; F85-T89 PolarHBondContact O-N 3.4Å; F85-T89 PolarHBondContact O-OG1 2.83Å |
| 86 | I | 97 | Very high | 91 | Very high | 0 Ų | 0 | 34.6 Ų | 34.6 | 0% | 0 | 19% | 0.187 | C | C | . | . | H | α-helix | trans | -66.2 | -45.2 | 179.5 | -62.6 | 160.5 | 0 | 0 | 0 | 110.9 | F20 L24 V64 L65 V68 S82 Q83 C84 T89 L90 | F20-I86 HydrophobicContact CE1-CG1 4.05Å; F20-I86 HydrophobicContact CZ-CG1 4.48Å; L24-I86 HydrophobicContact CD1-CD1 3.86Å; L24-I86 HydrophobicContact CD1-CG1 4.17Å; L24-I86 HydrophobicContact CD2-CG1 4.26Å; V64-I86 HydrophobicContact CG1-CD1 3.93Å; V64-I86 HydrophobicContact CG1-CG1 4.33Å; L65-I86 HydrophobicContact CB-CG2 3.92Å; L65-I86 HydrophobicContact CD1-CB 4.3Å; L65-I86 HydrophobicContact CD1-CD1 4.22Å; L65-I86 HydrophobicContact CD1-CG2 3.96Å; L65-I86 HydrophobicContact CG-CG2 4.36Å; V68-I86 HydrophobicContact CB-CD1 4.16Å; V68-I86 HydrophobicContact CG1-CD1 4.44Å; V68-I86 HydrophobicContact CG2-CD1 3.74Å; S82-I86 WeakPolarHBondContact O-CD1 3.15Å; S82-I86 VanDerWaalsContact O-CG1 3.26Å; S82-I86 WeakPolarHBondContact O-CG1 3.39Å; S82-I86 PolarHBondContact O-N 3.34Å; S82-I86 VanDerWaalsContact O-N 3.11Å; Q83-I86 PolarHBondContact O-N 3.45Å; C84-I86 VanDerWaalsContact C-N 3.34Å; C84-I86 PolarHBondContact O-N 3.26Å; I86-T89 PolarHBondContact O-N 2.87Å; I86-L90 HydrophobicContact CG2-CD1 4.04Å; I86-L90 WeakPolarHBondContact O-CG 3.43Å; I86-L90 PolarHBondContact O-N 3.11Å |
| 87 | L | 96.5 | Very high | 90 | Very high | 0 Ų | 0 | 32 Ų | 32 | 0% | 0 | 18% | 0.184 | C | C | . | . | H | α-helix | trans | -64.3 | -42.3 | 179.4 | -67.9 | 175.2 | 0 | 0 | 0 | 111.9 | L65 Q83 C84 T89 L90 E91 M117 F120 L133 K136 | L65-L87 HydrophobicContact CD2-CD2 4.35Å; Q83-L87 WeakPolarHBondContact O-CB 3.31Å; Q83-L87 VanDerWaalsContact O-CG 3.25Å; Q83-L87 WeakPolarHBondContact O-CG 3.33Å; Q83-L87 PolarHBondContact O-N 2.91Å; C84-L87 PolarHBondContact O-N 3.45Å; L87-T89 VanDerWaalsContact C-N 3.31Å; L87-T89 PolarHBondContact O-N 3.29Å; L87-L90 PolarHBondContact O-N 3.28Å; L87-E91 WeakPolarHBondContact O-CB 3.35Å; L87-E91 PolarHBondContact O-N 3.37Å; L87-M117 HydrophobicContact CD2-CE 3.56Å; L87-M117 HydrophobicContact CD2-SD 3.76Å; L87-F120 HydrophobicContact CD2-CE2 4.29Å; L87-L133 HydrophobicContact CD1-CD2 3.91Å; L87-K136 HydrophobicContact CB-CB 3.93Å; L87-K136 HydrophobicContact CB-CD 4.45Å; L87-K136 HydrophobicContact CD1-CB 3.94Å |
| 88 | D | 95.3 | Very high | 88.9 | Confident | 39 Ų | 39 | 30.7 Ų | 30.7 | 21% | 0.209 | 18% | 0.178 | C | C | . | . | H | α-helix | trans | -63.9 | -38.4 | 175.6 | -71.9 | -23.3 | 0 | 0 | 0 | 111.7 | C84 E91 Q92 K136 | C84-D88 WeakPolarHBondContact O-CB 3.43Å; C84-D88 VanDerWaalsContact O-CG 3.26Å; C84-D88 PolarHBondContact O-N 3.15Å; D88-E91 PolarHBondContact O-N 2.86Å; D88-Q92 WeakPolarHBondContact O-CB 3.42Å; D88-Q92 VanDerWaalsContact O-CG 3.3Å; D88-Q92 WeakPolarHBondContact O-CG 3.48Å; D88-Q92 PolarHBondContact O-N 3.18Å; D88-K136 WeakPolarHBondContact OD1-CD 3.49Å; D88-K136 IonicContact OD1-NZ 3.5Å; D88-K136 PolarHBondContact OD1-NZ 3.43Å; D88-K136 IonicContact OD2-NZ 3.9Å; D88-K136 PolarHBondContact OD2-NZ 3.11Å |
| 89 | T | 95.4 | Very high | 87.2 | Confident | 0 Ų | 0 | 35 Ų | 35 | 0% | 0 | 20% | 0.202 | C | C | . | . | H | α-helix | trans | -65.4 | -43.1 | 175.8 | -52.7 | 0 | 0 | 0 | 0 | 111 | Q43 L46 V47 L61 F85 I86 L87 Q92 C93 | Q43-T89 HydrophobicContact CG-CG2 4.22Å; Q43-T89 WeakPolarHBondContact CG-OG1 3.45Å; Q43-T89 PolarHBondContact NE2-OG1 3.03Å; L46-T89 HydrophobicContact CB-CG2 4.4Å; V47-T89 HydrophobicContact CG2-CG2 4.14Å; L61-T89 HydrophobicContact CD1-CG2 3.75Å; L61-T89 HydrophobicContact CD2-CG2 4.16Å; F85-T89 WeakPolarHBondContact O-CB 3.29Å; F85-T89 PolarHBondContact O-N 3.4Å; F85-T89 PolarHBondContact O-OG1 2.83Å; I86-T89 PolarHBondContact O-N 2.87Å; L87-T89 VanDerWaalsContact C-N 3.31Å; L87-T89 PolarHBondContact O-N 3.29Å; T89-Q92 PolarHBondContact O-N 3.12Å; T89-C93 WeakPolarHBondContact O-CB 3.4Å; T89-C93 PolarHBondContact O-N 2.91Å; T89-C93 PolarHBondContact O-SG 2.71Å |
| 90 | L | 94.3 | Very high | 85.3 | Confident | 0 Ų | 0 | 38.5 Ų | 38.5 | 0% | 0 | 22% | 0.224 | C | C | . | . | H | α-helix | trans | -63.5 | -45 | 175.9 | -77.7 | 168.3 | 0 | 0 | 0 | 111.8 | V58 L61 L65 I86 L87 Q92 C93 L94 I113 V140 | V58-L90 HydrophobicContact CG1-CD2 4.24Å; L61-L90 HydrophobicContact CB-CD2 3.69Å; L61-L90 HydrophobicContact CB-CG 4.16Å; L61-L90 HydrophobicContact CD1-CD2 3.93Å; L61-L90 HydrophobicContact CD1-CG 4.3Å; L61-L90 HydrophobicContact CG-CD2 4.48Å; L65-L90 HydrophobicContact CD2-CD1 4.19Å; I86-L90 HydrophobicContact CG2-CD1 4.04Å; I86-L90 WeakPolarHBondContact O-CG 3.43Å; I86-L90 PolarHBondContact O-N 3.11Å; L87-L90 PolarHBondContact O-N 3.28Å; L90-Q92 PolarHBondContact O-N 3.28Å; L90-C93 PolarHBondContact O-N 3.03Å; L90-L94 WeakPolarHBondContact O-CG 3.46Å; L90-L94 PolarHBondContact O-N 2.89Å; L90-I113 HydrophobicContact CD1-CD1 4.13Å; L90-I113 HydrophobicContact CD2-CD1 3.85Å; L90-I113 HydrophobicContact CG-CD1 4.46Å; L90-V140 HydrophobicContact CB-CG1 4.46Å; L90-V140 HydrophobicContact CB-CG2 4.2Å |
| 91 | E | 93 | Very high | 83.1 | Confident | 53 Ų | 53 | 42.5 Ų | 42.5 | 25% | 0.248 | 26% | 0.255 | C | S | . | . | H | α-helix | trans | -55.5 | -51.3 | 175.7 | -178.3 | -172.6 | 161.6 | 0 | 0 | 110.8 | L87 D88 C93 L94 A95 K139 V140 | L87-E91 WeakPolarHBondContact O-CB 3.35Å; L87-E91 PolarHBondContact O-N 3.37Å; D88-E91 PolarHBondContact O-N 2.86Å; E91-C93 PolarHBondContact O-N 2.85Å; E91-L94 PolarHBondContact O-N 3.23Å; E91-A95 PolarHBondContact O-N 3.32Å; E91-K139 HydrophobicContact CG-CB 4.13Å; E91-K139 VanDerWaalsContact OE1-CD 3.22Å; E91-K139 WeakPolarHBondContact OE1-CD 3.41Å; E91-K139 IonicContact OE1-NZ 2.76Å; E91-K139 WeakPolarHBondContact OE2-CD 3.43Å; E91-V140 HydrophobicContact CB-CG2 4.11Å |
| 92 | Q | 92.3 | Very high | 81.1 | Confident | 91 Ų | 91 | 42.4 Ų | 42.4 | 43% | 0.425 | 26% | 0.258 | S | S | . | . | H | α-helix | trans | -65.8 | -35.7 | -179.5 | -71.1 | 176.9 | 42.1 | 0 | 0 | 113 | V47 D88 T89 L90 L94 | V47-Q92 HydrophobicContact CG1-CB 3.95Å; V47-Q92 HydrophobicContact CG2-CB 3.72Å; D88-Q92 WeakPolarHBondContact O-CB 3.42Å; D88-Q92 VanDerWaalsContact O-CG 3.3Å; D88-Q92 WeakPolarHBondContact O-CG 3.48Å; D88-Q92 PolarHBondContact O-N 3.18Å; T89-Q92 PolarHBondContact O-N 3.12Å; L90-Q92 PolarHBondContact O-N 3.28Å; Q92-L94 VanDerWaalsContact C-N 3.34Å |
| 93 | C | 90 | Very high | 79.1 | Confident | 2 Ų | 2 | 48.7 Ų | 48.7 | 1% | 0.014 | 29% | 0.287 | C | S | . | . | H | α-helix | trans | -64.9 | -38.6 | 174.3 | -70.1 | 0 | 0 | 0 | 0 | 111.8 | S50 V58 T89 L90 E91 | S50-C93 PolarHBondContact OG-SG 3.07Å; S50-C93 VanDerWaalsContact OG-SG 3.39Å; V58-C93 HydrophobicContact CG2-CB 4.45Å; T89-C93 WeakPolarHBondContact O-CB 3.4Å; T89-C93 PolarHBondContact O-N 2.91Å; T89-C93 PolarHBondContact O-SG 2.71Å; L90-C93 PolarHBondContact O-N 3.03Å; E91-C93 PolarHBondContact O-N 2.85Å |
| 94 | L | 86.2 | Confident | 76.9 | Confident | 8 Ų | 8 | 54.9 Ų | 54.9 | 4% | 0.042 | 32% | 0.32 | C | S | . | . | H | α-helix | trans | -73.9 | -27.9 | -179.6 | -74.2 | 163.5 | 0 | 0 | 0 | 113.3 | F54 L90 E91 Q92 G96 V140 L144 | F54-L94 HydrophobicContact CE2-CD2 4.35Å; F54-L94 HydrophobicContact CZ-CD2 3.79Å; L90-L94 WeakPolarHBondContact O-CG 3.46Å; L90-L94 PolarHBondContact O-N 2.89Å; E91-L94 PolarHBondContact O-N 3.23Å; Q92-L94 VanDerWaalsContact C-N 3.34Å; L94-G96 VanDerWaalsContact C-N 3.25Å; L94-G96 PolarHBondContact O-N 3Å; L94-V140 HydrophobicContact CD1-CB 4.48Å; L94-V140 HydrophobicContact CD1-CG1 3.7Å; L94-L144 HydrophobicContact CD1-CB 4.35Å; L94-L144 HydrophobicContact CD2-CB 4.42Å; L94-L144 HydrophobicContact CD2-CD1 3.81Å |
| 95 | A | 83.1 | Confident | 75.2 | Confident | 86 Ų | 86 | 59.8 Ų | 59.8 | 71% | 0.711 | 35% | 0.345 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -73.5 | -13.3 | 177.3 | 0 | 0 | 0 | 0 | 0 | 114 | E91 | E91-A95 PolarHBondContact O-N 3.32Š|
| 96 | G | 72.3 | Confident | 74 | Confident | 20 Ų | 20 | 60 Ų | 60 | 21% | 0.206 | 35% | 0.346 | C | S | . | . | S | Bend | trans | -75.7 | 164.1 | -179.6 | 0 | 0 | 0 | 0 | 0 | 114.3 | L94 Q98 | L94-G96 VanDerWaalsContact C-N 3.25Å; L94-G96 PolarHBondContact O-N 3Å; G96-Q98 PolarHBondContact O-N 3.33Å |
| 97 | P | 63.9 | Low | 73 | Confident | 105 Ų | 105 | 64.2 Ų | 64.2 | 68% | 0.682 | 37% | 0.366 | S | S | * | . | P | Polyproline II helix | trans | -61.9 | 121.8 | 174.2 | 24.9 | -31.6 | 0 | 0 | 0 | 110.4 | ||
| 98 | Q | 62.6 | Low | 72.4 | Confident | 63 Ų | 63 | 69 Ų | 69 | 29% | 0.294 | 39% | 0.392 | S | S | . | . | P | Polyproline II helix | trans | -90 | 122.9 | 177.7 | -64.5 | -170.6 | 8.3 | 0 | 0 | 110.4 | G96 S147 | G96-Q98 PolarHBondContact O-N 3.33Å; Q98-S147 PolarHBondContact NE2-OG 3.39Å; Q98-S147 PolarHBondContact OE1-OG 3.02Å |
| 99 | D | 54.3 | Low | 71.9 | Confident | 112 Ų | 112 | 68.5 Ų | 68.5 | 60% | 0.599 | 39% | 0.389 | S | S | * | . | P | Polyproline II helix | trans | -77.8 | 120.8 | 173.3 | -120.9 | -15.1 | 0 | 0 | 0 | 109.3 | S101 | D99-S101 PolarHBondContact O-N 3.36Š|
| 100 | T | 51.5 | Low | 71.3 | Confident | 113 Ų | 113 | 69 Ų | 69 | 69% | 0.693 | 39% | 0.392 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -68.5 | 19.2 | -172.7 | 50.8 | 0 | 0 | 0 | 0 | 115.2 | H103 | T100-H103 PolarHBondContact O-CD2 3.4Å; T100-H103 PolarHBondContact O-NE2 3.39Å; T100-H103 VanDerWaalsContact O-NE2 3.15Å |
| 101 | S | 45 | Very low | 71 | Confident | 102 Ų | 102 | 73.6 Ų | 73.6 | 71% | 0.713 | 41% | 0.412 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -107.2 | 2.4 | -165.3 | 64 | 0 | 0 | 0 | 0 | 116 | D99 | D99-S101 PolarHBondContact O-N 3.36Š|
| 102 | S | 49.9 | Very low | 70.8 | Confident | 46 Ų | 46 | 74.1 Ų | 74.1 | 32% | 0.322 | 42% | 0.416 | S | S | . | . | trans | -130.8 | 55.4 | -176.9 | 54.5 | 0 | 0 | 0 | 0 | 115.6 | L104 E106 | S102-L104 PolarHBondContact O-N 3.39Å; S102-E106 WeakPolarHBondContact O-CG 3.36Å; S102-E106 PolarHBondContact OG-OE1 3.37Å | ||
| 103 | H | 53.7 | Low | 70.7 | Confident | 131 Ų | 131 | 69.9 Ų | 69.9 | 61% | 0.606 | 40% | 0.396 | S | S | * | . | H | α-helix | trans | -70 | -16.9 | -168.4 | -77.7 | -58.6 | 0 | 0 | 0 | 118.3 | T100 E106 | T100-H103 PolarHBondContact O-CD2 3.4Å; T100-H103 PolarHBondContact O-NE2 3.39Å; T100-H103 VanDerWaalsContact O-NE2 3.15Å; H103-E106 IonicContact ND1-OE2 3.39Å |
| 104 | L | 49.4 | Very low | 70.7 | Confident | 151 Ų | 151 | 70 Ų | 70 | 79% | 0.791 | 40% | 0.397 | S | S | * | . | H | α-helix | trans | -89.8 | -46.2 | -171 | -93.6 | 149.5 | 0 | 0 | 0 | 114.4 | S102 E106 | S102-L104 PolarHBondContact O-N 3.39Å; L104-E106 PolarHBondContact O-N 3.5Å |
| 105 | D | 58.6 | Low | 71 | Confident | 114 Ų | 114 | 74.7 Ų | 74.7 | 61% | 0.61 | 42% | 0.419 | S | S | * | . | H | α-helix | trans | -70.9 | -25.3 | 176.5 | -70.8 | -30.1 | 0 | 0 | 0 | 111.7 | S55 N109 | S55-D105 WeakPolarHBondContact OG-CB 3.22Å; D105-N109 PolarHBondContact O-N 3.15Å; D105-N109 PolarHBondContact O-ND2 3.1Å |
| 106 | E | 69.6 | Low | 71.4 | Confident | 23 Ų | 23 | 70.9 Ų | 70.9 | 11% | 0.107 | 39% | 0.386 | C | S | . | . | H | α-helix | trans | -60.7 | -44.2 | 175.9 | -86.5 | 170 | -175.1 | 0 | 0 | 112.4 | F54 S102 H103 L104 N108 N109 V110 | F54-E106 HydrophobicContact CD1-CG 4.36Å; F54-E106 HydrophobicContact CE1-CG 4.45Å; S102-E106 WeakPolarHBondContact O-CG 3.36Å; S102-E106 PolarHBondContact OG-OE1 3.37Å; H103-E106 IonicContact ND1-OE2 3.39Å; L104-E106 PolarHBondContact O-N 3.5Å; E106-N108 VanDerWaalsContact C-N 3.34Å; E106-N108 PolarHBondContact O-N 3.44Å; E106-N109 PolarHBondContact O-N 2.94Å; E106-V110 WeakPolarHBondContact O-CB 3.27Å; E106-V110 WeakPolarHBondContact O-CG2 3.15Å; E106-V110 PolarHBondContact O-N 3Å |
| 107 | E | 76.3 | Confident | 72.4 | Confident | 90 Ų | 90 | 69.9 Ų | 69.9 | 42% | 0.421 | 38% | 0.376 | S | S | . | . | H | α-helix | trans | -65 | -37.6 | -173 | -151.2 | -161.6 | 137.2 | 0 | 0 | 112.7 | K111 L151 | E107-K111 WeakPolarHBondContact O-CG 3.43Å; E107-K111 PolarHBondContact O-N 3.35Å; E107-K111 VanDerWaalsContact O-N 3.08Å; E107-K111 WeakPolarHBondContact OE1-CE 3.3Å; E107-K111 IonicContact OE1-NZ 3.26Å; E107-K111 PolarHBondContact OE1-NZ 2.95Å; E107-L151 HydrophobicContact CG-CD1 3.91Å |
| 108 | N | 82.8 | Confident | 73.7 | Confident | 101 Ų | 101 | 65.1 Ų | 65.1 | 54% | 0.54 | 35% | 0.346 | S | S | . | . | H | α-helix | trans | -70.5 | -42.7 | 174.9 | -82.4 | -19.4 | 0 | 0 | 0 | 112 | E106 V110 K111 L112 | E106-N108 VanDerWaalsContact C-N 3.34Å; E106-N108 PolarHBondContact O-N 3.44Å; N108-V110 VanDerWaalsContact C-N 3.28Å; N108-V110 PolarHBondContact O-N 3.41Å; N108-K111 PolarHBondContact O-N 3.26Å; N108-L112 WeakPolarHBondContact O-CG 3.28Å; N108-L112 PolarHBondContact O-N 3Å |
| 109 | N | 84.6 | Confident | 75.1 | Confident | 27 Ų | 27 | 66.7 Ų | 66.7 | 14% | 0.144 | 35% | 0.351 | C | S | . | . | H | α-helix | trans | -61 | -39.7 | 175 | -74.4 | -25.7 | 0 | 0 | 0 | 111.2 | S55 I62 D105 E106 L112 I113 | S55-N109 PolarHBondContact O-ND2 2.82Å; S55-N109 PolarHBondContact OG-ND2 3.45Å; I62-N109 HydrophobicContact CD1-CB 3.99Å; I62-N109 WeakPolarHBondContact CD1-O 3.37Å; D105-N109 PolarHBondContact O-N 3.15Å; D105-N109 PolarHBondContact O-ND2 3.1Å; E106-N109 PolarHBondContact O-N 2.94Å; N109-L112 PolarHBondContact O-N 2.89Å; N109-I113 WeakPolarHBondContact O-CB 3.44Å; N109-I113 WeakPolarHBondContact O-CG2 3.35Å; N109-I113 PolarHBondContact O-N 3.44Å |
| 110 | V | 83.7 | Confident | 76.8 | Confident | 10 Ų | 10 | 61.6 Ų | 61.6 | 6% | 0.061 | 32% | 0.324 | C | S | . | . | H | α-helix | trans | -62.6 | -43.6 | 175.5 | 179.2 | 0 | 0 | 0 | 0 | 110.4 | E106 N108 L112 I113 V114 L144 L151 | E106-V110 WeakPolarHBondContact O-CB 3.27Å; E106-V110 WeakPolarHBondContact O-CG2 3.15Å; E106-V110 PolarHBondContact O-N 3Å; N108-V110 VanDerWaalsContact C-N 3.28Å; N108-V110 PolarHBondContact O-N 3.41Å; V110-L112 PolarHBondContact O-N 3.06Å; V110-I113 WeakPolarHBondContact O-CG2 3.3Å; V110-V114 HydrophobicContact CG1-CG2 4.32Å; V110-V114 WeakPolarHBondContact O-CB 3.4Å; V110-V114 WeakPolarHBondContact O-CG2 3.18Å; V110-V114 PolarHBondContact O-N 3.39Å; V110-L144 HydrophobicContact CG1-CD1 4.21Å; V110-L144 HydrophobicContact CG1-CD2 3.98Å; V110-L144 HydrophobicContact CG1-CG 4.16Å; V110-L144 HydrophobicContact CG2-CD1 4.03Å; V110-L151 HydrophobicContact CB-CD2 3.91Å; V110-L151 HydrophobicContact CG1-CD2 3.33Å |
| 111 | K | 87.4 | Confident | 78.6 | Confident | 97 Ų | 97 | 56.2 Ų | 56.2 | 42% | 0.422 | 29% | 0.291 | S | S | . | . | H | α-helix | trans | -60.4 | -45.1 | 175.8 | -72.5 | 171.5 | -171.9 | 157.7 | 0 | 112 | E107 N108 Q115 L151 | E107-K111 WeakPolarHBondContact O-CG 3.43Å; E107-K111 PolarHBondContact O-N 3.35Å; E107-K111 VanDerWaalsContact O-N 3.08Å; E107-K111 WeakPolarHBondContact OE1-CE 3.3Å; E107-K111 IonicContact OE1-NZ 3.26Å; E107-K111 PolarHBondContact OE1-NZ 2.95Å; N108-K111 PolarHBondContact O-N 3.26Å; K111-Q115 WeakPolarHBondContact O-CB 3.3Å; K111-Q115 PolarHBondContact O-N 3.49Å; K111-Q115 VanDerWaalsContact O-N 3.1Å; K111-L151 HydrophobicContact CG-CD2 3.89Å |
| 112 | L | 89.8 | Confident | 80.6 | Confident | 64 Ų | 64 | 54.6 Ų | 54.6 | 34% | 0.335 | 27% | 0.272 | S | S | . | . | H | α-helix | trans | -66.6 | -47.3 | -179.5 | -71.1 | 170.6 | 0 | 0 | 0 | 112.1 | I62 N108 N109 V110 V114 Q115 E116 | I62-L112 HydrophobicContact CG2-CB 4.01Å; N108-L112 WeakPolarHBondContact O-CG 3.28Å; N108-L112 PolarHBondContact O-N 3Å; N109-L112 PolarHBondContact O-N 2.89Å; V110-L112 PolarHBondContact O-N 3.06Å; L112-V114 PolarHBondContact O-N 3Å; L112-Q115 WeakPolarHBondContact O-CB 3.44Å; L112-Q115 PolarHBondContact O-N 3.25Å; L112-E116 PolarHBondContact O-N 3.06Å |
| 113 | I | 90.3 | Very high | 82.2 | Confident | 2 Ų | 2 | 55 Ų | 55 | 1% | 0.01 | 27% | 0.27 | C | S | . | . | H | α-helix | trans | -65.6 | -39.9 | -179.5 | -160.9 | 170.7 | 0 | 0 | 0 | 111 | V58 I62 L90 N109 V110 Q115 E116 M117 V140 L144 | V58-I113 HydrophobicContact CG1-CD1 4.43Å; I62-I113 HydrophobicContact CD1-CB 3.82Å; I62-I113 HydrophobicContact CD1-CD1 4.48Å; I62-I113 HydrophobicContact CD1-CG1 4.45Å; I62-I113 HydrophobicContact CG1-CB 4.03Å; I62-I113 HydrophobicContact CG1-CD1 4.27Å; I62-I113 HydrophobicContact CG1-CG1 4.2Å; L90-I113 HydrophobicContact CD1-CD1 4.13Å; L90-I113 HydrophobicContact CD2-CD1 3.85Å; L90-I113 HydrophobicContact CG-CD1 4.46Å; N109-I113 WeakPolarHBondContact O-CB 3.44Å; N109-I113 WeakPolarHBondContact O-CG2 3.35Å; N109-I113 PolarHBondContact O-N 3.44Å; V110-I113 WeakPolarHBondContact O-CG2 3.3Å; I113-Q115 VanDerWaalsContact C-N 3.29Å; I113-Q115 PolarHBondContact O-N 2.92Å; I113-E116 PolarHBondContact O-N 3Å; I113-M117 HydrophobicContact CG1-CE 4.16Å; I113-M117 HydrophobicContact CG1-CG 4.41Å; I113-M117 VanDerWaalsContact O-CG 3.28Å; I113-M117 WeakPolarHBondContact O-CG 2.96Å; I113-M117 PolarHBondContact O-N 2.69Å; I113-V140 HydrophobicContact CD1-CG1 3.94Å; I113-V140 HydrophobicContact CG1-CG1 4.35Å; I113-L144 HydrophobicContact CG2-CD1 4.13Å; I113-L144 HydrophobicContact CG2-CD2 3.42Å; I113-L144 VanDerWaalsContact CG2-CD2 3.42Å; I113-L144 HydrophobicContact CG2-CG 4.43Å |
| 114 | V | 90.3 | Very high | 83.2 | Confident | 6 Ų | 6 | 52.3 Ų | 52.3 | 4% | 0.036 | 26% | 0.264 | C | S | . | . | H | α-helix | trans | -59.6 | -43 | 174.2 | 171.1 | 0 | 0 | 0 | 0 | 110.3 | V110 L112 E116 M117 C118 L141 L144 I152 | V110-V114 HydrophobicContact CG1-CG2 4.32Å; V110-V114 WeakPolarHBondContact O-CB 3.4Å; V110-V114 WeakPolarHBondContact O-CG2 3.18Å; V110-V114 PolarHBondContact O-N 3.39Å; L112-V114 PolarHBondContact O-N 3Å; V114-E116 PolarHBondContact O-N 2.77Å; V114-M117 PolarHBondContact O-N 3.1Å; V114-C118 WeakPolarHBondContact O-CB 3.49Å; V114-C118 PolarHBondContact O-N 3.3Å; V114-C118 PolarHBondContact O-SG 3.48Å; V114-L141 HydrophobicContact CG2-CD2 4.41Å; V114-L144 HydrophobicContact CG2-CD2 3.57Å; V114-I152 HydrophobicContact CG2-CD1 4.09Å; V114-I152 HydrophobicContact CG2-CG1 3.95Å |
| 115 | Q | 91.3 | Very high | 84.2 | Confident | 105 Ų | 105 | 48 Ų | 48 | 49% | 0.491 | 24% | 0.244 | S | C | . | . | H | α-helix | trans | -62.8 | -40.8 | 177.6 | -171.5 | 175.1 | 6.2 | 0 | 0 | 112.6 | K111 L112 I113 | K111-Q115 WeakPolarHBondContact O-CB 3.3Å; K111-Q115 PolarHBondContact O-N 3.49Å; K111-Q115 VanDerWaalsContact O-N 3.1Å; L112-Q115 WeakPolarHBondContact O-CB 3.44Å; L112-Q115 PolarHBondContact O-N 3.25Å; I113-Q115 VanDerWaalsContact C-N 3.29Å; I113-Q115 PolarHBondContact O-N 2.92Å |
| 116 | E | 92.4 | Very high | 84.7 | Confident | 6 Ų | 6 | 48.1 Ų | 48.1 | 3% | 0.028 | 25% | 0.245 | C | C | . | . | H | α-helix | trans | -68.4 | -43.1 | 174.6 | -66.3 | -52.8 | 133.6 | 0 | 0 | 112 | L65 Q66 N69 L112 I113 V114 C118 K119 F120 | L65-E116 HydrophobicContact CD2-CB 4.16Å; Q66-E116 HydrophobicContact CG-CG 3.94Å; Q66-E116 WeakPolarHBondContact CG-OE1 3.33Å; Q66-E116 PolarHBondContact NE2-OE1 3.12Å; N69-E116 PolarHBondContact ND2-OE2 2.96Å; L112-E116 PolarHBondContact O-N 3.06Å; I113-E116 PolarHBondContact O-N 3Å; V114-E116 PolarHBondContact O-N 2.77Å; E116-C118 VanDerWaalsContact C-N 3.31Å; E116-C118 PolarHBondContact O-N 3.27Å; E116-K119 WeakPolarHBondContact O-CB 3.07Å; E116-K119 PolarHBondContact O-N 2.73Å; E116-K119 VanDerWaalsContact O-N 3.07Å; E116-K119 IonicContact OE1-NZ 2.62Å; E116-K119 PolarHBondContact OE1-NZ 3.45Å; E116-K119 WeakPolarHBondContact OE2-CD 3.5Å; E116-K119 IonicContact OE2-NZ 3.99Å; E116-K119 PolarHBondContact OE2-NZ 2.97Å; E116-F120 VanDerWaalsContact O-CD2 3.29Å; E116-F120 WeakPolarHBondContact O-CD2 3.23Å |
| 117 | M | 93.3 | Very high | 84.9 | Confident | 0 Ų | 0 | 49.2 Ų | 49.2 | 0% | 0 | 26% | 0.255 | C | S | . | . | H | α-helix | trans | -61.3 | -40.7 | 177.9 | -67.1 | -49.4 | 101.7 | 0 | 0 | 111.5 | L65 L87 I113 V114 K119 F120 I121 A137 V140 L141 | L65-M117 HydrophobicContact CD2-CE 3.65Å; L87-M117 HydrophobicContact CD2-CE 3.56Å; L87-M117 HydrophobicContact CD2-SD 3.76Å; I113-M117 HydrophobicContact CG1-CE 4.16Å; I113-M117 HydrophobicContact CG1-CG 4.41Å; I113-M117 VanDerWaalsContact O-CG 3.28Å; I113-M117 WeakPolarHBondContact O-CG 2.96Å; I113-M117 PolarHBondContact O-N 2.69Å; V114-M117 PolarHBondContact O-N 3.1Å; M117-K119 PolarHBondContact O-N 3.01Å; M117-F120 HydrophobicContact CE-CD2 4.29Å; M117-F120 HydrophobicContact CE-CE2 4.31Å; M117-F120 PolarHBondContact O-N 3.42Å; M117-I121 WeakPolarHBondContact O-CG1 3.36Å; M117-I121 PolarHBondContact O-N 2.77Å; M117-A137 HydrophobicContact SD-CB 3.83Å; M117-V140 HydrophobicContact CE-CG1 4.43Å; M117-V140 HydrophobicContact CG-CB 4.36Å; M117-V140 HydrophobicContact CG-CG1 3.94Å; M117-V140 HydrophobicContact SD-CB 3.76Å; M117-V140 HydrophobicContact SD-CG1 3.64Å; M117-V140 HydrophobicContact SD-CG2 4.3Å; M117-L141 HydrophobicContact CB-CD1 3.98Å; M117-L141 HydrophobicContact CB-CD2 3.82Å; M117-L141 HydrophobicContact CB-CG 3.71Å; M117-L141 HydrophobicContact CG-CD2 4.2Å; M117-L141 HydrophobicContact CG-CG 4.03Å |
| 118 | C | 91.4 | Very high | 84.6 | Confident | 5 Ų | 5 | 47.7 Ų | 47.7 | 3% | 0.034 | 25% | 0.249 | C | C | . | . | H | α-helix | trans | -55 | -34.8 | 174.5 | -75.8 | 0 | 0 | 0 | 0 | 112.8 | V114 E116 F120 I121 Q122 V184 | V114-C118 WeakPolarHBondContact O-CB 3.49Å; V114-C118 PolarHBondContact O-N 3.3Å; V114-C118 PolarHBondContact O-SG 3.48Å; E116-C118 VanDerWaalsContact C-N 3.31Å; E116-C118 PolarHBondContact O-N 3.27Å; C118-F120 VanDerWaalsContact C-N 3.34Å; C118-F120 PolarHBondContact O-N 3.23Å; C118-I121 PolarHBondContact O-N 3.07Å; C118-Q122 VanDerWaalsContact O-CG 3.3Å; C118-Q122 WeakPolarHBondContact O-CG 3.07Å; C118-Q122 PolarHBondContact O-N 2.76Å; C118-Q122 VanDerWaalsContact O-N 3.12Å; C118-V184 HydrophobicContact CB-CG1 3.93Å |
| 119 | K | 90.6 | Very high | 84.6 | Confident | 96 Ų | 96 | 45.6 Ų | 45.6 | 42% | 0.417 | 24% | 0.237 | S | C | . | . | H | α-helix | trans | -63.6 | -41.1 | 176.8 | -61.7 | 174.8 | -171.2 | 168.2 | 0 | 111.3 | E116 M117 Q122 I123 | E116-K119 WeakPolarHBondContact O-CB 3.07Å; E116-K119 PolarHBondContact O-N 2.73Å; E116-K119 VanDerWaalsContact O-N 3.07Å; E116-K119 IonicContact OE1-NZ 2.62Å; E116-K119 PolarHBondContact OE1-NZ 3.45Å; E116-K119 WeakPolarHBondContact OE2-CD 3.5Å; E116-K119 IonicContact OE2-NZ 3.99Å; E116-K119 PolarHBondContact OE2-NZ 2.97Å; M117-K119 PolarHBondContact O-N 3.01Å; K119-Q122 PolarHBondContact O-N 3.31Å; K119-I123 WeakPolarHBondContact O-CG1 3.44Å; K119-I123 PolarHBondContact O-N 3.44Å |
| 120 | F | 91.7 | Very high | 84.5 | Confident | 4 Ų | 4 | 44.6 Ų | 44.6 | 2% | 0.018 | 23% | 0.232 | C | C | . | . | H | α-helix | trans | -68.9 | -37 | 176.7 | -65.9 | -73.7 | 0 | 0 | 0 | 112.5 | L65 Q83 L87 E116 M117 C118 Q122 I123 L133 A137 | L65-F120 HydrophobicContact CD1-CE2 4.25Å; L65-F120 HydrophobicContact CD1-CZ 4.04Å; L65-F120 HydrophobicContact CD2-CE2 4.16Å; L65-F120 HydrophobicContact CG-CE2 4.49Å; Q83-F120 HydrophobicContact CG-CE1 4.39Å; Q83-F120 HydrophobicContact CG-CZ 4.42Å; L87-F120 HydrophobicContact CD2-CE2 4.29Å; E116-F120 VanDerWaalsContact O-CD2 3.29Å; E116-F120 WeakPolarHBondContact O-CD2 3.23Å; M117-F120 HydrophobicContact CE-CD2 4.29Å; M117-F120 HydrophobicContact CE-CE2 4.31Å; M117-F120 PolarHBondContact O-N 3.42Å; C118-F120 VanDerWaalsContact C-N 3.34Å; C118-F120 PolarHBondContact O-N 3.23Å; F120-Q122 VanDerWaalsContact C-N 3.27Å; F120-Q122 PolarHBondContact O-N 3.18Å; F120-I123 HydrophobicContact CB-CD1 4.48Å; F120-I123 HydrophobicContact CD1-CD1 3.8Å; F120-I123 WeakPolarHBondContact O-CB 3.27Å; F120-I123 PolarHBondContact O-N 2.86Å; F120-L133 HydrophobicContact CD1-CB 4.16Å; F120-L133 HydrophobicContact CD1-CD1 4.48Å; F120-L133 HydrophobicContact CE1-CD1 4.45Å; F120-A137 HydrophobicContact CB-CB 3.59Å; F120-A137 HydrophobicContact CD2-CB 4.4Å; F120-A137 HydrophobicContact CG-CB 4.22Å |
| 121 | I | 88.6 | Confident | 84.2 | Confident | 1 Ų | 1 | 46.4 Ų | 46.4 | 1% | 0.005 | 24% | 0.241 | C | C | . | . | H | α-helix | trans | -64.1 | -34.2 | 176.2 | -60.8 | -54.4 | 0 | 0 | 0 | 111.9 | M117 C118 I123 K134 A137 L141 V184 Y191 | M117-I121 WeakPolarHBondContact O-CG1 3.36Å; M117-I121 PolarHBondContact O-N 2.77Å; C118-I121 PolarHBondContact O-N 3.07Å; I121-I123 VanDerWaalsContact C-N 3.3Å; I121-I123 PolarHBondContact O-N 3.15Å; I121-K134 HydrophobicContact CD1-CG 4.01Å; I121-K134 WeakPolarHBondContact O-CE 3.5Å; I121-K134 PolarHBondContact O-NZ 2.92Å; I121-A137 HydrophobicContact CD1-CB 4.39Å; I121-L141 HydrophobicContact CD1-CD1 4.2Å; I121-L141 HydrophobicContact CG1-CD1 3.93Å; I121-V184 HydrophobicContact CB-CG2 3.89Å; I121-V184 HydrophobicContact CG2-CG2 3.52Å; I121-Y191 HydrophobicContact CD1-CD2 4.14Å; I121-Y191 HydrophobicContact CD1-CE1 4.38Å; I121-Y191 HydrophobicContact CD1-CE2 3.98Å; I121-Y191 HydrophobicContact CD1-CG 4.45Å; I121-Y191 HydrophobicContact CG1-CD2 4.39Å; I121-Y191 HydrophobicContact CG1-CE2 4.27Å; I121-Y191 HydrophobicContact CG2-CD2 4.36Å; I121-Y191 HydrophobicContact CG2-CE2 3.56Å |
| 122 | Q | 86.3 | Confident | 84.2 | Confident | 68 Ų | 68 | 45.9 Ų | 45.9 | 32% | 0.318 | 24% | 0.24 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -75.9 | -11.7 | 178.6 | -71.4 | 172.6 | 5.5 | 0 | 0 | 114.3 | C118 K119 F120 P124 I180 V184 | C118-Q122 VanDerWaalsContact O-CG 3.3Å; C118-Q122 WeakPolarHBondContact O-CG 3.07Å; C118-Q122 PolarHBondContact O-N 2.76Å; C118-Q122 VanDerWaalsContact O-N 3.12Å; K119-Q122 PolarHBondContact O-N 3.31Å; F120-Q122 VanDerWaalsContact C-N 3.27Å; F120-Q122 PolarHBondContact O-N 3.18Å; Q122-P124 WeakPolarHBondContact O-CD 3.35Å; Q122-I180 HydrophobicContact CB-CG2 4.37Å; Q122-I180 HydrophobicContact CG-CG2 4.49Å; Q122-V184 HydrophobicContact CG-CB 3.82Å; Q122-V184 HydrophobicContact CG-CG1 4.41Å; Q122-V184 HydrophobicContact CG-CG2 3.41Å; Q122-V184 VanDerWaalsContact CG-CG2 3.41Å |
| 123 | I | 83.4 | Confident | 84.3 | Confident | 54 Ų | 54 | 43.3 Ų | 43.3 | 28% | 0.277 | 23% | 0.226 | S | C | . | . | S | Bend | trans | -61.8 | 126.6 | -179.2 | -60.7 | 177.5 | 0 | 0 | 0 | 108.5 | K119 F120 I121 V125 A130 | K119-I123 WeakPolarHBondContact O-CG1 3.44Å; K119-I123 PolarHBondContact O-N 3.44Å; F120-I123 HydrophobicContact CB-CD1 4.48Å; F120-I123 HydrophobicContact CD1-CD1 3.8Å; F120-I123 WeakPolarHBondContact O-CB 3.27Å; F120-I123 PolarHBondContact O-N 2.86Å; I121-I123 VanDerWaalsContact C-N 3.3Å; I121-I123 PolarHBondContact O-N 3.15Å; I123-V125 PolarHBondContact O-N 3.48Å; I123-A130 HydrophobicContact CG2-CB 3.63Å |
| 124 | P | 74.7 | Confident | 84.4 | Confident | 75 Ų | 75 | 44.3 Ų | 44.3 | 49% | 0.487 | 23% | 0.23 | S | C | . | . | trans | -56 | 133.7 | 172.4 | -21 | 31.4 | 0 | 0 | 0 | 109.9 | Q122 D126 | Q122-P124 WeakPolarHBondContact O-CD 3.35Å; P124-D126 PolarHBondContact O-N 3.31Å; P124-D126 VanDerWaalsContact O-OD1 3.09Å | ||
| 125 | V | 70.9 | Confident | 84.3 | Confident | 61 Ų | 61 | 45.4 Ų | 45.4 | 37% | 0.37 | 24% | 0.243 | S | C | . | . | S | Bend | trans | -84.6 | 71.6 | -177.5 | -168 | 0 | 0 | 0 | 0 | 109.1 | I123 I131 K134 | I123-V125 PolarHBondContact O-N 3.48Å; V125-I131 HydrophobicContact CG1-CB 4.4Å; V125-I131 HydrophobicContact CG1-CD1 3.95Å; V125-I131 HydrophobicContact CG1-CG1 3.19Å; V125-K134 HydrophobicContact CG2-CD 4.15Å |
| 126 | D | 69.4 | Low | 84.4 | Confident | 116 Ų | 116 | 42.3 Ų | 42.3 | 62% | 0.62 | 23% | 0.228 | S | C | * | . | trans | -111.2 | -13.3 | -176.2 | 56.4 | 3.6 | 0 | 0 | 0 | 113.7 | P124 | P124-D126 PolarHBondContact O-N 3.31Å; P124-D126 VanDerWaalsContact O-OD1 3.09Å | ||
| 127 | S | 72.7 | Confident | 84.5 | Confident | 45 Ų | 45 | 42 Ų | 42 | 32% | 0.315 | 23% | 0.227 | S | C | . | . | S | Bend | trans | -134.9 | 154.3 | 178.4 | 64.1 | 0 | 0 | 0 | 0 | 112.3 | Q129 A130 I131 | S127-Q129 PolarHBondContact O-N 3.42Å; S127-A130 WeakPolarHBondContact O-CB 3.5Å; S127-A130 PolarHBondContact O-N 3.4Å; S127-A130 VanDerWaalsContact O-N 3.15Å; S127-A130 WeakPolarHBondContact OG-CB 3.3Å; S127-A130 PolarHBondContact OG-N 2.82Å; S127-I131 PolarHBondContact O-N 3.26Å; S127-I131 VanDerWaalsContact O-N 3.11Å |
| 128 | N | 70.6 | Confident | 84.5 | Confident | 58 Ų | 58 | 42.7 Ų | 42.7 | 31% | 0.31 | 23% | 0.231 | S | C | . | . | H | α-helix | trans | -58.9 | -34.6 | 173.8 | -81.6 | -5.2 | 0 | 0 | 0 | 112.2 | I131 Q132 G523 | N128-I131 PolarHBondContact O-N 3.15Å; N128-Q132 WeakPolarHBondContact O-CG 3.48Å; N128-Q132 PolarHBondContact O-N 3.08Å; N128-G523 PolarHBondContact OD1-O 3.01Å |
| 129 | Q | 83.1 | Confident | 84.5 | Confident | 58 Ų | 58 | 47.9 Ų | 47.9 | 27% | 0.271 | 25% | 0.253 | S | S | . | . | H | α-helix | trans | -62.4 | -46.5 | 175.7 | -71 | 180 | -13.1 | 0 | 0 | 111.3 | F80 S127 I131 Q132 L133 | F80-Q129 HydrophobicContact CB-CG 4.44Å; F80-Q129 HydrophobicContact CD1-CG 4.03Å; F80-Q129 HydrophobicContact CD2-CB 3.48Å; F80-Q129 VanDerWaalsContact CD2-CB 3.48Å; F80-Q129 HydrophobicContact CD2-CG 3.61Å; F80-Q129 HydrophobicContact CE1-CG 4.19Å; F80-Q129 VanDerWaalsContact CE2-CA 3.48Å; F80-Q129 HydrophobicContact CE2-CB 3.63Å; F80-Q129 HydrophobicContact CE2-CG 3.78Å; F80-Q129 HydrophobicContact CG-CB 4.1Å; F80-Q129 HydrophobicContact CG-CG 3.74Å; F80-Q129 HydrophobicContact CZ-CB 4.36Å; F80-Q129 HydrophobicContact CZ-CG 4.06Å; S127-Q129 PolarHBondContact O-N 3.42Å; Q129-I131 VanDerWaalsContact C-N 3.34Å; Q129-I131 PolarHBondContact O-N 2.66Å; Q129-Q132 PolarHBondContact O-N 3.49Å; Q129-L133 WeakPolarHBondContact O-CG 3.21Å; Q129-L133 PolarHBondContact O-N 3.3Å |
| 130 | A | 82.6 | Confident | 84.6 | Confident | 5 Ų | 5 | 43.3 Ų | 43.3 | 4% | 0.041 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -60.1 | -41.7 | 175.9 | 0 | 0 | 0 | 0 | 0 | 112.4 | I123 S127 L133 K134 | I123-A130 HydrophobicContact CG2-CB 3.63Å; S127-A130 WeakPolarHBondContact O-CB 3.5Å; S127-A130 PolarHBondContact O-N 3.4Å; S127-A130 VanDerWaalsContact O-N 3.15Å; S127-A130 WeakPolarHBondContact OG-CB 3.3Å; S127-A130 PolarHBondContact OG-N 2.82Å; A130-L133 PolarHBondContact O-N 2.98Å; A130-K134 WeakPolarHBondContact O-CB 3.46Å; A130-K134 PolarHBondContact O-N 2.57Å |
| 131 | I | 78.1 | Confident | 84.6 | Confident | 48 Ų | 48 | 43.1 Ų | 43.1 | 25% | 0.246 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -59.1 | -50.1 | 176.2 | -65 | 165.7 | 0 | 0 | 0 | 110.8 | V125 S127 N128 Q129 L133 K134 G135 | V125-I131 HydrophobicContact CG1-CB 4.4Å; V125-I131 HydrophobicContact CG1-CD1 3.95Å; V125-I131 HydrophobicContact CG1-CG1 3.19Å; S127-I131 PolarHBondContact O-N 3.26Å; S127-I131 VanDerWaalsContact O-N 3.11Å; N128-I131 PolarHBondContact O-N 3.15Å; Q129-I131 VanDerWaalsContact C-N 3.34Å; Q129-I131 PolarHBondContact O-N 2.66Å; I131-L133 PolarHBondContact O-N 2.82Å; I131-K134 PolarHBondContact O-N 3.42Å; I131-G135 PolarHBondContact O-N 3.14Å |
| 132 | Q | 86.6 | Confident | 84.7 | Confident | 87 Ų | 87 | 46.9 Ų | 46.9 | 41% | 0.407 | 25% | 0.247 | S | C | . | . | H | α-helix | trans | -64 | -42.8 | -177.8 | -72.1 | -174.3 | 34.7 | 0 | 0 | 112 | F80 N128 Q129 G135 K136 | F80-Q132 HydrophobicContact CE2-CB 4.21Å; F80-Q132 HydrophobicContact CZ-CB 4.29Å; N128-Q132 WeakPolarHBondContact O-CG 3.48Å; N128-Q132 PolarHBondContact O-N 3.08Å; Q129-Q132 PolarHBondContact O-N 3.49Å; Q132-G135 PolarHBondContact O-N 3.16Å; Q132-K136 WeakPolarHBondContact O-CG 3.42Å; Q132-K136 PolarHBondContact O-N 3.34Å |
| 133 | L | 92.1 | Very high | 84.8 | Confident | 9 Ų | 9 | 44.3 Ų | 44.3 | 5% | 0.047 | 24% | 0.239 | C | C | . | . | H | α-helix | trans | -62.6 | -44.3 | 176.6 | -71.1 | 174.3 | 0 | 0 | 0 | 111.7 | F80 Q83 L87 F120 Q129 A130 I131 G135 K136 A137 | F80-L133 HydrophobicContact CD2-CD1 4.01Å; F80-L133 HydrophobicContact CD2-CD2 4.23Å; F80-L133 HydrophobicContact CD2-CG 3.93Å; F80-L133 HydrophobicContact CE2-CD2 4.35Å; F80-L133 HydrophobicContact CE2-CG 4Å; Q83-L133 HydrophobicContact CB-CD2 3.66Å; Q83-L133 VanDerWaalsContact OE1-CD1 3.31Å; L87-L133 HydrophobicContact CD1-CD2 3.91Å; F120-L133 HydrophobicContact CD1-CB 4.16Å; F120-L133 HydrophobicContact CD1-CD1 4.48Å; F120-L133 HydrophobicContact CE1-CD1 4.45Å; Q129-L133 WeakPolarHBondContact O-CG 3.21Å; Q129-L133 PolarHBondContact O-N 3.3Å; A130-L133 PolarHBondContact O-N 2.98Å; I131-L133 PolarHBondContact O-N 2.82Å; L133-G135 VanDerWaalsContact C-N 3.33Å; L133-G135 PolarHBondContact O-N 2.86Å; L133-K136 PolarHBondContact O-N 2.96Å; L133-A137 VanDerWaalsContact O-CB 3.31Å; L133-A137 WeakPolarHBondContact O-CB 3.21Å; L133-A137 PolarHBondContact O-N 3.08Å |
| 134 | K | 92.2 | Very high | 85 | Confident | 23 Ų | 23 | 42 Ų | 42 | 10% | 0.1 | 23% | 0.227 | C | C | . | . | H | α-helix | trans | -61.2 | -42.5 | 175.5 | -174.2 | 167.2 | -177 | 156.5 | 0 | 111.5 | I121 V125 A130 I131 A137 S138 E187 Y191 | I121-K134 HydrophobicContact CD1-CG 4.01Å; I121-K134 WeakPolarHBondContact O-CE 3.5Å; I121-K134 PolarHBondContact O-NZ 2.92Å; V125-K134 HydrophobicContact CG2-CD 4.15Å; A130-K134 WeakPolarHBondContact O-CB 3.46Å; A130-K134 PolarHBondContact O-N 2.57Å; I131-K134 PolarHBondContact O-N 3.42Å; K134-A137 PolarHBondContact O-N 3.4Å; K134-S138 WeakPolarHBondContact O-CB 3.49Å; K134-S138 PolarHBondContact O-N 2.97Å; K134-E187 IonicContact NZ-OE2 3.2Å; K134-Y191 WeakPolarHBondContact CE-OH 3.29Å |
| 135 | G | 88.8 | Confident | 85.7 | Confident | 30 Ų | 30 | 38.5 Ų | 38.5 | 31% | 0.309 | 20% | 0.204 | S | C | . | . | H | α-helix | trans | -59 | -51.1 | 174.5 | 0 | 0 | 0 | 0 | 0 | 112.5 | I131 Q132 L133 S138 K139 | I131-G135 PolarHBondContact O-N 3.14Å; Q132-G135 PolarHBondContact O-N 3.16Å; L133-G135 VanDerWaalsContact C-N 3.33Å; L133-G135 PolarHBondContact O-N 2.86Å; G135-S138 PolarHBondContact O-N 3.45Å; G135-S138 PolarHBondContact O-OG 2.81Å; G135-K139 PolarHBondContact O-N 3.26Å |
| 136 | K | 92.8 | Very high | 86.5 | Confident | 40 Ų | 40 | 40.7 Ų | 40.7 | 17% | 0.174 | 21% | 0.213 | C | C | . | . | H | α-helix | trans | -62.5 | -45 | 177.5 | -69.6 | 176.3 | -173.8 | -78.8 | 0 | 112 | C84 L87 D88 Q132 L133 S138 K139 V140 | C84-K136 HydrophobicContact CB-CD 4.14Å; L87-K136 HydrophobicContact CB-CB 3.93Å; L87-K136 HydrophobicContact CB-CD 4.45Å; L87-K136 HydrophobicContact CD1-CB 3.94Å; D88-K136 WeakPolarHBondContact OD1-CD 3.49Å; D88-K136 IonicContact OD1-NZ 3.5Å; D88-K136 PolarHBondContact OD1-NZ 3.43Å; D88-K136 IonicContact OD2-NZ 3.9Å; D88-K136 PolarHBondContact OD2-NZ 3.11Å; Q132-K136 WeakPolarHBondContact O-CG 3.42Å; Q132-K136 PolarHBondContact O-N 3.34Å; L133-K136 PolarHBondContact O-N 2.96Å; K136-S138 VanDerWaalsContact C-N 3.28Å; K136-S138 PolarHBondContact O-N 3.34Å; K136-K139 PolarHBondContact O-N 3.32Å; K136-K139 VanDerWaalsContact O-N 3.16Å; K136-V140 PolarHBondContact O-N 2.79Å; K136-V140 VanDerWaalsContact O-N 3.14Å |
| 137 | A | 94.3 | Very high | 87 | Confident | 0 Ų | 0 | 37.6 Ų | 37.6 | 0% | 0 | 20% | 0.2 | C | C | . | . | H | α-helix | trans | -60.1 | -37.3 | 176.6 | 0 | 0 | 0 | 0 | 0 | 112.7 | M117 F120 I121 L133 K134 K139 V140 L141 | M117-A137 HydrophobicContact SD-CB 3.83Å; F120-A137 HydrophobicContact CB-CB 3.59Å; F120-A137 HydrophobicContact CD2-CB 4.4Å; F120-A137 HydrophobicContact CG-CB 4.22Å; I121-A137 HydrophobicContact CD1-CB 4.39Å; L133-A137 VanDerWaalsContact O-CB 3.31Å; L133-A137 WeakPolarHBondContact O-CB 3.21Å; L133-A137 PolarHBondContact O-N 3.08Å; K134-A137 PolarHBondContact O-N 3.4Å; A137-K139 VanDerWaalsContact C-N 3.34Å; A137-K139 PolarHBondContact O-N 2.75Å; A137-V140 PolarHBondContact O-N 3.38Å; A137-L141 PolarHBondContact O-N 3.36Å |
| 138 | S | 92.7 | Very high | 87.6 | Confident | 13 Ų | 13 | 36.9 Ų | 36.9 | 9% | 0.091 | 20% | 0.195 | C | C | . | . | H | α-helix | trans | -63.5 | -37.8 | 176.4 | 74.3 | 0 | 0 | 0 | 0 | 113 | K134 G135 K136 L141 Y142 Y191 | K134-S138 WeakPolarHBondContact O-CB 3.49Å; K134-S138 PolarHBondContact O-N 2.97Å; G135-S138 PolarHBondContact O-N 3.45Å; G135-S138 PolarHBondContact O-OG 2.81Å; K136-S138 VanDerWaalsContact C-N 3.28Å; K136-S138 PolarHBondContact O-N 3.34Å; S138-L141 PolarHBondContact O-N 2.93Å; S138-Y142 PolarHBondContact O-N 3.24Å; S138-Y191 VanDerWaalsContact CB-CD1 3.46Å |
| 139 | K | 91.7 | Very high | 88.6 | Confident | 114 Ų | 114 | 35.7 Ų | 35.7 | 50% | 0.496 | 19% | 0.187 | S | C | . | . | H | α-helix | trans | -69 | -38.3 | 176.2 | -64.6 | -175.7 | -178.8 | -177.5 | 0 | 112.3 | E91 G135 K136 A137 Y142 G143 | E91-K139 HydrophobicContact CG-CB 4.13Å; E91-K139 VanDerWaalsContact OE1-CD 3.22Å; E91-K139 WeakPolarHBondContact OE1-CD 3.41Å; E91-K139 IonicContact OE1-NZ 2.76Å; E91-K139 WeakPolarHBondContact OE2-CD 3.43Å; G135-K139 PolarHBondContact O-N 3.26Å; K136-K139 PolarHBondContact O-N 3.32Å; K136-K139 VanDerWaalsContact O-N 3.16Å; A137-K139 VanDerWaalsContact C-N 3.34Å; A137-K139 PolarHBondContact O-N 2.75Å; K139-Y142 PolarHBondContact O-N 3.01Å; K139-G143 PolarHBondContact O-N 3.45Å |
| 140 | V | 92.7 | Very high | 88.9 | Confident | 0 Ų | 0 | 37.9 Ų | 37.9 | 0% | 0 | 20% | 0.201 | C | C | . | . | H | α-helix | trans | -60.2 | -45.9 | 172.4 | 175.1 | 0 | 0 | 0 | 0 | 110.4 | L90 E91 L94 I113 M117 K136 A137 Y142 G143 L144 | L90-V140 HydrophobicContact CB-CG1 4.46Å; L90-V140 HydrophobicContact CB-CG2 4.2Å; E91-V140 HydrophobicContact CB-CG2 4.11Å; L94-V140 HydrophobicContact CD1-CB 4.48Å; L94-V140 HydrophobicContact CD1-CG1 3.7Å; I113-V140 HydrophobicContact CD1-CG1 3.94Å; I113-V140 HydrophobicContact CG1-CG1 4.35Å; M117-V140 HydrophobicContact CE-CG1 4.43Å; M117-V140 HydrophobicContact CG-CB 4.36Å; M117-V140 HydrophobicContact CG-CG1 3.94Å; M117-V140 HydrophobicContact SD-CB 3.76Å; M117-V140 HydrophobicContact SD-CG1 3.64Å; M117-V140 HydrophobicContact SD-CG2 4.3Å; K136-V140 PolarHBondContact O-N 2.79Å; K136-V140 VanDerWaalsContact O-N 3.14Å; A137-V140 PolarHBondContact O-N 3.38Å; V140-Y142 PolarHBondContact O-N 2.68Å; V140-G143 PolarHBondContact O-N 3.25Å; V140-L144 VanDerWaalsContact O-CB 3.26Å; V140-L144 WeakPolarHBondContact O-CB 3.3Å; V140-L144 PolarHBondContact O-N 3.13Å |
| 141 | L | 92 | Very high | 89.1 | Confident | 0 Ų | 0 | 39.6 Ų | 39.6 | 0% | 0 | 21% | 0.209 | C | C | . | . | H | α-helix | trans | -60.8 | -42.7 | 174.9 | -77.7 | 169.4 | 0 | 0 | 0 | 112.5 | V114 M117 I121 A137 S138 L144 S145 L188 Y191 | V114-L141 HydrophobicContact CG2-CD2 4.41Å; M117-L141 HydrophobicContact CB-CD1 3.98Å; M117-L141 HydrophobicContact CB-CD2 3.82Å; M117-L141 HydrophobicContact CB-CG 3.71Å; M117-L141 HydrophobicContact CG-CD2 4.2Å; M117-L141 HydrophobicContact CG-CG 4.03Å; I121-L141 HydrophobicContact CD1-CD1 4.2Å; I121-L141 HydrophobicContact CG1-CD1 3.93Å; A137-L141 PolarHBondContact O-N 3.36Å; S138-L141 PolarHBondContact O-N 2.93Å; L141-L144 PolarHBondContact O-N 3.17Å; L141-S145 WeakPolarHBondContact O-CB 3.34Å; L141-S145 PolarHBondContact O-N 3.06Å; L141-S145 PolarHBondContact O-OG 3.35Å; L141-L188 HydrophobicContact CD1-CD2 3.89Å; L141-L188 HydrophobicContact CD2-CD2 4.13Å; L141-Y191 HydrophobicContact CD1-CD2 4.5Å |
| 142 | Y | 91.5 | Very high | 89.6 | Confident | 81 Ų | 81 | 37.4 Ų | 37.4 | 32% | 0.318 | 20% | 0.198 | S | C | . | . | H | α-helix | trans | -61.1 | -53.1 | 177.3 | -176.1 | -90 | 0 | 0 | 0 | 111.3 | S138 K139 V140 L144 S145 I146 Y191 H193 | S138-Y142 PolarHBondContact O-N 3.24Å; K139-Y142 PolarHBondContact O-N 3.01Å; V140-Y142 PolarHBondContact O-N 2.68Å; Y142-L144 VanDerWaalsContact C-N 3.3Å; Y142-L144 PolarHBondContact O-N 3.32Å; Y142-S145 PolarHBondContact O-N 2.88Å; Y142-S145 VanDerWaalsContact O-N 3.11Å; Y142-S145 PolarHBondContact O-OG 2.97Å; Y142-I146 HydrophobicContact CD1-CD1 4.3Å; Y142-I146 HydrophobicContact CE1-CD1 4.01Å; Y142-I146 PolarHBondContact O-N 2.82Å; Y142-Y191 VanDerWaalsContact CA-O 3.3Å; Y142-Y191 WeakPolarHBondContact CA-O 3.43Å; Y142-Y191 WeakPolarHBondContact CB-O 3.48Å; Y142-Y191 PolarHBondContact N-O 2.97Å; Y142-H193 HydrophobicContact CD2-CB 4.38Å; Y142-H193 HydrophobicContact CE2-CB 4.1Å; Y142-H193 AromaticContact CZ-CD2 3.78Å; Y142-H193 PolarHBondContact OH-CD2 3.11Å |
| 143 | G | 87.7 | Confident | 89.9 | Confident | 13 Ų | 13 | 33.6 Ų | 33.6 | 13% | 0.134 | 18% | 0.18 | C | C | . | . | H | α-helix | trans | -58.2 | -41.5 | 178.5 | 0 | 0 | 0 | 0 | 0 | 112.7 | K139 V140 S145 I146 | K139-G143 PolarHBondContact O-N 3.45Å; V140-G143 PolarHBondContact O-N 3.25Å; G143-S145 PolarHBondContact O-N 3.46Å; G143-I146 PolarHBondContact O-N 3.4Å |
| 144 | L | 88.8 | Confident | 89.9 | Confident | 6 Ų | 6 | 36.4 Ų | 36.4 | 3% | 0.031 | 20% | 0.2 | C | C | . | . | H | α-helix | trans | -65.2 | -36.8 | 176.6 | -170.6 | 71.3 | 0 | 0 | 0 | 113.1 | L94 V110 I113 V114 V140 L141 Y142 I146 S147 S148 I152 | L94-L144 HydrophobicContact CD1-CB 4.35Å; L94-L144 HydrophobicContact CD2-CB 4.42Å; L94-L144 HydrophobicContact CD2-CD1 3.81Å; V110-L144 HydrophobicContact CG1-CD1 4.21Å; V110-L144 HydrophobicContact CG1-CD2 3.98Å; V110-L144 HydrophobicContact CG1-CG 4.16Å; V110-L144 HydrophobicContact CG2-CD1 4.03Å; I113-L144 HydrophobicContact CG2-CD1 4.13Å; I113-L144 HydrophobicContact CG2-CD2 3.42Å; I113-L144 VanDerWaalsContact CG2-CD2 3.42Å; I113-L144 HydrophobicContact CG2-CG 4.43Å; V114-L144 HydrophobicContact CG2-CD2 3.57Å; V140-L144 VanDerWaalsContact O-CB 3.26Å; V140-L144 WeakPolarHBondContact O-CB 3.3Å; V140-L144 PolarHBondContact O-N 3.13Å; L141-L144 PolarHBondContact O-N 3.17Å; Y142-L144 VanDerWaalsContact C-N 3.3Å; Y142-L144 PolarHBondContact O-N 3.32Å; L144-I146 PolarHBondContact O-N 3Å; L144-S147 PolarHBondContact O-N 3.09Å; L144-S147 PolarHBondContact O-OG 3.23Å; L144-S148 PolarHBondContact O-N 3.15Å; L144-I152 HydrophobicContact CD2-CD1 4.13Å; L144-I152 HydrophobicContact CG-CD1 4.33Å |
| 145 | S | 89.5 | Confident | 89.8 | Confident | 1 Ų | 1 | 39.4 Ų | 39.4 | 1% | 0.007 | 21% | 0.211 | C | C | . | . | H | α-helix | trans | -69.7 | -21 | -177.7 | 69.7 | 0 | 0 | 0 | 0 | 113.8 | L141 Y142 G143 S147 F149 H193 | L141-S145 WeakPolarHBondContact O-CB 3.34Å; L141-S145 PolarHBondContact O-N 3.06Å; L141-S145 PolarHBondContact O-OG 3.35Å; Y142-S145 PolarHBondContact O-N 2.88Å; Y142-S145 VanDerWaalsContact O-N 3.11Å; Y142-S145 PolarHBondContact O-OG 2.97Å; G143-S145 PolarHBondContact O-N 3.46Å; S145-S147 VanDerWaalsContact C-N 3.34Å; S145-F149 VanDerWaalsContact O-CA 3.31Å; S145-F149 WeakPolarHBondContact O-CA 3.39Å; S145-F149 WeakPolarHBondContact O-CB 3.27Å; S145-F149 PolarHBondContact O-N 2.65Å; S145-F149 VanDerWaalsContact O-N 3.13Å; S145-H193 VanDerWaalsContact OG-CB 3.27Å; S145-H193 WeakPolarHBondContact OG-CB 3.29Å; S145-H193 PolarHBondContact OG-N 3.01Å |
| 146 | I | 86.2 | Confident | 90 | Very high | 107 Ų | 107 | 38 Ų | 38 | 55% | 0.549 | 20% | 0.196 | S | C | . | . | H | α-helix | trans | -64.6 | -40.7 | 175.6 | -63.3 | 170.5 | 0 | 0 | 0 | 110.6 | Y142 G143 L144 H193 | Y142-I146 HydrophobicContact CD1-CD1 4.3Å; Y142-I146 HydrophobicContact CE1-CD1 4.01Å; Y142-I146 PolarHBondContact O-N 2.82Å; G143-I146 PolarHBondContact O-N 3.4Å; L144-I146 PolarHBondContact O-N 3Å; I146-H193 HydrophobicContact CG1-CB 4.12Å |
| 147 | S | 81 | Confident | 90 | Very high | 51 Ų | 51 | 37.1 Ų | 37.1 | 36% | 0.357 | 19% | 0.194 | S | C | . | . | H | α-helix | trans | -92.5 | -27.8 | -179.1 | 56.1 | 0 | 0 | 0 | 0 | 113.6 | Q98 L144 S145 | Q98-S147 PolarHBondContact NE2-OG 3.39Å; Q98-S147 PolarHBondContact OE1-OG 3.02Å; L144-S147 PolarHBondContact O-N 3.09Å; L144-S147 PolarHBondContact O-OG 3.23Å; S145-S147 VanDerWaalsContact C-N 3.34Å |
| 148 | S | 85.7 | Confident | 89.8 | Confident | 30 Ų | 30 | 44.2 Ų | 44.2 | 21% | 0.21 | 23% | 0.226 | C | C | . | . | H | α-helix | trans | -130.1 | 40.2 | -171 | -55.6 | 0 | 0 | 0 | 0 | 113.6 | L144 D150 L151 | L144-S148 PolarHBondContact O-N 3.15Å; S148-D150 PolarHBondContact O-N 3.33Å; S148-L151 PolarHBondContact O-N 3.45Å |
| 149 | F | 89.6 | Confident | 89.5 | Confident | 34 Ų | 34 | 45.8 Ų | 45.8 | 15% | 0.149 | 23% | 0.229 | C | C | . | . | H | α-helix | trans | -52 | -54.2 | -177.1 | -179.3 | -95.5 | 0 | 0 | 0 | 113.5 | S145 L151 I152 F153 I192 H193 F194 A198 | S145-F149 VanDerWaalsContact O-CA 3.31Å; S145-F149 WeakPolarHBondContact O-CA 3.39Å; S145-F149 WeakPolarHBondContact O-CB 3.27Å; S145-F149 PolarHBondContact O-N 2.65Å; S145-F149 VanDerWaalsContact O-N 3.13Å; F149-L151 PolarHBondContact O-N 3.46Å; F149-I152 PolarHBondContact O-N 2.97Å; F149-F153 HydrophobicContact CD1-CB 4Å; F149-F153 HydrophobicContact CD1-CG 4.38Å; F149-F153 HydrophobicContact CE1-CB 3.62Å; F149-F153 HydrophobicContact CE1-CD1 4.07Å; F149-F153 AromaticContact CE1-CD2 3.75Å; F149-F153 HydrophobicContact CE1-CD2 3.75Å; F149-F153 HydrophobicContact CE1-CE2 4.43Å; F149-F153 AromaticContact CE1-CG 3.53Å; F149-F153 HydrophobicContact CE1-CG 3.53Å; F149-F153 HydrophobicContact CE2-CD2 4.26Å; F149-F153 HydrophobicContact CZ-CB 3.9Å; F149-F153 AromaticContact CZ-CD2 3.38Å; F149-F153 HydrophobicContact CZ-CD2 3.38Å; F149-F153 HydrophobicContact CZ-CE2 4.01Å; F149-F153 AromaticContact CZ-CG 3.69Å; F149-F153 HydrophobicContact CZ-CG 3.69Å; F149-F153 WeakPolarHBondContact O-CB 3.37Å; F149-F153 PolarHBondContact O-N 3.16Å; F149-I192 HydrophobicContact CE2-CD1 3.97Å; F149-H193 WeakPolarHBondContact CD2-O 3.5Å; F149-H193 WeakPolarHBondContact CE2-O 3.43Å; F149-F194 HydrophobicContact CE2-CD1 4.14Å; F149-F194 AromaticContact CE2-CE1 3.99Å; F149-F194 HydrophobicContact CE2-CE1 3.99Å; F149-F194 HydrophobicContact CZ-CD1 4.25Å; F149-F194 AromaticContact CZ-CE1 3.91Å; F149-F194 HydrophobicContact CZ-CE1 3.91Å; F149-A198 HydrophobicContact CE1-CB 4.12Å; F149-A198 HydrophobicContact CE2-CB 3.96Å; F149-A198 HydrophobicContact CZ-CB 3.6Å |
| 150 | D | 89.5 | Confident | 89.4 | Confident | 104 Ų | 104 | 40.3 Ų | 40.3 | 56% | 0.556 | 21% | 0.206 | S | C | * | . | H | α-helix | trans | -61.6 | -32.4 | -171.5 | -75.9 | -50.4 | 0 | 0 | 0 | 112.8 | S148 S154 K201 | S148-D150 PolarHBondContact O-N 3.33Å; D150-S154 VanDerWaalsContact O-CB 3.28Å; D150-S154 WeakPolarHBondContact O-CB 3.35Å; D150-S154 PolarHBondContact O-N 3.3Å; D150-K201 IonicContact OD1-NZ 3.99Å; D150-K201 PolarHBondContact OD1-NZ 2.93Å |
| 151 | L | 87.2 | Confident | 89.2 | Confident | 41 Ų | 41 | 45.6 Ų | 45.6 | 22% | 0.215 | 23% | 0.229 | C | C | . | . | H | α-helix | trans | -65.2 | -50.3 | 177.7 | -167.3 | 90.5 | 0 | 0 | 0 | 110.9 | E107 V110 K111 S148 F149 S154 | E107-L151 HydrophobicContact CG-CD1 3.91Å; V110-L151 HydrophobicContact CB-CD2 3.91Å; V110-L151 HydrophobicContact CG1-CD2 3.33Å; K111-L151 HydrophobicContact CG-CD2 3.89Å; S148-L151 PolarHBondContact O-N 3.45Å; F149-L151 PolarHBondContact O-N 3.46Å; L151-S154 PolarHBondContact O-OG 3.29Å |
| 152 | I | 89.7 | Confident | 88.9 | Confident | 2 Ų | 2 | 46.7 Ų | 46.7 | 1% | 0.01 | 24% | 0.236 | C | C | . | . | H | α-helix | trans | -69 | -41.6 | 179.9 | -51.2 | 175.4 | 0 | 0 | 0 | 110 | V114 L144 F149 S154 R155 I156 L188 I192 | V114-I152 HydrophobicContact CG2-CD1 4.09Å; V114-I152 HydrophobicContact CG2-CG1 3.95Å; L144-I152 HydrophobicContact CD2-CD1 4.13Å; L144-I152 HydrophobicContact CG-CD1 4.33Å; F149-I152 PolarHBondContact O-N 2.97Å; I152-S154 VanDerWaalsContact C-N 3.33Å; I152-S154 PolarHBondContact O-N 2.99Å; I152-R155 WeakPolarHBondContact O-CB 3.41Å; I152-R155 PolarHBondContact O-N 2.99Å; I152-R155 VanDerWaalsContact O-N 3.17Å; I152-I156 PolarHBondContact O-N 3.23Å; I152-L188 HydrophobicContact CG2-CD1 4.23Å; I152-I192 HydrophobicContact CB-CG2 4.42Å; I152-I192 HydrophobicContact CD1-CG2 4.29Å; I152-I192 HydrophobicContact CG2-CG2 3.74Å |
| 153 | F | 93.1 | Very high | 88.6 | Confident | 6 Ų | 6 | 44.6 Ų | 44.6 | 3% | 0.026 | 23% | 0.23 | C | C | . | . | H | α-helix | trans | -61.6 | -37.9 | 178.8 | -171.3 | -103.3 | 0 | 0 | 0 | 112.6 | F149 R155 I156 V157 F194 K201 L202 E205 | F149-F153 HydrophobicContact CD1-CB 4Å; F149-F153 HydrophobicContact CD1-CG 4.38Å; F149-F153 HydrophobicContact CE1-CB 3.62Å; F149-F153 HydrophobicContact CE1-CD1 4.07Å; F149-F153 AromaticContact CE1-CD2 3.75Å; F149-F153 HydrophobicContact CE1-CD2 3.75Å; F149-F153 HydrophobicContact CE1-CE2 4.43Å; F149-F153 AromaticContact CE1-CG 3.53Å; F149-F153 HydrophobicContact CE1-CG 3.53Å; F149-F153 HydrophobicContact CE2-CD2 4.26Å; F149-F153 HydrophobicContact CZ-CB 3.9Å; F149-F153 AromaticContact CZ-CD2 3.38Å; F149-F153 HydrophobicContact CZ-CD2 3.38Å; F149-F153 HydrophobicContact CZ-CE2 4.01Å; F149-F153 AromaticContact CZ-CG 3.69Å; F149-F153 HydrophobicContact CZ-CG 3.69Å; F149-F153 WeakPolarHBondContact O-CB 3.37Å; F149-F153 PolarHBondContact O-N 3.16Å; F153-R155 PolarHBondContact O-N 3.47Å; F153-I156 WeakPolarHBondContact O-CB 3.29Å; F153-I156 PolarHBondContact O-N 3.42Å; F153-I156 VanDerWaalsContact O-N 3.13Å; F153-V157 HydrophobicContact CD1-CG2 3.74Å; F153-V157 HydrophobicContact CE1-CG2 3.36Å; F153-V157 HydrophobicContact CE2-CG2 4.5Å; F153-V157 HydrophobicContact CG-CG2 4.45Å; F153-V157 HydrophobicContact CZ-CG2 3.79Å; F153-V157 WeakPolarHBondContact O-CG2 3.07Å; F153-V157 PolarHBondContact O-N 3.37Å; F153-F194 HydrophobicContact CD2-CE1 4.38Å; F153-F194 HydrophobicContact CE2-CE1 4.18Å; F153-K201 HydrophobicContact CD1-CD 4.35Å; F153-K201 HydrophobicContact CE1-CD 3.77Å; F153-K201 HydrophobicContact CE1-CG 3.87Å; F153-K201 HydrophobicContact CZ-CB 4.47Å; F153-K201 HydrophobicContact CZ-CD 4.22Å; F153-K201 HydrophobicContact CZ-CG 3.97Å; F153-L202 HydrophobicContact CE2-CB 4.02Å; F153-L202 HydrophobicContact CE2-CD1 3.89Å; F153-L202 HydrophobicContact CZ-CB 4.37Å; F153-L202 HydrophobicContact CZ-CD1 4.49Å; F153-E205 HydrophobicContact CE1-CG 4.42Å; F153-E205 HydrophobicContact CZ-CG 4.33Å |
| 154 | S | 91.6 | Very high | 88.2 | Confident | 68 Ų | 68 | 44.8 Ų | 44.8 | 48% | 0.476 | 23% | 0.229 | S | C | . | . | H | α-helix | trans | -59.2 | -33.8 | 177.1 | 73.5 | 0 | 0 | 0 | 0 | 112.8 | D150 L151 I152 V157 F158 | D150-S154 VanDerWaalsContact O-CB 3.28Å; D150-S154 WeakPolarHBondContact O-CB 3.35Å; D150-S154 PolarHBondContact O-N 3.3Å; L151-S154 PolarHBondContact O-OG 3.29Å; I152-S154 VanDerWaalsContact C-N 3.33Å; I152-S154 PolarHBondContact O-N 2.99Å; S154-V157 PolarHBondContact O-N 2.76Å; S154-F158 WeakPolarHBondContact O-CB 3.46Å; S154-F158 PolarHBondContact O-N 2.89Å |
| 155 | R | 90.4 | Very high | 87.7 | Confident | 86 Ų | 86 | 48.6 Ų | 48.6 | 33% | 0.325 | 25% | 0.253 | S | S | . | . | H | α-helix | trans | -69.1 | -40.7 | 177 | -167.4 | 169.6 | 170.3 | 175.9 | -9.3 | 111.6 | I152 F153 F158 R159 D185 | I152-R155 WeakPolarHBondContact O-CB 3.41Å; I152-R155 PolarHBondContact O-N 2.99Å; I152-R155 VanDerWaalsContact O-N 3.17Å; F153-R155 PolarHBondContact O-N 3.47Å; R155-F158 PolarHBondContact O-N 3.14Å; R155-R159 PolarHBondContact O-N 2.97Å; R155-R159 VanDerWaalsContact O-N 3.13Å; R155-D185 IonicContact CZ-OD1 3.77Å; R155-D185 IonicContact NE-OD1 3.54Å; R155-D185 PolarHBondContact NE-OD1 3.38Å; R155-D185 IonicContact NE-OD2 2.9Å; R155-D185 IonicContact NH2-OD1 3.94Å; R155-D185 PolarHBondContact NH2-OD1 3.4Å |
| 156 | I | 91.7 | Very high | 86.7 | Confident | 0 Ų | 0 | 51.8 Ų | 51.8 | 0% | 0 | 27% | 0.27 | C | S | . | . | H | α-helix | trans | -62.5 | -49.5 | 173.9 | -58.6 | 169.9 | 0 | 0 | 0 | 110.1 | I152 F153 F158 R159 L160 D185 L188 M189 I192 L202 | I152-I156 PolarHBondContact O-N 3.23Å; F153-I156 WeakPolarHBondContact O-CB 3.29Å; F153-I156 PolarHBondContact O-N 3.42Å; F153-I156 VanDerWaalsContact O-N 3.13Å; I156-F158 VanDerWaalsContact C-N 3.35Å; I156-F158 PolarHBondContact O-N 3.31Å; I156-R159 PolarHBondContact O-N 3.4Å; I156-R159 VanDerWaalsContact O-N 3.15Å; I156-L160 HydrophobicContact CG2-CD1 4.12Å; I156-L160 HydrophobicContact CG2-CG 4.43Å; I156-L160 WeakPolarHBondContact O-CG 3.35Å; I156-L160 PolarHBondContact O-N 2.66Å; I156-D185 WeakPolarHBondContact CG1-O 3.45Å; I156-L188 HydrophobicContact CD1-CB 4.14Å; I156-L188 HydrophobicContact CG1-CB 4.12Å; I156-M189 HydrophobicContact CD1-CB 4.02Å; I156-M189 HydrophobicContact CG2-CE 3.82Å; I156-I192 HydrophobicContact CD1-CD1 3.47Å; I156-I192 VanDerWaalsContact CD1-CD1 3.47Å; I156-I192 HydrophobicContact CD1-CG1 4.48Å; I156-L202 HydrophobicContact CG2-CD1 4.47Å |
| 157 | V | 92.6 | Very high | 85.2 | Confident | 22 Ų | 22 | 52.2 Ų | 52.2 | 13% | 0.133 | 28% | 0.278 | C | S | . | . | H | α-helix | trans | -60.7 | -43.5 | 179.5 | 173.4 | 0 | 0 | 0 | 0 | 111.6 | F153 S154 R159 L160 K161 E205 Y209 | F153-V157 HydrophobicContact CD1-CG2 3.74Å; F153-V157 HydrophobicContact CE1-CG2 3.36Å; F153-V157 HydrophobicContact CE2-CG2 4.5Å; F153-V157 HydrophobicContact CG-CG2 4.45Å; F153-V157 HydrophobicContact CZ-CG2 3.79Å; F153-V157 WeakPolarHBondContact O-CG2 3.07Å; F153-V157 PolarHBondContact O-N 3.37Å; S154-V157 PolarHBondContact O-N 2.76Å; V157-R159 VanDerWaalsContact C-N 3.27Å; V157-R159 PolarHBondContact O-N 3.06Å; V157-L160 PolarHBondContact O-N 3.28Å; V157-K161 PolarHBondContact O-N 3.5Å; V157-E205 HydrophobicContact CG2-CB 4.47Å; V157-E205 HydrophobicContact CG2-CG 4.08Å; V157-Y209 HydrophobicContact CG1-CE2 3.88Å |
| 158 | F | 90.3 | Very high | 83.6 | Confident | 150 Ų | 150 | 53.9 Ų | 53.9 | 66% | 0.658 | 29% | 0.289 | S | S | * | . | H | α-helix | trans | -57 | -43 | 175.8 | 179.9 | -96.5 | 0 | 0 | 0 | 111.5 | S154 R155 I156 K161 S162 | S154-F158 WeakPolarHBondContact O-CB 3.46Å; S154-F158 PolarHBondContact O-N 2.89Å; R155-F158 PolarHBondContact O-N 3.14Å; I156-F158 VanDerWaalsContact C-N 3.35Å; I156-F158 PolarHBondContact O-N 3.31Å; F158-K161 WeakPolarHBondContact O-CB 3.3Å; F158-K161 PolarHBondContact O-N 3.26Å; F158-S162 PolarHBondContact O-N 3.01Å |
| 159 | R | 87.7 | Confident | 81.3 | Confident | 45 Ų | 45 | 57.9 Ų | 57.9 | 17% | 0.17 | 32% | 0.317 | C | S | . | . | H | α-helix | trans | -70 | -40.5 | 178 | -169.6 | 65.7 | -172.7 | 160.5 | -1.3 | 112.9 | R155 I156 V157 K161 S162 M163 D182 D185 I186 | R155-R159 PolarHBondContact O-N 2.97Å; R155-R159 VanDerWaalsContact O-N 3.13Å; I156-R159 PolarHBondContact O-N 3.4Å; I156-R159 VanDerWaalsContact O-N 3.15Å; V157-R159 VanDerWaalsContact C-N 3.27Å; V157-R159 PolarHBondContact O-N 3.06Å; R159-K161 PolarHBondContact O-N 2.97Å; R159-S162 PolarHBondContact NH1-OG 2.84Å; R159-S162 PolarHBondContact O-N 3.27Å; R159-S162 PolarHBondContact O-OG 2.89Å; R159-M163 WeakPolarHBondContact O-CG 3.47Å; R159-M163 PolarHBondContact O-N 3.26Å; R159-D182 IonicContact CZ-OD2 2.9Å; R159-D182 PolarHBondContact NE-O 3.25Å; R159-D182 IonicContact NH1-OD2 2.79Å; R159-D182 VanDerWaalsContact NH2-CB 3.29Å; R159-D182 IonicContact NH2-OD2 3.78Å; R159-D182 PolarHBondContact NH2-OD2 2.95Å; R159-D185 HydrophobicContact CB-CB 4.14Å; R159-D185 HydrophobicContact CG-CB 4.13Å; R159-I186 HydrophobicContact CB-CD1 4.05Å; R159-I186 HydrophobicContact CG-CD1 3.75Å; R159-I186 HydrophobicContact CG-CG1 3.91Å |
| 160 | L | 89.1 | Confident | 78.9 | Confident | 0 Ų | 0 | 61.2 Ų | 61.2 | 0% | 0 | 34% | 0.34 | C | S | . | . | H | α-helix | trans | -57.7 | -41.1 | 173.9 | -71.4 | 170.9 | 0 | 0 | 0 | 111.4 | I156 V157 S164 I186 I206 Y209 P211 L220 | I156-L160 HydrophobicContact CG2-CD1 4.12Å; I156-L160 HydrophobicContact CG2-CG 4.43Å; I156-L160 WeakPolarHBondContact O-CG 3.35Å; I156-L160 PolarHBondContact O-N 2.66Å; V157-L160 PolarHBondContact O-N 3.28Å; L160-S164 PolarHBondContact O-N 2.81Å; L160-I186 HydrophobicContact CD2-CD1 3.95Å; L160-I186 HydrophobicContact CG-CD1 4.22Å; L160-I206 HydrophobicContact CD1-CG1 3.7Å; L160-I206 HydrophobicContact CD2-CG1 4.14Å; L160-Y209 HydrophobicContact CB-CD2 4.26Å; L160-P211 HydrophobicContact CD2-CG 4.15Å; L160-L220 HydrophobicContact CD2-CD1 3.84Å |
| 161 | K | 89 | Confident | 76 | Confident | 110 Ų | 110 | 61.7 Ų | 61.7 | 48% | 0.478 | 35% | 0.352 | S | S | . | . | H | α-helix | trans | -63.5 | -47 | 174.5 | -176.2 | 177.5 | 179.3 | -177 | 0 | 111.7 | V157 F158 R159 M163 S164 T165 Y209 | V157-K161 PolarHBondContact O-N 3.5Å; F158-K161 WeakPolarHBondContact O-CB 3.3Å; F158-K161 PolarHBondContact O-N 3.26Å; R159-K161 PolarHBondContact O-N 2.97Å; K161-M163 VanDerWaalsContact C-N 3.32Å; K161-M163 PolarHBondContact O-N 3.39Å; K161-S164 WeakPolarHBondContact O-CB 3.19Å; K161-S164 PolarHBondContact O-N 3.43Å; K161-S164 VanDerWaalsContact O-N 3.11Å; K161-S164 PolarHBondContact O-OG 3.43Å; K161-T165 PolarHBondContact O-N 2.92Å; K161-T165 PolarHBondContact O-OG1 2.82Å; K161-Y209 HydrophobicContact CB-CD1 3.91Å; K161-Y209 HydrophobicContact CB-CE1 3.7Å; K161-Y209 HydrophobicContact CB-CE2 4.32Å; K161-Y209 HydrophobicContact CB-CG 4.34Å; K161-Y209 HydrophobicContact CD-CE1 3.9Å; K161-Y209 HydrophobicContact CG-CD1 3.96Å; K161-Y209 HydrophobicContact CG-CE1 3.58Å |
| 162 | S | 84.9 | Confident | 73.4 | Confident | 23 Ų | 23 | 66.8 Ų | 66.8 | 16% | 0.161 | 38% | 0.378 | C | S | . | . | H | α-helix | trans | -62.2 | -39.8 | -179.6 | 72.8 | 0 | 0 | 0 | 0 | 112.2 | F158 R159 S164 T165 D166 | F158-S162 PolarHBondContact O-N 3.01Å; R159-S162 PolarHBondContact NH1-OG 2.84Å; R159-S162 PolarHBondContact O-N 3.27Å; R159-S162 PolarHBondContact O-OG 2.89Å; S162-S164 PolarHBondContact O-N 2.9Å; S162-T165 PolarHBondContact O-N 3.32Å; S162-T165 VanDerWaalsContact O-N 3.16Å; S162-T165 PolarHBondContact O-OG1 3.29Å; S162-D166 PolarHBondContact O-N 3.47Å |
| 163 | M | 84.4 | Confident | 70.5 | Confident | 37 Ų | 37 | 72.4 Ų | 72.4 | 18% | 0.182 | 42% | 0.418 | C | S | . | . | H | α-helix | trans | -61.2 | -28.5 | 176.2 | -70.1 | -179.9 | 71.5 | 0 | 0 | 113.3 | R159 K161 I186 P211 L220 | R159-M163 WeakPolarHBondContact O-CG 3.47Å; R159-M163 PolarHBondContact O-N 3.26Å; K161-M163 VanDerWaalsContact C-N 3.32Å; K161-M163 PolarHBondContact O-N 3.39Å; M163-I186 HydrophobicContact SD-CD1 3.9Å; M163-I186 HydrophobicContact SD-CG1 3.92Å; M163-P211 HydrophobicContact CB-CB 4Å; M163-L220 HydrophobicContact CE-CD2 4.42Å |
| 164 | S | 80.8 | Confident | 67.3 | Low | 17 Ų | 17 | 75 Ų | 75 | 12% | 0.119 | 45% | 0.447 | C | S | . | . | H | α-helix | trans | -76.2 | -28.6 | 177.6 | 73.7 | 0 | 0 | 0 | 0 | 113.9 | L160 K161 S162 Y209 | L160-S164 PolarHBondContact O-N 2.81Å; K161-S164 WeakPolarHBondContact O-CB 3.19Å; K161-S164 PolarHBondContact O-N 3.43Å; K161-S164 VanDerWaalsContact O-N 3.11Å; K161-S164 PolarHBondContact O-OG 3.43Å; S162-S164 PolarHBondContact O-N 2.9Å; S164-Y209 WeakPolarHBondContact CB-O 3.28Å |
| 165 | T | 77.8 | Confident | 64.2 | Low | 87 Ų | 87 | 79.2 Ų | 79.2 | 53% | 0.534 | 46% | 0.464 | S | S | . | . | H | α-helix | trans | -93.9 | -17.1 | -173.9 | 49.9 | 0 | 0 | 0 | 0 | 114.1 | K161 S162 T167 | K161-T165 PolarHBondContact O-N 2.92Å; K161-T165 PolarHBondContact O-OG1 2.82Å; S162-T165 PolarHBondContact O-N 3.32Å; S162-T165 VanDerWaalsContact O-N 3.16Å; S162-T165 PolarHBondContact O-OG1 3.29Å; T165-T167 PolarHBondContact O-N 2.91Å |
| 166 | D | 68 | Low | 61.4 | Low | 67 Ų | 67 | 84.3 Ų | 84.3 | 36% | 0.358 | 50% | 0.496 | S | S | . | . | trans | -67.7 | 95.5 | -179.5 | -78.2 | -10.8 | 0 | 0 | 0 | 111.9 | S162 K214 | S162-D166 PolarHBondContact O-N 3.47Å; D166-K214 IonicContact OD2-NZ 2.83Å | ||
| 167 | T | 54.5 | Low | 58.7 | Low | 116 Ų | 116 | 87.2 Ų | 87.2 | 71% | 0.712 | 52% | 0.521 | S | S | * | . | trans | -94.1 | 4.8 | 177.6 | 46.7 | 0 | 0 | 0 | 0 | 114.4 | T165 S169 | T165-T167 PolarHBondContact O-N 2.91Å; T167-S169 PolarHBondContact O-N 3.38Å | ||
| 168 | S | 48.2 | Very low | 56.1 | Low | 86 Ų | 86 | 92.7 Ų | 92.7 | 60% | 0.601 | 55% | 0.548 | S | S | * | . | trans | -81.8 | 89.8 | -176 | 46.2 | 0 | 0 | 0 | 0 | 112.6 | V170 | S168-V170 PolarHBondContact O-N 2.93Š| ||
| 169 | S | 37.6 | Very low | 53.7 | Low | 115 Ų | 115 | 87.5 Ų | 87.5 | 80% | 0.804 | 54% | 0.537 | S | S | * | . | trans | -67.7 | 71.9 | 147.6 | 58.7 | 0 | 0 | 0 | 0 | 109.2 | T167 | T167-S169 PolarHBondContact O-N 3.38Š| ||
| 170 | V | 37.8 | Very low | 51.7 | Low | 104 Ų | 104 | 90.8 Ų | 90.8 | 63% | 0.63 | 56% | 0.557 | S | S | * | * | trans | -107.3 | 94.1 | 161.2 | -179.2 | 0 | 0 | 0 | 0 | 106.5 | S168 L172 | S168-V170 PolarHBondContact O-N 2.93Å; V170-L172 VanDerWaalsContact C-N 3.26Å; V170-L172 HydrophobicContact CG1-CD1 4.23Å; V170-L172 HydrophobicContact CG1-CG 4.12Å; V170-L172 PolarHBondContact O-N 2.89Å | ||
| 171 | S | 29.6 | Very low | 50 | Low | 114 Ų | 114 | 92.4 Ų | 92.4 | 80% | 0.797 | 57% | 0.574 | S | S | * | * | trans | -57.6 | 90.6 | 159.2 | 50.5 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 172 | L | 32.4 | Very low | 48.6 | Very low | 147 Ų | 147 | 91.5 Ų | 91.5 | 77% | 0.77 | 57% | 0.574 | S | S | * | * | trans | -97.9 | 101 | 151.8 | -82.5 | 161.6 | 0 | 0 | 0 | 106.6 | V170 G174 | V170-L172 VanDerWaalsContact C-N 3.26Å; V170-L172 HydrophobicContact CG1-CD1 4.23Å; V170-L172 HydrophobicContact CG1-CG 4.12Å; V170-L172 PolarHBondContact O-N 2.89Å; L172-G174 PolarHBondContact O-N 3.45Å | ||
| 173 | S | 29 | Very low | 48.1 | Very low | 121 Ų | 121 | 92 Ų | 92 | 85% | 0.846 | 58% | 0.579 | S | S | * | * | trans | -52.7 | 113 | 160.7 | 46.3 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 174 | G | 26.7 | Very low | 48.2 | Very low | 61 Ų | 61 | 90.3 Ų | 90.3 | 63% | 0.629 | 57% | 0.571 | S | S | * | * | trans | 122.4 | 74.8 | 174.7 | 0 | 0 | 0 | 0 | 0 | 112.2 | L172 | L172-G174 PolarHBondContact O-N 3.45Š| ||
| 175 | D | 25.6 | Very low | 48.5 | Very low | 155 Ų | 155 | 90.7 Ų | 90.7 | 83% | 0.829 | 57% | 0.572 | S | S | * | * | trans | -171.8 | 123.2 | 134.9 | -92.6 | -24.7 | 0 | 0 | 0 | 109.7 | A177 | D175-A177 PolarHBondContact O-N 2.97Š| ||
| 176 | L | 32.6 | Very low | 49.1 | Very low | 193 Ų | 193 | 86.9 Ų | 86.9 | 100% | 1.01 | 55% | 0.548 | S | S | * | . | S | Bend | trans | -71.3 | 24.3 | 175.8 | -110 | 148.3 | 0 | 0 | 0 | 112.8 | ||
| 177 | A | 33.9 | Very low | 50.1 | Low | 62 Ų | 62 | 84.5 Ų | 84.5 | 51% | 0.512 | 54% | 0.535 | S | S | . | . | trans | -148.8 | 83.8 | -177.4 | 0 | 0 | 0 | 0 | 0 | 110.4 | D175 G179 | D175-A177 PolarHBondContact O-N 2.97Å; A177-G179 PolarHBondContact O-N 3.26Å | ||
| 178 | L | 38.1 | Very low | 51.8 | Low | 137 Ų | 137 | 79 Ų | 79 | 72% | 0.717 | 50% | 0.501 | S | S | * | . | S | Bend | trans | -55.6 | 112.4 | 148.1 | -85.3 | 160.7 | 0 | 0 | 0 | 105.8 | I180 N216 | L178-I180 PolarHBondContact O-N 3.38Å; L178-I180 VanDerWaalsContact O-N 3.17Å; L178-N216 HydrophobicContact CD1-CB 4.44Å; L178-N216 WeakPolarHBondContact CD1-ND2 3.48Å |
| 179 | G | 40.7 | Very low | 53.8 | Low | 40 Ų | 40 | 75 Ų | 75 | 41% | 0.412 | 47% | 0.473 | S | S | . | . | trans | -44.7 | 117.8 | -164.2 | 0 | 0 | 0 | 0 | 0 | 113.3 | A177 G181 D182 | A177-G179 PolarHBondContact O-N 3.26Å; G179-G181 PolarHBondContact O-N 3.23Å; G179-D182 WeakPolarHBondContact O-CB 3.38Å; G179-D182 PolarHBondContact O-N 3.2Å | ||
| 180 | I | 45.6 | Very low | 56.4 | Low | 114 Ų | 114 | 69.7 Ų | 69.7 | 59% | 0.585 | 44% | 0.436 | S | S | * | . | H | α-helix | trans | -53.2 | -27.1 | 176.3 | -63.8 | 165.5 | 0 | 0 | 0 | 111.2 | Q122 L178 D182 | Q122-I180 HydrophobicContact CB-CG2 4.37Å; Q122-I180 HydrophobicContact CG-CG2 4.49Å; L178-I180 PolarHBondContact O-N 3.38Å; L178-I180 VanDerWaalsContact O-N 3.17Å; I180-D182 PolarHBondContact O-N 3.19Å |
| 181 | G | 52 | Low | 58.9 | Low | 35 Ų | 35 | 65.2 Ų | 65.2 | 36% | 0.361 | 41% | 0.407 | S | S | . | . | H | α-helix | trans | -64.6 | -33.2 | 175.1 | 0 | 0 | 0 | 0 | 0 | 115.1 | G179 | G179-G181 PolarHBondContact O-N 3.23Å |
| 182 | D | 61 | Low | 61.9 | Low | 90 Ų | 90 | 59.9 Ų | 59.9 | 48% | 0.481 | 37% | 0.37 | S | S | . | . | H | α-helix | trans | -82 | -20.7 | -171 | -91.7 | 18.9 | 0 | 0 | 0 | 113.7 | R159 G179 I180 | R159-D182 IonicContact CZ-OD2 2.9Å; R159-D182 PolarHBondContact NE-O 3.25Å; R159-D182 IonicContact NH1-OD2 2.79Å; R159-D182 VanDerWaalsContact NH2-CB 3.29Å; R159-D182 IonicContact NH2-OD2 3.78Å; R159-D182 PolarHBondContact NH2-OD2 2.95Å; G179-D182 WeakPolarHBondContact O-CB 3.38Å; G179-D182 PolarHBondContact O-N 3.2Å; I180-D182 PolarHBondContact O-N 3.19Å |
| 183 | A | 74.5 | Confident | 64.7 | Low | 33 Ų | 33 | 54.4 Ų | 54.4 | 27% | 0.273 | 34% | 0.34 | S | S | . | . | H | α-helix | trans | -79.4 | -30.1 | 176.2 | 0 | 0 | 0 | 0 | 0 | 111.8 | D185 I186 E187 V219 | A183-D185 VanDerWaalsContact C-N 3.31Å; A183-D185 PolarHBondContact O-N 3.31Å; A183-I186 WeakPolarHBondContact O-CB 3.08Å; A183-I186 PolarHBondContact O-N 3.27Å; A183-E187 WeakPolarHBondContact O-CG 3.28Å; A183-E187 PolarHBondContact O-N 3.29Å; A183-V219 HydrophobicContact CB-CG1 4.49Å |
| 184 | V | 86 | Confident | 67.8 | Low | 2 Ų | 2 | 48.9 Ų | 48.9 | 1% | 0.012 | 30% | 0.301 | C | S | . | . | H | α-helix | trans | -63.2 | -36.1 | -170.6 | 110.3 | 0 | 0 | 0 | 0 | 113.1 | C118 I121 Q122 I186 E187 L188 | C118-V184 HydrophobicContact CB-CG1 3.93Å; I121-V184 HydrophobicContact CB-CG2 3.89Å; I121-V184 HydrophobicContact CG2-CG2 3.52Å; Q122-V184 HydrophobicContact CG-CB 3.82Å; Q122-V184 HydrophobicContact CG-CG1 4.41Å; Q122-V184 HydrophobicContact CG-CG2 3.41Å; Q122-V184 VanDerWaalsContact CG-CG2 3.41Å; V184-I186 PolarHBondContact O-N 2.97Å; V184-E187 CarbonylContact O-C 3.52Å; V184-E187 WeakPolarHBondContact O-CA 3.47Å; V184-E187 PolarHBondContact O-N 3.32Å; V184-L188 WeakPolarHBondContact O-CG 3.32Å; V184-L188 PolarHBondContact O-N 2.87Å |
| 185 | D | 87.4 | Confident | 70.9 | Confident | 26 Ų | 26 | 48.9 Ų | 48.9 | 14% | 0.139 | 29% | 0.286 | C | S | . | . | H | α-helix | trans | -65.1 | -29.8 | 179.5 | -72.3 | -19.7 | 0 | 0 | 0 | 111.4 | R155 I156 R159 A183 | R155-D185 IonicContact CZ-OD1 3.77Å; R155-D185 IonicContact NE-OD1 3.54Å; R155-D185 PolarHBondContact NE-OD1 3.38Å; R155-D185 IonicContact NE-OD2 2.9Å; R155-D185 IonicContact NH2-OD1 3.94Å; R155-D185 PolarHBondContact NH2-OD1 3.4Å; I156-D185 WeakPolarHBondContact CG1-O 3.45Å; R159-D185 HydrophobicContact CB-CB 4.14Å; R159-D185 HydrophobicContact CG-CB 4.13Å; A183-D185 VanDerWaalsContact C-N 3.31Å; A183-D185 PolarHBondContact O-N 3.31Å |
| 186 | I | 89.3 | Confident | 74.2 | Confident | 6 Ų | 6 | 43.7 Ų | 43.7 | 3% | 0.031 | 26% | 0.259 | C | S | . | . | H | α-helix | trans | -76.1 | -42.7 | 169.9 | -63.2 | -57.3 | 0 | 0 | 0 | 109.7 | R159 L160 M163 A183 V184 L188 M189 V219 L220 | R159-I186 HydrophobicContact CB-CD1 4.05Å; R159-I186 HydrophobicContact CG-CD1 3.75Å; R159-I186 HydrophobicContact CG-CG1 3.91Å; L160-I186 HydrophobicContact CD2-CD1 3.95Å; L160-I186 HydrophobicContact CG-CD1 4.22Å; M163-I186 HydrophobicContact SD-CD1 3.9Å; M163-I186 HydrophobicContact SD-CG1 3.92Å; A183-I186 WeakPolarHBondContact O-CB 3.08Å; A183-I186 PolarHBondContact O-N 3.27Å; V184-I186 PolarHBondContact O-N 2.97Å; I186-L188 PolarHBondContact O-N 3.22Å; I186-L188 VanDerWaalsContact O-N 3.14Å; I186-M189 HydrophobicContact CB-CE 4.45Å; I186-M189 HydrophobicContact CD1-CE 4.34Å; I186-M189 HydrophobicContact CG2-CE 3.73Å; I186-M189 WeakPolarHBondContact O-CE 3.34Å; I186-M189 WeakPolarHBondContact O-CG 3.4Å; I186-M189 PolarHBondContact O-N 3.39Å; I186-M189 VanDerWaalsContact O-N 3.15Å; I186-V219 HydrophobicContact CG2-CG1 4.32Å; I186-L220 HydrophobicContact CG2-CB 4.11Å; I186-L220 HydrophobicContact CG2-CD1 3.79Å |
| 187 | E | 89 | Confident | 77.1 | Confident | 18 Ų | 18 | 42.5 Ų | 42.5 | 8% | 0.084 | 25% | 0.245 | C | C | . | . | H | α-helix | trans | -60.9 | -21.7 | 176.5 | -60.2 | -164 | 164.6 | 0 | 0 | 113.5 | K134 A183 V184 M189 Q190 Y191 V219 | K134-E187 IonicContact NZ-OE2 3.2Å; A183-E187 WeakPolarHBondContact O-CG 3.28Å; A183-E187 PolarHBondContact O-N 3.29Å; V184-E187 CarbonylContact O-C 3.52Å; V184-E187 WeakPolarHBondContact O-CA 3.47Å; V184-E187 PolarHBondContact O-N 3.32Å; E187-M189 PolarHBondContact O-N 3.29Å; E187-M189 VanDerWaalsContact O-N 3.13Å; E187-Q190 WeakPolarHBondContact O-CB 3.37Å; E187-Q190 WeakPolarHBondContact O-CG 3.48Å; E187-Q190 PolarHBondContact O-N 3.47Å; E187-Y191 HydrophobicContact CB-CE2 4.07Å; E187-Y191 WeakPolarHBondContact O-CD2 3.48Å; E187-Y191 WeakPolarHBondContact O-CE2 3.44Å; E187-V219 HydrophobicContact CG-CG1 3.61Å |
| 188 | L | 90.8 | Very high | 80 | Confident | 1 Ų | 1 | 40 Ų | 40 | 1% | 0.005 | 23% | 0.225 | C | C | . | . | G | 310 helix | trans | -54.9 | -31.9 | 174.3 | -75.4 | 175 | 0 | 0 | 0 | 112.8 | L141 I152 I156 V184 I186 Q190 Y191 I192 | L141-L188 HydrophobicContact CD1-CD2 3.89Å; L141-L188 HydrophobicContact CD2-CD2 4.13Å; I152-L188 HydrophobicContact CG2-CD1 4.23Å; I156-L188 HydrophobicContact CD1-CB 4.14Å; I156-L188 HydrophobicContact CG1-CB 4.12Å; V184-L188 WeakPolarHBondContact O-CG 3.32Å; V184-L188 PolarHBondContact O-N 2.87Å; I186-L188 PolarHBondContact O-N 3.22Å; I186-L188 VanDerWaalsContact O-N 3.14Å; L188-Q190 PolarHBondContact O-N 3.08Å; L188-Q190 VanDerWaalsContact O-N 3.08Å; L188-Y191 PolarHBondContact O-N 3.4Å; L188-I192 PolarHBondContact O-N 2.96Å |
| 189 | M | 90.8 | Very high | 82.7 | Confident | 0 Ų | 0 | 33.5 Ų | 33.5 | 0% | 0 | 19% | 0.191 | C | C | . | . | G | 310 helix | trans | -64 | -15.3 | 177.2 | 79.1 | -174.3 | 59.2 | 0 | 0 | 113 | I156 I186 E187 Y191 F194 L220 S223 I224 | I156-M189 HydrophobicContact CD1-CB 4.02Å; I156-M189 HydrophobicContact CG2-CE 3.82Å; I186-M189 HydrophobicContact CB-CE 4.45Å; I186-M189 HydrophobicContact CD1-CE 4.34Å; I186-M189 HydrophobicContact CG2-CE 3.73Å; I186-M189 WeakPolarHBondContact O-CE 3.34Å; I186-M189 WeakPolarHBondContact O-CG 3.4Å; I186-M189 PolarHBondContact O-N 3.39Å; I186-M189 VanDerWaalsContact O-N 3.15Å; E187-M189 PolarHBondContact O-N 3.29Å; E187-M189 VanDerWaalsContact O-N 3.13Å; M189-Y191 VanDerWaalsContact C-N 3.35Å; M189-F194 HydrophobicContact CB-CE2 4.31Å; M189-F194 HydrophobicContact CB-CZ 4.36Å; M189-F194 WeakPolarHBondContact O-CE2 3.36Å; M189-L220 HydrophobicContact CE-CD1 3.95Å; M189-S223 VanDerWaalsContact SD-C 3.52Å; M189-S223 WeakPolarHBondContact SD-CB 3.19Å; M189-I224 HydrophobicContact SD-CG1 4.07Å |
| 190 | Q | 91.1 | Very high | 85.4 | Confident | 5 Ų | 5 | 32 Ų | 32 | 2% | 0.023 | 17% | 0.173 | C | C | . | . | G | 310 helix | trans | -81.3 | -16.8 | 177.5 | -46.4 | 177 | 16.4 | 0 | 0 | 112.9 | E187 L188 S223 N230 Y517 | E187-Q190 WeakPolarHBondContact O-CB 3.37Å; E187-Q190 WeakPolarHBondContact O-CG 3.48Å; E187-Q190 PolarHBondContact O-N 3.47Å; L188-Q190 PolarHBondContact O-N 3.08Å; L188-Q190 VanDerWaalsContact O-N 3.08Å; Q190-S223 PolarHBondContact NE2-OG 2.93Å; Q190-N230 PolarHBondContact O-ND2 3.45Å; Q190-Y517 HydrophobicContact CB-CD1 4.04Å; Q190-Y517 HydrophobicContact CB-CE1 3.58Å; Q190-Y517 HydrophobicContact CG-CD1 4.18Å; Q190-Y517 HydrophobicContact CG-CE1 3.25Å; Q190-Y517 PolarHBondContact NE2-OH 2.99Å; Q190-Y517 PolarHBondContact OE1-OH 3.21Å |
| 191 | Y | 90.9 | Very high | 87.7 | Confident | 10 Ų | 10 | 30.3 Ų | 30.3 | 4% | 0.039 | 16% | 0.162 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -121.7 | -6.9 | -167.9 | -50.1 | -66.3 | 0 | 0 | 0 | 113.5 | I121 K134 S138 L141 Y142 E187 L188 M189 P518 | I121-Y191 HydrophobicContact CD1-CD2 4.14Å; I121-Y191 HydrophobicContact CD1-CE1 4.38Å; I121-Y191 HydrophobicContact CD1-CE2 3.98Å; I121-Y191 HydrophobicContact CD1-CG 4.45Å; I121-Y191 HydrophobicContact CG1-CD2 4.39Å; I121-Y191 HydrophobicContact CG1-CE2 4.27Å; I121-Y191 HydrophobicContact CG2-CD2 4.36Å; I121-Y191 HydrophobicContact CG2-CE2 3.56Å; K134-Y191 WeakPolarHBondContact CE-OH 3.29Å; S138-Y191 VanDerWaalsContact CB-CD1 3.46Å; L141-Y191 HydrophobicContact CD1-CD2 4.5Å; Y142-Y191 VanDerWaalsContact CA-O 3.3Å; Y142-Y191 WeakPolarHBondContact CA-O 3.43Å; Y142-Y191 WeakPolarHBondContact CB-O 3.48Å; Y142-Y191 PolarHBondContact N-O 2.97Å; E187-Y191 HydrophobicContact CB-CE2 4.07Å; E187-Y191 WeakPolarHBondContact O-CD2 3.48Å; E187-Y191 WeakPolarHBondContact O-CE2 3.44Å; L188-Y191 PolarHBondContact O-N 3.4Å; M189-Y191 VanDerWaalsContact C-N 3.35Å; Y191-P518 HydrophobicContact CD1-CG 3.77Å; Y191-P518 HydrophobicContact CE1-CG 3.77Å |
| 192 | I | 92 | Very high | 89.8 | Confident | 1 Ų | 1 | 28.7 Ų | 28.7 | 1% | 0.005 | 14% | 0.144 | C | C | . | . | S | Bend | trans | -95.5 | 156 | 176.9 | 64.9 | 172.9 | 0 | 0 | 0 | 112 | F149 I152 I156 L188 F194 | F149-I192 HydrophobicContact CE2-CD1 3.97Å; I152-I192 HydrophobicContact CB-CG2 4.42Å; I152-I192 HydrophobicContact CD1-CG2 4.29Å; I152-I192 HydrophobicContact CG2-CG2 3.74Å; I156-I192 HydrophobicContact CD1-CD1 3.47Å; I156-I192 VanDerWaalsContact CD1-CD1 3.47Å; I156-I192 HydrophobicContact CD1-CG1 4.48Å; L188-I192 PolarHBondContact O-N 2.96Å; I192-F194 HydrophobicContact CD1-CE1 4.4Å; I192-F194 HydrophobicContact CD1-CE2 3.8Å; I192-F194 HydrophobicContact CD1-CZ 3.61Å; I192-F194 HydrophobicContact CG1-CD2 4.11Å; I192-F194 HydrophobicContact CG1-CE2 3.42Å; I192-F194 VanDerWaalsContact CG1-CE2 3.42Å; I192-F194 HydrophobicContact CG1-CZ 3.82Å |
| 193 | H | 92.2 | Very high | 91.4 | Very high | 32 Ų | 32 | 24.4 Ų | 24.4 | 15% | 0.148 | 12% | 0.122 | C | C | . | . | trans | -69.8 | 130.6 | 175.8 | 178.9 | -86.6 | 0 | 0 | 0 | 111.1 | Y142 S145 I146 F149 Y235 | Y142-H193 HydrophobicContact CD2-CB 4.38Å; Y142-H193 HydrophobicContact CE2-CB 4.1Å; Y142-H193 AromaticContact CZ-CD2 3.78Å; Y142-H193 PolarHBondContact OH-CD2 3.11Å; S145-H193 VanDerWaalsContact OG-CB 3.27Å; S145-H193 WeakPolarHBondContact OG-CB 3.29Å; S145-H193 PolarHBondContact OG-N 3.01Å; I146-H193 HydrophobicContact CG1-CB 4.12Å; F149-H193 WeakPolarHBondContact CD2-O 3.5Å; F149-H193 WeakPolarHBondContact CE2-O 3.43Å; H193-Y235 PolarHBondContact CE1-OH 2.96Å; H193-Y235 AromaticContact NE2-CZ 3.84Å; H193-Y235 PolarHBondContact NE2-OH 2.9Å | ||
| 194 | F | 93.8 | Very high | 92.4 | Very high | 6 Ų | 6 | 27.9 Ų | 27.9 | 3% | 0.026 | 13% | 0.128 | C | C | . | . | trans | -123.9 | 118.7 | 170.9 | -76.6 | -78.8 | 0 | 0 | 0 | 109.5 | F149 F153 M189 I192 A198 L202 A227 | F149-F194 HydrophobicContact CE2-CD1 4.14Å; F149-F194 AromaticContact CE2-CE1 3.99Å; F149-F194 HydrophobicContact CE2-CE1 3.99Å; F149-F194 HydrophobicContact CZ-CD1 4.25Å; F149-F194 AromaticContact CZ-CE1 3.91Å; F149-F194 HydrophobicContact CZ-CE1 3.91Å; F153-F194 HydrophobicContact CD2-CE1 4.38Å; F153-F194 HydrophobicContact CE2-CE1 4.18Å; M189-F194 HydrophobicContact CB-CE2 4.31Å; M189-F194 HydrophobicContact CB-CZ 4.36Å; M189-F194 WeakPolarHBondContact O-CE2 3.36Å; I192-F194 HydrophobicContact CD1-CE1 4.4Å; I192-F194 HydrophobicContact CD1-CE2 3.8Å; I192-F194 HydrophobicContact CD1-CZ 3.61Å; I192-F194 HydrophobicContact CG1-CD2 4.11Å; I192-F194 HydrophobicContact CG1-CE2 3.42Å; I192-F194 VanDerWaalsContact CG1-CE2 3.42Å; I192-F194 HydrophobicContact CG1-CZ 3.82Å; F194-A198 HydrophobicContact CD1-CB 3.81Å; F194-L202 HydrophobicContact CE1-CB 3.88Å; F194-L202 HydrophobicContact CE1-CD2 3.87Å; F194-L202 HydrophobicContact CE1-CG 4.32Å; F194-L202 HydrophobicContact CE2-CD2 4.34Å; F194-L202 HydrophobicContact CZ-CB 4.45Å; F194-L202 HydrophobicContact CZ-CD1 4.44Å; F194-L202 HydrophobicContact CZ-CD2 3.7Å; F194-L202 HydrophobicContact CZ-CG 4.41Å; F194-A227 HydrophobicContact CD2-CB 4.12Å; F194-A227 HydrophobicContact CE2-CB 4.02Å | ||
| 195 | D | 92.7 | Very high | 92.9 | Very high | 60 Ų | 60 | 30.1 Ų | 30.1 | 32% | 0.321 | 14% | 0.138 | S | C | . | . | trans | -84.5 | 177.4 | 157.2 | 79.7 | -5.7 | 0 | 0 | 0 | 110.5 | K197 A198 L199 Y235 | D195-K197 VanDerWaalsContact C-N 3.27Å; D195-K197 PolarHBondContact O-N 2.75Å; D195-K197 PolarHBondContact OD1-N 3.09Å; D195-K197 VanDerWaalsContact OD1-N 3.09Å; D195-A198 PolarHBondContact O-N 3.17Å; D195-A198 WeakPolarHBondContact OD1-CB 3.36Å; D195-A198 PolarHBondContact OD1-N 2.88Å; D195-L199 WeakPolarHBondContact O-CB 3.1Å; D195-L199 PolarHBondContact O-N 3.16Å; D195-Y235 HydrophobicContact CB-CE2 4.33Å | ||
| 196 | L | 93.2 | Very high | 93.2 | Very high | 47 Ų | 47 | 28.9 Ų | 28.9 | 25% | 0.246 | 13% | 0.131 | C | C | . | . | H | α-helix | trans | -60.8 | -36.2 | -178.2 | -179.7 | 60.3 | 0 | 0 | 0 | 112.4 | I200 W231 L250 | L196-I200 HydrophobicContact CD1-CD1 4.22Å; L196-I200 HydrophobicContact CD1-CG1 4.43Å; L196-I200 HydrophobicContact CG-CD1 4.1Å; L196-I200 WeakPolarHBondContact O-CD1 3.42Å; L196-I200 VanDerWaalsContact O-CG1 3.25Å; L196-I200 WeakPolarHBondContact O-CG1 3.29Å; L196-I200 PolarHBondContact O-N 2.71Å; L196-W231 HydrophobicContact CB-CZ2 4.38Å; L196-W231 HydrophobicContact CD1-CH2 4.29Å; L196-W231 HydrophobicContact CD1-CZ2 3.78Å; L196-L250 HydrophobicContact CD1-CD2 4.25Å |
| 197 | K | 94 | Very high | 93.3 | Very high | 167 Ų | 167 | 28.8 Ų | 28.8 | 73% | 0.726 | 13% | 0.132 | S | C | * | . | H | α-helix | trans | -70.9 | -44.2 | -179.6 | -71.6 | 179.7 | 178.6 | 175.9 | 0 | 111.1 | D195 L199 I200 K201 | D195-K197 VanDerWaalsContact C-N 3.27Å; D195-K197 PolarHBondContact O-N 2.75Å; D195-K197 PolarHBondContact OD1-N 3.09Å; D195-K197 VanDerWaalsContact OD1-N 3.09Å; K197-L199 VanDerWaalsContact C-N 3.32Å; K197-I200 PolarHBondContact O-N 3.49Å; K197-K201 WeakPolarHBondContact O-CB 3.49Å; K197-K201 PolarHBondContact O-N 3.5Å |
| 198 | A | 94.7 | Very high | 93.4 | Very high | 10 Ų | 10 | 36.4 Ų | 36.4 | 8% | 0.083 | 16% | 0.161 | C | C | . | . | H | α-helix | trans | -62.9 | -39.1 | 175.5 | 0 | 0 | 0 | 0 | 0 | 111.4 | F149 F194 D195 K201 L202 | F149-A198 HydrophobicContact CE1-CB 4.12Å; F149-A198 HydrophobicContact CE2-CB 3.96Å; F149-A198 HydrophobicContact CZ-CB 3.6Å; F194-A198 HydrophobicContact CD1-CB 3.81Å; D195-A198 PolarHBondContact O-N 3.17Å; D195-A198 WeakPolarHBondContact OD1-CB 3.36Å; D195-A198 PolarHBondContact OD1-N 2.88Å; A198-K201 WeakPolarHBondContact O-CB 3.39Å; A198-K201 PolarHBondContact O-N 2.86Å; A198-L202 PolarHBondContact O-N 3.07Å |
| 199 | L | 95.4 | Very high | 93.4 | Very high | 1 Ų | 1 | 38.7 Ų | 38.7 | 1% | 0.005 | 17% | 0.17 | C | C | . | . | H | α-helix | trans | -65.3 | -45.8 | 175.3 | -175.5 | 63.2 | 0 | 0 | 0 | 111.4 | D195 K197 K201 L202 L203 I228 W231 | D195-L199 WeakPolarHBondContact O-CB 3.1Å; D195-L199 PolarHBondContact O-N 3.16Å; K197-L199 VanDerWaalsContact C-N 3.32Å; L199-K201 VanDerWaalsContact C-N 3.28Å; L199-K201 PolarHBondContact O-N 3.17Å; L199-L202 HydrophobicContact CD1-CD2 4.48Å; L199-L202 WeakPolarHBondContact O-CB 3.34Å; L199-L202 PolarHBondContact O-N 3.08Å; L199-L203 HydrophobicContact CG-CD1 4.31Å; L199-L203 WeakPolarHBondContact O-CG 3.29Å; L199-L203 PolarHBondContact O-N 3.03Å; L199-I228 HydrophobicContact CD1-CG1 4.25Å; L199-W231 HydrophobicContact CD2-CB 4.12Å; L199-W231 HydrophobicContact CD2-CD2 3.79Å; L199-W231 HydrophobicContact CD2-CE3 3.8Å; L199-W231 HydrophobicContact CD2-CG 3.9Å |
| 200 | I | 96 | Very high | 93.2 | Very high | 9 Ų | 9 | 46 Ų | 46 | 5% | 0.046 | 20% | 0.197 | C | C | . | . | H | α-helix | trans | -59.2 | -42.4 | 174 | -69 | 165.7 | 0 | 0 | 0 | 110.5 | L196 K197 L203 R204 E249 L250 | L196-I200 HydrophobicContact CD1-CD1 4.22Å; L196-I200 HydrophobicContact CD1-CG1 4.43Å; L196-I200 HydrophobicContact CG-CD1 4.1Å; L196-I200 WeakPolarHBondContact O-CD1 3.42Å; L196-I200 VanDerWaalsContact O-CG1 3.25Å; L196-I200 WeakPolarHBondContact O-CG1 3.29Å; L196-I200 PolarHBondContact O-N 2.71Å; K197-I200 PolarHBondContact O-N 3.49Å; I200-L203 PolarHBondContact O-N 3.04Å; I200-R204 VanDerWaalsContact O-CB 3.24Å; I200-R204 WeakPolarHBondContact O-CB 3.44Å; I200-R204 PolarHBondContact O-N 3.37Å; I200-E249 HydrophobicContact CG2-CB 4.29Å; I200-L250 HydrophobicContact CD1-CB 4.13Å; I200-L250 HydrophobicContact CG1-CB 4.04Å; I200-L250 HydrophobicContact CG1-CD1 3.87Å |
| 201 | K | 95.3 | Very high | 93 | Very high | 78 Ų | 78 | 45.9 Ų | 45.9 | 34% | 0.339 | 20% | 0.197 | S | C | . | . | H | α-helix | trans | -58.7 | -48.6 | 175.7 | -170.3 | -178 | -179.3 | -177.7 | 0 | 110.7 | D150 F153 K197 A198 L199 R204 E205 | D150-K201 IonicContact OD1-NZ 3.99Å; D150-K201 PolarHBondContact OD1-NZ 2.93Å; F153-K201 HydrophobicContact CD1-CD 4.35Å; F153-K201 HydrophobicContact CE1-CD 3.77Å; F153-K201 HydrophobicContact CE1-CG 3.87Å; F153-K201 HydrophobicContact CZ-CB 4.47Å; F153-K201 HydrophobicContact CZ-CD 4.22Å; F153-K201 HydrophobicContact CZ-CG 3.97Å; K197-K201 WeakPolarHBondContact O-CB 3.49Å; K197-K201 PolarHBondContact O-N 3.5Å; A198-K201 WeakPolarHBondContact O-CB 3.39Å; A198-K201 PolarHBondContact O-N 2.86Å; L199-K201 VanDerWaalsContact C-N 3.28Å; L199-K201 PolarHBondContact O-N 3.17Å; K201-R204 WeakPolarHBondContact O-CB 3.48Å; K201-R204 PolarHBondContact O-N 2.9Å; K201-E205 WeakPolarHBondContact O-CG 3.46Å; K201-E205 PolarHBondContact O-N 2.74Å |
| 202 | L | 95.6 | Very high | 92.7 | Very high | 0 Ų | 0 | 46.3 Ų | 46.3 | 0% | 0 | 20% | 0.199 | C | C | . | . | H | α-helix | trans | -56.8 | -53.3 | 175.9 | 178.9 | 68.8 | 0 | 0 | 0 | 111.9 | F153 I156 F194 A198 L199 R204 E205 I206 A227 | F153-L202 HydrophobicContact CE2-CB 4.02Å; F153-L202 HydrophobicContact CE2-CD1 3.89Å; F153-L202 HydrophobicContact CZ-CB 4.37Å; F153-L202 HydrophobicContact CZ-CD1 4.49Å; I156-L202 HydrophobicContact CG2-CD1 4.47Å; F194-L202 HydrophobicContact CE1-CB 3.88Å; F194-L202 HydrophobicContact CE1-CD2 3.87Å; F194-L202 HydrophobicContact CE1-CG 4.32Å; F194-L202 HydrophobicContact CE2-CD2 4.34Å; F194-L202 HydrophobicContact CZ-CB 4.45Å; F194-L202 HydrophobicContact CZ-CD1 4.44Å; F194-L202 HydrophobicContact CZ-CD2 3.7Å; F194-L202 HydrophobicContact CZ-CG 4.41Å; A198-L202 PolarHBondContact O-N 3.07Å; L199-L202 HydrophobicContact CD1-CD2 4.48Å; L199-L202 WeakPolarHBondContact O-CB 3.34Å; L199-L202 PolarHBondContact O-N 3.08Å; L202-R204 PolarHBondContact O-N 3.02Å; L202-E205 PolarHBondContact O-N 3.09Å; L202-I206 HydrophobicContact CD1-CD1 3.92Å; L202-I206 HydrophobicContact CD1-CG1 4.36Å; L202-I206 HydrophobicContact CD2-CD1 4.44Å; L202-I206 HydrophobicContact CG-CD1 3.8Å; L202-I206 VanDerWaalsContact O-CG1 3.31Å; L202-I206 WeakPolarHBondContact O-CG1 3.27Å; L202-I206 PolarHBondContact O-N 2.89Å; L202-A227 HydrophobicContact CD2-CB 4.05Å |
| 203 | L | 95.4 | Very high | 91.7 | Very high | 0 Ų | 0 | 53.6 Ų | 53.6 | 0% | 0 | 23% | 0.226 | C | C | . | . | H | α-helix | trans | -62.6 | -34.7 | -177.6 | -65 | 176.3 | 0 | 0 | 0 | 111.9 | L199 I200 S207 I224 L250 C253 L257 L282 L285 | L199-L203 HydrophobicContact CG-CD1 4.31Å; L199-L203 WeakPolarHBondContact O-CG 3.29Å; L199-L203 PolarHBondContact O-N 3.03Å; I200-L203 PolarHBondContact O-N 3.04Å; L203-S207 VanDerWaalsContact O-CB 3.28Å; L203-S207 WeakPolarHBondContact O-CB 3.33Å; L203-S207 PolarHBondContact O-N 3.34Å; L203-S207 PolarHBondContact O-OG 3.29Å; L203-I224 HydrophobicContact CD2-CG2 4.09Å; L203-L250 HydrophobicContact CD1-CD1 3.76Å; L203-C253 HydrophobicContact CB-CB 4.06Å; L203-L257 HydrophobicContact CD2-CD2 3.81Å; L203-L282 HydrophobicContact CD2-CD2 4.39Å; L203-L285 HydrophobicContact CD1-CD1 4.47Å |
| 204 | R | 95.4 | Very high | 90.7 | Very high | 106 Ų | 106 | 56.9 Ų | 56.9 | 40% | 0.4 | 24% | 0.24 | S | C | . | . | H | α-helix | trans | -64.9 | -48 | 174.5 | -170.2 | 178.9 | -62.9 | 172.3 | 2.3 | 111.9 | I200 K201 L202 S207 Y208 E249 | I200-R204 VanDerWaalsContact O-CB 3.24Å; I200-R204 WeakPolarHBondContact O-CB 3.44Å; I200-R204 PolarHBondContact O-N 3.37Å; K201-R204 WeakPolarHBondContact O-CB 3.48Å; K201-R204 PolarHBondContact O-N 2.9Å; L202-R204 PolarHBondContact O-N 3.02Å; R204-S207 PolarHBondContact O-N 3.32Å; R204-Y208 WeakPolarHBondContact O-CB 3.47Å; R204-Y208 PolarHBondContact O-N 3.39Å; R204-E249 IonicContact CZ-OE2 3.53Å; R204-E249 IonicContact NH2-OE2 2.86Å; R204-E249 PolarHBondContact NH2-OE2 2.95Å |
| 205 | E | 94.9 | Very high | 89.3 | Confident | 49 Ų | 49 | 62.2 Ų | 62.2 | 23% | 0.229 | 27% | 0.269 | C | S | . | . | H | α-helix | trans | -62 | -44.4 | 178.3 | -68.7 | -61.6 | 160.1 | 0 | 0 | 111.5 | F153 V157 K201 L202 S207 Y208 Y209 | F153-E205 HydrophobicContact CE1-CG 4.42Å; F153-E205 HydrophobicContact CZ-CG 4.33Å; V157-E205 HydrophobicContact CG2-CB 4.47Å; V157-E205 HydrophobicContact CG2-CG 4.08Å; K201-E205 WeakPolarHBondContact O-CG 3.46Å; K201-E205 PolarHBondContact O-N 2.74Å; L202-E205 PolarHBondContact O-N 3.09Å; E205-S207 VanDerWaalsContact C-N 3.34Å; E205-S207 PolarHBondContact O-N 2.84Å; E205-Y208 PolarHBondContact O-N 3.34Å; E205-Y208 VanDerWaalsContact O-N 3.16Å; E205-Y209 WeakPolarHBondContact O-CD2 3.27Å; E205-Y209 PolarHBondContact O-N 2.93Å; E205-Y209 WeakPolarHBondContact OE2-CE2 3.16Å |
| 206 | I | 93.7 | Very high | 88.2 | Confident | 0 Ų | 0 | 65 Ų | 65 | 0% | 0 | 28% | 0.284 | C | S | . | . | H | α-helix | trans | -61.7 | -45.1 | 176.7 | -63.5 | 168.3 | 0 | 0 | 0 | 110.6 | L160 L202 Y208 Y209 R210 P211 F212 I224 L257 | L160-I206 HydrophobicContact CD1-CG1 3.7Å; L160-I206 HydrophobicContact CD2-CG1 4.14Å; L202-I206 HydrophobicContact CD1-CD1 3.92Å; L202-I206 HydrophobicContact CD1-CG1 4.36Å; L202-I206 HydrophobicContact CD2-CD1 4.44Å; L202-I206 HydrophobicContact CG-CD1 3.8Å; L202-I206 VanDerWaalsContact O-CG1 3.31Å; L202-I206 WeakPolarHBondContact O-CG1 3.27Å; L202-I206 PolarHBondContact O-N 2.89Å; I206-Y208 PolarHBondContact O-N 3.21Å; I206-Y209 PolarHBondContact O-N 3.49Å; I206-R210 PolarHBondContact O-N 2.94Å; I206-P211 HydrophobicContact CG2-CG 4.26Å; I206-P211 WeakPolarHBondContact O-CD 3.5Å; I206-F212 HydrophobicContact CG2-CE1 4.24Å; I206-F212 HydrophobicContact CG2-CE2 4.37Å; I206-F212 HydrophobicContact CG2-CZ 3.56Å; I206-I224 HydrophobicContact CD1-CD1 3.8Å; I206-I224 HydrophobicContact CD1-CG1 3.7Å; I206-I224 HydrophobicContact CG2-CD1 4.28Å; I206-L257 HydrophobicContact CG2-CD1 3.73Å |
| 207 | S | 92 | Very high | 87.7 | Confident | 5 Ų | 5 | 63 Ų | 63 | 4% | 0.035 | 27% | 0.273 | C | S | . | . | H | α-helix | trans | -62.2 | -31.4 | 177.5 | -62.5 | 0 | 0 | 0 | 0 | 112.7 | L203 R204 E205 Q260 | L203-S207 VanDerWaalsContact O-CB 3.28Å; L203-S207 WeakPolarHBondContact O-CB 3.33Å; L203-S207 PolarHBondContact O-N 3.34Å; L203-S207 PolarHBondContact O-OG 3.29Å; R204-S207 PolarHBondContact O-N 3.32Å; E205-S207 VanDerWaalsContact C-N 3.34Å; E205-S207 PolarHBondContact O-N 2.84Å; S207-Q260 PolarHBondContact O-NE2 3.35Å |
| 208 | Y | 91.7 | Very high | 87.3 | Confident | 177 Ų | 177 | 59 Ų | 59 | 69% | 0.694 | 26% | 0.257 | S | S | * | . | H | α-helix | trans | -75.3 | -50.4 | 179.2 | -179.1 | -102.5 | 0 | 0 | 0 | 111.7 | R204 E205 I206 | R204-Y208 WeakPolarHBondContact O-CB 3.47Å; R204-Y208 PolarHBondContact O-N 3.39Å; E205-Y208 PolarHBondContact O-N 3.34Å; E205-Y208 VanDerWaalsContact O-N 3.16Å; I206-Y208 PolarHBondContact O-N 3.21Å |
| 209 | Y | 90.4 | Very high | 86.8 | Confident | 50 Ų | 50 | 60.4 Ų | 60.4 | 20% | 0.196 | 26% | 0.264 | C | S | . | . | H | α-helix | trans | -77.3 | -24.8 | -177 | -67.7 | -61.9 | 0 | 0 | 0 | 114 | V157 L160 K161 S164 E205 I206 | V157-Y209 HydrophobicContact CG1-CE2 3.88Å; L160-Y209 HydrophobicContact CB-CD2 4.26Å; K161-Y209 HydrophobicContact CB-CD1 3.91Å; K161-Y209 HydrophobicContact CB-CE1 3.7Å; K161-Y209 HydrophobicContact CB-CE2 4.32Å; K161-Y209 HydrophobicContact CB-CG 4.34Å; K161-Y209 HydrophobicContact CD-CE1 3.9Å; K161-Y209 HydrophobicContact CG-CD1 3.96Å; K161-Y209 HydrophobicContact CG-CE1 3.58Å; S164-Y209 WeakPolarHBondContact CB-O 3.28Å; E205-Y209 WeakPolarHBondContact O-CD2 3.27Å; E205-Y209 PolarHBondContact O-N 2.93Å; E205-Y209 WeakPolarHBondContact OE2-CE2 3.16Å; I206-Y209 PolarHBondContact O-N 3.49Å |
| 210 | R | 87.7 | Confident | 86.6 | Confident | 154 Ų | 154 | 60.5 Ų | 60.5 | 58% | 0.581 | 27% | 0.265 | S | S | * | . | trans | 50.5 | 62.1 | -179.4 | -55 | -166.2 | 178.2 | -176.4 | 0.1 | 113.8 | I206 F212 Q260 | I206-R210 PolarHBondContact O-N 2.94Å; R210-F212 PolarHBondContact O-N 3.31Å; R210-Q260 HydrophobicContact CG-CG 4.49Å; R210-Q260 VanDerWaalsContact NE-NE2 3.12Å | ||
| 211 | P | 84.9 | Confident | 86.4 | Confident | 2 Ų | 2 | 60.2 Ų | 60.2 | 1% | 0.013 | 26% | 0.264 | C | S | . | . | trans | -69.8 | 4.1 | -175.9 | 31.5 | -38.8 | 0 | 0 | 0 | 115 | L160 M163 I206 R213 L220 | L160-P211 HydrophobicContact CD2-CG 4.15Å; M163-P211 HydrophobicContact CB-CB 4Å; I206-P211 HydrophobicContact CG2-CG 4.26Å; I206-P211 WeakPolarHBondContact O-CD 3.5Å; P211-R213 VanDerWaalsContact C-N 3.32Å; P211-R213 PolarHBondContact O-N 2.92Å; P211-L220 HydrophobicContact CB-CD2 3.94Å; P211-L220 HydrophobicContact CG-CD2 3.49Å; P211-L220 VanDerWaalsContact CG-CD2 3.49Å | ||
| 212 | F | 84.9 | Confident | 86.1 | Confident | 18 Ų | 18 | 58.3 Ų | 58.3 | 8% | 0.079 | 26% | 0.257 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -81.5 | 49.3 | -167 | -46.9 | -53.4 | 0 | 0 | 0 | 115.6 | I206 R210 N217 L220 F221 L257 Q260 L261 F264 | I206-F212 HydrophobicContact CG2-CE1 4.24Å; I206-F212 HydrophobicContact CG2-CE2 4.37Å; I206-F212 HydrophobicContact CG2-CZ 3.56Å; R210-F212 PolarHBondContact O-N 3.31Å; F212-N217 WeakPolarHBondContact CA-ND2 3.48Å; F212-L220 HydrophobicContact CD1-CD2 4.15Å; F212-L220 HydrophobicContact CE1-CD2 3.86Å; F212-F221 HydrophobicContact CD1-CD1 4.46Å; F212-F221 AromaticContact CD1-CE1 3.5Å; F212-F221 HydrophobicContact CD1-CE1 3.5Å; F212-F221 HydrophobicContact CD1-CZ 4.18Å; F212-F221 HydrophobicContact CE1-CD1 4.33Å; F212-F221 AromaticContact CE1-CE1 3.74Å; F212-F221 HydrophobicContact CE1-CE1 3.74Å; F212-F221 HydrophobicContact CG-CE1 4.43Å; F212-L257 HydrophobicContact CE2-CD1 3.66Å; F212-L257 HydrophobicContact CZ-CD1 3.58Å; F212-Q260 HydrophobicContact CD2-CB 4.11Å; F212-Q260 HydrophobicContact CE2-CB 4.11Å; F212-L261 HydrophobicContact CD1-CD2 4.21Å; F212-L261 HydrophobicContact CD2-CD2 4.3Å; F212-L261 HydrophobicContact CE1-CD2 4.05Å; F212-L261 HydrophobicContact CE2-CD2 4.16Å; F212-L261 HydrophobicContact CG-CD2 4.32Å; F212-L261 HydrophobicContact CZ-CD2 4.02Å; F212-F264 HydrophobicContact CB-CD2 4.24Å; F212-F264 HydrophobicContact CB-CG 4.43Å; F212-F264 WeakPolarHBondContact O-CD2 3.31Å; F212-F264 WeakPolarHBondContact O-CE2 3.39Å |
| 213 | R | 71.9 | Confident | 85.9 | Confident | 155 Ų | 155 | 58.3 Ų | 58.3 | 59% | 0.585 | 26% | 0.257 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -103.4 | -20.6 | -173 | -64.4 | -164.4 | -178.4 | 177.4 | 3 | 116.9 | P211 N217 | P211-R213 VanDerWaalsContact C-N 3.32Å; P211-R213 PolarHBondContact O-N 2.92Å; R213-N217 PolarHBondContact N-ND2 3.09Å |
| 214 | K | 69.9 | Low | 85.9 | Confident | 101 Ų | 101 | 58.3 Ų | 58.3 | 44% | 0.439 | 26% | 0.257 | S | S | . | . | S | Bend | trans | -108.6 | 155.2 | -173.5 | -62.6 | -179.8 | -176.7 | 173.6 | 0 | 111.4 | D166 N216 N217 | D166-K214 IonicContact OD2-NZ 2.83Å; K214-N216 PolarHBondContact O-N 3.41Å; K214-N217 PolarHBondContact O-ND2 3.22Å; K214-N217 VanDerWaalsContact O-ND2 3.08Å |
| 215 | D | 66 | Low | 85.8 | Confident | 118 Ų | 118 | 53.9 Ų | 53.9 | 63% | 0.631 | 24% | 0.241 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -67.6 | -14.8 | 175.6 | -70.3 | -41 | 0 | 0 | 0 | 113.4 | R271 | D215-R271 IonicContact OD1-CZ 3.65Å; D215-R271 IonicContact OD1-NE 3.92Å; D215-R271 PolarHBondContact OD1-NE 2.88Å; D215-R271 IonicContact OD1-NH2 2.63Å; D215-R271 PolarHBondContact OD1-NH2 3.33Å; D215-R271 IonicContact OD2-NH2 2.83Å |
| 216 | N | 68.6 | Low | 85.7 | Confident | 119 Ų | 119 | 52.7 Ų | 52.7 | 64% | 0.636 | 24% | 0.236 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -102.1 | 44.1 | -177.6 | -76.4 | -6 | 0 | 0 | 0 | 113.8 | L178 K214 Q218 | L178-N216 HydrophobicContact CD1-CB 4.44Å; L178-N216 WeakPolarHBondContact CD1-ND2 3.48Å; K214-N216 PolarHBondContact O-N 3.41Å; N216-Q218 VanDerWaalsContact C-N 3.34Å |
| 217 | N | 83 | Confident | 85.8 | Confident | 4 Ų | 4 | 52.7 Ų | 52.7 | 2% | 0.021 | 24% | 0.236 | C | C | . | . | trans | -89.8 | 9.8 | 177.7 | -77.3 | -28.8 | 0 | 0 | 0 | 114.4 | F212 R213 K214 V219 L220 F221 | F212-N217 WeakPolarHBondContact CA-ND2 3.48Å; R213-N217 PolarHBondContact N-ND2 3.09Å; K214-N217 PolarHBondContact O-ND2 3.22Å; K214-N217 VanDerWaalsContact O-ND2 3.08Å; N217-V219 VanDerWaalsContact C-N 3.33Å; N217-V219 PolarHBondContact O-N 3.17Å; N217-L220 WeakPolarHBondContact O-CB 3.03Å; N217-L220 PolarHBondContact O-N 3Å; N217-L220 VanDerWaalsContact O-N 3.11Å; N217-F221 HydrophobicContact CB-CD2 4.11Å; N217-F221 HydrophobicContact CB-CE1 4.15Å; N217-F221 HydrophobicContact CB-CE2 3.51Å; N217-F221 HydrophobicContact CB-CZ 3.54Å; N217-F221 VanDerWaalsContact O-CD2 3.29Å; N217-F221 WeakPolarHBondContact O-CD2 3.48Å; N217-F221 WeakPolarHBondContact O-CG 3.27Å; N217-F221 PolarHBondContact O-N 2.46Å | ||
| 218 | Q | 84.8 | Confident | 85.9 | Confident | 84 Ų | 84 | 52.5 Ų | 52.5 | 39% | 0.393 | 23% | 0.234 | S | C | . | . | H | α-helix | trans | -59.3 | -41.6 | -173.9 | -165.6 | 63.3 | 37.5 | 0 | 0 | 113 | N216 L220 F221 N222 | N216-Q218 VanDerWaalsContact C-N 3.34Å; Q218-L220 VanDerWaalsContact C-N 3.32Å; Q218-L220 PolarHBondContact O-N 3.27Å; Q218-F221 PolarHBondContact O-N 2.78Å; Q218-N222 PolarHBondContact NE2-OD1 3.3Å; Q218-N222 WeakPolarHBondContact O-CB 3.4Å; Q218-N222 VanDerWaalsContact O-CG 3.24Å; Q218-N222 PolarHBondContact O-N 3.01Å; Q218-N222 PolarHBondContact O-OD1 2.78Å |
| 219 | V | 85.5 | Confident | 86.1 | Confident | 38 Ų | 38 | 44.2 Ų | 44.2 | 23% | 0.23 | 20% | 0.202 | C | C | . | . | H | α-helix | trans | -59.3 | -46.7 | 177.1 | 177.1 | 0 | 0 | 0 | 0 | 110.1 | A183 I186 E187 N217 S223 | A183-V219 HydrophobicContact CB-CG1 4.49Å; I186-V219 HydrophobicContact CG2-CG1 4.32Å; E187-V219 HydrophobicContact CG-CG1 3.61Å; N217-V219 VanDerWaalsContact C-N 3.33Å; N217-V219 PolarHBondContact O-N 3.17Å; V219-S223 VanDerWaalsContact O-CB 3.24Å; V219-S223 WeakPolarHBondContact O-CB 3.21Å; V219-S223 PolarHBondContact O-N 2.97Å; V219-S223 PolarHBondContact O-OG 3.41Å |
| 220 | L | 90.6 | Very high | 86.2 | Confident | 3 Ų | 3 | 43.2 Ų | 43.2 | 2% | 0.016 | 20% | 0.2 | C | C | . | . | H | α-helix | trans | -61.1 | -48.4 | 177.9 | 177.2 | 64.1 | 0 | 0 | 0 | 111.7 | L160 M163 I186 M189 P211 F212 N217 Q218 N222 S223 I224 | L160-L220 HydrophobicContact CD2-CD1 3.84Å; M163-L220 HydrophobicContact CE-CD2 4.42Å; I186-L220 HydrophobicContact CG2-CB 4.11Å; I186-L220 HydrophobicContact CG2-CD1 3.79Å; M189-L220 HydrophobicContact CE-CD1 3.95Å; P211-L220 HydrophobicContact CB-CD2 3.94Å; P211-L220 HydrophobicContact CG-CD2 3.49Å; P211-L220 VanDerWaalsContact CG-CD2 3.49Å; F212-L220 HydrophobicContact CD1-CD2 4.15Å; F212-L220 HydrophobicContact CE1-CD2 3.86Å; N217-L220 WeakPolarHBondContact O-CB 3.03Å; N217-L220 PolarHBondContact O-N 3Å; N217-L220 VanDerWaalsContact O-N 3.11Å; Q218-L220 VanDerWaalsContact C-N 3.32Å; Q218-L220 PolarHBondContact O-N 3.27Å; L220-N222 PolarHBondContact O-N 3.18Å; L220-S223 PolarHBondContact O-N 3.22Å; L220-S223 VanDerWaalsContact O-N 3.11Å; L220-I224 HydrophobicContact CD1-CD1 4.04Å; L220-I224 HydrophobicContact CD1-CG1 4.22Å; L220-I224 HydrophobicContact CG-CD1 4Å; L220-I224 VanDerWaalsContact O-CG1 3.29Å; L220-I224 WeakPolarHBondContact O-CG1 3.39Å; L220-I224 PolarHBondContact O-N 3.25Å |
| 221 | F | 92 | Very high | 86.5 | Confident | 4 Ų | 4 | 36 Ų | 36 | 2% | 0.018 | 17% | 0.173 | C | C | . | . | H | α-helix | trans | -60.7 | -48.4 | -179.4 | -60.3 | -38.6 | 0 | 0 | 0 | 112.1 | F212 N217 Q218 S223 I224 E225 L261 F264 V275 L278 | F212-F221 HydrophobicContact CD1-CD1 4.46Å; F212-F221 AromaticContact CD1-CE1 3.5Å; F212-F221 HydrophobicContact CD1-CE1 3.5Å; F212-F221 HydrophobicContact CD1-CZ 4.18Å; F212-F221 HydrophobicContact CE1-CD1 4.33Å; F212-F221 AromaticContact CE1-CE1 3.74Å; F212-F221 HydrophobicContact CE1-CE1 3.74Å; F212-F221 HydrophobicContact CG-CE1 4.43Å; N217-F221 HydrophobicContact CB-CD2 4.11Å; N217-F221 HydrophobicContact CB-CE1 4.15Å; N217-F221 HydrophobicContact CB-CE2 3.51Å; N217-F221 HydrophobicContact CB-CZ 3.54Å; N217-F221 VanDerWaalsContact O-CD2 3.29Å; N217-F221 WeakPolarHBondContact O-CD2 3.48Å; N217-F221 WeakPolarHBondContact O-CG 3.27Å; N217-F221 PolarHBondContact O-N 2.46Å; Q218-F221 PolarHBondContact O-N 2.78Å; F221-S223 PolarHBondContact O-N 3.05Å; F221-I224 PolarHBondContact O-N 3.08Å; F221-E225 PolarHBondContact O-N 2.99Å; F221-L261 HydrophobicContact CD1-CD2 4.23Å; F221-L261 HydrophobicContact CE1-CD2 3.64Å; F221-L261 HydrophobicContact CZ-CD2 4.38Å; F221-F264 AromaticContact CE2-CE1 3.99Å; F221-F264 HydrophobicContact CE2-CE1 3.99Å; F221-F264 HydrophobicContact CZ-CD1 4.17Å; F221-F264 AromaticContact CZ-CE1 3.77Å; F221-F264 HydrophobicContact CZ-CE1 3.77Å; F221-F264 HydrophobicContact CZ-CZ 4.31Å; F221-V275 HydrophobicContact CD1-CG1 4.46Å; F221-V275 HydrophobicContact CD2-CG1 4.1Å; F221-V275 HydrophobicContact CE1-CG1 4.02Å; F221-V275 HydrophobicContact CE2-CG1 3.63Å; F221-V275 HydrophobicContact CG-CG1 4.5Å; F221-V275 HydrophobicContact CZ-CG1 3.59Å; F221-L278 HydrophobicContact CB-CD2 4.22Å; F221-L278 HydrophobicContact CD1-CD2 3.86Å; F221-L278 HydrophobicContact CG-CD2 4.42Å |
| 222 | N | 89.2 | Confident | 87 | Confident | 37 Ų | 37 | 35.9 Ų | 35.9 | 20% | 0.198 | 17% | 0.172 | C | C | . | . | H | α-helix | trans | -60.1 | -39 | 175.7 | -67.1 | -3.5 | 0 | 0 | 0 | 110.2 | Q218 L220 I224 E225 N226 Y517 | Q218-N222 PolarHBondContact NE2-OD1 3.3Å; Q218-N222 WeakPolarHBondContact O-CB 3.4Å; Q218-N222 VanDerWaalsContact O-CG 3.24Å; Q218-N222 PolarHBondContact O-N 3.01Å; Q218-N222 PolarHBondContact O-OD1 2.78Å; L220-N222 PolarHBondContact O-N 3.18Å; N222-I224 PolarHBondContact O-N 3.3Å; N222-E225 WeakPolarHBondContact O-CB 3.42Å; N222-E225 PolarHBondContact O-N 3.14Å; N222-N226 PolarHBondContact O-N 2.73Å; N222-N226 PolarHBondContact O-ND2 2.84Å; N222-Y517 HydrophobicContact CB-CE2 3.83Å; N222-Y517 WeakPolarHBondContact CB-OH 3.23Å; N222-Y517 PolarHBondContact O-OH 3.28Å; N222-Y517 VanDerWaalsContact O-OH 3.09Å |
| 223 | S | 92.2 | Very high | 87.2 | Confident | 0 Ų | 0 | 38.2 Ų | 38.2 | 0% | 0 | 19% | 0.185 | C | C | . | . | H | α-helix | trans | -69.7 | -38 | -174 | -55.3 | 0 | 0 | 0 | 0 | 111.9 | M189 Q190 V219 L220 F221 E225 A227 Y517 | M189-S223 VanDerWaalsContact SD-C 3.52Å; M189-S223 WeakPolarHBondContact SD-CB 3.19Å; Q190-S223 PolarHBondContact NE2-OG 2.93Å; V219-S223 VanDerWaalsContact O-CB 3.24Å; V219-S223 WeakPolarHBondContact O-CB 3.21Å; V219-S223 PolarHBondContact O-N 2.97Å; V219-S223 PolarHBondContact O-OG 3.41Å; L220-S223 PolarHBondContact O-N 3.22Å; L220-S223 VanDerWaalsContact O-N 3.11Å; F221-S223 PolarHBondContact O-N 3.05Å; S223-E225 VanDerWaalsContact C-N 3.34Å; S223-A227 WeakPolarHBondContact O-CB 3.49Å; S223-A227 PolarHBondContact O-N 3.07Å; S223-Y517 WeakPolarHBondContact CA-OH 3.32Å; S223-Y517 PolarHBondContact N-OH 3.47Å; S223-Y517 PolarHBondContact OG-OH 3.12Å |
| 224 | I | 94.7 | Very high | 88.1 | Confident | 0 Ų | 0 | 33.3 Ų | 33.3 | 0% | 0 | 17% | 0.173 | C | C | . | . | H | α-helix | trans | -63.6 | -45.1 | 172.2 | -60.6 | 164 | 0 | 0 | 0 | 109.9 | M189 L203 I206 L220 F221 N222 N226 A227 I228 L278 | M189-I224 HydrophobicContact SD-CG1 4.07Å; L203-I224 HydrophobicContact CD2-CG2 4.09Å; I206-I224 HydrophobicContact CD1-CD1 3.8Å; I206-I224 HydrophobicContact CD1-CG1 3.7Å; I206-I224 HydrophobicContact CG2-CD1 4.28Å; L220-I224 HydrophobicContact CD1-CD1 4.04Å; L220-I224 HydrophobicContact CD1-CG1 4.22Å; L220-I224 HydrophobicContact CG-CD1 4Å; L220-I224 VanDerWaalsContact O-CG1 3.29Å; L220-I224 WeakPolarHBondContact O-CG1 3.39Å; L220-I224 PolarHBondContact O-N 3.25Å; F221-I224 PolarHBondContact O-N 3.08Å; N222-I224 PolarHBondContact O-N 3.3Å; I224-N226 VanDerWaalsContact C-N 3.3Å; I224-N226 PolarHBondContact O-N 3.4Å; I224-A227 PolarHBondContact O-N 3.19Å; I224-I228 HydrophobicContact CG2-CD1 4.19Å; I224-I228 WeakPolarHBondContact O-CG1 3.3Å; I224-I228 PolarHBondContact O-N 2.97Å; I224-I228 VanDerWaalsContact O-N 3.08Å; I224-L278 HydrophobicContact CB-CD1 4.04Å; I224-L278 HydrophobicContact CB-CD2 4.37Å; I224-L278 HydrophobicContact CD1-CD2 4.13Å; I224-L278 HydrophobicContact CG2-CD1 3.65Å; I224-L278 HydrophobicContact CG2-CD2 4.47Å |
| 225 | E | 94.2 | Very high | 89.2 | Confident | 13 Ų | 13 | 32 Ų | 32 | 6% | 0.061 | 17% | 0.165 | C | C | . | . | H | α-helix | trans | -58.2 | -45.2 | -179.4 | -157.7 | -153.9 | 118.9 | 0 | 0 | 111.8 | F221 N222 S223 I228 W229 L278 M281 K342 | F221-E225 PolarHBondContact O-N 2.99Å; N222-E225 WeakPolarHBondContact O-CB 3.42Å; N222-E225 PolarHBondContact O-N 3.14Å; S223-E225 VanDerWaalsContact C-N 3.34Å; E225-I228 WeakPolarHBondContact O-CB 3.42Å; E225-I228 PolarHBondContact O-N 3.03Å; E225-W229 VanDerWaalsContact O-CD1 3.27Å; E225-W229 PolarHBondContact O-N 2.91Å; E225-W229 PolarHBondContact OE1-NE1 3.33Å; E225-L278 HydrophobicContact CB-CD1 4.49Å; E225-M281 HydrophobicContact CG-CG 3.66Å; E225-K342 VanDerWaalsContact OE1-CD 3.31Å; E225-K342 WeakPolarHBondContact OE1-CD 3.31Å; E225-K342 WeakPolarHBondContact OE1-CE 3.45Å; E225-K342 IonicContact OE1-NZ 3.56Å; E225-K342 PolarHBondContact OE1-NZ 3.41Å; E225-K342 WeakPolarHBondContact OE2-CE 3.39Å; E225-K342 IonicContact OE2-NZ 2.66Å; E225-K342 PolarHBondContact OE2-NZ 2.74Å |
| 226 | N | 92.5 | Very high | 90.5 | Very high | 25 Ų | 25 | 27.2 Ų | 27.2 | 13% | 0.134 | 14% | 0.141 | C | C | . | . | H | α-helix | trans | -76.5 | -28.7 | -179.5 | -73.5 | -79.4 | 0 | 0 | 0 | 113.1 | N222 I224 I228 W229 N230 Y517 | N222-N226 PolarHBondContact O-N 2.73Å; N222-N226 PolarHBondContact O-ND2 2.84Å; I224-N226 VanDerWaalsContact C-N 3.3Å; I224-N226 PolarHBondContact O-N 3.4Å; N226-I228 PolarHBondContact O-N 3.28Å; N226-W229 PolarHBondContact O-N 3.11Å; N226-N230 VanDerWaalsContact O-CB 3.24Å; N226-N230 WeakPolarHBondContact O-CB 3.43Å; N226-N230 PolarHBondContact O-N 3.22Å; N226-N230 PolarHBondContact O-ND2 3.27Å; N226-N230 PolarHBondContact O-OD1 2.9Å; N226-Y517 HydrophobicContact CB-CD1 3.24Å; N226-Y517 HydrophobicContact CB-CE1 3.03Å; N226-Y517 HydrophobicContact CB-CG 4.21Å; N226-Y517 VanDerWaalsContact CG-CG 3.41Å; N226-Y517 WeakPolarHBondContact ND2-CD1 3.25Å; N226-Y517 WeakPolarHBondContact ND2-CD2 3.27Å; N226-Y517 WeakPolarHBondContact ND2-CE1 3.47Å; N226-Y517 WeakPolarHBondContact ND2-CE2 3.36Å; N226-Y517 VanDerWaalsContact OD1-CD1 3.25Å; N226-Y517 WeakPolarHBondContact OD1-CD1 3.24Å |
| 227 | A | 94.5 | Very high | 91.5 | Very high | 0 Ų | 0 | 26.2 Ų | 26.2 | 0% | 0 | 14% | 0.136 | C | C | . | . | H | α-helix | trans | -59.6 | -39.6 | 167.9 | 0 | 0 | 0 | 0 | 0 | 111.1 | F194 L202 S223 I224 W231 | F194-A227 HydrophobicContact CD2-CB 4.12Å; F194-A227 HydrophobicContact CE2-CB 4.02Å; L202-A227 HydrophobicContact CD2-CB 4.05Å; S223-A227 WeakPolarHBondContact O-CB 3.49Å; S223-A227 PolarHBondContact O-N 3.07Å; I224-A227 PolarHBondContact O-N 3.19Å; A227-W231 PolarHBondContact O-N 3.13Å; A227-W231 VanDerWaalsContact O-N 3.14Å |
| 228 | I | 95.9 | Very high | 92 | Very high | 0 Ų | 0 | 33.3 Ų | 33.3 | 0% | 0 | 16% | 0.162 | C | C | . | . | H | α-helix | trans | -66.2 | -47.8 | 174.6 | -62.7 | 165.9 | 0 | 0 | 0 | 110.6 | L199 I224 E225 N226 W231 M232 L278 M281 L282 L285 | L199-I228 HydrophobicContact CD1-CG1 4.25Å; I224-I228 HydrophobicContact CG2-CD1 4.19Å; I224-I228 WeakPolarHBondContact O-CG1 3.3Å; I224-I228 PolarHBondContact O-N 2.97Å; I224-I228 VanDerWaalsContact O-N 3.08Å; E225-I228 WeakPolarHBondContact O-CB 3.42Å; E225-I228 PolarHBondContact O-N 3.03Å; N226-I228 PolarHBondContact O-N 3.28Å; I228-W231 PolarHBondContact O-N 3.22Å; I228-M232 HydrophobicContact CG2-SD 4.13Å; I228-M232 WeakPolarHBondContact O-CG 3.37Å; I228-M232 PolarHBondContact O-N 3.5Å; I228-L278 HydrophobicContact CD1-CD1 4.37Å; I228-M281 HydrophobicContact CB-CE 4.36Å; I228-M281 HydrophobicContact CD1-CB 4.15Å; I228-M281 HydrophobicContact CG2-CE 3.64Å; I228-L282 HydrophobicContact CD1-CD2 4.28Å; I228-L285 HydrophobicContact CD1-CD1 4.02Å; I228-L285 HydrophobicContact CG1-CD1 4.15Å; I228-L285 HydrophobicContact CG2-CD1 3.99Å; I228-L285 HydrophobicContact CG2-CD2 4.11Å; I228-L285 HydrophobicContact CG2-CG 4.25Å |
| 229 | W | 94.4 | Very high | 92.3 | Very high | 4 Ų | 4 | 29.3 Ų | 29.3 | 2% | 0.015 | 14% | 0.144 | C | C | . | . | H | α-helix | trans | -60.8 | -46.4 | 177.7 | -77.8 | 120.3 | 0 | 0 | 0 | 112.7 | E225 N226 W231 M232 D233 M281 K342 K345 A346 Y349 | E225-W229 VanDerWaalsContact O-CD1 3.27Å; E225-W229 PolarHBondContact O-N 2.91Å; E225-W229 PolarHBondContact OE1-NE1 3.33Å; N226-W229 PolarHBondContact O-N 3.11Å; W229-W231 VanDerWaalsContact C-N 3.25Å; W229-W231 PolarHBondContact O-N 2.82Å; W229-M232 HydrophobicContact CE3-CE 4.31Å; W229-M232 HydrophobicContact CE3-SD 4.06Å; W229-M232 HydrophobicContact CZ3-CE 3.78Å; W229-M232 HydrophobicContact CZ3-SD 4.02Å; W229-M232 CarbonylContact O-C 3.6Å; W229-M232 WeakPolarHBondContact O-CB 3.43Å; W229-M232 PolarHBondContact O-N 3.03Å; W229-D233 WeakPolarHBondContact O-CB 3.28Å; W229-D233 PolarHBondContact O-N 3.45Å; W229-M281 HydrophobicContact CD2-CE 3.74Å; W229-M281 HydrophobicContact CE3-CE 4.19Å; W229-M281 HydrophobicContact CG-CE 4.27Å; W229-M281 HydrophobicContact CH2-CE 3.93Å; W229-M281 HydrophobicContact CH2-SD 4.12Å; W229-M281 HydrophobicContact CZ2-CE 3.48Å; W229-M281 VanDerWaalsContact CZ2-CE 3.48Å; W229-M281 HydrophobicContact CZ2-SD 3.37Å; W229-M281 WeakPolarHBondContact CZ2-SD 3.46Å; W229-M281 HydrophobicContact CZ3-CE 4.27Å; W229-K342 HydrophobicContact CZ2-CB 4.02Å; W229-K342 HydrophobicContact CZ2-CG 4.14Å; W229-K345 HydrophobicContact CD2-CD 4.49Å; W229-K345 HydrophobicContact CE3-CD 4.23Å; W229-K345 HydrophobicContact CH2-CB 3.71Å; W229-K345 HydrophobicContact CH2-CD 3.63Å; W229-K345 HydrophobicContact CH2-CG 3.58Å; W229-K345 HydrophobicContact CZ2-CB 4.31Å; W229-K345 HydrophobicContact CZ2-CD 3.87Å; W229-K345 HydrophobicContact CZ2-CG 4.28Å; W229-K345 HydrophobicContact CZ3-CB 4.36Å; W229-K345 HydrophobicContact CZ3-CD 3.81Å; W229-K345 HydrophobicContact CZ3-CG 3.75Å; W229-A346 HydrophobicContact CH2-CB 4.02Å; W229-Y349 HydrophobicContact CZ3-CE2 4.22Å |
| 230 | N | 92.6 | Very high | 92.5 | Very high | 28 Ų | 28 | 30.1 Ų | 30.1 | 15% | 0.15 | 14% | 0.143 | C | C | . | . | H | α-helix | trans | -58.5 | -39.6 | 178 | -70.5 | -8.8 | 0 | 0 | 0 | 111.4 | Q190 N226 T234 | Q190-N230 PolarHBondContact O-ND2 3.45Å; N226-N230 VanDerWaalsContact O-CB 3.24Å; N226-N230 WeakPolarHBondContact O-CB 3.43Å; N226-N230 PolarHBondContact O-N 3.22Å; N226-N230 PolarHBondContact O-ND2 3.27Å; N226-N230 PolarHBondContact O-OD1 2.9Å; N230-T234 VanDerWaalsContact O-CB 3.27Å; N230-T234 WeakPolarHBondContact O-CB 3.34Å; N230-T234 PolarHBondContact O-N 2.94Å; N230-T234 PolarHBondContact O-OG1 3.19Å |
| 231 | W | 95.1 | Very high | 92.5 | Very high | 3 Ų | 3 | 33.4 Ų | 33.4 | 1% | 0.011 | 16% | 0.16 | C | C | . | . | H | α-helix | trans | -64 | -45.8 | 173.7 | 169.9 | 72.2 | 0 | 0 | 0 | 111.7 | L196 L199 A227 I228 W229 D233 T234 Y235 R238 Y239 L242 L285 | L196-W231 HydrophobicContact CB-CZ2 4.38Å; L196-W231 HydrophobicContact CD1-CH2 4.29Å; L196-W231 HydrophobicContact CD1-CZ2 3.78Å; L199-W231 HydrophobicContact CD2-CB 4.12Å; L199-W231 HydrophobicContact CD2-CD2 3.79Å; L199-W231 HydrophobicContact CD2-CE3 3.8Å; L199-W231 HydrophobicContact CD2-CG 3.9Å; A227-W231 PolarHBondContact O-N 3.13Å; A227-W231 VanDerWaalsContact O-N 3.14Å; I228-W231 PolarHBondContact O-N 3.22Å; W229-W231 VanDerWaalsContact C-N 3.25Å; W229-W231 PolarHBondContact O-N 2.82Å; W231-D233 PolarHBondContact O-N 2.93Å; W231-T234 PolarHBondContact O-N 3.36Å; W231-Y235 AromaticContact CD1-CD2 3.63Å; W231-Y235 AromaticContact NE1-CD2 3.88Å; W231-Y235 PolarHBondContact O-N 3.24Å; W231-R238 HydrophobicContact CZ2-CB 4.24Å; W231-Y239 HydrophobicContact CH2-CD2 4.23Å; W231-Y239 AromaticContact CZ3-CD2 3.95Å; W231-Y239 HydrophobicContact CZ3-CD2 3.95Å; W231-L242 HydrophobicContact CH2-CD2 4.03Å; W231-L285 HydrophobicContact CE3-CD2 4.27Å; W231-L285 HydrophobicContact CH2-CD2 4.49Å; W231-L285 HydrophobicContact CZ3-CD2 3.61Å |
| 232 | M | 94 | Very high | 92.4 | Very high | 0 Ų | 0 | 33.6 Ų | 33.6 | 0% | 0 | 16% | 0.162 | C | C | . | . | H | α-helix | trans | -63.4 | -39.3 | 177.4 | -68.7 | 176.9 | 61.6 | 0 | 0 | 112.5 | I228 W229 Y235 P236 Y239 M281 A346 Y349 | I228-M232 HydrophobicContact CG2-SD 4.13Å; I228-M232 WeakPolarHBondContact O-CG 3.37Å; I228-M232 PolarHBondContact O-N 3.5Å; W229-M232 HydrophobicContact CE3-CE 4.31Å; W229-M232 HydrophobicContact CE3-SD 4.06Å; W229-M232 HydrophobicContact CZ3-CE 3.78Å; W229-M232 HydrophobicContact CZ3-SD 4.02Å; W229-M232 CarbonylContact O-C 3.6Å; W229-M232 WeakPolarHBondContact O-CB 3.43Å; W229-M232 PolarHBondContact O-N 3.03Å; M232-Y235 CarbonylContact O-C 3.46Å; M232-P236 VanDerWaalsContact O-CA 3.3Å; M232-P236 WeakPolarHBondContact O-CA 3.33Å; M232-P236 VanDerWaalsContact O-N 3.15Å; M232-Y239 HydrophobicContact CE-CD1 3.83Å; M232-Y239 HydrophobicContact CE-CD2 3.94Å; M232-Y239 HydrophobicContact CE-CE1 3.71Å; M232-Y239 HydrophobicContact CE-CE2 3.85Å; M232-Y239 HydrophobicContact CE-CG 3.93Å; M232-Y239 HydrophobicContact CG-CD2 4.14Å; M232-Y239 HydrophobicContact CG-CG 4.23Å; M232-Y239 HydrophobicContact SD-CD2 4.22Å; M232-Y239 HydrophobicContact SD-CE2 4.27Å; M232-M281 HydrophobicContact SD-CE 4.06Å; M232-A346 HydrophobicContact CE-CB 4.08Å; M232-Y349 HydrophobicContact CE-CD2 4.11Å; M232-Y349 HydrophobicContact CE-CG 4.2Å |
| 233 | D | 90.7 | Very high | 92.3 | Very high | 66 Ų | 66 | 32 Ų | 32 | 35% | 0.353 | 15% | 0.153 | S | C | . | . | H | α-helix | trans | -68.2 | -38 | 176.8 | -77.4 | -26.7 | 0 | 0 | 0 | 111.9 | W229 W231 Y349 | W229-D233 WeakPolarHBondContact O-CB 3.28Å; W229-D233 PolarHBondContact O-N 3.45Å; W231-D233 PolarHBondContact O-N 2.93Å; D233-Y349 PolarHBondContact OD1-OH 2.83Å |
| 234 | T | 90.4 | Very high | 91.9 | Very high | 52 Ų | 52 | 37 Ų | 37 | 32% | 0.319 | 18% | 0.179 | S | C | . | . | H | α-helix | trans | -76.3 | -36.5 | 178.8 | -53.2 | 0 | 0 | 0 | 0 | 111.9 | N230 W231 P236 | N230-T234 VanDerWaalsContact O-CB 3.27Å; N230-T234 WeakPolarHBondContact O-CB 3.34Å; N230-T234 PolarHBondContact O-N 2.94Å; N230-T234 PolarHBondContact O-OG1 3.19Å; W231-T234 PolarHBondContact O-N 3.36Å; T234-P236 VanDerWaalsContact C-CD 3.48Å |
| 235 | Y | 93.3 | Very high | 91.4 | Very high | 73 Ų | 73 | 41.8 Ų | 41.8 | 29% | 0.286 | 21% | 0.208 | S | C | . | . | trans | -130.4 | 62.4 | -174.6 | -56.7 | -73.2 | 0 | 0 | 0 | 113 | H193 D195 W231 M232 D237 R238 Y239 | H193-Y235 PolarHBondContact CE1-OH 2.96Å; H193-Y235 AromaticContact NE2-CZ 3.84Å; H193-Y235 PolarHBondContact NE2-OH 2.9Å; D195-Y235 HydrophobicContact CB-CE2 4.33Å; W231-Y235 AromaticContact CD1-CD2 3.63Å; W231-Y235 AromaticContact NE1-CD2 3.88Å; W231-Y235 PolarHBondContact O-N 3.24Å; M232-Y235 CarbonylContact O-C 3.46Å; Y235-D237 VanDerWaalsContact C-N 3.31Å; Y235-D237 PolarHBondContact O-N 3.41Å; Y235-R238 PolarHBondContact O-N 2.78Å; Y235-R238 VanDerWaalsContact O-N 3.12Å; Y235-Y239 PolarHBondContact O-N 3.16Å | ||
| 236 | P | 92.4 | Very high | 90.7 | Very high | 18 Ų | 18 | 44 Ų | 44 | 12% | 0.117 | 22% | 0.218 | C | C | . | . | H | α-helix | trans | -59.3 | -40.7 | -176.8 | 24.6 | -35.5 | 0 | 0 | 0 | 112.4 | M232 T234 R238 Y239 Y240 Y349 L440 | M232-P236 VanDerWaalsContact O-CA 3.3Å; M232-P236 WeakPolarHBondContact O-CA 3.33Å; M232-P236 VanDerWaalsContact O-N 3.15Å; T234-P236 VanDerWaalsContact C-CD 3.48Å; P236-R238 VanDerWaalsContact C-N 3.31Å; P236-R238 PolarHBondContact O-N 3.09Å; P236-Y239 PolarHBondContact O-N 3.5Å; P236-Y240 PolarHBondContact O-N 2.89Å; P236-Y349 HydrophobicContact CB-CD1 3.88Å; P236-Y349 HydrophobicContact CB-CE1 4.39Å; P236-L440 HydrophobicContact CB-CD1 4.01Å; P236-L440 HydrophobicContact CB-CD2 3.57Å; P236-L440 HydrophobicContact CB-CG 4.47Å; P236-L440 HydrophobicContact CG-CD2 3.52Å |
| 237 | D | 90.6 | Very high | 90.6 | Very high | 99 Ų | 99 | 44.9 Ų | 44.9 | 53% | 0.529 | 22% | 0.223 | S | C | . | . | H | α-helix | trans | -64.1 | -36.5 | 179.4 | -54 | -37.5 | 0 | 0 | 0 | 111.8 | Y235 Y239 Y240 D241 | Y235-D237 VanDerWaalsContact C-N 3.31Å; Y235-D237 PolarHBondContact O-N 3.41Å; D237-Y239 VanDerWaalsContact C-N 3.34Å; D237-Y240 WeakPolarHBondContact O-CB 3.23Å; D237-Y240 PolarHBondContact O-N 2.98Å; D237-D241 VanDerWaalsContact O-CG 3.32Å; D237-D241 PolarHBondContact O-N 2.88Å |
| 238 | R | 92 | Very high | 90.3 | Very high | 153 Ų | 153 | 54.8 Ų | 54.8 | 58% | 0.577 | 26% | 0.26 | S | S | * | . | H | α-helix | trans | -69.6 | -33.6 | 177.8 | -62.8 | -58.6 | -168.3 | 179.8 | 0.6 | 112.1 | W231 Y235 P236 D241 L242 | W231-R238 HydrophobicContact CZ2-CB 4.24Å; Y235-R238 PolarHBondContact O-N 2.78Å; Y235-R238 VanDerWaalsContact O-N 3.12Å; P236-R238 VanDerWaalsContact C-N 3.31Å; P236-R238 PolarHBondContact O-N 3.09Å; R238-D241 IonicContact NH1-OD2 3.75Å; R238-L242 WeakPolarHBondContact O-CB 3.34Å; R238-L242 PolarHBondContact O-N 3.34Å; R238-L242 VanDerWaalsContact O-N 3.09Å |
| 239 | Y | 92.9 | Very high | 90.1 | Very high | 0 Ų | 0 | 59.8 Ų | 59.8 | 0% | 0 | 28% | 0.284 | C | S | . | . | H | α-helix | trans | -68.1 | -41 | 171.4 | 172.6 | -101.7 | 0 | 0 | 0 | 111.3 | W231 M232 Y235 P236 D237 L242 Q243 I284 Y349 I350 | W231-Y239 HydrophobicContact CH2-CD2 4.23Å; W231-Y239 AromaticContact CZ3-CD2 3.95Å; W231-Y239 HydrophobicContact CZ3-CD2 3.95Å; M232-Y239 HydrophobicContact CE-CD1 3.83Å; M232-Y239 HydrophobicContact CE-CD2 3.94Å; M232-Y239 HydrophobicContact CE-CE1 3.71Å; M232-Y239 HydrophobicContact CE-CE2 3.85Å; M232-Y239 HydrophobicContact CE-CG 3.93Å; M232-Y239 HydrophobicContact CG-CD2 4.14Å; M232-Y239 HydrophobicContact CG-CG 4.23Å; M232-Y239 HydrophobicContact SD-CD2 4.22Å; M232-Y239 HydrophobicContact SD-CE2 4.27Å; Y235-Y239 PolarHBondContact O-N 3.16Å; P236-Y239 PolarHBondContact O-N 3.5Å; D237-Y239 VanDerWaalsContact C-N 3.34Å; Y239-L242 WeakPolarHBondContact O-CB 3.07Å; Y239-L242 PolarHBondContact O-N 3.44Å; Y239-Q243 HydrophobicContact CE1-CG 4.33Å; Y239-Q243 VanDerWaalsContact CE2-NE2 3.32Å; Y239-Q243 PolarHBondContact O-N 3.18Å; Y239-Q243 PolarHBondContact OH-NE2 2.95Å; Y239-I284 HydrophobicContact CE2-CG2 3.95Å; Y239-I284 WeakPolarHBondContact OH-CG2 3.38Å; Y239-Y349 HydrophobicContact CD1-CG 4.44Å; Y239-I350 HydrophobicContact CE1-CG1 4.15Å |
| 240 | Y | 89.4 | Confident | 90 | Very high | 54 Ų | 54 | 59.6 Ų | 59.6 | 21% | 0.212 | 28% | 0.283 | C | S | . | . | H | α-helix | trans | -60.4 | -46.7 | 174 | -177.2 | -111.7 | 0 | 0 | 0 | 111.8 | P236 D237 L242 Q243 I244 I350 N351 | P236-Y240 PolarHBondContact O-N 2.89Å; D237-Y240 WeakPolarHBondContact O-CB 3.23Å; D237-Y240 PolarHBondContact O-N 2.98Å; Y240-L242 PolarHBondContact O-N 3.32Å; Y240-Q243 WeakPolarHBondContact O-CB 3.36Å; Y240-Q243 PolarHBondContact O-N 3.22Å; Y240-I244 HydrophobicContact CD1-CD1 4.44Å; Y240-I244 HydrophobicContact CE1-CD1 3.94Å; Y240-I350 HydrophobicContact CD2-CB 4.43Å; Y240-I350 HydrophobicContact CD2-CG2 4.06Å; Y240-I350 HydrophobicContact CE2-CG2 3.8Å; Y240-N351 HydrophobicContact CE2-CB 4.06Å |
| 241 | D | 89.1 | Confident | 89.9 | Confident | 72 Ų | 72 | 59 Ų | 59 | 39% | 0.385 | 28% | 0.279 | S | S | . | . | H | α-helix | trans | -55.5 | -39.8 | 174.1 | -72.8 | -20 | 0 | 0 | 0 | 111.9 | D237 R238 Q243 I244 T245 | D237-D241 VanDerWaalsContact O-CG 3.32Å; D237-D241 PolarHBondContact O-N 2.88Å; R238-D241 IonicContact NH1-OD2 3.75Å; D241-Q243 VanDerWaalsContact C-N 3.27Å; D241-Q243 PolarHBondContact O-N 3.32Å; D241-I244 PolarHBondContact O-N 3.17Å; D241-I244 VanDerWaalsContact O-N 3.1Å; D241-T245 PolarHBondContact O-N 3.31Å |
| 242 | L | 90.1 | Very high | 89.7 | Confident | 9 Ų | 9 | 63.7 Ų | 63.7 | 5% | 0.047 | 30% | 0.301 | C | S | . | . | H | α-helix | trans | -63.2 | -32.2 | 179.2 | -174.1 | 69.4 | 0 | 0 | 0 | 112.1 | W231 R238 Y239 Y240 I244 N247 L250 L285 P287 | W231-L242 HydrophobicContact CH2-CD2 4.03Å; R238-L242 WeakPolarHBondContact O-CB 3.34Å; R238-L242 PolarHBondContact O-N 3.34Å; R238-L242 VanDerWaalsContact O-N 3.09Å; Y239-L242 WeakPolarHBondContact O-CB 3.07Å; Y239-L242 PolarHBondContact O-N 3.44Å; Y240-L242 PolarHBondContact O-N 3.32Å; L242-I244 PolarHBondContact O-N 2.82Å; L242-N247 HydrophobicContact CD1-CB 3.8Å; L242-L250 HydrophobicContact CD1-CD2 4.05Å; L242-L250 HydrophobicContact CD2-CD2 3.6Å; L242-L250 HydrophobicContact CG-CD2 4.46Å; L242-L285 HydrophobicContact CD2-CD2 4.33Å; L242-P287 VanDerWaalsContact O-CG 3.26Å; L242-P287 WeakPolarHBondContact O-CG 3.45Å |
| 243 | Q | 87.5 | Confident | 89.6 | Confident | 4 Ų | 4 | 63.8 Ų | 63.8 | 2% | 0.019 | 30% | 0.302 | C | S | . | . | H | α-helix | trans | -66.6 | -26 | 175.7 | -62.2 | -58.9 | -54.8 | 0 | 0 | 112.7 | Y239 Y240 D241 I284 I350 | Y239-Q243 HydrophobicContact CE1-CG 4.33Å; Y239-Q243 VanDerWaalsContact CE2-NE2 3.32Å; Y239-Q243 PolarHBondContact O-N 3.18Å; Y239-Q243 PolarHBondContact OH-NE2 2.95Å; Y240-Q243 WeakPolarHBondContact O-CB 3.36Å; Y240-Q243 PolarHBondContact O-N 3.22Å; D241-Q243 VanDerWaalsContact C-N 3.27Å; D241-Q243 PolarHBondContact O-N 3.32Å; Q243-I284 PolarHBondContact NE2-O 3.36Å; Q243-I350 HydrophobicContact CG-CD1 3.81Å; Q243-I350 HydrophobicContact CG-CG1 4.05Å |
| 244 | I | 83.1 | Confident | 89.7 | Confident | 105 Ų | 105 | 60.8 Ų | 60.8 | 54% | 0.538 | 29% | 0.286 | S | S | . | . | H | α-helix | trans | -92.4 | -47.7 | 179.3 | -56.3 | 172.6 | 0 | 0 | 0 | 110.4 | Y240 D241 L242 | Y240-I244 HydrophobicContact CD1-CD1 4.44Å; Y240-I244 HydrophobicContact CE1-CD1 3.94Å; D241-I244 PolarHBondContact O-N 3.17Å; D241-I244 VanDerWaalsContact O-N 3.1Å; L242-I244 PolarHBondContact O-N 2.82Å |
| 245 | T | 84 | Confident | 89.7 | Confident | 99 Ų | 99 | 60.1 Ų | 60.1 | 61% | 0.607 | 28% | 0.278 | S | S | * | . | S | Bend | trans | -118.7 | 123.7 | -172.6 | -50.4 | 0 | 0 | 0 | 0 | 111.2 | D241 | D241-T245 PolarHBondContact O-N 3.31Š|
| 246 | Q | 81 | Confident | 89.6 | Confident | 60 Ų | 60 | 61.9 Ų | 61.9 | 28% | 0.28 | 29% | 0.285 | S | S | . | . | trans | -74.9 | 146.6 | -175.9 | -77.5 | 160.6 | 18.8 | 0 | 0 | 114.4 | K288 | Q246-K288 VanDerWaalsContact CD-CE 3.49Š| ||
| 247 | N | 89.4 | Confident | 89.7 | Confident | 43 Ų | 43 | 61 Ų | 61 | 23% | 0.23 | 28% | 0.279 | C | S | . | . | trans | -110.6 | 102.6 | 166.9 | -171.9 | -37.8 | 0 | 0 | 0 | 110 | L242 E249 L250 D251 | L242-N247 HydrophobicContact CD1-CB 3.8Å; N247-E249 VanDerWaalsContact C-N 3.27Å; N247-E249 PolarHBondContact O-N 3.17Å; N247-E249 PolarHBondContact OD1-N 2.92Å; N247-E249 VanDerWaalsContact OD1-N 3.14Å; N247-L250 HydrophobicContact CB-CB 3.95Å; N247-L250 PolarHBondContact O-N 3.25Å; N247-L250 VanDerWaalsContact O-N 3.15Å; N247-L250 PolarHBondContact OD1-N 2.95Å; N247-D251 PolarHBondContact O-N 3.05Å | ||
| 248 | R | 88.4 | Confident | 89.8 | Confident | 209 Ų | 209 | 56.5 Ų | 56.5 | 79% | 0.789 | 26% | 0.255 | S | S | * | . | H | α-helix | trans | -60.5 | -33.2 | -176.5 | -66.3 | -174.1 | -179.3 | -178.6 | 1 | 113.7 | E252 | R248-E252 WeakPolarHBondContact O-CB 3.39Å; R248-E252 PolarHBondContact O-N 3.43Å; R248-E252 VanDerWaalsContact O-N 3.1Å |
| 249 | E | 91.8 | Very high | 89.8 | Confident | 105 Ų | 105 | 52.1 Ų | 52.1 | 49% | 0.491 | 24% | 0.243 | S | C | . | . | H | α-helix | trans | -70.1 | -40.9 | 178.3 | -69.1 | -169.1 | -163.3 | 0 | 0 | 111.2 | I200 R204 N247 C253 | I200-E249 HydrophobicContact CG2-CB 4.29Å; R204-E249 IonicContact CZ-OE2 3.53Å; R204-E249 IonicContact NH2-OE2 2.86Å; R204-E249 PolarHBondContact NH2-OE2 2.95Å; N247-E249 VanDerWaalsContact C-N 3.27Å; N247-E249 PolarHBondContact O-N 3.17Å; N247-E249 PolarHBondContact OD1-N 2.92Å; N247-E249 VanDerWaalsContact OD1-N 3.14Å; E249-C253 PolarHBondContact O-N 3.41Å; E249-C253 VanDerWaalsContact O-N 3.15Å; E249-C253 PolarHBondContact O-SG 3.14Å |
| 250 | L | 93.3 | Very high | 89.8 | Confident | 0 Ų | 0 | 53.1 Ų | 53.1 | 0% | 0 | 25% | 0.247 | C | C | . | . | H | α-helix | trans | -64.1 | -48.4 | 175.3 | -178.6 | 64 | 0 | 0 | 0 | 110.7 | L196 I200 L203 L242 N247 E252 C253 C254 L285 | L196-L250 HydrophobicContact CD1-CD2 4.25Å; I200-L250 HydrophobicContact CD1-CB 4.13Å; I200-L250 HydrophobicContact CG1-CB 4.04Å; I200-L250 HydrophobicContact CG1-CD1 3.87Å; L203-L250 HydrophobicContact CD1-CD1 3.76Å; L242-L250 HydrophobicContact CD1-CD2 4.05Å; L242-L250 HydrophobicContact CD2-CD2 3.6Å; L242-L250 HydrophobicContact CG-CD2 4.46Å; N247-L250 HydrophobicContact CB-CB 3.95Å; N247-L250 PolarHBondContact O-N 3.25Å; N247-L250 VanDerWaalsContact O-N 3.15Å; N247-L250 PolarHBondContact OD1-N 2.95Å; L250-E252 VanDerWaalsContact C-N 3.28Å; L250-E252 PolarHBondContact O-N 3.49Å; L250-C253 WeakPolarHBondContact O-CB 3.44Å; L250-C253 PolarHBondContact O-N 2.9Å; L250-C253 VanDerWaalsContact O-N 3.15Å; L250-C254 WeakPolarHBondContact O-CB 3.49Å; L250-C254 PolarHBondContact O-N 3.46Å; L250-C254 PolarHBondContact O-SG 2.58Å; L250-L285 HydrophobicContact CD2-CB 4.25Å |
| 251 | D | 89.3 | Confident | 89.9 | Confident | 14 Ų | 14 | 50.6 Ų | 50.6 | 8% | 0.075 | 24% | 0.237 | C | C | . | . | H | α-helix | trans | -52.5 | -50 | 177.9 | -69.1 | -20.1 | 0 | 0 | 0 | 110.2 | N247 C253 C254 Y255 | N247-D251 PolarHBondContact O-N 3.05Å; D251-C253 PolarHBondContact O-N 2.81Å; D251-C254 PolarHBondContact O-N 3.04Å; D251-Y255 HydrophobicContact CB-CD2 4.27Å; D251-Y255 HydrophobicContact CB-CE2 4.24Å; D251-Y255 WeakPolarHBondContact O-CB 3.45Å; D251-Y255 WeakPolarHBondContact O-CD2 3.44Å; D251-Y255 PolarHBondContact O-N 2.83Å |
| 252 | E | 90.6 | Very high | 90.1 | Very high | 102 Ų | 102 | 49.2 Ų | 49.2 | 48% | 0.477 | 23% | 0.23 | S | C | . | . | H | α-helix | trans | -61 | -43.5 | -179.1 | -170.7 | 176.9 | -169.3 | 0 | 0 | 112.7 | R248 L250 R256 | R248-E252 WeakPolarHBondContact O-CB 3.39Å; R248-E252 PolarHBondContact O-N 3.43Å; R248-E252 VanDerWaalsContact O-N 3.1Å; L250-E252 VanDerWaalsContact C-N 3.28Å; L250-E252 PolarHBondContact O-N 3.49Å; E252-R256 WeakPolarHBondContact O-CG 3.25Å; E252-R256 PolarHBondContact O-N 2.88Å; E252-R256 VanDerWaalsContact O-N 3.08Å; E252-R256 IonicContact OE1-CZ 2.77Å; E252-R256 IonicContact OE1-NE 3.77Å; E252-R256 IonicContact OE1-NH2 3.86Å; E252-R256 PolarHBondContact OE1-NH2 3.24Å; E252-R256 IonicContact OE2-NH2 2.75Å |
| 253 | C | 93 | Very high | 90.1 | Very high | 3 Ų | 3 | 52 Ų | 52 | 2% | 0.02 | 25% | 0.251 | C | S | . | . | H | α-helix | trans | -61.1 | -49.1 | 174.7 | -77.4 | 0 | 0 | 0 | 0 | 111.5 | L203 E249 L250 D251 Y255 R256 L257 | L203-C253 HydrophobicContact CB-CB 4.06Å; E249-C253 PolarHBondContact O-N 3.41Å; E249-C253 VanDerWaalsContact O-N 3.15Å; E249-C253 PolarHBondContact O-SG 3.14Å; L250-C253 WeakPolarHBondContact O-CB 3.44Å; L250-C253 PolarHBondContact O-N 2.9Å; L250-C253 VanDerWaalsContact O-N 3.15Å; D251-C253 PolarHBondContact O-N 2.81Å; C253-Y255 PolarHBondContact O-N 3.27Å; C253-R256 PolarHBondContact O-N 3.41Å; C253-L257 VanDerWaalsContact O-CB 3.3Å; C253-L257 WeakPolarHBondContact O-CB 3.39Å; C253-L257 PolarHBondContact O-N 3.26Å |
| 254 | C | 93.3 | Very high | 90.2 | Very high | 2 Ų | 2 | 52.2 Ų | 52.2 | 1% | 0.014 | 25% | 0.251 | C | S | . | . | H | α-helix | trans | -62.5 | -42.6 | 179.4 | -73.2 | 0 | 0 | 0 | 0 | 112.1 | L250 D251 L257 F258 C286 | L250-C254 WeakPolarHBondContact O-CB 3.49Å; L250-C254 PolarHBondContact O-N 3.46Å; L250-C254 PolarHBondContact O-SG 2.58Å; D251-C254 PolarHBondContact O-N 3.04Å; C254-L257 PolarHBondContact O-N 3.4Å; C254-F258 WeakPolarHBondContact O-CB 3.38Å; C254-F258 PolarHBondContact O-N 3.42Å; C254-C286 WeakPolarHBondContact CB-SG 3.48Å |
| 255 | Y | 89.7 | Confident | 90.6 | Very high | 38 Ų | 38 | 47.4 Ų | 47.4 | 15% | 0.149 | 23% | 0.227 | C | C | . | . | H | α-helix | trans | -60.2 | -50.7 | 176 | -85.2 | -64.6 | 0 | 0 | 0 | 112.1 | D251 C253 L257 F258 D259 I289 Q309 | D251-Y255 HydrophobicContact CB-CD2 4.27Å; D251-Y255 HydrophobicContact CB-CE2 4.24Å; D251-Y255 WeakPolarHBondContact O-CB 3.45Å; D251-Y255 WeakPolarHBondContact O-CD2 3.44Å; D251-Y255 PolarHBondContact O-N 2.83Å; C253-Y255 PolarHBondContact O-N 3.27Å; Y255-L257 VanDerWaalsContact C-N 3.29Å; Y255-L257 PolarHBondContact O-N 2.98Å; Y255-F258 PolarHBondContact O-N 2.9Å; Y255-D259 PolarHBondContact O-N 2.93Å; Y255-I289 HydrophobicContact CD1-CD1 4.45Å; Y255-I289 HydrophobicContact CE1-CD1 3.63Å; Y255-I289 HydrophobicContact CE1-CG1 4.02Å; Y255-I289 HydrophobicContact CE2-CD1 4.46Å; Y255-I289 WeakPolarHBondContact OH-CG1 3.49Å; Y255-Q309 VanDerWaalsContact CD1-NE2 3.28Å |
| 256 | R | 91.3 | Very high | 90.7 | Very high | 111 Ų | 111 | 46.1 Ų | 46.1 | 42% | 0.419 | 23% | 0.227 | S | C | . | . | H | α-helix | trans | -61.2 | -41.6 | 179.7 | -71.5 | -175.4 | -151.1 | 162.4 | 2.6 | 111.4 | E252 C253 Q260 | E252-R256 WeakPolarHBondContact O-CG 3.25Å; E252-R256 PolarHBondContact O-N 2.88Å; E252-R256 VanDerWaalsContact O-N 3.08Å; E252-R256 IonicContact OE1-CZ 2.77Å; E252-R256 IonicContact OE1-NE 3.77Å; E252-R256 IonicContact OE1-NH2 3.86Å; E252-R256 PolarHBondContact OE1-NH2 3.24Å; E252-R256 IonicContact OE2-NH2 2.75Å; C253-R256 PolarHBondContact O-N 3.41Å; R256-Q260 VanDerWaalsContact O-CG 3.25Å; R256-Q260 WeakPolarHBondContact O-CG 3.35Å; R256-Q260 PolarHBondContact O-N 3.35Å |
| 257 | L | 93.6 | Very high | 91 | Very high | 0 Ų | 0 | 49.4 Ų | 49.4 | 0% | 0 | 24% | 0.242 | C | C | . | . | H | α-helix | trans | -68.6 | -42.4 | 179.8 | -167.5 | 61.8 | 0 | 0 | 0 | 111.4 | L203 I206 F212 C253 C254 Y255 D259 Q260 L261 L282 | L203-L257 HydrophobicContact CD2-CD2 3.81Å; I206-L257 HydrophobicContact CG2-CD1 3.73Å; F212-L257 HydrophobicContact CE2-CD1 3.66Å; F212-L257 HydrophobicContact CZ-CD1 3.58Å; C253-L257 VanDerWaalsContact O-CB 3.3Å; C253-L257 WeakPolarHBondContact O-CB 3.39Å; C253-L257 PolarHBondContact O-N 3.26Å; C254-L257 PolarHBondContact O-N 3.4Å; Y255-L257 VanDerWaalsContact C-N 3.29Å; Y255-L257 PolarHBondContact O-N 2.98Å; L257-D259 VanDerWaalsContact C-N 3.34Å; L257-D259 PolarHBondContact O-N 3.35Å; L257-Q260 WeakPolarHBondContact O-CB 3.38Å; L257-Q260 PolarHBondContact O-N 2.91Å; L257-L261 HydrophobicContact CG-CD1 4.39Å; L257-L261 WeakPolarHBondContact O-CG 3Å; L257-L261 PolarHBondContact O-N 3.11Å; L257-L282 HydrophobicContact CB-CD1 4.03Å; L257-L282 HydrophobicContact CD2-CD1 3.86Å; L257-L282 HydrophobicContact CD2-CD2 3.84Å; L257-L282 HydrophobicContact CD2-CG 4.5Å; L257-L282 HydrophobicContact CG-CD1 3.84Å |
| 258 | F | 93.7 | Very high | 90.9 | Very high | 4 Ų | 4 | 49.4 Ų | 49.4 | 2% | 0.018 | 25% | 0.245 | C | C | . | . | H | α-helix | trans | -58.1 | -46.1 | 175.3 | -171.6 | -79.6 | 0 | 0 | 0 | 111.3 | C254 Y255 Q260 L261 D262 Q279 L282 L283 K308 Q309 F312 | C254-F258 WeakPolarHBondContact O-CB 3.38Å; C254-F258 PolarHBondContact O-N 3.42Å; Y255-F258 PolarHBondContact O-N 2.9Å; F258-Q260 VanDerWaalsContact C-N 3.28Å; F258-Q260 PolarHBondContact O-N 3.35Å; F258-L261 PolarHBondContact O-N 2.69Å; F258-D262 HydrophobicContact CD1-CB 4.46Å; F258-D262 HydrophobicContact CE1-CB 4.34Å; F258-D262 VanDerWaalsContact O-CB 3.29Å; F258-D262 WeakPolarHBondContact O-CB 3.45Å; F258-D262 PolarHBondContact O-N 2.9Å; F258-Q279 HydrophobicContact CD2-CB 4.17Å; F258-Q279 HydrophobicContact CD2-CG 4.25Å; F258-Q279 HydrophobicContact CE2-CB 3.74Å; F258-Q279 HydrophobicContact CE2-CG 4.05Å; F258-L282 HydrophobicContact CB-CD1 4.46Å; F258-L283 HydrophobicContact CD2-CD1 4.35Å; F258-L283 HydrophobicContact CD2-CG 4.33Å; F258-L283 HydrophobicContact CE2-CD1 3.52Å; F258-L283 HydrophobicContact CE2-CG 3.95Å; F258-L283 HydrophobicContact CZ-CD1 4.16Å; F258-K308 HydrophobicContact CE1-CB 4.33Å; F258-Q309 HydrophobicContact CD1-CG 4.12Å; F258-Q309 HydrophobicContact CE1-CG 3.92Å; F258-Q309 HydrophobicContact CZ-CG 4.15Å; F258-F312 HydrophobicContact CE2-CD1 4.25Å; F258-F312 HydrophobicContact CE2-CG 4.3Å; F258-F312 HydrophobicContact CZ-CB 3.75Å; F258-F312 HydrophobicContact CZ-CD1 4.11Å; F258-F312 HydrophobicContact CZ-CD2 4.37Å; F258-F312 AromaticContact CZ-CG 3.82Å; F258-F312 HydrophobicContact CZ-CG 3.82Å |
| 259 | D | 91.6 | Very high | 90.8 | Very high | 61 Ų | 61 | 41.8 Ų | 41.8 | 33% | 0.326 | 22% | 0.224 | S | C | . | . | H | α-helix | trans | -58.8 | -38.8 | 177 | -94.7 | -31.7 | 0 | 0 | 0 | 113.2 | Y255 L257 S263 K308 | Y255-D259 PolarHBondContact O-N 2.93Å; L257-D259 VanDerWaalsContact C-N 3.34Å; L257-D259 PolarHBondContact O-N 3.35Å; D259-S263 WeakPolarHBondContact O-CB 3.25Å; D259-S263 PolarHBondContact O-N 2.77Å; D259-S263 PolarHBondContact O-OG 2.89Å; D259-K308 WeakPolarHBondContact OD1-CD 3.42Å; D259-K308 WeakPolarHBondContact OD1-CE 3.32Å; D259-K308 IonicContact OD1-NZ 3.71Å; D259-K308 PolarHBondContact OD1-NZ 3.4Å |
| 260 | Q | 92.1 | Very high | 90.6 | Very high | 21 Ų | 21 | 44.4 Ų | 44.4 | 10% | 0.098 | 23% | 0.234 | C | C | . | . | H | α-helix | trans | -69.5 | -44.4 | 178.1 | -68.7 | 169.6 | 15.7 | 0 | 0 | 111.3 | S207 R210 F212 R256 L257 F258 S263 F264 | S207-Q260 PolarHBondContact O-NE2 3.35Å; R210-Q260 HydrophobicContact CG-CG 4.49Å; R210-Q260 VanDerWaalsContact NE-NE2 3.12Å; F212-Q260 HydrophobicContact CD2-CB 4.11Å; F212-Q260 HydrophobicContact CE2-CB 4.11Å; R256-Q260 VanDerWaalsContact O-CG 3.25Å; R256-Q260 WeakPolarHBondContact O-CG 3.35Å; R256-Q260 PolarHBondContact O-N 3.35Å; L257-Q260 WeakPolarHBondContact O-CB 3.38Å; L257-Q260 PolarHBondContact O-N 2.91Å; F258-Q260 VanDerWaalsContact C-N 3.28Å; F258-Q260 PolarHBondContact O-N 3.35Å; Q260-S263 PolarHBondContact O-N 2.91Å; Q260-F264 PolarHBondContact O-N 3.47Å |
| 261 | L | 93 | Very high | 90.4 | Very high | 0 Ų | 0 | 46 Ų | 46 | 0% | 0 | 24% | 0.24 | C | C | . | . | H | α-helix | trans | -66.4 | -38 | 177 | -67.8 | 174.3 | 0 | 0 | 0 | 111.7 | F212 F221 L257 F258 F264 A265 V275 L278 Q279 L282 | F212-L261 HydrophobicContact CD1-CD2 4.21Å; F212-L261 HydrophobicContact CD2-CD2 4.3Å; F212-L261 HydrophobicContact CE1-CD2 4.05Å; F212-L261 HydrophobicContact CE2-CD2 4.16Å; F212-L261 HydrophobicContact CG-CD2 4.32Å; F212-L261 HydrophobicContact CZ-CD2 4.02Å; F221-L261 HydrophobicContact CD1-CD2 4.23Å; F221-L261 HydrophobicContact CE1-CD2 3.64Å; F221-L261 HydrophobicContact CZ-CD2 4.38Å; L257-L261 HydrophobicContact CG-CD1 4.39Å; L257-L261 WeakPolarHBondContact O-CG 3Å; L257-L261 PolarHBondContact O-N 3.11Å; F258-L261 PolarHBondContact O-N 2.69Å; L261-F264 WeakPolarHBondContact O-CB 3.39Å; L261-F264 PolarHBondContact O-N 2.87Å; L261-A265 VanDerWaalsContact O-CB 3.31Å; L261-A265 WeakPolarHBondContact O-CB 3.16Å; L261-A265 PolarHBondContact O-N 2.84Å; L261-V275 HydrophobicContact CD2-CG1 4.11Å; L261-L278 HydrophobicContact CD1-CD2 3.72Å; L261-L278 HydrophobicContact CD1-CG 3.89Å; L261-L278 HydrophobicContact CD2-CD2 4.39Å; L261-Q279 HydrophobicContact CB-CG 4.02Å; L261-Q279 HydrophobicContact CD1-CG 4.26Å; L261-L282 HydrophobicContact CD1-CD1 3.67Å |
| 262 | D | 92 | Very high | 90.4 | Very high | 43 Ų | 43 | 49.4 Ų | 49.4 | 23% | 0.23 | 25% | 0.252 | C | S | . | . | H | α-helix | trans | -63.8 | -42.6 | 176 | -171.8 | 63.2 | 0 | 0 | 0 | 111.5 | F258 F264 A265 A266 K308 | F258-D262 HydrophobicContact CD1-CB 4.46Å; F258-D262 HydrophobicContact CE1-CB 4.34Å; F258-D262 VanDerWaalsContact O-CB 3.29Å; F258-D262 WeakPolarHBondContact O-CB 3.45Å; F258-D262 PolarHBondContact O-N 2.9Å; D262-F264 VanDerWaalsContact C-N 3.32Å; D262-F264 PolarHBondContact O-N 3.48Å; D262-A265 WeakPolarHBondContact O-CB 3.49Å; D262-A265 PolarHBondContact O-N 2.85Å; D262-A266 PolarHBondContact O-N 3.09Å; D262-K308 WeakPolarHBondContact OD2-CD 3.33Å |
| 263 | S | 90.7 | Very high | 90.4 | Very high | 69 Ų | 69 | 45.5 Ų | 45.5 | 48% | 0.483 | 24% | 0.235 | S | C | . | . | H | α-helix | trans | -61.1 | -41.6 | 174 | -55 | 0 | 0 | 0 | 0 | 111.5 | D259 Q260 A266 | D259-S263 WeakPolarHBondContact O-CB 3.25Å; D259-S263 PolarHBondContact O-N 2.77Å; D259-S263 PolarHBondContact O-OG 2.89Å; Q260-S263 PolarHBondContact O-N 2.91Å; S263-A266 PolarHBondContact O-N 3.38Å |
| 264 | F | 90.3 | Very high | 90.2 | Very high | 8 Ų | 8 | 46.6 Ų | 46.6 | 4% | 0.035 | 24% | 0.243 | C | C | . | . | H | α-helix | trans | -67.2 | -37.2 | 175.3 | 178.5 | -99.2 | 0 | 0 | 0 | 112.6 | F212 F221 Q260 L261 D262 A266 R271 V275 | F212-F264 HydrophobicContact CB-CD2 4.24Å; F212-F264 HydrophobicContact CB-CG 4.43Å; F212-F264 WeakPolarHBondContact O-CD2 3.31Å; F212-F264 WeakPolarHBondContact O-CE2 3.39Å; F221-F264 AromaticContact CE2-CE1 3.99Å; F221-F264 HydrophobicContact CE2-CE1 3.99Å; F221-F264 HydrophobicContact CZ-CD1 4.17Å; F221-F264 AromaticContact CZ-CE1 3.77Å; F221-F264 HydrophobicContact CZ-CE1 3.77Å; F221-F264 HydrophobicContact CZ-CZ 4.31Å; Q260-F264 PolarHBondContact O-N 3.47Å; L261-F264 WeakPolarHBondContact O-CB 3.39Å; L261-F264 PolarHBondContact O-N 2.87Å; D262-F264 VanDerWaalsContact C-N 3.32Å; D262-F264 PolarHBondContact O-N 3.48Å; F264-A266 VanDerWaalsContact C-N 3.3Å; F264-A266 PolarHBondContact O-N 3.36Å; F264-R271 HydrophobicContact CD1-CB 4.16Å; F264-R271 HydrophobicContact CD1-CG 4.44Å; F264-R271 HydrophobicContact CE1-CB 3.81Å; F264-R271 HydrophobicContact CE1-CG 3.74Å; F264-R271 HydrophobicContact CE2-CG 4.44Å; F264-R271 HydrophobicContact CZ-CB 4.33Å; F264-R271 VanDerWaalsContact CZ-CD 3.49Å; F264-R271 HydrophobicContact CZ-CG 3.75Å; F264-V275 HydrophobicContact CD1-CG1 3.83Å; F264-V275 HydrophobicContact CE1-CG1 4.06Å |
| 265 | A | 89.8 | Confident | 90.2 | Very high | 4 Ų | 4 | 46.5 Ų | 46.5 | 3% | 0.033 | 24% | 0.242 | C | C | . | . | H | α-helix | trans | -69.3 | -25.5 | 178.1 | 0 | 0 | 0 | 0 | 0 | 113.4 | L261 D262 E267 R272 V275 | L261-A265 VanDerWaalsContact O-CB 3.31Å; L261-A265 WeakPolarHBondContact O-CB 3.16Å; L261-A265 PolarHBondContact O-N 2.84Å; D262-A265 WeakPolarHBondContact O-CB 3.49Å; D262-A265 PolarHBondContact O-N 2.85Å; A265-E267 PolarHBondContact O-N 3.1Å; A265-R272 HydrophobicContact CB-CB 4.28Å; A265-R272 HydrophobicContact CB-CG 4.35Å; A265-V275 HydrophobicContact CB-CG2 3.73Å |
| 266 | A | 87.7 | Confident | 90.4 | Very high | 72 Ų | 72 | 45 Ų | 45 | 60% | 0.595 | 24% | 0.237 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -64.5 | -25 | 179.9 | 0 | 0 | 0 | 0 | 0 | 112.6 | D262 S263 F264 | D262-A266 PolarHBondContact O-N 3.09Å; S263-A266 PolarHBondContact O-N 3.38Å; F264-A266 VanDerWaalsContact C-N 3.3Å; F264-A266 PolarHBondContact O-N 3.36Å |
| 267 | E | 85.6 | Confident | 90.6 | Very high | 129 Ų | 129 | 40.4 Ų | 40.4 | 60% | 0.603 | 22% | 0.221 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -72.5 | -31.6 | -172.9 | -65.5 | -176.2 | -131.8 | 0 | 0 | 114.4 | A265 R271 | A265-E267 PolarHBondContact O-N 3.1Å; E267-R271 IonicContact OE1-NH1 3.46Å; E267-R271 PolarHBondContact OE1-NH1 3.29Å; E267-R271 VanDerWaalsContact OE1-NH1 3.13Å; E267-R271 IonicContact OE2-CZ 2.83Å; E267-R271 IonicContact OE2-NH1 3.68Å; E267-R271 PolarHBondContact OE2-NH1 3.01Å; E267-R271 IonicContact OE2-NH2 2.82Å |
| 268 | S | 88.4 | Confident | 90.7 | Very high | 42 Ų | 42 | 40.6 Ų | 40.6 | 29% | 0.294 | 22% | 0.222 | S | C | . | . | trans | -160.5 | 159.5 | 176.6 | 71.8 | 0 | 0 | 0 | 0 | 113.4 | K270 R271 R272 | S268-K270 VanDerWaalsContact C-N 3.26Å; S268-K270 PolarHBondContact O-N 3.19Å; S268-R271 PolarHBondContact O-N 3.28Å; S268-R271 WeakPolarHBondContact OG-CG 3.31Å; S268-R271 PolarHBondContact OG-N 3.37Å; S268-R271 VanDerWaalsContact OG-N 3.09Å; S268-R272 WeakPolarHBondContact O-CB 3.45Å; S268-R272 PolarHBondContact O-N 3.3Å | ||
| 269 | S | 86.9 | Confident | 90.7 | Very high | 50 Ų | 50 | 40.4 Ų | 40.4 | 35% | 0.35 | 22% | 0.221 | S | C | . | . | H | α-helix | trans | -62.5 | -31.4 | 173.2 | 59.1 | 0 | 0 | 0 | 0 | 113.1 | S273 | S269-S273 PolarHBondContact O-N 3.46Å; S269-S273 PolarHBondContact O-OG 3.19Å |
| 270 | K | 86.3 | Confident | 90.9 | Very high | 159 Ų | 159 | 37.5 Ų | 37.5 | 69% | 0.691 | 21% | 0.206 | S | C | * | . | H | α-helix | trans | -71.6 | -40.7 | 178.5 | -173.5 | -179.7 | 178.4 | -176.2 | 0 | 112 | S268 R272 S273 S274 | S268-K270 VanDerWaalsContact C-N 3.26Å; S268-K270 PolarHBondContact O-N 3.19Å; K270-R272 VanDerWaalsContact C-N 3.34Å; K270-S273 PolarHBondContact O-OG 3.45Å; K270-S274 PolarHBondContact O-N 3.42Å; K270-S274 PolarHBondContact O-OG 3.45Å |
| 271 | R | 89.2 | Confident | 91 | Very high | 35 Ų | 35 | 36.5 Ų | 36.5 | 13% | 0.132 | 20% | 0.201 | C | C | . | . | H | α-helix | trans | -68.2 | -37.1 | 173.4 | -73.4 | -176.7 | -177.9 | -175.1 | 15 | 111.7 | D215 F264 E267 S268 S274 V275 | D215-R271 IonicContact OD1-CZ 3.65Å; D215-R271 IonicContact OD1-NE 3.92Å; D215-R271 PolarHBondContact OD1-NE 2.88Å; D215-R271 IonicContact OD1-NH2 2.63Å; D215-R271 PolarHBondContact OD1-NH2 3.33Å; D215-R271 IonicContact OD2-NH2 2.83Å; F264-R271 HydrophobicContact CD1-CB 4.16Å; F264-R271 HydrophobicContact CD1-CG 4.44Å; F264-R271 HydrophobicContact CE1-CB 3.81Å; F264-R271 HydrophobicContact CE1-CG 3.74Å; F264-R271 HydrophobicContact CE2-CG 4.44Å; F264-R271 HydrophobicContact CZ-CB 4.33Å; F264-R271 VanDerWaalsContact CZ-CD 3.49Å; F264-R271 HydrophobicContact CZ-CG 3.75Å; E267-R271 IonicContact OE1-NH1 3.46Å; E267-R271 PolarHBondContact OE1-NH1 3.29Å; E267-R271 VanDerWaalsContact OE1-NH1 3.13Å; E267-R271 IonicContact OE2-CZ 2.83Å; E267-R271 IonicContact OE2-NH1 3.68Å; E267-R271 PolarHBondContact OE2-NH1 3.01Å; E267-R271 IonicContact OE2-NH2 2.82Å; S268-R271 PolarHBondContact O-N 3.28Å; S268-R271 WeakPolarHBondContact OG-CG 3.31Å; S268-R271 PolarHBondContact OG-N 3.37Å; S268-R271 VanDerWaalsContact OG-N 3.09Å; R271-S274 PolarHBondContact O-N 3.31Å; R271-S274 PolarHBondContact O-OG 3.32Å; R271-V275 WeakPolarHBondContact O-CG2 3.18Å; R271-V275 PolarHBondContact O-N 3.43Å |
| 272 | R | 90.4 | Very high | 91.1 | Very high | 85 Ų | 85 | 36.6 Ų | 36.6 | 32% | 0.321 | 20% | 0.202 | S | C | . | . | H | α-helix | trans | -59.2 | -49.1 | 174 | -170.6 | 177.4 | -50.6 | 131.3 | 9.5 | 112 | A265 S268 K270 S274 V275 W276 L332 | A265-R272 HydrophobicContact CB-CB 4.28Å; A265-R272 HydrophobicContact CB-CG 4.35Å; S268-R272 WeakPolarHBondContact O-CB 3.45Å; S268-R272 PolarHBondContact O-N 3.3Å; K270-R272 VanDerWaalsContact C-N 3.34Å; R272-S274 VanDerWaalsContact C-N 3.27Å; R272-S274 PolarHBondContact O-N 3.2Å; R272-V275 PolarHBondContact O-N 3.08Å; R272-W276 HydrophobicContact CG-CD2 4.28Å; R272-W276 VanDerWaalsContact CG-CE2 3.44Å; R272-W276 HydrophobicContact CG-CG 4.49Å; R272-W276 HydrophobicContact CG-CZ2 3.76Å; R272-W276 VanDerWaalsContact O-CG 3.29Å; R272-W276 PolarHBondContact O-N 3.01Å; R272-L332 HydrophobicContact CB-CD2 4.17Å; R272-L332 HydrophobicContact CG-CD2 4.03Å |
| 273 | S | 89.7 | Confident | 91.1 | Very high | 19 Ų | 19 | 34.6 Ų | 34.6 | 13% | 0.133 | 19% | 0.191 | C | C | . | . | H | α-helix | trans | -62.7 | -31.1 | 177.9 | 58.7 | 0 | 0 | 0 | 0 | 113.6 | S269 K270 H331 A335 | S269-S273 PolarHBondContact O-N 3.46Å; S269-S273 PolarHBondContact O-OG 3.19Å; K270-S273 PolarHBondContact O-OG 3.45Å; S273-H331 PolarHBondContact OG-CD2 3.02Å; S273-A335 VanDerWaalsContact O-CB 3.23Å; S273-A335 WeakPolarHBondContact O-CB 3.47Å |
| 274 | S | 89.3 | Confident | 91.1 | Very high | 26 Ų | 26 | 31.3 Ų | 31.3 | 18% | 0.182 | 17% | 0.168 | C | C | . | . | H | α-helix | trans | -77 | -24.9 | -178.3 | 59.5 | 0 | 0 | 0 | 0 | 114 | K270 R271 R272 | K270-S274 PolarHBondContact O-N 3.42Å; K270-S274 PolarHBondContact O-OG 3.45Å; R271-S274 PolarHBondContact O-N 3.31Å; R271-S274 PolarHBondContact O-OG 3.32Å; R272-S274 VanDerWaalsContact C-N 3.27Å; R272-S274 PolarHBondContact O-N 3.2Å |
| 275 | V | 92.8 | Very high | 91.2 | Very high | 0 Ų | 0 | 31 Ų | 31 | 0% | 0 | 17% | 0.166 | C | C | . | . | H | α-helix | trans | -102.5 | -16.4 | -178.3 | -57.8 | 0 | 0 | 0 | 0 | 114.5 | F221 L261 F264 A265 R271 R272 L278 Q279 | F221-V275 HydrophobicContact CD1-CG1 4.46Å; F221-V275 HydrophobicContact CD2-CG1 4.1Å; F221-V275 HydrophobicContact CE1-CG1 4.02Å; F221-V275 HydrophobicContact CE2-CG1 3.63Å; F221-V275 HydrophobicContact CG-CG1 4.5Å; F221-V275 HydrophobicContact CZ-CG1 3.59Å; L261-V275 HydrophobicContact CD2-CG1 4.11Å; F264-V275 HydrophobicContact CD1-CG1 3.83Å; F264-V275 HydrophobicContact CE1-CG1 4.06Å; A265-V275 HydrophobicContact CB-CG2 3.73Å; R271-V275 WeakPolarHBondContact O-CG2 3.18Å; R271-V275 PolarHBondContact O-N 3.43Å; R272-V275 PolarHBondContact O-N 3.08Å; V275-L278 PolarHBondContact O-N 3.43Å; V275-Q279 HydrophobicContact CG2-CG 4.37Å; V275-Q279 PolarHBondContact O-N 2.98Å |
| 276 | W | 94.8 | Very high | 91.2 | Very high | 8 Ų | 8 | 30.9 Ų | 30.9 | 3% | 0.03 | 17% | 0.165 | C | C | . | . | H | α-helix | trans | -51.3 | -45.4 | 179.9 | -86.3 | 4.9 | 0 | 0 | 0 | 114.8 | R272 L278 Q279 M280 F312 I316 T319 L332 A335 A336 | R272-W276 HydrophobicContact CG-CD2 4.28Å; R272-W276 VanDerWaalsContact CG-CE2 3.44Å; R272-W276 HydrophobicContact CG-CG 4.49Å; R272-W276 HydrophobicContact CG-CZ2 3.76Å; R272-W276 VanDerWaalsContact O-CG 3.29Å; R272-W276 PolarHBondContact O-N 3.01Å; W276-L278 VanDerWaalsContact C-N 3.34Å; W276-L278 PolarHBondContact O-N 3.25Å; W276-Q279 PolarHBondContact O-N 2.82Å; W276-M280 PolarHBondContact O-N 3.41Å; W276-F312 HydrophobicContact CB-CE2 4.37Å; W276-F312 AromaticContact CD1-CE2 3.56Å; W276-F312 AromaticContact CG-CE2 4Å; W276-F312 HydrophobicContact CG-CE2 4Å; W276-F312 AromaticContact NE1-CE2 3.96Å; W276-I316 HydrophobicContact CD2-CG1 4.33Å; W276-I316 HydrophobicContact CE3-CG1 4.32Å; W276-I316 HydrophobicContact CZ3-CG1 4.48Å; W276-T319 HydrophobicContact CH2-CG2 4.3Å; W276-T319 WeakPolarHBondContact CH2-OG1 3.31Å; W276-T319 HydrophobicContact CZ3-CG2 4.25Å; W276-L332 HydrophobicContact CE3-CD2 4.3Å; W276-L332 HydrophobicContact CH2-CB 4.47Å; W276-L332 HydrophobicContact CH2-CD2 3.58Å; W276-L332 HydrophobicContact CZ2-CD2 3.9Å; W276-L332 HydrophobicContact CZ3-CB 4.3Å; W276-L332 HydrophobicContact CZ3-CD2 3.81Å; W276-L332 VanDerWaalsContact CZ3-O 3.27Å; W276-L332 WeakPolarHBondContact CZ3-O 3.37Å; W276-A335 HydrophobicContact CB-CB 4.47Å; W276-A335 HydrophobicContact CE3-CB 3.94Å; W276-A336 HydrophobicContact CE3-CB 4.06Å; W276-A336 HydrophobicContact CZ3-CB 3.68Å |
| 277 | P | 93.8 | Very high | 90.9 | Very high | 14 Ų | 14 | 27.7 Ų | 27.7 | 9% | 0.091 | 14% | 0.138 | C | C | . | . | H | α-helix | trans | -59.1 | -43.2 | 175.6 | -25.7 | 36 | 0 | 0 | 0 | 112.9 | M280 M281 I338 K342 | P277-M280 WeakPolarHBondContact O-CB 3.32Å; P277-M280 PolarHBondContact O-N 3.04Å; P277-M281 WeakPolarHBondContact O-CG 3.39Å; P277-M281 PolarHBondContact O-N 2.95Å; P277-M281 VanDerWaalsContact O-N 3.08Å; P277-I338 HydrophobicContact CB-CG2 4.21Å; P277-I338 HydrophobicContact CG-CG2 3.89Å; P277-K342 HydrophobicContact CB-CD 3.95Å |
| 278 | L | 95.5 | Very high | 90.5 | Very high | 3 Ų | 3 | 25.1 Ų | 25.1 | 2% | 0.016 | 13% | 0.126 | C | C | . | . | H | α-helix | trans | -69.7 | -41.6 | 178.3 | 178.9 | 59.6 | 0 | 0 | 0 | 112.1 | F221 I224 E225 I228 L261 V275 W276 M280 M281 L282 | F221-L278 HydrophobicContact CB-CD2 4.22Å; F221-L278 HydrophobicContact CD1-CD2 3.86Å; F221-L278 HydrophobicContact CG-CD2 4.42Å; I224-L278 HydrophobicContact CB-CD1 4.04Å; I224-L278 HydrophobicContact CB-CD2 4.37Å; I224-L278 HydrophobicContact CD1-CD2 4.13Å; I224-L278 HydrophobicContact CG2-CD1 3.65Å; I224-L278 HydrophobicContact CG2-CD2 4.47Å; E225-L278 HydrophobicContact CB-CD1 4.49Å; I228-L278 HydrophobicContact CD1-CD1 4.37Å; L261-L278 HydrophobicContact CD1-CD2 3.72Å; L261-L278 HydrophobicContact CD1-CG 3.89Å; L261-L278 HydrophobicContact CD2-CD2 4.39Å; V275-L278 PolarHBondContact O-N 3.43Å; W276-L278 VanDerWaalsContact C-N 3.34Å; W276-L278 PolarHBondContact O-N 3.25Å; L278-M280 PolarHBondContact O-N 3.3Å; L278-M281 PolarHBondContact O-N 3.31Å; L278-M281 VanDerWaalsContact O-N 3.11Å; L278-L282 WeakPolarHBondContact O-CG 3.46Å; L278-L282 PolarHBondContact O-N 3.01Å |
| 279 | Q | 95.3 | Very high | 90 | Very high | 1 Ų | 1 | 23.3 Ų | 23.3 | 1% | 0.005 | 11% | 0.113 | C | C | . | . | H | α-helix | trans | -58.3 | -39.4 | 174.6 | -77.5 | -175.2 | -59.5 | 0 | 0 | 111.4 | F258 L261 V275 W276 L282 L283 F312 | F258-Q279 HydrophobicContact CD2-CB 4.17Å; F258-Q279 HydrophobicContact CD2-CG 4.25Å; F258-Q279 HydrophobicContact CE2-CB 3.74Å; F258-Q279 HydrophobicContact CE2-CG 4.05Å; L261-Q279 HydrophobicContact CB-CG 4.02Å; L261-Q279 HydrophobicContact CD1-CG 4.26Å; V275-Q279 HydrophobicContact CG2-CG 4.37Å; V275-Q279 PolarHBondContact O-N 2.98Å; W276-Q279 PolarHBondContact O-N 2.82Å; Q279-L282 PolarHBondContact O-N 3.36Å; Q279-L283 PolarHBondContact O-N 2.84Å; Q279-L283 VanDerWaalsContact O-N 3.16Å; Q279-F312 HydrophobicContact CB-CD2 4.27Å; Q279-F312 HydrophobicContact CB-CE1 4.49Å; Q279-F312 HydrophobicContact CB-CE2 3.64Å; Q279-F312 HydrophobicContact CB-CZ 3.76Å |
| 280 | M | 94.7 | Very high | 89.8 | Confident | 0 Ų | 0 | 21 Ų | 21 | 0% | 0 | 10% | 0.096 | C | C | . | . | H | α-helix | trans | -63 | -46.2 | 173 | -173 | 62.6 | 79.4 | 0 | 0 | 111.5 | W276 P277 L278 L282 L283 I284 F312 L313 I316 A339 L343 | W276-M280 PolarHBondContact O-N 3.41Å; P277-M280 WeakPolarHBondContact O-CB 3.32Å; P277-M280 PolarHBondContact O-N 3.04Å; L278-M280 PolarHBondContact O-N 3.3Å; M280-L282 VanDerWaalsContact C-N 3.3Å; M280-L282 PolarHBondContact O-N 3.38Å; M280-L283 WeakPolarHBondContact O-CB 3.35Å; M280-L283 PolarHBondContact O-N 3.32Å; M280-L283 VanDerWaalsContact O-N 3.14Å; M280-I284 HydrophobicContact CG-CD1 3.9Å; M280-I284 HydrophobicContact CG-CG1 4.43Å; M280-I284 VanDerWaalsContact O-CG1 3.25Å; M280-I284 WeakPolarHBondContact O-CG1 3.35Å; M280-I284 PolarHBondContact O-N 3.46Å; M280-F312 HydrophobicContact CB-CZ 4.26Å; M280-F312 HydrophobicContact CE-CE1 4.1Å; M280-F312 HydrophobicContact CE-CZ 4.36Å; M280-F312 HydrophobicContact SD-CE1 4.41Å; M280-L313 HydrophobicContact CE-CD2 3.99Å; M280-L313 HydrophobicContact SD-CD2 4.38Å; M280-I316 HydrophobicContact CE-CD1 3.66Å; M280-A339 HydrophobicContact CB-CB 4.08Å; M280-A339 HydrophobicContact CE-CB 4.28Å; M280-A339 HydrophobicContact CG-CB 4.41Å; M280-L343 HydrophobicContact CG-CB 4.42Å; M280-L343 HydrophobicContact SD-CB 4.4Å; M280-L343 HydrophobicContact SD-CD1 4.07Å |
| 281 | M | 95 | Very high | 89.4 | Confident | 0 Ų | 0 | 17.6 Ų | 17.6 | 0% | 0 | 8% | 0.082 | C | C | . | . | H | α-helix | trans | -59.9 | -37.6 | 177 | -68.2 | -54.6 | -66.3 | 0 | 0 | 113.1 | E225 I228 W229 M232 P277 L278 I284 L285 K342 | E225-M281 HydrophobicContact CG-CG 3.66Å; I228-M281 HydrophobicContact CB-CE 4.36Å; I228-M281 HydrophobicContact CD1-CB 4.15Å; I228-M281 HydrophobicContact CG2-CE 3.64Å; W229-M281 HydrophobicContact CD2-CE 3.74Å; W229-M281 HydrophobicContact CE3-CE 4.19Å; W229-M281 HydrophobicContact CG-CE 4.27Å; W229-M281 HydrophobicContact CH2-CE 3.93Å; W229-M281 HydrophobicContact CH2-SD 4.12Å; W229-M281 HydrophobicContact CZ2-CE 3.48Å; W229-M281 VanDerWaalsContact CZ2-CE 3.48Å; W229-M281 HydrophobicContact CZ2-SD 3.37Å; W229-M281 WeakPolarHBondContact CZ2-SD 3.46Å; W229-M281 HydrophobicContact CZ3-CE 4.27Å; M232-M281 HydrophobicContact SD-CE 4.06Å; P277-M281 WeakPolarHBondContact O-CG 3.39Å; P277-M281 PolarHBondContact O-N 2.95Å; P277-M281 VanDerWaalsContact O-N 3.08Å; L278-M281 PolarHBondContact O-N 3.31Å; L278-M281 VanDerWaalsContact O-N 3.11Å; M281-I284 WeakPolarHBondContact O-CB 3.33Å; M281-I284 PolarHBondContact O-N 2.96Å; M281-I284 HydrophobicContact SD-CD1 3.9Å; M281-L285 WeakPolarHBondContact O-CG 3.42Å; M281-L285 PolarHBondContact O-N 3Å; M281-K342 HydrophobicContact CG-CD 4.39Å; M281-K342 HydrophobicContact SD-CB 4.11Å; M281-K342 HydrophobicContact SD-CD 4.35Å |
| 282 | L | 94.5 | Very high | 88.9 | Confident | 2 Ų | 2 | 18.9 Ų | 18.9 | 1% | 0.01 | 9% | 0.09 | C | C | . | . | H | α-helix | trans | -66.9 | -36.9 | 175.9 | -64.1 | 177.1 | 0 | 0 | 0 | 112.6 | L203 I228 L257 F258 L261 L278 Q279 M280 L285 C286 | L203-L282 HydrophobicContact CD2-CD2 4.39Å; I228-L282 HydrophobicContact CD1-CD2 4.28Å; L257-L282 HydrophobicContact CB-CD1 4.03Å; L257-L282 HydrophobicContact CD2-CD1 3.86Å; L257-L282 HydrophobicContact CD2-CD2 3.84Å; L257-L282 HydrophobicContact CD2-CG 4.5Å; L257-L282 HydrophobicContact CG-CD1 3.84Å; F258-L282 HydrophobicContact CB-CD1 4.46Å; L261-L282 HydrophobicContact CD1-CD1 3.67Å; L278-L282 WeakPolarHBondContact O-CG 3.46Å; L278-L282 PolarHBondContact O-N 3.01Å; Q279-L282 PolarHBondContact O-N 3.36Å; M280-L282 VanDerWaalsContact C-N 3.3Å; M280-L282 PolarHBondContact O-N 3.38Å; L282-L285 PolarHBondContact O-N 3.05Å; L282-C286 PolarHBondContact O-SG 3.36Å; L282-C286 VanDerWaalsContact O-SG 3.37Å |
| 283 | L | 91.6 | Very high | 88.1 | Confident | 1 Ų | 1 | 16 Ų | 16 | 1% | 0.005 | 8% | 0.081 | C | C | . | . | H | α-helix | trans | -65.9 | -40.4 | 173.7 | -86.7 | 155.4 | 0 | 0 | 0 | 112 | F258 Q279 M280 L285 C286 I289 F290 Q309 F312 | F258-L283 HydrophobicContact CD2-CD1 4.35Å; F258-L283 HydrophobicContact CD2-CG 4.33Å; F258-L283 HydrophobicContact CE2-CD1 3.52Å; F258-L283 HydrophobicContact CE2-CG 3.95Å; F258-L283 HydrophobicContact CZ-CD1 4.16Å; Q279-L283 PolarHBondContact O-N 2.84Å; Q279-L283 VanDerWaalsContact O-N 3.16Å; M280-L283 WeakPolarHBondContact O-CB 3.35Å; M280-L283 PolarHBondContact O-N 3.32Å; M280-L283 VanDerWaalsContact O-N 3.14Å; L283-L285 PolarHBondContact O-N 3.43Å; L283-C286 CarbonylContact O-C 3.49Å; L283-C286 WeakPolarHBondContact O-CA 3.02Å; L283-C286 PolarHBondContact O-N 3.4Å; L283-I289 HydrophobicContact CD2-CB 4.09Å; L283-I289 HydrophobicContact CD2-CD1 3.77Å; L283-I289 HydrophobicContact CD2-CG2 3.44Å; L283-I289 VanDerWaalsContact CD2-CG2 3.44Å; L283-F290 HydrophobicContact CB-CE1 4.2Å; L283-F290 HydrophobicContact CB-CZ 3.96Å; L283-F290 HydrophobicContact CD2-CE1 4.3Å; L283-Q309 HydrophobicContact CD2-CB 4.07Å; L283-Q309 HydrophobicContact CD2-CG 4.11Å; L283-F312 HydrophobicContact CD1-CD1 3.31Å; L283-F312 HydrophobicContact CD1-CE1 3.3Å; L283-F312 HydrophobicContact CD1-CG 4.43Å; L283-F312 HydrophobicContact CD1-CZ 4.41Å |
| 284 | I | 91.7 | Very high | 87.2 | Confident | 0 Ų | 0 | 22.3 Ų | 22.3 | 0% | 0 | 10% | 0.102 | C | C | . | . | H | α-helix | trans | -59 | -33.2 | 177.9 | -73 | 168.7 | 0 | 0 | 0 | 112 | Y239 Q243 M280 M281 C286 F290 L343 A346 F359 | Y239-I284 HydrophobicContact CE2-CG2 3.95Å; Y239-I284 WeakPolarHBondContact OH-CG2 3.38Å; Q243-I284 PolarHBondContact NE2-O 3.36Å; M280-I284 HydrophobicContact CG-CD1 3.9Å; M280-I284 HydrophobicContact CG-CG1 4.43Å; M280-I284 VanDerWaalsContact O-CG1 3.25Å; M280-I284 WeakPolarHBondContact O-CG1 3.35Å; M280-I284 PolarHBondContact O-N 3.46Å; M281-I284 WeakPolarHBondContact O-CB 3.33Å; M281-I284 PolarHBondContact O-N 2.96Å; M281-I284 HydrophobicContact SD-CD1 3.9Å; I284-C286 VanDerWaalsContact C-N 3.27Å; I284-C286 PolarHBondContact O-N 2.93Å; I284-F290 HydrophobicContact CG1-CE2 4.48Å; I284-L343 HydrophobicContact CD1-CD1 4.03Å; I284-L343 HydrophobicContact CG1-CD1 3.88Å; I284-A346 HydrophobicContact CD1-CB 3.79Å; I284-A346 HydrophobicContact CG1-CB 4.36Å; I284-A346 HydrophobicContact CG2-CB 3.61Å; I284-F359 HydrophobicContact CB-CE2 4.31Å; I284-F359 HydrophobicContact CD1-CZ 4.42Å; I284-F359 HydrophobicContact CG1-CE2 4Å; I284-F359 HydrophobicContact CG1-CZ 3.88Å; I284-F359 HydrophobicContact CG2-CE2 4.04Å; I284-F359 HydrophobicContact CG2-CZ 4.14Å |
| 285 | L | 92.4 | Very high | 86.1 | Confident | 0 Ų | 0 | 24 Ų | 24 | 0% | 0 | 12% | 0.124 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -75.5 | -11 | 174.8 | -65.8 | 178 | 0 | 0 | 0 | 113.9 | L203 I228 W231 L242 L250 M281 L282 L283 P287 | L203-L285 HydrophobicContact CD1-CD1 4.47Å; I228-L285 HydrophobicContact CD1-CD1 4.02Å; I228-L285 HydrophobicContact CG1-CD1 4.15Å; I228-L285 HydrophobicContact CG2-CD1 3.99Å; I228-L285 HydrophobicContact CG2-CD2 4.11Å; I228-L285 HydrophobicContact CG2-CG 4.25Å; W231-L285 HydrophobicContact CE3-CD2 4.27Å; W231-L285 HydrophobicContact CH2-CD2 4.49Å; W231-L285 HydrophobicContact CZ3-CD2 3.61Å; L242-L285 HydrophobicContact CD2-CD2 4.33Å; L250-L285 HydrophobicContact CD2-CB 4.25Å; M281-L285 WeakPolarHBondContact O-CG 3.42Å; M281-L285 PolarHBondContact O-N 3Å; L282-L285 PolarHBondContact O-N 3.05Å; L283-L285 PolarHBondContact O-N 3.43Å; L285-P287 VanDerWaalsContact C-CD 3.45Å; L285-P287 VanDerWaalsContact O-CD 3.24Å; L285-P287 WeakPolarHBondContact O-CD 3.27Å |
| 286 | C | 89.4 | Confident | 84.7 | Confident | 2 Ų | 2 | 25.7 Ų | 25.7 | 1% | 0.014 | 13% | 0.133 | C | C | . | . | trans | -119.8 | 70.2 | -174 | -62.8 | 0 | 0 | 0 | 0 | 111.8 | C254 L282 L283 I284 K288 I289 | C254-C286 WeakPolarHBondContact CB-SG 3.48Å; L282-C286 PolarHBondContact O-SG 3.36Å; L282-C286 VanDerWaalsContact O-SG 3.37Å; L283-C286 CarbonylContact O-C 3.49Å; L283-C286 WeakPolarHBondContact O-CA 3.02Å; L283-C286 PolarHBondContact O-N 3.4Å; I284-C286 VanDerWaalsContact C-N 3.27Å; I284-C286 PolarHBondContact O-N 2.93Å; C286-K288 PolarHBondContact O-N 2.93Å; C286-I289 HydrophobicContact CB-CD1 3.48Å; C286-I289 VanDerWaalsContact CB-CD1 3.48Å; C286-I289 HydrophobicContact CB-CG1 4.07Å; C286-I289 WeakPolarHBondContact O-CB 3.29Å; C286-I289 PolarHBondContact O-N 2.65Å | ||
| 287 | P | 80.9 | Confident | 82.7 | Confident | 5 Ų | 5 | 33.6 Ų | 33.6 | 3% | 0.032 | 17% | 0.167 | C | C | . | . | H | α-helix | trans | -58.5 | -26.1 | -171.5 | 18 | -29.8 | 0 | 0 | 0 | 114.7 | L242 L285 I289 F290 Q291 | L242-P287 VanDerWaalsContact O-CG 3.26Å; L242-P287 WeakPolarHBondContact O-CG 3.45Å; L285-P287 VanDerWaalsContact C-CD 3.45Å; L285-P287 VanDerWaalsContact O-CD 3.24Å; L285-P287 WeakPolarHBondContact O-CD 3.27Å; P287-I289 PolarHBondContact O-N 3.05Å; P287-F290 WeakPolarHBondContact O-CB 3.39Å; P287-F290 PolarHBondContact O-N 3.08Å; P287-Q291 PolarHBondContact O-N 3.25Å; P287-Q291 VanDerWaalsContact O-N 3.16Å |
| 288 | K | 77.7 | Confident | 80.8 | Confident | 76 Ų | 76 | 39.2 Ų | 39.2 | 33% | 0.33 | 20% | 0.201 | S | C | . | . | H | α-helix | trans | -60.9 | -34.6 | 177.7 | -150.7 | 177.4 | -148.1 | 162.5 | 0 | 112.7 | Q246 C286 F290 Q291 E292 | Q246-K288 VanDerWaalsContact CD-CE 3.49Å; C286-K288 PolarHBondContact O-N 2.93Å; K288-F290 VanDerWaalsContact C-N 3.29Å; K288-F290 PolarHBondContact O-N 3.37Å; K288-Q291 PolarHBondContact O-N 3.28Å; K288-E292 HydrophobicContact CG-CG 4.47Å; K288-E292 WeakPolarHBondContact O-CB 3.23Å; K288-E292 WeakPolarHBondContact O-CG 3.24Å; K288-E292 PolarHBondContact O-N 2.91Å |
| 289 | I | 79 | Confident | 78.8 | Confident | 4 Ų | 4 | 46.7 Ų | 46.7 | 2% | 0.021 | 24% | 0.241 | C | C | . | . | H | α-helix | trans | -60.6 | -45.3 | 178.1 | -65.2 | 169.8 | 0 | 0 | 0 | 109.5 | Y255 L283 C286 P287 E292 L293 L306 Q309 | Y255-I289 HydrophobicContact CD1-CD1 4.45Å; Y255-I289 HydrophobicContact CE1-CD1 3.63Å; Y255-I289 HydrophobicContact CE1-CG1 4.02Å; Y255-I289 HydrophobicContact CE2-CD1 4.46Å; Y255-I289 WeakPolarHBondContact OH-CG1 3.49Å; L283-I289 HydrophobicContact CD2-CB 4.09Å; L283-I289 HydrophobicContact CD2-CD1 3.77Å; L283-I289 HydrophobicContact CD2-CG2 3.44Å; L283-I289 VanDerWaalsContact CD2-CG2 3.44Å; C286-I289 HydrophobicContact CB-CD1 3.48Å; C286-I289 VanDerWaalsContact CB-CD1 3.48Å; C286-I289 HydrophobicContact CB-CG1 4.07Å; C286-I289 WeakPolarHBondContact O-CB 3.29Å; C286-I289 PolarHBondContact O-N 2.65Å; P287-I289 PolarHBondContact O-N 3.05Å; I289-E292 PolarHBondContact O-N 3.26Å; I289-L293 HydrophobicContact CG2-CD1 3.51Å; I289-L293 HydrophobicContact CG2-CG 4.04Å; I289-L293 VanDerWaalsContact O-CB 3.28Å; I289-L293 WeakPolarHBondContact O-CB 3.47Å; I289-L293 WeakPolarHBondContact O-CG 3.49Å; I289-L293 PolarHBondContact O-N 3.36Å; I289-L306 HydrophobicContact CB-CD2 4.24Å; I289-L306 HydrophobicContact CG1-CD2 4.05Å; I289-L306 HydrophobicContact CG2-CD2 4.03Å; I289-Q309 HydrophobicContact CD1-CG 4.31Å; I289-Q309 HydrophobicContact CG2-CB 4.1Å; I289-Q309 HydrophobicContact CG2-CG 4.49Å |
| 290 | F | 81.1 | Confident | 76.8 | Confident | 2 Ų | 2 | 50.1 Ų | 50.1 | 1% | 0.009 | 26% | 0.263 | C | S | . | . | H | α-helix | trans | -63.5 | -43.3 | 177.9 | -69.5 | -27.5 | 0 | 0 | 0 | 112.2 | L283 I284 P287 K288 R294 L313 L343 V358 F359 I362 | L283-F290 HydrophobicContact CB-CE1 4.2Å; L283-F290 HydrophobicContact CB-CZ 3.96Å; L283-F290 HydrophobicContact CD2-CE1 4.3Å; I284-F290 HydrophobicContact CG1-CE2 4.48Å; P287-F290 WeakPolarHBondContact O-CB 3.39Å; P287-F290 PolarHBondContact O-N 3.08Å; K288-F290 VanDerWaalsContact C-N 3.29Å; K288-F290 PolarHBondContact O-N 3.37Å; F290-R294 PolarHBondContact O-N 3.01Å; F290-R294 VanDerWaalsContact O-N 3.14Å; F290-L313 HydrophobicContact CD1-CD1 4.38Å; F290-L313 HydrophobicContact CE1-CD1 4.1Å; F290-L343 HydrophobicContact CE2-CD1 4.46Å; F290-L343 HydrophobicContact CZ-CD1 4.24Å; F290-V358 VanDerWaalsContact C-CG1 3.48Å; F290-V358 HydrophobicContact CB-CG1 4.14Å; F290-V358 VanDerWaalsContact O-CG1 3.25Å; F290-V358 WeakPolarHBondContact O-CG1 3.49Å; F290-F359 AromaticContact CD2-CD2 3.78Å; F290-F359 HydrophobicContact CD2-CD2 3.78Å; F290-F359 HydrophobicContact CD2-CE2 4.12Å; F290-F359 AromaticContact CE2-CD2 3.73Å; F290-F359 HydrophobicContact CE2-CD2 3.73Å; F290-F359 AromaticContact CE2-CE2 3.58Å; F290-F359 HydrophobicContact CE2-CE2 3.58Å; F290-F359 HydrophobicContact CE2-CZ 4.48Å; F290-I362 HydrophobicContact CB-CD1 3.29Å; F290-I362 HydrophobicContact CD1-CD1 3.18Å; F290-I362 HydrophobicContact CD2-CD1 4.35Å; F290-I362 HydrophobicContact CE1-CD1 4.04Å; F290-I362 HydrophobicContact CE1-CG2 4.46Å; F290-I362 HydrophobicContact CG-CD1 3.36Å |
| 291 | Q | 78.7 | Confident | 74.8 | Confident | 86 Ų | 86 | 56 Ų | 56 | 40% | 0.402 | 30% | 0.301 | S | S | . | . | H | α-helix | trans | -59.2 | -47.9 | 174.5 | -67 | 175.1 | -1.6 | 0 | 0 | 112.4 | P287 K288 G295 V358 | P287-Q291 PolarHBondContact O-N 3.25Å; P287-Q291 VanDerWaalsContact O-N 3.16Å; K288-Q291 PolarHBondContact O-N 3.28Å; Q291-G295 PolarHBondContact O-N 2.94Å; Q291-V358 HydrophobicContact CB-CG2 4.47Å; Q291-V358 HydrophobicContact CG-CB 4.14Å; Q291-V358 HydrophobicContact CG-CG2 3.83Å |
| 292 | E | 78.5 | Confident | 73 | Confident | 63 Ų | 63 | 57.5 Ų | 57.5 | 29% | 0.294 | 31% | 0.311 | S | S | . | . | H | α-helix | trans | -69.5 | -40.3 | -178.5 | -72.1 | 177 | -177.1 | 0 | 0 | 112 | K288 I289 R294 G295 I296 L306 | K288-E292 HydrophobicContact CG-CG 4.47Å; K288-E292 WeakPolarHBondContact O-CB 3.23Å; K288-E292 WeakPolarHBondContact O-CG 3.24Å; K288-E292 PolarHBondContact O-N 2.91Å; I289-E292 PolarHBondContact O-N 3.26Å; E292-R294 VanDerWaalsContact C-N 3.34Å; E292-R294 PolarHBondContact O-N 3.25Å; E292-G295 PolarHBondContact O-N 3.24Å; E292-I296 WeakPolarHBondContact O-CG1 3.41Å; E292-I296 PolarHBondContact O-N 3.08Å; E292-L306 HydrophobicContact CB-CD2 4.23Å; E292-L306 WeakPolarHBondContact OE2-CD1 3.49Å; E292-L306 VanDerWaalsContact OE2-CD2 3.31Å; E292-L306 WeakPolarHBondContact OE2-CD2 3.47Å |
| 293 | L | 74.5 | Confident | 71.6 | Confident | 24 Ų | 24 | 63.9 Ų | 63.9 | 13% | 0.126 | 34% | 0.34 | C | S | . | . | H | α-helix | trans | -64.4 | -36.6 | 178.1 | -71.7 | 176.1 | 0 | 0 | 0 | 112.6 | I289 I296 K310 L313 | I289-L293 HydrophobicContact CG2-CD1 3.51Å; I289-L293 HydrophobicContact CG2-CG 4.04Å; I289-L293 VanDerWaalsContact O-CB 3.28Å; I289-L293 WeakPolarHBondContact O-CB 3.47Å; I289-L293 WeakPolarHBondContact O-CG 3.49Å; I289-L293 PolarHBondContact O-N 3.36Å; L293-I296 HydrophobicContact CD2-CD1 4.26Å; L293-I296 PolarHBondContact O-N 2.89Å; L293-K310 HydrophobicContact CD2-CB 3.55Å; L293-K310 HydrophobicContact CD2-CD 4.3Å; L293-K310 HydrophobicContact CD2-CG 3.89Å; L293-L313 HydrophobicContact CD1-CD1 3.63Å |
| 294 | R | 70.6 | Confident | 70.3 | Confident | 151 Ų | 151 | 71.2 Ų | 71.2 | 57% | 0.57 | 38% | 0.379 | S | S | * | . | H | α-helix | trans | -69.4 | -34 | 175.3 | -171.9 | 178.2 | -178.4 | -159.7 | 6.6 | 112.6 | F290 E292 I296 V358 | F290-R294 PolarHBondContact O-N 3.01Å; F290-R294 VanDerWaalsContact O-N 3.14Å; E292-R294 VanDerWaalsContact C-N 3.34Å; E292-R294 PolarHBondContact O-N 3.25Å; R294-I296 PolarHBondContact O-N 3.37Å; R294-V358 HydrophobicContact CB-CG1 3.95Å |
| 295 | G | 65.6 | Low | 69.3 | Low | 63 Ų | 63 | 78.7 Ų | 78.7 | 65% | 0.649 | 41% | 0.412 | S | S | * | . | H | α-helix | trans | -65.8 | -17.8 | 177.6 | 0 | 0 | 0 | 0 | 0 | 114 | Q291 E292 K297 | Q291-G295 PolarHBondContact O-N 2.94Å; E292-G295 PolarHBondContact O-N 3.24Å; G295-K297 PolarHBondContact O-N 2.71Å |
| 296 | I | 62.9 | Low | 68.6 | Low | 35 Ų | 35 | 79 Ų | 79 | 18% | 0.179 | 41% | 0.413 | C | S | . | . | S | Bend | trans | -81.9 | 97 | -179.6 | -60.6 | 163.4 | 0 | 0 | 0 | 109.2 | E292 L293 R294 T298 T300 C302 | E292-I296 WeakPolarHBondContact O-CG1 3.41Å; E292-I296 PolarHBondContact O-N 3.08Å; L293-I296 HydrophobicContact CD2-CD1 4.26Å; L293-I296 PolarHBondContact O-N 2.89Å; R294-I296 PolarHBondContact O-N 3.37Å; I296-T298 PolarHBondContact O-N 3.02Å; I296-T300 WeakPolarHBondContact CG2-O 3.3Å; I296-C302 HydrophobicContact CD1-CB 3.84Å; I296-C302 WeakPolarHBondContact CD1-SG 3.46Å |
| 297 | K | 53.8 | Low | 68.3 | Low | 173 Ų | 173 | 83.7 Ų | 83.7 | 75% | 0.752 | 44% | 0.435 | S | S | * | . | trans | -53 | 141.4 | 162.8 | -70.8 | -177.7 | 178.6 | 179.3 | 0 | 108.7 | G295 N299 T300 | G295-K297 PolarHBondContact O-N 2.71Å; K297-N299 PolarHBondContact O-N 3.29Å; K297-T300 PolarHBondContact O-N 3.38Å; K297-T300 PolarHBondContact O-OG1 2.92Å | ||
| 298 | T | 53.8 | Low | 68.6 | Low | 133 Ų | 133 | 87 Ų | 87 | 82% | 0.816 | 45% | 0.449 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -47.9 | -12.5 | -164.3 | 39 | 0 | 0 | 0 | 0 | 117.4 | I296 | I296-T298 PolarHBondContact O-N 3.02Š|
| 299 | N | 52.1 | Low | 69.2 | Low | 159 Ų | 159 | 83.6 Ų | 83.6 | 85% | 0.85 | 43% | 0.434 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -128 | 21.7 | 179.5 | -69.5 | -26.3 | 0 | 0 | 0 | 115.5 | K297 | K297-N299 PolarHBondContact O-N 3.29Š|
| 300 | T | 53.6 | Low | 69.5 | Low | 74 Ų | 74 | 85.6 Ų | 85.6 | 45% | 0.454 | 44% | 0.442 | S | S | . | . | S | Bend | trans | -98.8 | 132.2 | 176.9 | -21.5 | 0 | 0 | 0 | 0 | 110.5 | I296 K297 C302 | I296-T300 WeakPolarHBondContact CG2-O 3.3Å; K297-T300 PolarHBondContact O-N 3.38Å; K297-T300 PolarHBondContact O-OG1 2.92Å; T300-C302 PolarHBondContact O-N 2.86Å |
| 301 | P | 53.1 | Low | 69.8 | Low | 124 Ų | 124 | 89.8 Ų | 89.8 | 81% | 0.805 | 46% | 0.464 | S | S | * | . | P | Polyproline II helix | trans | -62.3 | 124.3 | 177.8 | 22 | -30.1 | 0 | 0 | 0 | 110.4 | ||
| 302 | C | 57.2 | Low | 70.5 | Confident | 30 Ų | 30 | 86 Ų | 86 | 20% | 0.203 | 45% | 0.447 | C | S | . | . | P | Polyproline II helix | trans | -68.1 | 153.7 | 176.1 | -165.1 | 0 | 0 | 0 | 0 | 109.6 | I296 T300 L304 L306 K310 | I296-C302 HydrophobicContact CD1-CB 3.84Å; I296-C302 WeakPolarHBondContact CD1-SG 3.46Å; T300-C302 PolarHBondContact O-N 2.86Å; C302-L304 PolarHBondContact O-N 3.27Å; C302-L306 VanDerWaalsContact SG-CB 3.6Å; C302-K310 HydrophobicContact CB-CD 4.42Å |
| 303 | Q | 64.8 | Low | 71 | Confident | 136 Ų | 136 | 83.6 Ų | 83.6 | 64% | 0.636 | 44% | 0.436 | S | S | * | . | P | Polyproline II helix | trans | -58.5 | 132.9 | 166.1 | -68 | -173.7 | 6.5 | 0 | 0 | 108.8 | K305 L306 | Q303-K305 PolarHBondContact O-N 3.46Å; Q303-L306 HydrophobicContact CB-CD1 4Å; Q303-L306 PolarHBondContact O-N 2.68Å |
| 304 | L | 65.4 | Low | 71.7 | Confident | 156 Ų | 156 | 86.8 Ų | 86.8 | 82% | 0.817 | 45% | 0.45 | S | S | * | . | G | 310 helix | trans | -49.7 | -26.5 | -177.7 | -118.1 | 139.5 | 0 | 0 | 0 | 113.4 | C302 L306 | C302-L304 PolarHBondContact O-N 3.27Å; L304-L306 VanDerWaalsContact C-N 3.33Å; L304-L306 PolarHBondContact O-N 2.88Å |
| 305 | K | 70.1 | Confident | 72.6 | Confident | 157 Ų | 157 | 82 Ų | 82 | 68% | 0.683 | 44% | 0.44 | S | S | * | . | G | 310 helix | trans | -72.6 | -19.5 | 179.5 | -143.7 | 179.6 | -177.6 | -174 | 0 | 114.5 | Q303 Q309 | Q303-K305 PolarHBondContact O-N 3.46Å; K305-Q309 PolarHBondContact O-OE1 3.21Å |
| 306 | L | 77.5 | Confident | 73.9 | Confident | 5 Ų | 5 | 79 Ų | 79 | 3% | 0.026 | 41% | 0.409 | C | S | . | . | G | 310 helix | trans | -109.9 | 2 | -176.8 | -73.2 | 112.4 | 0 | 0 | 0 | 114.1 | I289 E292 C302 Q303 L304 K308 Q309 K310 | I289-L306 HydrophobicContact CB-CD2 4.24Å; I289-L306 HydrophobicContact CG1-CD2 4.05Å; I289-L306 HydrophobicContact CG2-CD2 4.03Å; E292-L306 HydrophobicContact CB-CD2 4.23Å; E292-L306 WeakPolarHBondContact OE2-CD1 3.49Å; E292-L306 VanDerWaalsContact OE2-CD2 3.31Å; E292-L306 WeakPolarHBondContact OE2-CD2 3.47Å; C302-L306 VanDerWaalsContact SG-CB 3.6Å; Q303-L306 HydrophobicContact CB-CD1 4Å; Q303-L306 PolarHBondContact O-N 2.68Å; L304-L306 VanDerWaalsContact C-N 3.33Å; L304-L306 PolarHBondContact O-N 2.88Å; L306-K308 PolarHBondContact O-N 2.99Å; L306-Q309 PolarHBondContact O-N 3.21Å; L306-Q309 PolarHBondContact O-OE1 3.07Å; L306-K310 PolarHBondContact O-N 3.25Å; L306-K310 VanDerWaalsContact O-N 3.09Å |
| 307 | E | 82.9 | Confident | 75.1 | Confident | 102 Ų | 102 | 80.3 Ų | 80.3 | 48% | 0.477 | 41% | 0.414 | S | S | . | . | H | α-helix | trans | -64.4 | -42.1 | -171.9 | -169.9 | 171.4 | -171.6 | 0 | 0 | 112.6 | Q309 K310 L311 | E307-Q309 PolarHBondContact O-N 3.01Å; E307-K310 WeakPolarHBondContact O-CB 3.31Å; E307-K310 PolarHBondContact O-N 3.24Å; E307-L311 HydrophobicContact CG-CD1 4.24Å; E307-L311 VanDerWaalsContact O-CG 3.32Å; E307-L311 WeakPolarHBondContact O-CG 3.46Å; E307-L311 PolarHBondContact O-N 3.16Å |
| 308 | K | 87.9 | Confident | 76.8 | Confident | 75 Ų | 75 | 78.4 Ų | 78.4 | 33% | 0.326 | 41% | 0.406 | S | S | . | . | H | α-helix | trans | -65.6 | -40.8 | 179.4 | -70.5 | 175.7 | 173.6 | -174.3 | 0 | 112.8 | F258 D259 D262 L306 K310 L311 F312 | F258-K308 HydrophobicContact CE1-CB 4.33Å; D259-K308 WeakPolarHBondContact OD1-CD 3.42Å; D259-K308 WeakPolarHBondContact OD1-CE 3.32Å; D259-K308 IonicContact OD1-NZ 3.71Å; D259-K308 PolarHBondContact OD1-NZ 3.4Å; D262-K308 WeakPolarHBondContact OD2-CD 3.33Å; L306-K308 PolarHBondContact O-N 2.99Å; K308-K310 VanDerWaalsContact C-N 3.34Å; K308-L311 PolarHBondContact O-N 3.44Å; K308-F312 WeakPolarHBondContact O-CB 3.35Å; K308-F312 PolarHBondContact O-N 2.98Å |
| 309 | Q | 89.8 | Confident | 78.6 | Confident | 3 Ų | 3 | 73.8 Ų | 73.8 | 1% | 0.014 | 38% | 0.377 | C | S | . | . | H | α-helix | trans | -64.9 | -41.2 | 177.9 | -64 | 82.2 | -2.8 | 0 | 0 | 110.8 | Y255 F258 L283 I289 K305 L306 E307 F312 L313 | Y255-Q309 VanDerWaalsContact CD1-NE2 3.28Å; F258-Q309 HydrophobicContact CD1-CG 4.12Å; F258-Q309 HydrophobicContact CE1-CG 3.92Å; F258-Q309 HydrophobicContact CZ-CG 4.15Å; L283-Q309 HydrophobicContact CD2-CB 4.07Å; L283-Q309 HydrophobicContact CD2-CG 4.11Å; I289-Q309 HydrophobicContact CD1-CG 4.31Å; I289-Q309 HydrophobicContact CG2-CB 4.1Å; I289-Q309 HydrophobicContact CG2-CG 4.49Å; K305-Q309 PolarHBondContact O-OE1 3.21Å; L306-Q309 PolarHBondContact O-N 3.21Å; L306-Q309 PolarHBondContact O-OE1 3.07Å; E307-Q309 PolarHBondContact O-N 3.01Å; Q309-F312 PolarHBondContact O-N 2.95Å; Q309-L313 PolarHBondContact O-N 3.3Å; Q309-L313 VanDerWaalsContact O-N 3.15Å |
| 310 | K | 85.1 | Confident | 80.3 | Confident | 47 Ų | 47 | 66.3 Ų | 66.3 | 20% | 0.204 | 34% | 0.337 | C | S | . | . | H | α-helix | trans | -59.3 | -50 | 172.2 | -172.4 | 177.2 | 174.9 | -178.8 | 0 | 111.3 | L293 C302 L306 E307 K308 F312 L313 Q314 | L293-K310 HydrophobicContact CD2-CB 3.55Å; L293-K310 HydrophobicContact CD2-CD 4.3Å; L293-K310 HydrophobicContact CD2-CG 3.89Å; C302-K310 HydrophobicContact CB-CD 4.42Å; L306-K310 PolarHBondContact O-N 3.25Å; L306-K310 VanDerWaalsContact O-N 3.09Å; E307-K310 WeakPolarHBondContact O-CB 3.31Å; E307-K310 PolarHBondContact O-N 3.24Å; K308-K310 VanDerWaalsContact C-N 3.34Å; K310-F312 VanDerWaalsContact C-N 3.28Å; K310-F312 PolarHBondContact O-N 3.13Å; K310-L313 PolarHBondContact O-N 2.8Å; K310-Q314 WeakPolarHBondContact O-CB 3.37Å; K310-Q314 WeakPolarHBondContact O-CG 3.46Å; K310-Q314 PolarHBondContact O-N 3.27Å |
| 311 | L | 89 | Confident | 81.9 | Confident | 89 Ų | 89 | 67.2 Ų | 67.2 | 47% | 0.466 | 34% | 0.343 | S | S | . | . | H | α-helix | trans | -62.7 | -35.1 | 180 | -72.7 | 170.7 | 0 | 0 | 0 | 112.4 | E307 K308 S315 | E307-L311 HydrophobicContact CG-CD1 4.24Å; E307-L311 VanDerWaalsContact O-CG 3.32Å; E307-L311 WeakPolarHBondContact O-CG 3.46Å; E307-L311 PolarHBondContact O-N 3.16Å; K308-L311 PolarHBondContact O-N 3.44Å; L311-S315 VanDerWaalsContact O-CB 3.27Å; L311-S315 WeakPolarHBondContact O-CB 3.47Å; L311-S315 PolarHBondContact O-N 3.38Å; L311-S315 PolarHBondContact O-OG 3.47Å |
| 312 | F | 92.4 | Very high | 83.3 | Confident | 7 Ų | 7 | 66.1 Ų | 66.1 | 3% | 0.031 | 33% | 0.328 | C | S | . | . | H | α-helix | trans | -61.8 | -53.1 | 174 | 164.3 | -98.1 | 0 | 0 | 0 | 111.9 | F258 W276 Q279 M280 L283 K308 Q309 K310 Q314 S315 I316 | F258-F312 HydrophobicContact CE2-CD1 4.25Å; F258-F312 HydrophobicContact CE2-CG 4.3Å; F258-F312 HydrophobicContact CZ-CB 3.75Å; F258-F312 HydrophobicContact CZ-CD1 4.11Å; F258-F312 HydrophobicContact CZ-CD2 4.37Å; F258-F312 AromaticContact CZ-CG 3.82Å; F258-F312 HydrophobicContact CZ-CG 3.82Å; W276-F312 HydrophobicContact CB-CE2 4.37Å; W276-F312 AromaticContact CD1-CE2 3.56Å; W276-F312 AromaticContact CG-CE2 4Å; W276-F312 HydrophobicContact CG-CE2 4Å; W276-F312 AromaticContact NE1-CE2 3.96Å; Q279-F312 HydrophobicContact CB-CD2 4.27Å; Q279-F312 HydrophobicContact CB-CE1 4.49Å; Q279-F312 HydrophobicContact CB-CE2 3.64Å; Q279-F312 HydrophobicContact CB-CZ 3.76Å; M280-F312 HydrophobicContact CB-CZ 4.26Å; M280-F312 HydrophobicContact CE-CE1 4.1Å; M280-F312 HydrophobicContact CE-CZ 4.36Å; M280-F312 HydrophobicContact SD-CE1 4.41Å; L283-F312 HydrophobicContact CD1-CD1 3.31Å; L283-F312 HydrophobicContact CD1-CE1 3.3Å; L283-F312 HydrophobicContact CD1-CG 4.43Å; L283-F312 HydrophobicContact CD1-CZ 4.41Å; K308-F312 WeakPolarHBondContact O-CB 3.35Å; K308-F312 PolarHBondContact O-N 2.98Å; Q309-F312 PolarHBondContact O-N 2.95Å; K310-F312 VanDerWaalsContact C-N 3.28Å; K310-F312 PolarHBondContact O-N 3.13Å; F312-Q314 VanDerWaalsContact C-N 3.35Å; F312-Q314 PolarHBondContact O-N 2.95Å; F312-S315 WeakPolarHBondContact O-CB 3.4Å; F312-S315 PolarHBondContact O-N 3.31Å; F312-S315 VanDerWaalsContact O-N 3.07Å; F312-I316 HydrophobicContact CD1-CD1 4.48Å; F312-I316 HydrophobicContact CD2-CD1 4.43Å; F312-I316 HydrophobicContact CE1-CD1 3.73Å; F312-I316 HydrophobicContact CE2-CD1 3.68Å; F312-I316 HydrophobicContact CE2-CG1 4.33Å; F312-I316 HydrophobicContact CZ-CD1 3.29Å; F312-I316 HydrophobicContact CZ-CG1 4.35Å; F312-I316 PolarHBondContact O-N 3.46Å |
| 313 | L | 89.1 | Confident | 84 | Confident | 13 Ų | 13 | 65.6 Ų | 65.6 | 7% | 0.068 | 33% | 0.328 | C | S | . | . | H | α-helix | trans | -61 | -44.8 | 178.5 | -71.4 | 179.7 | 0 | 0 | 0 | 111.4 | M280 F290 L293 Q309 K310 S315 I316 E317 | M280-L313 HydrophobicContact CE-CD2 3.99Å; M280-L313 HydrophobicContact SD-CD2 4.38Å; F290-L313 HydrophobicContact CD1-CD1 4.38Å; F290-L313 HydrophobicContact CE1-CD1 4.1Å; L293-L313 HydrophobicContact CD1-CD1 3.63Å; Q309-L313 PolarHBondContact O-N 3.3Å; Q309-L313 VanDerWaalsContact O-N 3.15Å; K310-L313 PolarHBondContact O-N 2.8Å; L313-S315 PolarHBondContact O-N 3.33Å; L313-I316 PolarHBondContact O-N 2.82Å; L313-I316 VanDerWaalsContact O-N 3.12Å; L313-E317 WeakPolarHBondContact O-CG 3.27Å; L313-E317 PolarHBondContact O-N 3.41Å |
| 314 | Q | 88.3 | Confident | 84.2 | Confident | 90 Ų | 90 | 62.6 Ų | 62.6 | 42% | 0.421 | 31% | 0.314 | S | S | . | . | H | α-helix | trans | -60.4 | -33.5 | 175 | -72.2 | -177.8 | -21.7 | 0 | 0 | 112.6 | K310 F312 K318 | K310-Q314 WeakPolarHBondContact O-CB 3.37Å; K310-Q314 WeakPolarHBondContact O-CG 3.46Å; K310-Q314 PolarHBondContact O-N 3.27Å; F312-Q314 VanDerWaalsContact C-N 3.35Å; F312-Q314 PolarHBondContact O-N 2.95Å; Q314-K318 WeakPolarHBondContact O-CB 3.34Å; Q314-K318 PolarHBondContact O-N 2.96Å |
| 315 | S | 91.3 | Very high | 84.2 | Confident | 51 Ų | 51 | 60.3 Ų | 60.3 | 36% | 0.357 | 31% | 0.306 | S | S | . | . | H | α-helix | trans | -69.9 | -37.5 | 176.4 | -65.1 | 0 | 0 | 0 | 0 | 112.1 | L311 F312 L313 T319 | L311-S315 VanDerWaalsContact O-CB 3.27Å; L311-S315 WeakPolarHBondContact O-CB 3.47Å; L311-S315 PolarHBondContact O-N 3.38Å; L311-S315 PolarHBondContact O-OG 3.47Å; F312-S315 WeakPolarHBondContact O-CB 3.4Å; F312-S315 PolarHBondContact O-N 3.31Å; F312-S315 VanDerWaalsContact O-N 3.07Å; L313-S315 PolarHBondContact O-N 3.33Å; S315-T319 WeakPolarHBondContact O-CB 3.37Å; S315-T319 PolarHBondContact O-N 3.04Å; S315-T319 PolarHBondContact O-OG1 3.03Å |
| 316 | I | 91.6 | Very high | 83.8 | Confident | 0 Ų | 0 | 57.8 Ų | 57.8 | 0% | 0 | 30% | 0.297 | C | S | . | . | H | α-helix | trans | -65.2 | -53.6 | 172.9 | -71.4 | -178.9 | 0 | 0 | 0 | 109.9 | W276 M280 F312 L313 K318 T319 L320 A336 A339 M366 | W276-I316 HydrophobicContact CD2-CG1 4.33Å; W276-I316 HydrophobicContact CE3-CG1 4.32Å; W276-I316 HydrophobicContact CZ3-CG1 4.48Å; M280-I316 HydrophobicContact CE-CD1 3.66Å; F312-I316 HydrophobicContact CD1-CD1 4.48Å; F312-I316 HydrophobicContact CD2-CD1 4.43Å; F312-I316 HydrophobicContact CE1-CD1 3.73Å; F312-I316 HydrophobicContact CE2-CD1 3.68Å; F312-I316 HydrophobicContact CE2-CG1 4.33Å; F312-I316 HydrophobicContact CZ-CD1 3.29Å; F312-I316 HydrophobicContact CZ-CG1 4.35Å; F312-I316 PolarHBondContact O-N 3.46Å; L313-I316 PolarHBondContact O-N 2.82Å; L313-I316 VanDerWaalsContact O-N 3.12Å; I316-K318 VanDerWaalsContact C-N 3.3Å; I316-K318 PolarHBondContact O-N 3.31Å; I316-T319 PolarHBondContact O-N 3.32Å; I316-L320 HydrophobicContact CG2-CD1 3.85Å; I316-L320 HydrophobicContact CG2-CG 4.42Å; I316-L320 WeakPolarHBondContact O-CG 3.22Å; I316-L320 PolarHBondContact O-N 2.97Å; I316-A336 HydrophobicContact CG2-CB 4.22Å; I316-A339 HydrophobicContact CD1-CB 4.08Å; I316-M366 HydrophobicContact CG2-SD 4.49Å |
| 317 | E | 89.4 | Confident | 82.8 | Confident | 62 Ų | 62 | 62.1 Ų | 62.1 | 29% | 0.29 | 33% | 0.333 | S | S | . | . | H | α-helix | trans | -56.2 | -44.2 | 178.9 | -71.7 | 177.5 | 169.2 | 0 | 0 | 111.6 | L313 T319 L320 T321 T365 | L313-E317 WeakPolarHBondContact O-CG 3.27Å; L313-E317 PolarHBondContact O-N 3.41Å; E317-T319 VanDerWaalsContact C-N 3.34Å; E317-T319 PolarHBondContact O-N 3.49Å; E317-L320 PolarHBondContact O-N 2.93Å; E317-T321 WeakPolarHBondContact O-CB 3.27Å; E317-T321 WeakPolarHBondContact O-CG2 3.12Å; E317-T321 PolarHBondContact O-N 2.9Å; E317-T321 PolarHBondContact O-OG1 3.17Å; E317-T365 WeakPolarHBondContact OE1-CB 3.47Å; E317-T365 PolarHBondContact OE1-OG1 3.25Å |
| 318 | K | 88.7 | Confident | 81.7 | Confident | 133 Ų | 133 | 62.8 Ų | 62.8 | 58% | 0.578 | 35% | 0.345 | S | S | * | . | H | α-helix | trans | -63.3 | -39.6 | 175.4 | -174.9 | 175.9 | -178.6 | 175.6 | 0 | 112.3 | Q314 I316 T321 M322 | Q314-K318 WeakPolarHBondContact O-CB 3.34Å; Q314-K318 PolarHBondContact O-N 2.96Å; I316-K318 VanDerWaalsContact C-N 3.3Å; I316-K318 PolarHBondContact O-N 3.31Å; K318-T321 WeakPolarHBondContact CA-OG1 3.41Å; K318-T321 PolarHBondContact O-OG1 3.2Å; K318-M322 HydrophobicContact CG-CG 4.19Å; K318-M322 HydrophobicContact CG-SD 4.23Å; K318-M322 WeakPolarHBondContact O-CB 3.43Å; K318-M322 VanDerWaalsContact O-CG 3.23Å; K318-M322 WeakPolarHBondContact O-CG 3.24Å; K318-M322 PolarHBondContact O-N 3.19Å |
| 319 | T | 91.1 | Very high | 80.9 | Confident | 36 Ų | 36 | 64.6 Ų | 64.6 | 22% | 0.221 | 35% | 0.352 | C | S | . | . | H | α-helix | trans | -68.1 | -39.9 | 179.8 | -59.5 | 0 | 0 | 0 | 0 | 111.2 | W276 S315 I316 E317 L332 A336 | W276-T319 HydrophobicContact CH2-CG2 4.3Å; W276-T319 WeakPolarHBondContact CH2-OG1 3.31Å; W276-T319 HydrophobicContact CZ3-CG2 4.25Å; S315-T319 WeakPolarHBondContact O-CB 3.37Å; S315-T319 PolarHBondContact O-N 3.04Å; S315-T319 PolarHBondContact O-OG1 3.03Å; I316-T319 PolarHBondContact O-N 3.32Å; E317-T319 VanDerWaalsContact C-N 3.34Å; E317-T319 PolarHBondContact O-N 3.49Å; T319-L332 HydrophobicContact CG2-CB 4.32Å; T319-A336 HydrophobicContact CG2-CB 4.22Å |
| 320 | L | 89.2 | Confident | 80.6 | Confident | 2 Ų | 2 | 67.3 Ų | 67.3 | 1% | 0.01 | 37% | 0.365 | C | S | . | . | H | α-helix | trans | -65.1 | -46.9 | 175.1 | -68.9 | 171.3 | 0 | 0 | 0 | 111.4 | I316 E317 G323 L333 A336 M366 E369 V370 Y373 | I316-L320 HydrophobicContact CG2-CD1 3.85Å; I316-L320 HydrophobicContact CG2-CG 4.42Å; I316-L320 WeakPolarHBondContact O-CG 3.22Å; I316-L320 PolarHBondContact O-N 2.97Å; E317-L320 PolarHBondContact O-N 2.93Å; L320-G323 PolarHBondContact O-N 3.23Å; L320-L333 HydrophobicContact CD2-CD1 4.29Å; L320-A336 HydrophobicContact CD2-CB 4.05Å; L320-A336 HydrophobicContact CG-CB 4.14Å; L320-M366 HydrophobicContact CD1-CB 3.8Å; L320-E369 HydrophobicContact CB-CB 4Å; L320-E369 HydrophobicContact CB-CG 4.37Å; L320-V370 HydrophobicContact CD1-CG2 4.18Å; L320-V370 HydrophobicContact CD2-CG2 4.38Å; L320-Y373 HydrophobicContact CD2-CD2 4.21Å; L320-Y373 HydrophobicContact CD2-CE2 4.43Å; L320-Y373 VanDerWaalsContact O-CE2 3.27Å; L320-Y373 WeakPolarHBondContact O-CE2 3.36Å; L320-Y373 PolarHBondContact O-OH 3.25Å |
| 321 | T | 86.6 | Confident | 80.7 | Confident | 94 Ų | 94 | 68.3 Ų | 68.3 | 58% | 0.577 | 37% | 0.37 | S | S | * | . | H | α-helix | trans | -71.4 | -31.4 | -178.4 | 49.9 | 0 | 0 | 0 | 0 | 114.4 | E317 K318 G323 | E317-T321 WeakPolarHBondContact O-CB 3.27Å; E317-T321 WeakPolarHBondContact O-CG2 3.12Å; E317-T321 PolarHBondContact O-N 2.9Å; E317-T321 PolarHBondContact O-OG1 3.17Å; K318-T321 WeakPolarHBondContact CA-OG1 3.41Å; K318-T321 PolarHBondContact O-OG1 3.2Å; T321-G323 VanDerWaalsContact C-N 3.29Å; T321-G323 PolarHBondContact O-N 3.14Å |
| 322 | M | 81.2 | Confident | 80.7 | Confident | 100 Ų | 100 | 64.3 Ų | 64.3 | 49% | 0.493 | 35% | 0.349 | S | S | . | . | H | α-helix | trans | -75.5 | -15.7 | 178.1 | -69.6 | -156.6 | 91.4 | 0 | 0 | 113.8 | K318 V325 | K318-M322 HydrophobicContact CG-CG 4.19Å; K318-M322 HydrophobicContact CG-SD 4.23Å; K318-M322 WeakPolarHBondContact O-CB 3.43Å; K318-M322 VanDerWaalsContact O-CG 3.23Å; K318-M322 WeakPolarHBondContact O-CG 3.24Å; K318-M322 PolarHBondContact O-N 3.19Å; M322-V325 WeakPolarHBondContact O-CG2 3.4Å |
| 323 | G | 72.8 | Confident | 80.6 | Confident | 19 Ų | 19 | 64.2 Ų | 64.2 | 20% | 0.196 | 35% | 0.349 | C | S | . | . | G | 310 helix | trans | 54.4 | -150.4 | 173.2 | 0 | 0 | 0 | 0 | 0 | 116.7 | L320 T321 V325 Y373 | L320-G323 PolarHBondContact O-N 3.23Å; T321-G323 VanDerWaalsContact C-N 3.29Å; T321-G323 PolarHBondContact O-N 3.14Å; G323-V325 PolarHBondContact O-N 2.75Å; G323-Y373 WeakPolarHBondContact CA-OH 3.31Å |
| 324 | H | 68.4 | Low | 80.7 | Confident | 74 Ų | 74 | 64.2 Ų | 64.2 | 34% | 0.343 | 35% | 0.351 | S | S | . | . | G | 310 helix | trans | -72.9 | 11.1 | -173.9 | -68.8 | -61 | 0 | 0 | 0 | 115.5 | H326 Y373 | H324-H326 PolarHBondContact O-N 2.94Å; H324-Y373 AromaticContact NE2-CD1 4Å |
| 325 | V | 66.2 | Low | 80.8 | Confident | 108 Ų | 108 | 60.1 Ų | 60.1 | 66% | 0.655 | 33% | 0.333 | S | S | * | . | G | 310 helix | trans | -63.4 | -17.7 | -172.2 | 179.5 | 0 | 0 | 0 | 0 | 112.6 | M322 G323 | M322-V325 WeakPolarHBondContact O-CG2 3.4Å; G323-V325 PolarHBondContact O-N 2.75Å |
| 326 | H | 61.2 | Low | 80.9 | Confident | 103 Ų | 103 | 57.7 Ų | 57.7 | 48% | 0.477 | 32% | 0.316 | S | S | . | . | trans | -129.7 | 103.7 | 174.6 | -66.7 | -62.1 | 0 | 0 | 0 | 112.9 | H324 T328 K329 | H324-H326 PolarHBondContact O-N 2.94Å; H326-T328 PolarHBondContact O-N 3.38Å; H326-T328 VanDerWaalsContact O-N 3.08Å; H326-K329 PolarHBondContact O-N 3.09Å | ||
| 327 | A | 57.1 | Low | 81 | Confident | 97 Ų | 97 | 57.7 Ų | 57.7 | 80% | 0.802 | 32% | 0.316 | S | S | * | . | G | 310 helix | trans | -55 | -27.6 | 176.6 | 0 | 0 | 0 | 0 | 0 | 113.8 | K329 | A327-K329 PolarHBondContact O-N 3.21Š|
| 328 | T | 58.8 | Low | 81.2 | Confident | 116 Ų | 116 | 56.8 Ų | 56.8 | 71% | 0.712 | 31% | 0.312 | S | S | * | . | G | 310 helix | trans | -74.8 | -2.5 | 179.5 | 52.7 | 0 | 0 | 0 | 0 | 114.8 | H326 H331 | H326-T328 PolarHBondContact O-N 3.38Å; H326-T328 VanDerWaalsContact O-N 3.08Å; T328-H331 PolarHBondContact O-CE1 3.07Å |
| 329 | K | 72.6 | Confident | 81.4 | Confident | 112 Ų | 112 | 50.5 Ų | 50.5 | 49% | 0.487 | 29% | 0.285 | S | S | . | . | G | 310 helix | trans | -123.7 | 18.7 | -179.6 | -64.3 | -175 | 179.9 | 174.9 | 0 | 113.4 | H326 A327 H331 L332 L333 | H326-K329 PolarHBondContact O-N 3.09Å; A327-K329 PolarHBondContact O-N 3.21Å; K329-H331 VanDerWaalsContact C-N 3.26Å; K329-H331 PolarHBondContact O-N 3.49Å; K329-L332 HydrophobicContact CB-CB 4.4Å; K329-L332 HydrophobicContact CB-CD1 4.14Å; K329-L332 HydrophobicContact CD-CD1 4.18Å; K329-L332 HydrophobicContact CG-CD1 4.05Å; K329-L332 WeakPolarHBondContact O-CB 3.48Å; K329-L332 PolarHBondContact O-N 3.42Å; K329-L333 PolarHBondContact O-N 3.49Å; K329-L333 VanDerWaalsContact O-N 3.09Å |
| 330 | H | 83.7 | Confident | 81.5 | Confident | 61 Ų | 61 | 48.8 Ų | 48.8 | 28% | 0.282 | 27% | 0.274 | S | S | . | . | H | α-helix | trans | -56.7 | -39.6 | 180 | -177.9 | -84.6 | 0 | 0 | 0 | 112.6 | L332 L333 A334 L381 | H330-L332 VanDerWaalsContact C-N 3.31Å; H330-L332 PolarHBondContact O-N 3Å; H330-L333 WeakPolarHBondContact O-CB 3.24Å; H330-L333 PolarHBondContact O-N 3.5Å; H330-L333 VanDerWaalsContact O-N 3.16Å; H330-A334 PolarHBondContact O-N 3.16Å; H330-L381 PolarHBondContact CE1-O 3.29Å; H330-L381 VanDerWaalsContact CE1-O 3.24Å; H330-L381 PolarHBondContact NE2-O 3.41Å |
| 331 | H | 85.3 | Confident | 81.8 | Confident | 67 Ų | 67 | 48.9 Ų | 48.9 | 31% | 0.31 | 28% | 0.275 | S | S | . | . | H | α-helix | trans | -63.9 | -31.7 | 175.2 | 62.6 | -69.8 | 0 | 0 | 0 | 113.8 | S273 T328 K329 A335 | S273-H331 PolarHBondContact OG-CD2 3.02Å; T328-H331 PolarHBondContact O-CE1 3.07Å; K329-H331 VanDerWaalsContact C-N 3.26Å; K329-H331 PolarHBondContact O-N 3.49Å; H331-A335 WeakPolarHBondContact O-CB 3.43Å; H331-A335 PolarHBondContact O-N 3.42Å |
| 332 | L | 90 | Very high | 82.1 | Confident | 6 Ų | 6 | 45.4 Ų | 45.4 | 3% | 0.031 | 25% | 0.252 | C | S | . | . | H | α-helix | trans | -70.7 | -43.3 | 172.7 | -82 | 161.4 | 0 | 0 | 0 | 110.6 | R272 W276 T319 K329 H330 A334 A335 A336 | R272-L332 HydrophobicContact CB-CD2 4.17Å; R272-L332 HydrophobicContact CG-CD2 4.03Å; W276-L332 HydrophobicContact CE3-CD2 4.3Å; W276-L332 HydrophobicContact CH2-CB 4.47Å; W276-L332 HydrophobicContact CH2-CD2 3.58Å; W276-L332 HydrophobicContact CZ2-CD2 3.9Å; W276-L332 HydrophobicContact CZ3-CB 4.3Å; W276-L332 HydrophobicContact CZ3-CD2 3.81Å; W276-L332 VanDerWaalsContact CZ3-O 3.27Å; W276-L332 WeakPolarHBondContact CZ3-O 3.37Å; T319-L332 HydrophobicContact CG2-CB 4.32Å; K329-L332 HydrophobicContact CB-CB 4.4Å; K329-L332 HydrophobicContact CB-CD1 4.14Å; K329-L332 HydrophobicContact CD-CD1 4.18Å; K329-L332 HydrophobicContact CG-CD1 4.05Å; K329-L332 WeakPolarHBondContact O-CB 3.48Å; K329-L332 PolarHBondContact O-N 3.42Å; H330-L332 VanDerWaalsContact C-N 3.31Å; H330-L332 PolarHBondContact O-N 3Å; L332-A334 VanDerWaalsContact C-N 3.32Å; L332-A334 PolarHBondContact O-N 3.34Å; L332-A335 PolarHBondContact O-N 3.11Å; L332-A336 WeakPolarHBondContact O-CB 3.48Å; L332-A336 PolarHBondContact O-N 3.29Å |
| 333 | L | 90.7 | Very high | 82.7 | Confident | 5 Ų | 5 | 40.6 Ų | 40.6 | 3% | 0.026 | 23% | 0.229 | C | C | . | . | H | α-helix | trans | -60.3 | -44 | 175.6 | -178.8 | 63.8 | 0 | 0 | 0 | 111.2 | L320 K329 H330 A336 C337 Y373 L381 | L320-L333 HydrophobicContact CD2-CD1 4.29Å; K329-L333 PolarHBondContact O-N 3.49Å; K329-L333 VanDerWaalsContact O-N 3.09Å; H330-L333 WeakPolarHBondContact O-CB 3.24Å; H330-L333 PolarHBondContact O-N 3.5Å; H330-L333 VanDerWaalsContact O-N 3.16Å; L333-A336 PolarHBondContact O-N 3.17Å; L333-C337 PolarHBondContact O-N 2.88Å; L333-C337 PolarHBondContact O-SG 3.05Å; L333-Y373 HydrophobicContact CD1-CD2 4.17Å; L333-Y373 HydrophobicContact CD1-CE2 4.04Å; L333-Y373 HydrophobicContact CD2-CD1 4.25Å; L333-Y373 HydrophobicContact CD2-CE1 4.24Å; L333-L381 HydrophobicContact CB-CD1 4.47Å; L333-L381 HydrophobicContact CD2-CD1 3.76Å; L333-L381 HydrophobicContact CG-CD1 3.77Å |
| 334 | A | 89.8 | Confident | 83.7 | Confident | 13 Ų | 13 | 39.8 Ų | 39.8 | 11% | 0.107 | 22% | 0.22 | C | C | . | . | H | α-helix | trans | -59.6 | -48.1 | 174.7 | 0 | 0 | 0 | 0 | 0 | 111.9 | H330 L332 A336 C337 I338 F382 | H330-A334 PolarHBondContact O-N 3.16Å; L332-A334 VanDerWaalsContact C-N 3.32Å; L332-A334 PolarHBondContact O-N 3.34Å; A334-A336 VanDerWaalsContact C-N 3.32Å; A334-A336 PolarHBondContact O-N 3.13Å; A334-C337 PolarHBondContact O-N 2.9Å; A334-I338 VanDerWaalsContact O-CG1 3.27Å; A334-I338 WeakPolarHBondContact O-CG1 3.39Å; A334-I338 PolarHBondContact O-N 3.3Å; A334-F382 HydrophobicContact CB-CE1 4.4Å |
| 335 | A | 91.7 | Very high | 84.9 | Confident | 4 Ų | 4 | 37 Ų | 37 | 3% | 0.033 | 21% | 0.207 | C | C | . | . | H | α-helix | trans | -61.8 | -37.2 | 176.5 | 0 | 0 | 0 | 0 | 0 | 113.2 | S273 W276 H331 L332 I338 A339 | S273-A335 VanDerWaalsContact O-CB 3.23Å; S273-A335 WeakPolarHBondContact O-CB 3.47Å; W276-A335 HydrophobicContact CB-CB 4.47Å; W276-A335 HydrophobicContact CE3-CB 3.94Å; H331-A335 WeakPolarHBondContact O-CB 3.43Å; H331-A335 PolarHBondContact O-N 3.42Å; L332-A335 PolarHBondContact O-N 3.11Å; A335-I338 PolarHBondContact O-N 3.23Å; A335-A339 WeakPolarHBondContact O-CB 3.45Å; A335-A339 PolarHBondContact O-N 2.92Å |
| 336 | A | 93.4 | Very high | 86.2 | Confident | 0 Ų | 0 | 31.8 Ų | 31.8 | 0% | 0 | 18% | 0.175 | C | C | . | . | H | α-helix | trans | -64.7 | -43.6 | 175.2 | 0 | 0 | 0 | 0 | 0 | 111.2 | W276 I316 T319 L320 L332 L333 A334 A339 G340 | W276-A336 HydrophobicContact CE3-CB 4.06Å; W276-A336 HydrophobicContact CZ3-CB 3.68Å; I316-A336 HydrophobicContact CG2-CB 4.22Å; T319-A336 HydrophobicContact CG2-CB 4.22Å; L320-A336 HydrophobicContact CD2-CB 4.05Å; L320-A336 HydrophobicContact CG-CB 4.14Å; L332-A336 WeakPolarHBondContact O-CB 3.48Å; L332-A336 PolarHBondContact O-N 3.29Å; L333-A336 PolarHBondContact O-N 3.17Å; A334-A336 VanDerWaalsContact C-N 3.32Å; A334-A336 PolarHBondContact O-N 3.13Å; A336-A339 PolarHBondContact O-N 3.35Å; A336-G340 PolarHBondContact O-N 3.2Å |
| 337 | C | 92.9 | Very high | 87.8 | Confident | 0 Ų | 0 | 26.9 Ų | 26.9 | 0% | 0 | 15% | 0.153 | C | C | . | . | H | α-helix | trans | -64.9 | -41.3 | 176 | -65.4 | 0 | 0 | 0 | 0 | 111.9 | L333 A334 G340 A341 L374 L381 | L333-C337 PolarHBondContact O-N 2.88Å; L333-C337 PolarHBondContact O-SG 3.05Å; A334-C337 PolarHBondContact O-N 2.9Å; C337-G340 PolarHBondContact O-N 3.23Å; C337-A341 WeakPolarHBondContact O-CB 3.39Å; C337-A341 PolarHBondContact O-N 3.43Å; C337-L374 HydrophobicContact CB-CD2 4.32Å; C337-L374 HydrophobicContact CB-CG 4.42Å; C337-L381 HydrophobicContact CB-CD2 3.75Å |
| 338 | I | 92.9 | Very high | 89.5 | Confident | 43 Ų | 43 | 22.3 Ų | 22.3 | 22% | 0.221 | 12% | 0.115 | C | C | . | . | H | α-helix | trans | -62.2 | -44.7 | 175.5 | -68.4 | 164.3 | 0 | 0 | 0 | 110.6 | P277 A334 A335 G340 A341 K342 V393 | P277-I338 HydrophobicContact CB-CG2 4.21Å; P277-I338 HydrophobicContact CG-CG2 3.89Å; A334-I338 VanDerWaalsContact O-CG1 3.27Å; A334-I338 WeakPolarHBondContact O-CG1 3.39Å; A334-I338 PolarHBondContact O-N 3.3Å; A335-I338 PolarHBondContact O-N 3.23Å; I338-G340 VanDerWaalsContact C-N 3.35Å; I338-A341 PolarHBondContact O-N 3.46Å; I338-K342 HydrophobicContact CG2-CD 4.48Å; I338-K342 WeakPolarHBondContact O-CG 3.3Å; I338-K342 PolarHBondContact O-N 3.12Å; I338-V393 HydrophobicContact CG1-CG1 4.01Å; I338-V393 HydrophobicContact CG1-CG2 4.14Å |
| 339 | A | 94 | Very high | 91.1 | Very high | 0 Ų | 0 | 17 Ų | 17 | 0% | 0 | 8% | 0.082 | C | C | . | . | H | α-helix | trans | -62 | -42.7 | 175.5 | 0 | 0 | 0 | 0 | 0 | 111.6 | M280 I316 A335 A336 K342 L343 | M280-A339 HydrophobicContact CB-CB 4.08Å; M280-A339 HydrophobicContact CE-CB 4.28Å; M280-A339 HydrophobicContact CG-CB 4.41Å; I316-A339 HydrophobicContact CD1-CB 4.08Å; A335-A339 WeakPolarHBondContact O-CB 3.45Å; A335-A339 PolarHBondContact O-N 2.92Å; A336-A339 PolarHBondContact O-N 3.35Å; A339-K342 PolarHBondContact O-N 2.96Å; A339-L343 PolarHBondContact O-N 3.17Å |
| 340 | G | 93.8 | Very high | 92 | Very high | 0 Ų | 0 | 11.7 Ų | 11.7 | 0% | 0 | 6% | 0.059 | C | C | . | . | H | α-helix | trans | -62.8 | -40.7 | 174.2 | 0 | 0 | 0 | 0 | 0 | 113.2 | A336 C337 I338 K342 L343 C344 | A336-G340 PolarHBondContact O-N 3.2Å; C337-G340 PolarHBondContact O-N 3.23Å; I338-G340 VanDerWaalsContact C-N 3.35Å; G340-K342 VanDerWaalsContact C-N 3.34Å; G340-K342 PolarHBondContact O-N 3.2Å; G340-L343 WeakPolarHBondContact O-CB 3.5Å; G340-L343 PolarHBondContact O-N 3.47Å; G340-C344 PolarHBondContact O-N 2.93Å; G340-C344 PolarHBondContact O-SG 2.97Å |
| 341 | A | 93.8 | Very high | 92.3 | Very high | 4 Ų | 4 | 11.1 Ų | 11.1 | 3% | 0.033 | 6% | 0.058 | C | C | . | . | H | α-helix | trans | -63.7 | -38.4 | 175 | 0 | 0 | 0 | 0 | 0 | 112 | C337 I338 C344 K345 L374 V393 C397 | C337-A341 WeakPolarHBondContact O-CB 3.39Å; C337-A341 PolarHBondContact O-N 3.43Å; I338-A341 PolarHBondContact O-N 3.46Å; A341-C344 WeakPolarHBondContact O-CB 3.47Å; A341-C344 PolarHBondContact O-N 3.33Å; A341-K345 PolarHBondContact O-N 3.33Å; A341-L374 HydrophobicContact CB-CD1 4.47Å; A341-V393 HydrophobicContact CB-CG1 4.24Å; A341-C397 HydrophobicContact CB-CB 3.94Å |
| 342 | K | 94 | Very high | 92.3 | Very high | 21 Ų | 21 | 10.6 Ų | 10.6 | 9% | 0.091 | 6% | 0.059 | C | C | . | . | H | α-helix | trans | -65.5 | -39 | 173.5 | -71.1 | -179 | -164.4 | -60.4 | 0 | 112.3 | E225 W229 P277 M281 I338 A339 G340 K345 A346 | E225-K342 VanDerWaalsContact OE1-CD 3.31Å; E225-K342 WeakPolarHBondContact OE1-CD 3.31Å; E225-K342 WeakPolarHBondContact OE1-CE 3.45Å; E225-K342 IonicContact OE1-NZ 3.56Å; E225-K342 PolarHBondContact OE1-NZ 3.41Å; E225-K342 WeakPolarHBondContact OE2-CE 3.39Å; E225-K342 IonicContact OE2-NZ 2.66Å; E225-K342 PolarHBondContact OE2-NZ 2.74Å; W229-K342 HydrophobicContact CZ2-CB 4.02Å; W229-K342 HydrophobicContact CZ2-CG 4.14Å; P277-K342 HydrophobicContact CB-CD 3.95Å; M281-K342 HydrophobicContact CG-CD 4.39Å; M281-K342 HydrophobicContact SD-CB 4.11Å; M281-K342 HydrophobicContact SD-CD 4.35Å; I338-K342 HydrophobicContact CG2-CD 4.48Å; I338-K342 WeakPolarHBondContact O-CG 3.3Å; I338-K342 PolarHBondContact O-N 3.12Å; A339-K342 PolarHBondContact O-N 2.96Å; G340-K342 VanDerWaalsContact C-N 3.34Å; G340-K342 PolarHBondContact O-N 3.2Å; K342-K345 PolarHBondContact O-N 3.38Å; K342-A346 WeakPolarHBondContact O-CB 3.25Å; K342-A346 PolarHBondContact O-N 3.18Å |
| 343 | L | 93.5 | Very high | 92.1 | Very high | 0 Ų | 0 | 14.4 Ų | 14.4 | 0% | 0 | 9% | 0.091 | C | C | . | . | H | α-helix | trans | -61.3 | -43.8 | 171.7 | -172.1 | 70.9 | 0 | 0 | 0 | 111.3 | M280 I284 F290 A339 G340 K345 A346 A347 F359 I362 L363 M366 | M280-L343 HydrophobicContact CG-CB 4.42Å; M280-L343 HydrophobicContact SD-CB 4.4Å; M280-L343 HydrophobicContact SD-CD1 4.07Å; I284-L343 HydrophobicContact CD1-CD1 4.03Å; I284-L343 HydrophobicContact CG1-CD1 3.88Å; F290-L343 HydrophobicContact CE2-CD1 4.46Å; F290-L343 HydrophobicContact CZ-CD1 4.24Å; A339-L343 PolarHBondContact O-N 3.17Å; G340-L343 WeakPolarHBondContact O-CB 3.5Å; G340-L343 PolarHBondContact O-N 3.47Å; L343-K345 VanDerWaalsContact C-N 3.35Å; L343-K345 PolarHBondContact O-N 2.85Å; L343-A346 PolarHBondContact O-N 3.11Å; L343-A347 PolarHBondContact O-N 3.25Å; L343-F359 HydrophobicContact CD1-CE1 3.65Å; L343-F359 HydrophobicContact CD1-CE2 4.11Å; L343-F359 HydrophobicContact CD1-CZ 3.41Å; L343-F359 VanDerWaalsContact CD1-CZ 3.41Å; L343-F359 HydrophobicContact CG-CE1 4.16Å; L343-F359 HydrophobicContact CG-CZ 4.35Å; L343-F359 WeakPolarHBondContact O-CE1 3.47Å; L343-I362 HydrophobicContact CD2-CG2 4.38Å; L343-L363 HydrophobicContact CD2-CB 4.45Å; L343-L363 HydrophobicContact CD2-CD1 4.14Å; L343-L363 HydrophobicContact CG-CD1 4.21Å; L343-M366 HydrophobicContact CD2-CE 3.95Å; L343-M366 HydrophobicContact CD2-CG 4.43Å; L343-M366 HydrophobicContact CD2-SD 3.64Å |
| 344 | C | 93.9 | Very high | 91.9 | Very high | 1 Ų | 1 | 16.5 Ų | 16.5 | 1% | 0.007 | 10% | 0.102 | C | C | . | . | H | α-helix | trans | -57.3 | -47.9 | 173.8 | -62.2 | 0 | 0 | 0 | 0 | 111.3 | G340 A341 A347 T348 L363 | G340-C344 PolarHBondContact O-N 2.93Å; G340-C344 PolarHBondContact O-SG 2.97Å; A341-C344 WeakPolarHBondContact O-CB 3.47Å; A341-C344 PolarHBondContact O-N 3.33Å; C344-A347 WeakPolarHBondContact O-CB 2.91Å; C344-A347 PolarHBondContact O-N 3.09Å; C344-T348 WeakPolarHBondContact O-CG2 3.47Å; C344-T348 PolarHBondContact O-N 3.41Å; C344-L363 HydrophobicContact CB-CD1 4.42Å; C344-L363 VanDerWaalsContact SG-CD1 3.57Å |
| 345 | K | 94.5 | Very high | 91.5 | Very high | 15 Ų | 15 | 19.5 Ų | 19.5 | 7% | 0.065 | 12% | 0.123 | C | C | . | . | H | α-helix | trans | -61.1 | -47.4 | -180 | -175.6 | 178.6 | 174.6 | -176 | 0 | 111.6 | W229 A341 K342 L343 A347 T348 Y349 E396 S400 | W229-K345 HydrophobicContact CD2-CD 4.49Å; W229-K345 HydrophobicContact CE3-CD 4.23Å; W229-K345 HydrophobicContact CH2-CB 3.71Å; W229-K345 HydrophobicContact CH2-CD 3.63Å; W229-K345 HydrophobicContact CH2-CG 3.58Å; W229-K345 HydrophobicContact CZ2-CB 4.31Å; W229-K345 HydrophobicContact CZ2-CD 3.87Å; W229-K345 HydrophobicContact CZ2-CG 4.28Å; W229-K345 HydrophobicContact CZ3-CB 4.36Å; W229-K345 HydrophobicContact CZ3-CD 3.81Å; W229-K345 HydrophobicContact CZ3-CG 3.75Å; A341-K345 PolarHBondContact O-N 3.33Å; K342-K345 PolarHBondContact O-N 3.38Å; L343-K345 VanDerWaalsContact C-N 3.35Å; L343-K345 PolarHBondContact O-N 2.85Å; K345-A347 VanDerWaalsContact C-N 3.31Å; K345-A347 PolarHBondContact O-N 3.3Å; K345-T348 WeakPolarHBondContact O-CB 3.24Å; K345-T348 PolarHBondContact O-N 2.62Å; K345-T348 VanDerWaalsContact O-N 3.08Å; K345-T348 PolarHBondContact O-OG1 2.94Å; K345-Y349 HydrophobicContact CG-CE2 4.41Å; K345-Y349 WeakPolarHBondContact O-CD2 3.22Å; K345-E396 IonicContact NZ-OE1 3.92Å; K345-E396 PolarHBondContact NZ-OE1 3.26Å; K345-E396 IonicContact NZ-OE2 2.76Å; K345-S400 WeakPolarHBondContact CA-OG 3.31Å; K345-S400 WeakPolarHBondContact CB-OG 3.43Å; K345-S400 PolarHBondContact N-OG 2.95Å |
| 346 | A | 93.7 | Very high | 91 | Very high | 0 Ų | 0 | 26 Ų | 26 | 0% | 0 | 16% | 0.157 | C | C | . | . | H | α-helix | trans | -62.3 | -37.6 | 179 | 0 | 0 | 0 | 0 | 0 | 112.4 | W229 M232 I284 K342 L343 T348 Y349 F359 | W229-A346 HydrophobicContact CH2-CB 4.02Å; M232-A346 HydrophobicContact CE-CB 4.08Å; I284-A346 HydrophobicContact CD1-CB 3.79Å; I284-A346 HydrophobicContact CG1-CB 4.36Å; I284-A346 HydrophobicContact CG2-CB 3.61Å; K342-A346 WeakPolarHBondContact O-CB 3.25Å; K342-A346 PolarHBondContact O-N 3.18Å; L343-A346 PolarHBondContact O-N 3.11Å; A346-T348 PolarHBondContact O-N 3.03Å; A346-T348 VanDerWaalsContact O-N 3.14Å; A346-Y349 PolarHBondContact O-N 3.01Å; A346-F359 HydrophobicContact CB-CE1 4.37Å; A346-F359 HydrophobicContact CB-CZ 3.79Å |
| 347 | A | 92.8 | Very high | 90.6 | Very high | 0 Ų | 0 | 26.9 Ų | 26.9 | 0% | 0 | 16% | 0.162 | C | C | . | . | H | α-helix | trans | -57 | -30 | 175.2 | 0 | 0 | 0 | 0 | 0 | 112.7 | L343 C344 K345 Y349 I350 F359 F360 L363 L404 | L343-A347 PolarHBondContact O-N 3.25Å; C344-A347 WeakPolarHBondContact O-CB 2.91Å; C344-A347 PolarHBondContact O-N 3.09Å; K345-A347 VanDerWaalsContact C-N 3.31Å; K345-A347 PolarHBondContact O-N 3.3Å; A347-Y349 PolarHBondContact O-N 3.1Å; A347-I350 WeakPolarHBondContact O-CB 3.38Å; A347-I350 PolarHBondContact O-N 3.49Å; A347-I350 VanDerWaalsContact O-N 3.07Å; A347-F359 HydrophobicContact CB-CD1 3.78Å; A347-F359 HydrophobicContact CB-CE1 3.62Å; A347-F360 HydrophobicContact CB-CD1 4.47Å; A347-F360 HydrophobicContact CB-CE1 4.13Å; A347-L363 HydrophobicContact CB-CD2 3.79Å; A347-L404 HydrophobicContact CB-CD1 4.47Å; A347-L404 HydrophobicContact CB-CD2 3.96Å |
| 348 | T | 93.5 | Very high | 90.1 | Very high | 1 Ų | 1 | 28 Ų | 28 | 1% | 0.006 | 17% | 0.168 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -68.6 | -19.2 | 179.7 | 72 | 0 | 0 | 0 | 0 | 114 | C344 K345 A346 R403 L404 W442 W443 | C344-T348 WeakPolarHBondContact O-CG2 3.47Å; C344-T348 PolarHBondContact O-N 3.41Å; K345-T348 WeakPolarHBondContact O-CB 3.24Å; K345-T348 PolarHBondContact O-N 2.62Å; K345-T348 VanDerWaalsContact O-N 3.08Å; K345-T348 PolarHBondContact O-OG1 2.94Å; A346-T348 PolarHBondContact O-N 3.03Å; A346-T348 VanDerWaalsContact O-N 3.14Å; T348-R403 HydrophobicContact CG2-CB 3.63Å; T348-L404 HydrophobicContact CG2-CD2 4.37Å; T348-L404 HydrophobicContact CG2-CG 4.15Å; T348-W442 PolarHBondContact O-NE1 3.08Å; T348-W443 PolarHBondContact O-NE1 3.43Å |
| 349 | Y | 92.8 | Very high | 89.7 | Confident | 4 Ų | 4 | 26 Ų | 26 | 2% | 0.016 | 16% | 0.158 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -83.6 | -3.4 | 174.9 | -65.3 | -105.3 | 0 | 0 | 0 | 111.9 | W229 M232 D233 P236 Y239 K345 A346 A347 L440 W442 W443 | W229-Y349 HydrophobicContact CZ3-CE2 4.22Å; M232-Y349 HydrophobicContact CE-CD2 4.11Å; M232-Y349 HydrophobicContact CE-CG 4.2Å; D233-Y349 PolarHBondContact OD1-OH 2.83Å; P236-Y349 HydrophobicContact CB-CD1 3.88Å; P236-Y349 HydrophobicContact CB-CE1 4.39Å; Y239-Y349 HydrophobicContact CD1-CG 4.44Å; K345-Y349 HydrophobicContact CG-CE2 4.41Å; K345-Y349 WeakPolarHBondContact O-CD2 3.22Å; A346-Y349 PolarHBondContact O-N 3.01Å; A347-Y349 PolarHBondContact O-N 3.1Å; Y349-L440 HydrophobicContact CD1-CD1 4.03Å; Y349-L440 HydrophobicContact CE1-CD1 4.48Å; Y349-L440 HydrophobicContact CG-CD1 4.45Å; Y349-W442 WeakPolarHBondContact O-CZ2 3.39Å; Y349-W443 HydrophobicContact CE2-CZ2 4.46Å |
| 350 | I | 91.5 | Very high | 89.5 | Confident | 0 Ų | 0 | 27 Ų | 27 | 0% | 0 | 16% | 0.163 | C | C | . | . | S | Bend | trans | -97.2 | 132.8 | 170.1 | -52.2 | 178.8 | 0 | 0 | 0 | 107.6 | Y239 Y240 Q243 A347 V352 N357 F359 F360 W442 | Y239-I350 HydrophobicContact CE1-CG1 4.15Å; Y240-I350 HydrophobicContact CD2-CB 4.43Å; Y240-I350 HydrophobicContact CD2-CG2 4.06Å; Y240-I350 HydrophobicContact CE2-CG2 3.8Å; Q243-I350 HydrophobicContact CG-CD1 3.81Å; Q243-I350 HydrophobicContact CG-CG1 4.05Å; A347-I350 WeakPolarHBondContact O-CB 3.38Å; A347-I350 PolarHBondContact O-N 3.49Å; A347-I350 VanDerWaalsContact O-N 3.07Å; I350-V352 PolarHBondContact O-N 3.4Å; I350-N357 HydrophobicContact CG2-CB 4.44Å; I350-F359 HydrophobicContact CD1-CB 3.62Å; I350-F359 HydrophobicContact CD1-CD1 3.93Å; I350-F359 HydrophobicContact CD1-CD2 3.95Å; I350-F359 HydrophobicContact CD1-CG 3.56Å; I350-F360 HydrophobicContact CB-CE2 4.32Å; I350-F360 HydrophobicContact CB-CZ 4.05Å; I350-F360 HydrophobicContact CG2-CE2 3.85Å; I350-F360 HydrophobicContact CG2-CZ 4.08Å; I350-W442 PolarHBondContact O-NE1 3.32Å |
| 351 | N | 88.8 | Confident | 89.1 | Confident | 49 Ų | 49 | 28.5 Ų | 28.5 | 26% | 0.262 | 18% | 0.175 | S | C | . | . | trans | -61.7 | 122.5 | 176.9 | -171.1 | -22.3 | 0 | 0 | 0 | 109.7 | Y240 A353 D354 W442 | Y240-N351 HydrophobicContact CE2-CB 4.06Å; N351-A353 PolarHBondContact O-N 3.17Å; N351-A353 VanDerWaalsContact O-N 3.12Å; N351-A353 WeakPolarHBondContact OD1-CB 3.29Å; N351-A353 PolarHBondContact OD1-N 2.96Å; N351-D354 WeakPolarHBondContact O-CB 3.5Å; N351-D354 PolarHBondContact O-N 2.88Å; N351-W442 HydrophobicContact CB-CD2 4.12Å; N351-W442 HydrophobicContact CB-CE3 4.39Å; N351-W442 HydrophobicContact CB-CG 4.27Å | ||
| 352 | V | 86.3 | Confident | 88.7 | Confident | 57 Ų | 57 | 29 Ų | 29 | 35% | 0.345 | 18% | 0.177 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -62.2 | -21.2 | -177.6 | -172 | 0 | 0 | 0 | 0 | 112 | I350 D354 S355 | I350-V352 PolarHBondContact O-N 3.4Å; V352-D354 PolarHBondContact O-N 3.49Å; V352-S355 PolarHBondContact O-N 2.99Å |
| 353 | A | 85.7 | Confident | 88.5 | Confident | 85 Ų | 85 | 28.1 Ų | 28.1 | 70% | 0.702 | 17% | 0.173 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -62.1 | -26.2 | 170.9 | 0 | 0 | 0 | 0 | 0 | 112.9 | N351 S355 | N351-A353 PolarHBondContact O-N 3.17Å; N351-A353 VanDerWaalsContact O-N 3.12Å; N351-A353 WeakPolarHBondContact OD1-CB 3.29Å; N351-A353 PolarHBondContact OD1-N 2.96Å; A353-S355 PolarHBondContact O-N 3.33Å; A353-S355 VanDerWaalsContact O-N 3.15Å |
| 354 | D | 86.5 | Confident | 88.3 | Confident | 49 Ų | 49 | 33.7 Ų | 33.7 | 26% | 0.262 | 20% | 0.199 | S | C | . | . | trans | -86.6 | 49.8 | 172.3 | -172.1 | 23 | 0 | 0 | 0 | 110.8 | N351 V352 D356 N357 F360 | N351-D354 WeakPolarHBondContact O-CB 3.5Å; N351-D354 PolarHBondContact O-N 2.88Å; V352-D354 PolarHBondContact O-N 3.49Å; D354-D356 PolarHBondContact O-N 3.46Å; D354-D356 VanDerWaalsContact O-N 3.15Å; D354-N357 WeakPolarHBondContact O-CB 3.47Å; D354-N357 PolarHBondContact O-N 3.01Å; D354-N357 PolarHBondContact OD2-ND2 3.34Å; D354-N357 VanDerWaalsContact OD2-ND2 3.16Å; D354-F360 WeakPolarHBondContact O-CE2 3.46Å | ||
| 355 | S | 81.8 | Confident | 88.1 | Confident | 77 Ų | 77 | 37 Ų | 37 | 54% | 0.538 | 22% | 0.219 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -63.5 | -19.6 | -174.7 | 63.4 | 0 | 0 | 0 | 0 | 114.2 | V352 A353 N357 | V352-S355 PolarHBondContact O-N 2.99Å; A353-S355 PolarHBondContact O-N 3.33Å; A353-S355 VanDerWaalsContact O-N 3.15Å; S355-N357 PolarHBondContact O-N 2.97Å |
| 356 | D | 81.7 | Confident | 87.9 | Confident | 141 Ų | 141 | 36.3 Ų | 36.3 | 75% | 0.754 | 22% | 0.216 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -73.6 | -12.3 | 175.1 | -72.2 | -36.9 | 0 | 0 | 0 | 113 | D354 V358 | D354-D356 PolarHBondContact O-N 3.46Å; D354-D356 VanDerWaalsContact O-N 3.15Å; D356-V358 PolarHBondContact O-N 2.6Å |
| 357 | N | 85 | Confident | 87.8 | Confident | 17 Ų | 17 | 36.7 Ų | 36.7 | 9% | 0.091 | 22% | 0.218 | C | C | . | . | S | Bend | trans | -55.9 | 128.6 | 176.4 | -163.6 | -53.2 | 0 | 0 | 0 | 110.5 | I350 D354 S355 F359 F360 | I350-N357 HydrophobicContact CG2-CB 4.44Å; D354-N357 WeakPolarHBondContact O-CB 3.47Å; D354-N357 PolarHBondContact O-N 3.01Å; D354-N357 PolarHBondContact OD2-ND2 3.34Å; D354-N357 VanDerWaalsContact OD2-ND2 3.16Å; S355-N357 PolarHBondContact O-N 2.97Å; N357-F359 PolarHBondContact O-N 3.47Å; N357-F359 WeakPolarHBondContact OD1-CB 3.41Å; N357-F359 PolarHBondContact OD1-N 2.83Å; N357-F360 HydrophobicContact CB-CD2 4.03Å; N357-F360 HydrophobicContact CB-CE2 4.27Å; N357-F360 PolarHBondContact O-N 3.25Å |
| 358 | V | 81.3 | Confident | 87.8 | Confident | 23 Ų | 23 | 40.9 Ų | 40.9 | 14% | 0.139 | 24% | 0.241 | C | C | . | . | H | α-helix | trans | -58.4 | -25.1 | -173.6 | 178.7 | 0 | 0 | 0 | 0 | 112.5 | F290 Q291 R294 D356 F360 A361 I362 | F290-V358 VanDerWaalsContact C-CG1 3.48Å; F290-V358 HydrophobicContact CB-CG1 4.14Å; F290-V358 VanDerWaalsContact O-CG1 3.25Å; F290-V358 WeakPolarHBondContact O-CG1 3.49Å; Q291-V358 HydrophobicContact CB-CG2 4.47Å; Q291-V358 HydrophobicContact CG-CB 4.14Å; Q291-V358 HydrophobicContact CG-CG2 3.83Å; R294-V358 HydrophobicContact CB-CG1 3.95Å; D356-V358 PolarHBondContact O-N 2.6Å; V358-F360 VanDerWaalsContact C-N 3.31Å; V358-F360 PolarHBondContact O-N 3.13Å; V358-A361 PolarHBondContact O-N 3.33Å; V358-I362 HydrophobicContact CG1-CD1 4.25Å; V358-I362 HydrophobicContact CG1-CG1 4.43Å; V358-I362 PolarHBondContact O-N 3.06Å; V358-I362 VanDerWaalsContact O-N 3.17Å |
| 359 | F | 85.4 | Confident | 87.7 | Confident | 1 Ų | 1 | 43.9 Ų | 43.9 | 0% | 0.004 | 25% | 0.254 | C | S | . | . | H | α-helix | trans | -54.4 | -45.1 | 175.3 | -156.3 | -81.5 | 0 | 0 | 0 | 112.7 | I284 F290 L343 A346 A347 I350 N357 A361 I362 L363 | I284-F359 HydrophobicContact CB-CE2 4.31Å; I284-F359 HydrophobicContact CD1-CZ 4.42Å; I284-F359 HydrophobicContact CG1-CE2 4Å; I284-F359 HydrophobicContact CG1-CZ 3.88Å; I284-F359 HydrophobicContact CG2-CE2 4.04Å; I284-F359 HydrophobicContact CG2-CZ 4.14Å; F290-F359 AromaticContact CD2-CD2 3.78Å; F290-F359 HydrophobicContact CD2-CD2 3.78Å; F290-F359 HydrophobicContact CD2-CE2 4.12Å; F290-F359 AromaticContact CE2-CD2 3.73Å; F290-F359 HydrophobicContact CE2-CD2 3.73Å; F290-F359 AromaticContact CE2-CE2 3.58Å; F290-F359 HydrophobicContact CE2-CE2 3.58Å; F290-F359 HydrophobicContact CE2-CZ 4.48Å; L343-F359 HydrophobicContact CD1-CE1 3.65Å; L343-F359 HydrophobicContact CD1-CE2 4.11Å; L343-F359 HydrophobicContact CD1-CZ 3.41Å; L343-F359 VanDerWaalsContact CD1-CZ 3.41Å; L343-F359 HydrophobicContact CG-CE1 4.16Å; L343-F359 HydrophobicContact CG-CZ 4.35Å; L343-F359 WeakPolarHBondContact O-CE1 3.47Å; A346-F359 HydrophobicContact CB-CE1 4.37Å; A346-F359 HydrophobicContact CB-CZ 3.79Å; A347-F359 HydrophobicContact CB-CD1 3.78Å; A347-F359 HydrophobicContact CB-CE1 3.62Å; I350-F359 HydrophobicContact CD1-CB 3.62Å; I350-F359 HydrophobicContact CD1-CD1 3.93Å; I350-F359 HydrophobicContact CD1-CD2 3.95Å; I350-F359 HydrophobicContact CD1-CG 3.56Å; N357-F359 PolarHBondContact O-N 3.47Å; N357-F359 WeakPolarHBondContact OD1-CB 3.41Å; N357-F359 PolarHBondContact OD1-N 2.83Å; F359-A361 PolarHBondContact O-N 3.48Å; F359-I362 PolarHBondContact O-N 2.82Å; F359-L363 PolarHBondContact O-N 3.46Å |
| 360 | F | 88.2 | Confident | 87.6 | Confident | 23 Ų | 23 | 43.7 Ų | 43.7 | 10% | 0.101 | 25% | 0.254 | C | S | . | . | H | α-helix | trans | -66.3 | -38.6 | 179.1 | -66.7 | -65.3 | 0 | 0 | 0 | 111.7 | A347 I350 D354 N357 V358 I362 L363 Q364 L404 | A347-F360 HydrophobicContact CB-CD1 4.47Å; A347-F360 HydrophobicContact CB-CE1 4.13Å; I350-F360 HydrophobicContact CB-CE2 4.32Å; I350-F360 HydrophobicContact CB-CZ 4.05Å; I350-F360 HydrophobicContact CG2-CE2 3.85Å; I350-F360 HydrophobicContact CG2-CZ 4.08Å; D354-F360 WeakPolarHBondContact O-CE2 3.46Å; N357-F360 HydrophobicContact CB-CD2 4.03Å; N357-F360 HydrophobicContact CB-CE2 4.27Å; N357-F360 PolarHBondContact O-N 3.25Å; V358-F360 VanDerWaalsContact C-N 3.31Å; V358-F360 PolarHBondContact O-N 3.13Å; F360-I362 VanDerWaalsContact C-N 3.32Å; F360-I362 PolarHBondContact O-N 3.3Å; F360-L363 WeakPolarHBondContact O-CB 3.34Å; F360-L363 PolarHBondContact O-N 2.94Å; F360-Q364 WeakPolarHBondContact O-CG 3.5Å; F360-Q364 PolarHBondContact O-N 3.14Å; F360-L404 HydrophobicContact CD1-CD2 4.45Å; F360-L404 HydrophobicContact CE1-CD2 3.77Å |
| 361 | A | 85.2 | Confident | 87.7 | Confident | 30 Ų | 30 | 45.7 Ų | 45.7 | 25% | 0.248 | 26% | 0.263 | C | S | . | . | H | α-helix | trans | -63.1 | -37.3 | 178.5 | 0 | 0 | 0 | 0 | 0 | 112.6 | V358 F359 | V358-A361 PolarHBondContact O-N 3.33Å; F359-A361 PolarHBondContact O-N 3.48Å |
| 362 | I | 86.7 | Confident | 87.7 | Confident | 16 Ų | 16 | 46.1 Ų | 46.1 | 8% | 0.082 | 27% | 0.27 | C | S | . | . | H | α-helix | trans | -73.3 | -39.4 | 175.5 | -66.7 | 179.2 | 0 | 0 | 0 | 111 | F290 L343 V358 F359 F360 Q364 T365 M366 | F290-I362 HydrophobicContact CB-CD1 3.29Å; F290-I362 HydrophobicContact CD1-CD1 3.18Å; F290-I362 HydrophobicContact CD2-CD1 4.35Å; F290-I362 HydrophobicContact CE1-CD1 4.04Å; F290-I362 HydrophobicContact CE1-CG2 4.46Å; F290-I362 HydrophobicContact CG-CD1 3.36Å; L343-I362 HydrophobicContact CD2-CG2 4.38Å; V358-I362 HydrophobicContact CG1-CD1 4.25Å; V358-I362 HydrophobicContact CG1-CG1 4.43Å; V358-I362 PolarHBondContact O-N 3.06Å; V358-I362 VanDerWaalsContact O-N 3.17Å; F359-I362 PolarHBondContact O-N 2.82Å; F360-I362 VanDerWaalsContact C-N 3.32Å; F360-I362 PolarHBondContact O-N 3.3Å; I362-Q364 PolarHBondContact O-N 3.4Å; I362-T365 PolarHBondContact O-N 2.99Å; I362-T365 PolarHBondContact O-OG1 3.44Å; I362-M366 HydrophobicContact CG2-CE 4.25Å |
| 363 | L | 90.2 | Very high | 87.8 | Confident | 2 Ų | 2 | 45 Ų | 45 | 1% | 0.01 | 26% | 0.259 | C | S | . | . | H | α-helix | trans | -56.3 | -41.8 | 174.8 | 176.1 | 61.4 | 0 | 0 | 0 | 111.4 | L343 C344 A347 F359 F360 T365 M366 I367 L404 | L343-L363 HydrophobicContact CD2-CB 4.45Å; L343-L363 HydrophobicContact CD2-CD1 4.14Å; L343-L363 HydrophobicContact CG-CD1 4.21Å; C344-L363 HydrophobicContact CB-CD1 4.42Å; C344-L363 VanDerWaalsContact SG-CD1 3.57Å; A347-L363 HydrophobicContact CB-CD2 3.79Å; F359-L363 PolarHBondContact O-N 3.46Å; F360-L363 WeakPolarHBondContact O-CB 3.34Å; F360-L363 PolarHBondContact O-N 2.94Å; L363-T365 PolarHBondContact O-N 3.2Å; L363-T365 VanDerWaalsContact O-N 3.15Å; L363-M366 PolarHBondContact O-N 2.97Å; L363-I367 HydrophobicContact CD1-CB 4.19Å; L363-I367 HydrophobicContact CD1-CD1 4.25Å; L363-I367 HydrophobicContact CD1-CG1 4.26Å; L363-I367 HydrophobicContact CD2-CD1 4.14Å; L363-I367 HydrophobicContact CG-CB 4.32Å; L363-I367 HydrophobicContact CG-CD1 4.04Å; L363-I367 HydrophobicContact CG-CG1 4.47Å; L363-I367 WeakPolarHBondContact O-CB 3.5Å; L363-I367 PolarHBondContact O-N 3.32Å; L363-L404 HydrophobicContact CD2-CD1 3.67Å |
| 364 | Q | 89.6 | Confident | 88 | Confident | 116 Ų | 116 | 41.1 Ų | 41.1 | 54% | 0.542 | 23% | 0.227 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -62.6 | -18.1 | 178.6 | -66.7 | -56.3 | -35.2 | 0 | 0 | 114.3 | F360 I362 M366 | F360-Q364 WeakPolarHBondContact O-CG 3.5Å; F360-Q364 PolarHBondContact O-N 3.14Å; I362-Q364 PolarHBondContact O-N 3.4Å; Q364-M366 VanDerWaalsContact C-N 3.26Å; Q364-M366 PolarHBondContact O-N 2.99Å |
| 365 | T | 88.1 | Confident | 88.1 | Confident | 70 Ų | 70 | 39.2 Ų | 39.2 | 43% | 0.429 | 22% | 0.216 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -76.9 | -12.5 | 179 | 71.5 | 0 | 0 | 0 | 0 | 113.8 | E317 I362 L363 | E317-T365 WeakPolarHBondContact OE1-CB 3.47Å; E317-T365 PolarHBondContact OE1-OG1 3.25Å; I362-T365 PolarHBondContact O-N 2.99Å; I362-T365 PolarHBondContact O-OG1 3.44Å; L363-T365 PolarHBondContact O-N 3.2Å; L363-T365 VanDerWaalsContact O-N 3.15Å |
| 366 | M | 90.9 | Very high | 88.3 | Confident | 1 Ų | 1 | 36.8 Ų | 36.8 | 1% | 0.005 | 20% | 0.199 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -137.8 | -10.3 | -175 | 66.1 | -174.8 | 77.4 | 0 | 0 | 115 | I316 L320 L343 I362 L363 Q364 D368 E369 V370 | I316-M366 HydrophobicContact CG2-SD 4.49Å; L320-M366 HydrophobicContact CD1-CB 3.8Å; L343-M366 HydrophobicContact CD2-CE 3.95Å; L343-M366 HydrophobicContact CD2-CG 4.43Å; L343-M366 HydrophobicContact CD2-SD 3.64Å; I362-M366 HydrophobicContact CG2-CE 4.25Å; L363-M366 PolarHBondContact O-N 2.97Å; Q364-M366 VanDerWaalsContact C-N 3.26Å; Q364-M366 PolarHBondContact O-N 2.99Å; M366-D368 PolarHBondContact O-N 3.07Å; M366-E369 PolarHBondContact O-N 3.48Å; M366-V370 VanDerWaalsContact O-CG2 3.28Å; M366-V370 WeakPolarHBondContact O-CG2 3.45Å; M366-V370 PolarHBondContact O-N 3.44Å; M366-V370 VanDerWaalsContact O-N 3.09Å |
| 367 | I | 92.4 | Very high | 88 | Confident | 8 Ų | 8 | 33.3 Ų | 33.3 | 4% | 0.041 | 19% | 0.19 | C | C | . | . | H | α-helix | trans | -63.5 | -37.2 | -171.2 | -164.2 | 176.1 | 0 | 0 | 0 | 113 | L363 V370 K371 L401 | L363-I367 HydrophobicContact CD1-CB 4.19Å; L363-I367 HydrophobicContact CD1-CD1 4.25Å; L363-I367 HydrophobicContact CD1-CG1 4.26Å; L363-I367 HydrophobicContact CD2-CD1 4.14Å; L363-I367 HydrophobicContact CG-CB 4.32Å; L363-I367 HydrophobicContact CG-CD1 4.04Å; L363-I367 HydrophobicContact CG-CG1 4.47Å; L363-I367 WeakPolarHBondContact O-CB 3.5Å; L363-I367 PolarHBondContact O-N 3.32Å; I367-V370 PolarHBondContact O-N 2.94Å; I367-K371 VanDerWaalsContact O-CG 3.3Å; I367-K371 WeakPolarHBondContact O-CG 3.35Å; I367-K371 PolarHBondContact O-N 2.97Å; I367-L401 HydrophobicContact CD1-CD2 3.68Å; I367-L401 HydrophobicContact CG1-CD2 3.93Å |
| 368 | D | 91.2 | Very high | 87.7 | Confident | 89 Ų | 89 | 38.5 Ų | 38.5 | 48% | 0.476 | 22% | 0.222 | S | C | . | . | H | α-helix | trans | -73.6 | -36.5 | -175.9 | -70.5 | -24.9 | 0 | 0 | 0 | 111.8 | M366 K371 S372 | M366-D368 PolarHBondContact O-N 3.07Å; D368-K371 PolarHBondContact O-N 3.33Å; D368-K371 IonicContact OD1-NZ 2.77Å; D368-K371 PolarHBondContact OD1-NZ 3.09Å; D368-S372 WeakPolarHBondContact O-CB 3.4Å; D368-S372 PolarHBondContact O-N 3Å |
| 369 | E | 91.5 | Very high | 87.7 | Confident | 63 Ų | 63 | 44 Ų | 44 | 29% | 0.294 | 25% | 0.245 | S | C | . | . | H | α-helix | trans | -64.5 | -46.5 | 172.8 | -69.9 | 68.6 | -165.8 | 0 | 0 | 110.1 | L320 M366 K371 S372 Y373 | L320-E369 HydrophobicContact CB-CB 4Å; L320-E369 HydrophobicContact CB-CG 4.37Å; M366-E369 PolarHBondContact O-N 3.48Å; E369-K371 VanDerWaalsContact C-N 3.33Å; E369-K371 PolarHBondContact O-N 3.49Å; E369-S372 PolarHBondContact O-N 3.4Å; E369-S372 VanDerWaalsContact O-N 3.12Å; E369-S372 PolarHBondContact O-OG 2.87Å; E369-Y373 HydrophobicContact CB-CE2 4.39Å; E369-Y373 WeakPolarHBondContact O-CD2 3.29Å; E369-Y373 PolarHBondContact O-N 2.83Å |
| 370 | V | 92.2 | Very high | 87.3 | Confident | 1 Ų | 1 | 46.8 Ų | 46.8 | 1% | 0.006 | 26% | 0.263 | C | S | . | . | H | α-helix | trans | -57.6 | -45.6 | 176.1 | 171.5 | 0 | 0 | 0 | 0 | 110.9 | L320 M366 I367 S372 Y373 L374 | L320-V370 HydrophobicContact CD1-CG2 4.18Å; L320-V370 HydrophobicContact CD2-CG2 4.38Å; M366-V370 VanDerWaalsContact O-CG2 3.28Å; M366-V370 WeakPolarHBondContact O-CG2 3.45Å; M366-V370 PolarHBondContact O-N 3.44Å; M366-V370 VanDerWaalsContact O-N 3.09Å; I367-V370 PolarHBondContact O-N 2.94Å; V370-S372 PolarHBondContact O-N 3.37Å; V370-Y373 PolarHBondContact O-N 2.87Å; V370-L374 HydrophobicContact CG1-CD1 3.7Å; V370-L374 HydrophobicContact CG1-CG 4.46Å; V370-L374 WeakPolarHBondContact O-CB 3.38Å; V370-L374 PolarHBondContact O-N 3.15Å |
| 371 | K | 92 | Very high | 87.1 | Confident | 41 Ų | 41 | 45.8 Ų | 45.8 | 18% | 0.178 | 26% | 0.258 | C | S | . | . | H | α-helix | trans | -58.5 | -47.8 | 174.3 | -69.6 | 169.7 | -166.7 | 150 | 0 | 111.3 | I367 D368 E369 Y373 L374 F375 L401 V410 | I367-K371 VanDerWaalsContact O-CG 3.3Å; I367-K371 WeakPolarHBondContact O-CG 3.35Å; I367-K371 PolarHBondContact O-N 2.97Å; D368-K371 PolarHBondContact O-N 3.33Å; D368-K371 IonicContact OD1-NZ 2.77Å; D368-K371 PolarHBondContact OD1-NZ 3.09Å; E369-K371 VanDerWaalsContact C-N 3.33Å; E369-K371 PolarHBondContact O-N 3.49Å; K371-Y373 PolarHBondContact O-N 3.47Å; K371-L374 PolarHBondContact O-N 2.77Å; K371-F375 PolarHBondContact O-N 3.36Å; K371-L401 HydrophobicContact CG-CD1 3.82Å; K371-L401 HydrophobicContact CG-CD2 4.35Å; K371-V410 HydrophobicContact CB-CG2 3.97Å; K371-V410 HydrophobicContact CD-CG2 4.14Å; K371-V410 HydrophobicContact CG-CG2 3.77Å |
| 372 | S | 89.2 | Confident | 86.8 | Confident | 59 Ų | 59 | 45 Ų | 45 | 41% | 0.413 | 25% | 0.249 | S | C | . | . | H | α-helix | trans | -63 | -27.3 | -176.2 | 80.9 | 0 | 0 | 0 | 0 | 113.5 | D368 E369 V370 S376 | D368-S372 WeakPolarHBondContact O-CB 3.4Å; D368-S372 PolarHBondContact O-N 3Å; E369-S372 PolarHBondContact O-N 3.4Å; E369-S372 VanDerWaalsContact O-N 3.12Å; E369-S372 PolarHBondContact O-OG 2.87Å; V370-S372 PolarHBondContact O-N 3.37Å; S372-S376 WeakPolarHBondContact O-CB 3.11Å |
| 373 | Y | 89 | Confident | 85.7 | Confident | 32 Ų | 32 | 52 Ų | 52 | 13% | 0.125 | 28% | 0.279 | C | S | . | . | H | α-helix | trans | -89 | -44 | 177.2 | -71.1 | -58.4 | 0 | 0 | 0 | 112.9 | L320 G323 H324 L333 E369 V370 K371 L381 | L320-Y373 HydrophobicContact CD2-CD2 4.21Å; L320-Y373 HydrophobicContact CD2-CE2 4.43Å; L320-Y373 VanDerWaalsContact O-CE2 3.27Å; L320-Y373 WeakPolarHBondContact O-CE2 3.36Å; L320-Y373 PolarHBondContact O-OH 3.25Å; G323-Y373 WeakPolarHBondContact CA-OH 3.31Å; H324-Y373 AromaticContact NE2-CD1 4Å; L333-Y373 HydrophobicContact CD1-CD2 4.17Å; L333-Y373 HydrophobicContact CD1-CE2 4.04Å; L333-Y373 HydrophobicContact CD2-CD1 4.25Å; L333-Y373 HydrophobicContact CD2-CE1 4.24Å; E369-Y373 HydrophobicContact CB-CE2 4.39Å; E369-Y373 WeakPolarHBondContact O-CD2 3.29Å; E369-Y373 PolarHBondContact O-N 2.83Å; V370-Y373 PolarHBondContact O-N 2.87Å; K371-Y373 PolarHBondContact O-N 3.47Å; Y373-L381 VanDerWaalsContact O-CB 3.27Å; Y373-L381 WeakPolarHBondContact O-CB 3.11Å; Y373-L381 PolarHBondContact O-N 3.37Å; Y373-L381 VanDerWaalsContact O-N 3.17Å |
| 374 | L | 89.1 | Confident | 84.2 | Confident | 4 Ų | 4 | 59.2 Ų | 59.2 | 2% | 0.021 | 32% | 0.318 | C | S | . | . | H | α-helix | trans | -73.1 | -33.1 | -176.8 | -69.5 | 175.1 | 0 | 0 | 0 | 112.6 | C337 A341 V370 K371 L381 F382 M394 C397 | C337-L374 HydrophobicContact CB-CD2 4.32Å; C337-L374 HydrophobicContact CB-CG 4.42Å; A341-L374 HydrophobicContact CB-CD1 4.47Å; V370-L374 HydrophobicContact CG1-CD1 3.7Å; V370-L374 HydrophobicContact CG1-CG 4.46Å; V370-L374 WeakPolarHBondContact O-CB 3.38Å; V370-L374 PolarHBondContact O-N 3.15Å; K371-L374 PolarHBondContact O-N 2.77Å; L374-L381 HydrophobicContact CD2-CD2 3.74Å; L374-F382 HydrophobicContact CD2-CE2 3.67Å; L374-F382 HydrophobicContact CD2-CZ 4.03Å; L374-M394 HydrophobicContact CD2-CG 4.32Å; L374-M394 WeakPolarHBondContact O-CE 3.09Å; L374-C397 HydrophobicContact CD1-CB 3.88Å |
| 375 | F | 90.4 | Very high | 83 | Confident | 10 Ų | 10 | 56.8 Ų | 56.8 | 4% | 0.044 | 31% | 0.308 | C | S | . | . | S | Bend | trans | -121.5 | 24.1 | -171.2 | -54.5 | -79.3 | 0 | 0 | 0 | 113.8 | K371 M394 C397 F398 L401 V410 V426 | K371-F375 PolarHBondContact O-N 3.36Å; F375-M394 HydrophobicContact CD1-CE 4.15Å; F375-M394 HydrophobicContact CE1-CB 4.36Å; F375-M394 HydrophobicContact CE1-CE 4.28Å; F375-M394 WeakPolarHBondContact CZ-O 3.43Å; F375-C397 HydrophobicContact CE2-CB 4.27Å; F375-C397 HydrophobicContact CZ-CB 4.17Å; F375-F398 HydrophobicContact CE1-CB 4.24Å; F375-F398 HydrophobicContact CE1-CD2 4.18Å; F375-F398 HydrophobicContact CZ-CB 4.01Å; F375-L401 HydrophobicContact CE2-CD1 3.98Å; F375-V410 HydrophobicContact CB-CG1 4.01Å; F375-V410 HydrophobicContact CB-CG2 4.2Å; F375-V410 HydrophobicContact CD1-CG1 3.5Å; F375-V410 HydrophobicContact CD2-CB 4.26Å; F375-V410 HydrophobicContact CD2-CG1 3.55Å; F375-V410 HydrophobicContact CD2-CG2 3.64Å; F375-V410 HydrophobicContact CE1-CG1 3.73Å; F375-V410 HydrophobicContact CE2-CG1 3.78Å; F375-V410 HydrophobicContact CE2-CG2 4.23Å; F375-V410 HydrophobicContact CG-CB 4.35Å; F375-V410 HydrophobicContact CG-CG1 3.4Å; F375-V410 HydrophobicContact CG-CG2 4.03Å; F375-V410 HydrophobicContact CZ-CG1 3.87Å; F375-V426 HydrophobicContact CE1-CG1 4.01Å |
| 376 | S | 85.8 | Confident | 81.9 | Confident | 25 Ų | 25 | 54.4 Ų | 54.4 | 18% | 0.175 | 29% | 0.294 | C | S | . | . | trans | -83.5 | 122.9 | 174.4 | 169 | 0 | 0 | 0 | 0 | 112.1 | S372 T378 K379 | S372-S376 WeakPolarHBondContact O-CB 3.11Å; S376-T378 VanDerWaalsContact C-N 3.31Å; S376-T378 PolarHBondContact O-N 3.08Å; S376-T378 PolarHBondContact OG-N 3.43Å; S376-T378 PolarHBondContact OG-OG1 2.81Å; S376-K379 PolarHBondContact OG-N 3.06Å; S376-K379 VanDerWaalsContact OG-N 3.07Å | ||
| 377 | A | 75.3 | Confident | 81.1 | Confident | 69 Ų | 69 | 57 Ų | 57 | 57% | 0.57 | 31% | 0.312 | S | S | * | . | S | Bend | trans | -69.3 | -27.2 | 172.5 | 0 | 0 | 0 | 0 | 0 | 113.1 | ||
| 378 | T | 79 | Confident | 80.1 | Confident | 125 Ų | 125 | 59.6 Ų | 59.6 | 77% | 0.767 | 33% | 0.328 | S | S | * | . | S | Bend | trans | -90.5 | -32.7 | -173.2 | 59.4 | 0 | 0 | 0 | 0 | 113.3 | S376 | S376-T378 VanDerWaalsContact C-N 3.31Å; S376-T378 PolarHBondContact O-N 3.08Å; S376-T378 PolarHBondContact OG-N 3.43Å; S376-T378 PolarHBondContact OG-OG1 2.81Å |
| 379 | K | 80.3 | Confident | 79.4 | Confident | 140 Ų | 140 | 59.9 Ų | 59.9 | 61% | 0.609 | 33% | 0.327 | S | S | * | . | S | Bend | trans | -142.5 | 73.2 | -178.2 | -67.3 | -176.3 | -176.7 | 173.8 | 0 | 109.6 | S376 | S376-K379 PolarHBondContact OG-N 3.06Å; S376-K379 VanDerWaalsContact OG-N 3.07Å |
| 380 | P | 77.8 | Confident | 79 | Confident | 58 Ų | 58 | 59.9 Ų | 59.9 | 38% | 0.377 | 33% | 0.327 | S | S | . | . | trans | -63.7 | 139.3 | 179.8 | 26.9 | -34.5 | 0 | 0 | 0 | 110.5 | ||||
| 381 | L | 82.4 | Confident | 78.7 | Confident | 2 Ų | 2 | 60.6 Ų | 60.6 | 1% | 0.01 | 33% | 0.33 | C | S | . | . | S | Bend | trans | -58.3 | -49.2 | 175.9 | 178.5 | 65.2 | 0 | 0 | 0 | 111.1 | H330 L333 C337 Y373 L374 | H330-L381 PolarHBondContact CE1-O 3.29Å; H330-L381 VanDerWaalsContact CE1-O 3.24Å; H330-L381 PolarHBondContact NE2-O 3.41Å; L333-L381 HydrophobicContact CB-CD1 4.47Å; L333-L381 HydrophobicContact CD2-CD1 3.76Å; L333-L381 HydrophobicContact CG-CD1 3.77Å; C337-L381 HydrophobicContact CB-CD2 3.75Å; Y373-L381 VanDerWaalsContact O-CB 3.27Å; Y373-L381 WeakPolarHBondContact O-CB 3.11Å; Y373-L381 PolarHBondContact O-N 3.37Å; Y373-L381 VanDerWaalsContact O-N 3.17Å; L374-L381 HydrophobicContact CD2-CD2 3.74Å |
| 382 | F | 79.7 | Confident | 78.4 | Confident | 14 Ų | 14 | 59.5 Ų | 59.5 | 6% | 0.061 | 33% | 0.326 | C | S | . | . | S | Bend | trans | -88.6 | 114.8 | 177.8 | -50 | -60.2 | 0 | 0 | 0 | 108.4 | A334 L374 P386 E390 M394 | A334-F382 HydrophobicContact CB-CE1 4.4Å; L374-F382 HydrophobicContact CD2-CE2 3.67Å; L374-F382 HydrophobicContact CD2-CZ 4.03Å; F382-P386 HydrophobicContact CB-CB 4.36Å; F382-E390 HydrophobicContact CD1-CB 4.03Å; F382-E390 HydrophobicContact CD1-CG 3.56Å; F382-E390 WeakPolarHBondContact CD1-OE1 3.32Å; F382-E390 HydrophobicContact CD2-CB 3.84Å; F382-E390 HydrophobicContact CD2-CG 4.31Å; F382-E390 HydrophobicContact CE1-CB 4.14Å; F382-E390 HydrophobicContact CE1-CG 3.64Å; F382-E390 HydrophobicContact CE2-CB 3.94Å; F382-E390 HydrophobicContact CE2-CG 4.36Å; F382-E390 HydrophobicContact CG-CB 3.88Å; F382-E390 HydrophobicContact CG-CG 3.92Å; F382-E390 HydrophobicContact CZ-CB 4.09Å; F382-E390 HydrophobicContact CZ-CG 4.04Å; F382-M394 HydrophobicContact CD2-CG 4.38Å; F382-M394 HydrophobicContact CD2-SD 4Å; F382-M394 HydrophobicContact CE2-CG 4.05Å; F382-M394 HydrophobicContact CE2-SD 4.28Å |
| 383 | K | 63.3 | Low | 78.4 | Confident | 164 Ų | 164 | 57.6 Ų | 57.6 | 71% | 0.713 | 31% | 0.312 | S | S | * | . | trans | -84.6 | 132.7 | 178.8 | -67.7 | -176.4 | 177.7 | -177.2 | 0 | 108.6 | ||||
| 384 | N | 58.8 | Low | 78.6 | Confident | 152 Ų | 152 | 56.4 Ų | 56.4 | 81% | 0.813 | 31% | 0.308 | S | S | * | . | S | Bend | trans | 79.2 | 172.8 | -167 | -48.7 | -29.1 | 0 | 0 | 0 | 112.7 | ||
| 385 | L | 63.7 | Low | 78.8 | Confident | 66 Ų | 66 | 56.3 Ų | 56.3 | 35% | 0.346 | 31% | 0.308 | S | S | . | . | S | Bend | trans | -54.1 | 123.6 | 175.8 | -143.6 | 86 | 0 | 0 | 0 | 108.1 | S387 P422 L528 | L385-S387 PolarHBondContact O-N 3.03Å; L385-P422 HydrophobicContact CD1-CG 3.75Å; L385-P422 HydrophobicContact CG-CG 4.33Å; L385-L528 HydrophobicContact CD2-CD1 3.61Å |
| 386 | P | 65.8 | Low | 78.9 | Confident | 19 Ų | 19 | 57.4 Ų | 57.4 | 12% | 0.123 | 31% | 0.313 | C | S | . | . | P | Polyproline II helix | trans | -57.5 | 138.5 | -174.5 | 20 | -31.2 | 0 | 0 | 0 | 110.5 | F382 E390 L391 M394 P422 | F382-P386 HydrophobicContact CB-CB 4.36Å; P386-E390 HydrophobicContact CB-CB 3.8Å; P386-L391 HydrophobicContact CB-CB 4.41Å; P386-L391 HydrophobicContact CG-CB 4.36Å; P386-L391 HydrophobicContact CG-CD1 3.9Å; P386-M394 HydrophobicContact CG-SD 4.44Å; P386-P422 HydrophobicContact CG-CB 4.13Å |
| 387 | S | 74.1 | Confident | 79.3 | Confident | 56 Ų | 56 | 56.2 Ų | 56.2 | 39% | 0.392 | 30% | 0.304 | S | S | . | . | P | Polyproline II helix | trans | -58.3 | 161.2 | 169.4 | 63.5 | 0 | 0 | 0 | 0 | 110.4 | L385 Q389 E390 L391 | L385-S387 PolarHBondContact O-N 3.03Å; S387-Q389 PolarHBondContact O-N 3.49Å; S387-Q389 VanDerWaalsContact O-N 3.15Å; S387-E390 WeakPolarHBondContact CB-OE2 3.29Å; S387-E390 PolarHBondContact N-OE2 2.9Å; S387-E390 PolarHBondContact O-N 3.27Å; S387-E390 WeakPolarHBondContact OG-CG 3.49Å; S387-E390 PolarHBondContact OG-N 3.35Å; S387-E390 PolarHBondContact OG-OE2 2.99Å; S387-L391 PolarHBondContact O-N 2.91Å |
| 388 | V | 70.9 | Confident | 80.3 | Confident | 62 Ų | 62 | 53 Ų | 53 | 38% | 0.376 | 28% | 0.278 | S | S | . | . | H | α-helix | trans | -52.3 | -41.8 | -179.3 | -180 | 0 | 0 | 0 | 0 | 111.8 | D392 A522 A525 | V388-D392 WeakPolarHBondContact O-CB 3.32Å; V388-D392 PolarHBondContact O-N 3.43Å; V388-A522 HydrophobicContact CG1-CB 4.23Å; V388-A525 HydrophobicContact CG1-CB 4.38Å; V388-A525 HydrophobicContact CG2-CB 3.76Å |
| 389 | Q | 76.4 | Confident | 81 | Confident | 95 Ų | 95 | 47.2 Ų | 47.2 | 44% | 0.444 | 24% | 0.242 | S | C | . | . | H | α-helix | trans | -67.3 | -38.1 | 178.2 | -66.1 | 179.8 | -5.3 | 0 | 0 | 112.8 | S387 V393 G514 L515 | S387-Q389 PolarHBondContact O-N 3.49Å; S387-Q389 VanDerWaalsContact O-N 3.15Å; Q389-V393 WeakPolarHBondContact O-CG2 3.44Å; Q389-V393 PolarHBondContact O-N 3.34Å; Q389-G514 PolarHBondContact NE2-O 2.86Å; Q389-L515 PolarHBondContact NE2-O 3.18Å |
| 390 | E | 84.1 | Confident | 81.7 | Confident | 63 Ų | 63 | 40.6 Ų | 40.6 | 29% | 0.294 | 21% | 0.214 | S | C | . | . | H | α-helix | trans | -71.3 | -40.1 | 178.4 | -69.4 | 166.3 | 147.8 | 0 | 0 | 111.2 | F382 P386 S387 D392 V393 M394 | F382-E390 HydrophobicContact CD1-CB 4.03Å; F382-E390 HydrophobicContact CD1-CG 3.56Å; F382-E390 WeakPolarHBondContact CD1-OE1 3.32Å; F382-E390 HydrophobicContact CD2-CB 3.84Å; F382-E390 HydrophobicContact CD2-CG 4.31Å; F382-E390 HydrophobicContact CE1-CB 4.14Å; F382-E390 HydrophobicContact CE1-CG 3.64Å; F382-E390 HydrophobicContact CE2-CB 3.94Å; F382-E390 HydrophobicContact CE2-CG 4.36Å; F382-E390 HydrophobicContact CG-CB 3.88Å; F382-E390 HydrophobicContact CG-CG 3.92Å; F382-E390 HydrophobicContact CZ-CB 4.09Å; F382-E390 HydrophobicContact CZ-CG 4.04Å; P386-E390 HydrophobicContact CB-CB 3.8Å; S387-E390 WeakPolarHBondContact CB-OE2 3.29Å; S387-E390 PolarHBondContact N-OE2 2.9Å; S387-E390 PolarHBondContact O-N 3.27Å; S387-E390 WeakPolarHBondContact OG-CG 3.49Å; S387-E390 PolarHBondContact OG-N 3.35Å; S387-E390 PolarHBondContact OG-OE2 2.99Å; E390-D392 VanDerWaalsContact C-N 3.34Å; E390-V393 PolarHBondContact O-N 3.44Å; E390-M394 WeakPolarHBondContact O-CG 3.39Å; E390-M394 PolarHBondContact O-N 2.65Å; E390-M394 VanDerWaalsContact O-N 3.09Å |
| 391 | L | 85.9 | Confident | 82.5 | Confident | 17 Ų | 17 | 38.3 Ų | 38.3 | 9% | 0.089 | 20% | 0.198 | C | C | . | . | H | α-helix | trans | -62.6 | -42.6 | 174.3 | -169.5 | 73.4 | 0 | 0 | 0 | 110.8 | P386 S387 V393 M394 I395 V426 M429 | P386-L391 HydrophobicContact CB-CB 4.41Å; P386-L391 HydrophobicContact CG-CB 4.36Å; P386-L391 HydrophobicContact CG-CD1 3.9Å; S387-L391 PolarHBondContact O-N 2.91Å; L391-V393 VanDerWaalsContact C-N 3.3Å; L391-V393 PolarHBondContact O-N 3.48Å; L391-M394 WeakPolarHBondContact O-CB 3.3Å; L391-M394 PolarHBondContact O-N 3.41Å; L391-M394 VanDerWaalsContact O-N 3.1Å; L391-I395 HydrophobicContact CD2-CD1 4.34Å; L391-I395 HydrophobicContact CG-CD1 3.98Å; L391-I395 HydrophobicContact CG-CG1 4.5Å; L391-I395 VanDerWaalsContact O-CG1 3.29Å; L391-I395 WeakPolarHBondContact O-CG1 3.2Å; L391-I395 PolarHBondContact O-N 2.8Å; L391-V426 HydrophobicContact CD1-CG2 3.53Å; L391-V426 HydrophobicContact CG-CG2 4.44Å; L391-M429 HydrophobicContact CD2-SD 3.95Å |
| 392 | D | 85 | Confident | 83 | Confident | 17 Ų | 17 | 38.3 Ų | 38.3 | 9% | 0.091 | 20% | 0.198 | C | C | . | . | H | α-helix | trans | -58.7 | -40.8 | 175.4 | -89.9 | -0 | 0 | 0 | 0 | 112 | V388 E390 I395 E396 S520 | V388-D392 WeakPolarHBondContact O-CB 3.32Å; V388-D392 PolarHBondContact O-N 3.43Å; E390-D392 VanDerWaalsContact C-N 3.34Å; D392-I395 PolarHBondContact O-N 3.11Å; D392-E396 WeakPolarHBondContact O-CB 3.43Å; D392-E396 WeakPolarHBondContact O-CG 3.36Å; D392-E396 PolarHBondContact O-N 3.33Å; D392-S520 PolarHBondContact OD1-OG 3.49Å; D392-S520 WeakPolarHBondContact OD2-CB 3.44Å; D392-S520 PolarHBondContact OD2-OG 3.02Å |
| 393 | V | 89.8 | Confident | 83.6 | Confident | 19 Ų | 19 | 38.4 Ų | 38.4 | 12% | 0.115 | 20% | 0.198 | C | C | . | . | H | α-helix | trans | -63 | -42.3 | 174.6 | 171.2 | 0 | 0 | 0 | 0 | 111.2 | I338 A341 Q389 E390 L391 E396 C397 | I338-V393 HydrophobicContact CG1-CG1 4.01Å; I338-V393 HydrophobicContact CG1-CG2 4.14Å; A341-V393 HydrophobicContact CB-CG1 4.24Å; Q389-V393 WeakPolarHBondContact O-CG2 3.44Å; Q389-V393 PolarHBondContact O-N 3.34Å; E390-V393 PolarHBondContact O-N 3.44Å; L391-V393 VanDerWaalsContact C-N 3.3Å; L391-V393 PolarHBondContact O-N 3.48Å; V393-E396 PolarHBondContact O-N 3.13Å; V393-C397 VanDerWaalsContact O-CB 3.29Å; V393-C397 WeakPolarHBondContact O-CB 3.27Å; V393-C397 PolarHBondContact O-N 3.42Å |
| 394 | M | 92.5 | Very high | 84.8 | Confident | 8 Ų | 8 | 32 Ų | 32 | 4% | 0.039 | 17% | 0.171 | C | C | . | . | H | α-helix | trans | -65 | -42.7 | 177 | -66.3 | 178.3 | 66.4 | 0 | 0 | 111.6 | L374 F375 F382 P386 E390 L391 C397 F398 V426 | L374-M394 HydrophobicContact CD2-CG 4.32Å; L374-M394 WeakPolarHBondContact O-CE 3.09Å; F375-M394 HydrophobicContact CD1-CE 4.15Å; F375-M394 HydrophobicContact CE1-CB 4.36Å; F375-M394 HydrophobicContact CE1-CE 4.28Å; F375-M394 WeakPolarHBondContact CZ-O 3.43Å; F382-M394 HydrophobicContact CD2-CG 4.38Å; F382-M394 HydrophobicContact CD2-SD 4Å; F382-M394 HydrophobicContact CE2-CG 4.05Å; F382-M394 HydrophobicContact CE2-SD 4.28Å; P386-M394 HydrophobicContact CG-SD 4.44Å; E390-M394 WeakPolarHBondContact O-CG 3.39Å; E390-M394 PolarHBondContact O-N 2.65Å; E390-M394 VanDerWaalsContact O-N 3.09Å; L391-M394 WeakPolarHBondContact O-CB 3.3Å; L391-M394 PolarHBondContact O-N 3.41Å; L391-M394 VanDerWaalsContact O-N 3.1Å; M394-C397 PolarHBondContact O-N 2.83Å; M394-F398 WeakPolarHBondContact O-CB 3.47Å; M394-F398 PolarHBondContact O-N 3.19Å; M394-V426 HydrophobicContact CB-CG1 4.3Å; M394-V426 HydrophobicContact CB-CG2 3.67Å; M394-V426 HydrophobicContact CE-CG2 4.06Å; M394-V426 HydrophobicContact SD-CG2 4.46Å |
| 395 | I | 93.3 | Very high | 86.1 | Confident | 2 Ų | 2 | 29.8 Ų | 29.8 | 1% | 0.01 | 16% | 0.159 | C | C | . | . | H | α-helix | trans | -62.1 | -48.1 | 175.8 | -66 | 162.6 | 0 | 0 | 0 | 110.4 | L391 D392 C397 F398 V399 V426 M429 A430 | L391-I395 HydrophobicContact CD2-CD1 4.34Å; L391-I395 HydrophobicContact CG-CD1 3.98Å; L391-I395 HydrophobicContact CG-CG1 4.5Å; L391-I395 VanDerWaalsContact O-CG1 3.29Å; L391-I395 WeakPolarHBondContact O-CG1 3.2Å; L391-I395 PolarHBondContact O-N 2.8Å; D392-I395 PolarHBondContact O-N 3.11Å; I395-C397 VanDerWaalsContact C-N 3.33Å; I395-C397 PolarHBondContact O-N 3.18Å; I395-F398 PolarHBondContact O-N 3.38Å; I395-V399 HydrophobicContact CG2-CG2 4.37Å; I395-V399 WeakPolarHBondContact O-CG2 3.22Å; I395-V399 PolarHBondContact O-N 2.92Å; I395-V426 HydrophobicContact CG1-CB 4.42Å; I395-V426 HydrophobicContact CG1-CG1 4.21Å; I395-V426 HydrophobicContact CG1-CG2 4.21Å; I395-M429 HydrophobicContact CD1-CB 3.72Å; I395-M429 HydrophobicContact CD1-CE 3.72Å; I395-M429 HydrophobicContact CD1-CG 4.4Å; I395-M429 HydrophobicContact CD1-SD 3.84Å; I395-M429 HydrophobicContact CG1-CB 4.19Å; I395-A430 HydrophobicContact CG2-CB 4.22Å |
| 396 | E | 92.2 | Very high | 86.8 | Confident | 33 Ų | 33 | 29.9 Ų | 29.9 | 15% | 0.154 | 16% | 0.156 | C | C | . | . | H | α-helix | trans | -59 | -44.9 | 177.3 | -79.7 | -163.3 | 151 | 0 | 0 | 112 | K345 D392 V393 S400 R433 | K345-E396 IonicContact NZ-OE1 3.92Å; K345-E396 PolarHBondContact NZ-OE1 3.26Å; K345-E396 IonicContact NZ-OE2 2.76Å; D392-E396 WeakPolarHBondContact O-CB 3.43Å; D392-E396 WeakPolarHBondContact O-CG 3.36Å; D392-E396 PolarHBondContact O-N 3.33Å; V393-E396 PolarHBondContact O-N 3.13Å; E396-S400 WeakPolarHBondContact O-CB 3.28Å; E396-S400 PolarHBondContact O-N 3.32Å; E396-S400 PolarHBondContact O-OG 3.5Å; E396-R433 IonicContact OE1-NH1 3.49Å; E396-R433 IonicContact OE1-NH2 3.54Å |
| 397 | C | 95.3 | Very high | 87.3 | Confident | 0 Ų | 0 | 31.8 Ų | 31.8 | 0% | 0 | 17% | 0.165 | C | C | . | . | H | α-helix | trans | -63.3 | -46 | 177 | -167.6 | 0 | 0 | 0 | 0 | 110.9 | A341 L374 F375 V393 M394 I395 V399 S400 L401 | A341-C397 HydrophobicContact CB-CB 3.94Å; L374-C397 HydrophobicContact CD1-CB 3.88Å; F375-C397 HydrophobicContact CE2-CB 4.27Å; F375-C397 HydrophobicContact CZ-CB 4.17Å; V393-C397 VanDerWaalsContact O-CB 3.29Å; V393-C397 WeakPolarHBondContact O-CB 3.27Å; V393-C397 PolarHBondContact O-N 3.42Å; M394-C397 PolarHBondContact O-N 2.83Å; I395-C397 VanDerWaalsContact C-N 3.33Å; I395-C397 PolarHBondContact O-N 3.18Å; C397-V399 PolarHBondContact O-N 3.27Å; C397-S400 WeakPolarHBondContact O-CB 3.5Å; C397-S400 PolarHBondContact O-N 3.4Å; C397-S400 VanDerWaalsContact O-N 3.16Å; C397-L401 VanDerWaalsContact O-CG 3.28Å; C397-L401 WeakPolarHBondContact O-CG 3.34Å; C397-L401 PolarHBondContact O-N 2.97Å |
| 398 | F | 95.5 | Very high | 87.5 | Confident | 1 Ų | 1 | 31.3 Ų | 31.3 | 0% | 0.004 | 16% | 0.158 | C | C | . | . | H | α-helix | trans | -58.7 | -50.3 | 178.3 | -172.9 | -76.2 | 0 | 0 | 0 | 111.8 | F375 M394 I395 S400 L401 F402 V410 F411 C414 V426 L427 A430 | F375-F398 HydrophobicContact CE1-CB 4.24Å; F375-F398 HydrophobicContact CE1-CD2 4.18Å; F375-F398 HydrophobicContact CZ-CB 4.01Å; M394-F398 WeakPolarHBondContact O-CB 3.47Å; M394-F398 PolarHBondContact O-N 3.19Å; I395-F398 PolarHBondContact O-N 3.38Å; F398-S400 PolarHBondContact O-N 3.28Å; F398-L401 PolarHBondContact O-N 3.35Å; F398-F402 WeakPolarHBondContact O-CB 3.21Å; F398-F402 PolarHBondContact O-N 3.35Å; F398-V410 HydrophobicContact CD2-CG1 3.66Å; F398-V410 HydrophobicContact CE2-CG1 3.97Å; F398-F411 HydrophobicContact CE1-CD2 4.17Å; F398-F411 HydrophobicContact CZ-CB 4.29Å; F398-F411 AromaticContact CZ-CD2 3.63Å; F398-F411 HydrophobicContact CZ-CD2 3.63Å; F398-F411 HydrophobicContact CZ-CE2 4.42Å; F398-F411 HydrophobicContact CZ-CG 4.38Å; F398-C414 HydrophobicContact CE2-CB 3.98Å; F398-V426 HydrophobicContact CB-CG1 3.78Å; F398-V426 HydrophobicContact CD2-CG1 4.07Å; F398-V426 HydrophobicContact CG-CG1 4.1Å; F398-L427 HydrophobicContact CE1-CD1 4.23Å; F398-L427 HydrophobicContact CE2-CD1 4.26Å; F398-L427 HydrophobicContact CZ-CD1 3.53Å; F398-A430 HydrophobicContact CB-CB 4.21Å; F398-A430 HydrophobicContact CD1-CB 3.34Å; F398-A430 HydrophobicContact CE1-CB 3.94Å; F398-A430 HydrophobicContact CG-CB 3.97Å |
| 399 | V | 95.4 | Very high | 88.2 | Confident | 3 Ų | 3 | 33.9 Ų | 33.9 | 2% | 0.018 | 17% | 0.166 | C | C | . | . | H | α-helix | trans | -59.6 | -39.2 | 177.9 | 171.9 | 0 | 0 | 0 | 0 | 110.5 | I395 C397 F402 R403 A430 R433 I434 | I395-V399 HydrophobicContact CG2-CG2 4.37Å; I395-V399 WeakPolarHBondContact O-CG2 3.22Å; I395-V399 PolarHBondContact O-N 2.92Å; C397-V399 PolarHBondContact O-N 3.27Å; V399-F402 PolarHBondContact O-N 3.31Å; V399-R403 VanDerWaalsContact CG1-CZ 3.48Å; V399-R403 WeakPolarHBondContact O-CB 3.32Å; V399-R403 VanDerWaalsContact O-CG 3.29Å; V399-R403 WeakPolarHBondContact O-CG 3.31Å; V399-R403 PolarHBondContact O-N 3.46Å; V399-A430 HydrophobicContact CG2-CB 3.62Å; V399-R433 HydrophobicContact CG2-CB 4.14Å; V399-I434 HydrophobicContact CG1-CG1 4.12Å; V399-I434 HydrophobicContact CG2-CD1 4.36Å; V399-I434 HydrophobicContact CG2-CG1 4.22Å |
| 400 | S | 95 | Very high | 88.8 | Confident | 2 Ų | 2 | 29.7 Ų | 29.7 | 1% | 0.014 | 15% | 0.146 | C | C | . | . | H | α-helix | trans | -65.4 | -46.6 | 177.9 | -55.5 | 0 | 0 | 0 | 0 | 111.8 | K345 E396 C397 F398 F402 R403 L404 | K345-S400 WeakPolarHBondContact CA-OG 3.31Å; K345-S400 WeakPolarHBondContact CB-OG 3.43Å; K345-S400 PolarHBondContact N-OG 2.95Å; E396-S400 WeakPolarHBondContact O-CB 3.28Å; E396-S400 PolarHBondContact O-N 3.32Å; E396-S400 PolarHBondContact O-OG 3.5Å; C397-S400 WeakPolarHBondContact O-CB 3.5Å; C397-S400 PolarHBondContact O-N 3.4Å; C397-S400 VanDerWaalsContact O-N 3.16Å; F398-S400 PolarHBondContact O-N 3.28Å; S400-F402 VanDerWaalsContact C-N 3.33Å; S400-F402 PolarHBondContact O-N 2.87Å; S400-R403 PolarHBondContact O-N 2.87Å; S400-L404 VanDerWaalsContact O-CG 3.3Å; S400-L404 WeakPolarHBondContact O-CG 3.36Å; S400-L404 PolarHBondContact O-N 3.46Å |
| 401 | L | 93.4 | Very high | 89 | Confident | 8.5 Ų | 8.5 | 26.9 Ų | 26.9 | 5% | 0.045 | 13% | 0.134 | C | C | . | . | H | α-helix | trans | -61.4 | -44.5 | 176.3 | -68.4 | 174.5 | 0 | 0 | 0 | 111.3 | I367 K371 F375 C397 F398 R403 L404 N405 N408 V410 | I367-L401 HydrophobicContact CD1-CD2 3.68Å; I367-L401 HydrophobicContact CG1-CD2 3.93Å; K371-L401 HydrophobicContact CG-CD1 3.82Å; K371-L401 HydrophobicContact CG-CD2 4.35Å; F375-L401 HydrophobicContact CE2-CD1 3.98Å; C397-L401 VanDerWaalsContact O-CG 3.28Å; C397-L401 WeakPolarHBondContact O-CG 3.34Å; C397-L401 PolarHBondContact O-N 2.97Å; F398-L401 PolarHBondContact O-N 3.35Å; L401-R403 VanDerWaalsContact C-N 3.34Å; L401-R403 PolarHBondContact O-N 3.39Å; L401-L404 PolarHBondContact O-N 3.27Å; L401-N405 CarbonylContact O-C 3.52Å; L401-N405 PolarHBondContact O-N 3.25Å; L401-N408 PolarHBondContact O-ND2 3.08Å; L401-V410 HydrophobicContact CD1-CB 4.23Å; L401-V410 HydrophobicContact CD1-CG1 4.48Å; L401-V410 HydrophobicContact CD1-CG2 3.89Å |
| 402 | F | 92.9 | Very high | 89.1 | Confident | 3 Ų | 3 | 33.8 Ų | 33.8 | 1% | 0.013 | 16% | 0.159 | C | C | . | . | H | α-helix | trans | -56.8 | -43.6 | 174 | 179.9 | -90.9 | 0 | 0 | 0 | 111.8 | F398 V399 S400 L404 N405 Y406 F411 I434 P444 K445 V449 | F398-F402 WeakPolarHBondContact O-CB 3.21Å; F398-F402 PolarHBondContact O-N 3.35Å; V399-F402 PolarHBondContact O-N 3.31Å; S400-F402 VanDerWaalsContact C-N 3.33Å; S400-F402 PolarHBondContact O-N 2.87Å; F402-L404 VanDerWaalsContact C-N 3.34Å; F402-L404 PolarHBondContact O-N 2.93Å; F402-N405 CarbonylContact O-C 3.41Å; F402-N405 VanDerWaalsContact O-C 3.32Å; F402-Y406 AromaticContact CD2-CD2 3.61Å; F402-Y406 HydrophobicContact CD2-CD2 3.61Å; F402-Y406 HydrophobicContact CD2-CE2 4.14Å; F402-Y406 AromaticContact CE2-CD2 3.43Å; F402-Y406 HydrophobicContact CE2-CD2 3.43Å; F402-Y406 VanDerWaalsContact CE2-CD2 3.43Å; F402-Y406 AromaticContact CE2-CE2 3.82Å; F402-Y406 HydrophobicContact CE2-CE2 3.82Å; F402-Y406 HydrophobicContact CZ-CD2 4.5Å; F402-Y406 VanDerWaalsContact O-CA 3.29Å; F402-Y406 WeakPolarHBondContact O-CA 3.37Å; F402-Y406 PolarHBondContact O-N 3.13Å; F402-F411 HydrophobicContact CD2-CD2 4.25Å; F402-F411 AromaticContact CD2-CE2 3.95Å; F402-F411 HydrophobicContact CD2-CE2 3.95Å; F402-F411 AromaticContact CD2-CZ 3.95Å; F402-F411 HydrophobicContact CD2-CZ 3.95Å; F402-F411 HydrophobicContact CE2-CE2 4.49Å; F402-F411 HydrophobicContact CE2-CZ 4.31Å; F402-I434 HydrophobicContact CB-CD1 4.12Å; F402-I434 HydrophobicContact CD1-CD1 3.53Å; F402-I434 VanDerWaalsContact CD1-CD1 3.47Å; F402-I434 HydrophobicContact CD1-CG1 4.2Å; F402-I434 HydrophobicContact CD1-CG2 4.3Å; F402-I434 HydrophobicContact CD2-CD1 4.28Å; F402-I434 HydrophobicContact CE1-CD1 3.97Å; F402-I434 HydrophobicContact CE1-CG1 4.5Å; F402-I434 HydrophobicContact CE1-CG2 3.96Å; F402-I434 HydrophobicContact CG-CD1 3.71Å; F402-I434 HydrophobicContact CZ-CD1 4.44Å; F402-I434 HydrophobicContact CZ-CG2 4.43Å; F402-P444 HydrophobicContact CD1-CB 4.38Å; F402-P444 HydrophobicContact CD1-CG 3.93Å; F402-P444 HydrophobicContact CE1-CB 3.86Å; F402-P444 HydrophobicContact CE1-CG 3.8Å; F402-P444 HydrophobicContact CZ-CB 4.33Å; F402-P444 HydrophobicContact CZ-CG 4.35Å; F402-P444 WeakPolarHBondContact O-CG 3.35Å; F402-K445 WeakPolarHBondContact CZ-O 3.31Å; F402-V449 HydrophobicContact CD2-CG2 4.47Å; F402-V449 HydrophobicContact CE2-CG2 3.62Å; F402-V449 HydrophobicContact CZ-CG2 3.99Å |
| 403 | R | 92.3 | Very high | 89.3 | Confident | 16 Ų | 16 | 35 Ų | 35 | 6% | 0.06 | 17% | 0.166 | C | C | . | . | H | α-helix | trans | -69.5 | -34.1 | -179.7 | -75.7 | 173 | -178.8 | 169.3 | 6.3 | 114.2 | T348 V399 S400 L401 Q437 W443 P444 | T348-R403 HydrophobicContact CG2-CB 3.63Å; V399-R403 VanDerWaalsContact CG1-CZ 3.48Å; V399-R403 WeakPolarHBondContact O-CB 3.32Å; V399-R403 VanDerWaalsContact O-CG 3.29Å; V399-R403 WeakPolarHBondContact O-CG 3.31Å; V399-R403 PolarHBondContact O-N 3.46Å; S400-R403 PolarHBondContact O-N 2.87Å; L401-R403 VanDerWaalsContact C-N 3.34Å; L401-R403 PolarHBondContact O-N 3.39Å; R403-Q437 VanDerWaalsContact NH2-CD 3.32Å; R403-W443 HydrophobicContact CB-CG 4.45Å; R403-W443 HydrophobicContact CG-CB 4.36Å; R403-W443 HydrophobicContact CG-CD2 4.25Å; R403-W443 HydrophobicContact CG-CG 4.03Å; R403-W443 VanDerWaalsContact CZ-CE3 3.46Å; R403-W443 VanDerWaalsContact CZ-CH2 3.43Å; R403-W443 VanDerWaalsContact NH2-CZ3 3.27Å; R403-P444 WeakPolarHBondContact O-CD 3.34Å |
| 404 | L | 89.7 | Confident | 89.3 | Confident | 29.5 Ų | 29.5 | 34.1 Ų | 34.1 | 15% | 0.154 | 16% | 0.161 | C | C | . | . | H | α-helix | trans | -76.5 | -44.7 | 178.4 | -69.6 | 167.9 | 0 | 0 | 0 | 111.6 | A347 T348 F360 L363 S400 L401 F402 | A347-L404 HydrophobicContact CB-CD1 4.47Å; A347-L404 HydrophobicContact CB-CD2 3.96Å; T348-L404 HydrophobicContact CG2-CD2 4.37Å; T348-L404 HydrophobicContact CG2-CG 4.15Å; F360-L404 HydrophobicContact CD1-CD2 4.45Å; F360-L404 HydrophobicContact CE1-CD2 3.77Å; L363-L404 HydrophobicContact CD2-CD1 3.67Å; S400-L404 VanDerWaalsContact O-CG 3.3Å; S400-L404 WeakPolarHBondContact O-CG 3.36Å; S400-L404 PolarHBondContact O-N 3.46Å; L401-L404 PolarHBondContact O-N 3.27Å; F402-L404 VanDerWaalsContact C-N 3.34Å; F402-L404 PolarHBondContact O-N 2.93Å |
| 405 | N | 85 | Confident | 89.1 | Confident | 105 Ų | 105 | 34.6 Ų | 34.6 | 56% | 0.561 | 16% | 0.163 | S | C | * | . | trans | -159.9 | 113.9 | 176 | -177.8 | 1.4 | 0 | 0 | 0 | 109.1 | L401 F402 N407 N408 | L401-N405 CarbonylContact O-C 3.52Å; L401-N405 PolarHBondContact O-N 3.25Å; F402-N405 CarbonylContact O-C 3.41Å; F402-N405 VanDerWaalsContact O-C 3.32Å; N405-N407 VanDerWaalsContact C-N 3.31Å; N405-N407 PolarHBondContact O-N 3.17Å; N405-N407 PolarHBondContact OD1-N 3.35Å; N405-N408 WeakPolarHBondContact O-CB 3.22Å; N405-N408 PolarHBondContact O-ND2 2.91Å | ||
| 406 | Y | 78.4 | Confident | 88.8 | Confident | 68.5 Ų | 68.5 | 38 Ų | 38 | 27% | 0.269 | 18% | 0.182 | S | C | . | . | S | Bend | trans | -61.6 | 25 | -179.6 | 133 | -92.7 | 0 | 0 | 0 | 111.4 | F402 N408 F411 L448 V449 | F402-Y406 AromaticContact CD2-CD2 3.61Å; F402-Y406 HydrophobicContact CD2-CD2 3.61Å; F402-Y406 HydrophobicContact CD2-CE2 4.14Å; F402-Y406 AromaticContact CE2-CD2 3.43Å; F402-Y406 HydrophobicContact CE2-CD2 3.43Å; F402-Y406 VanDerWaalsContact CE2-CD2 3.43Å; F402-Y406 AromaticContact CE2-CE2 3.82Å; F402-Y406 HydrophobicContact CE2-CE2 3.82Å; F402-Y406 HydrophobicContact CZ-CD2 4.5Å; F402-Y406 VanDerWaalsContact O-CA 3.29Å; F402-Y406 WeakPolarHBondContact O-CA 3.37Å; F402-Y406 PolarHBondContact O-N 3.13Å; Y406-N408 VanDerWaalsContact C-N 3.28Å; Y406-N408 PolarHBondContact O-N 3.15Å; Y406-N408 VanDerWaalsContact O-N 3.11Å; Y406-F411 AromaticContact CD2-CE2 3.89Å; Y406-F411 HydrophobicContact CD2-CE2 3.89Å; Y406-F411 HydrophobicContact CD2-CZ 4.49Å; Y406-F411 AromaticContact CE2-CD2 3.97Å; Y406-F411 HydrophobicContact CE2-CD2 3.97Å; Y406-F411 AromaticContact CE2-CE2 3.42Å; Y406-F411 HydrophobicContact CE2-CE2 3.42Å; Y406-F411 VanDerWaalsContact CE2-CE2 3.42Å; Y406-F411 AromaticContact CE2-CZ 3.8Å; Y406-F411 HydrophobicContact CE2-CZ 3.8Å; Y406-L448 HydrophobicContact CD1-CD1 3.85Å; Y406-L448 HydrophobicContact CD2-CB 4.06Å; Y406-L448 HydrophobicContact CD2-CD1 4.38Å; Y406-L448 HydrophobicContact CE1-CD1 4.33Å; Y406-L448 HydrophobicContact CE2-CB 4.14Å; Y406-L448 HydrophobicContact CG-CB 4.33Å; Y406-L448 HydrophobicContact CG-CD1 3.98Å; Y406-L448 PolarHBondContact OH-O 2.95Å; Y406-V449 HydrophobicContact CE2-CG2 4.21Å |
| 407 | N | 75.5 | Confident | 88.2 | Confident | 59 Ų | 59 | 39.9 Ų | 39.9 | 32% | 0.316 | 20% | 0.195 | S | C | . | . | S | Bend | trans | -95.4 | 93.1 | -178.4 | -171.4 | 6.3 | 0 | 0 | 0 | 110.6 | N405 E409 | N405-N407 VanDerWaalsContact C-N 3.31Å; N405-N407 PolarHBondContact O-N 3.17Å; N405-N407 PolarHBondContact OD1-N 3.35Å; N407-E409 PolarHBondContact ND2-OE2 2.86Å; N407-E409 PolarHBondContact O-N 3Å; N407-E409 WeakPolarHBondContact OD1-CG 3.05Å; N407-E409 PolarHBondContact OD1-N 2.87Å |
| 408 | N | 78.9 | Confident | 87.6 | Confident | 46.5 Ų | 46.5 | 47.7 Ų | 47.7 | 25% | 0.249 | 23% | 0.232 | C | C | . | . | trans | -81.7 | -105.8 | 178.7 | -6.4 | 3.7 | 0 | 0 | 0 | 113 | L401 N405 Y406 V410 F411 R412 R452 | L401-N408 PolarHBondContact O-ND2 3.08Å; N405-N408 WeakPolarHBondContact O-CB 3.22Å; N405-N408 PolarHBondContact O-ND2 2.91Å; Y406-N408 VanDerWaalsContact C-N 3.28Å; Y406-N408 PolarHBondContact O-N 3.15Å; Y406-N408 VanDerWaalsContact O-N 3.11Å; N408-V410 VanDerWaalsContact C-N 3.34Å; N408-V410 PolarHBondContact O-N 2.61Å; N408-V410 WeakPolarHBondContact OD1-CA 3.48Å; N408-V410 VanDerWaalsContact OD1-CB 3.3Å; N408-V410 WeakPolarHBondContact OD1-CB 3.3Å; N408-V410 PolarHBondContact OD1-N 2.91Å; N408-F411 PolarHBondContact O-N 3.15Å; N408-F411 PolarHBondContact OD1-N 3.33Å; N408-R412 WeakPolarHBondContact O-CB 3.35Å; N408-R412 PolarHBondContact O-N 3.24Å; N408-R452 PolarHBondContact OD1-NH2 3.24Å | ||
| 409 | E | 85.4 | Confident | 87.1 | Confident | 115 Ų | 115 | 48.4 Ų | 48.4 | 54% | 0.537 | 24% | 0.237 | S | C | . | . | H | α-helix | trans | -63.8 | -41.4 | -177.4 | -121.9 | 178.3 | 163.4 | 0 | 0 | 113.4 | N407 F411 R412 V413 | N407-E409 PolarHBondContact ND2-OE2 2.86Å; N407-E409 PolarHBondContact O-N 3Å; N407-E409 WeakPolarHBondContact OD1-CG 3.05Å; N407-E409 PolarHBondContact OD1-N 2.87Å; E409-F411 VanDerWaalsContact C-N 3.35Å; E409-F411 PolarHBondContact O-N 3.16Å; E409-R412 WeakPolarHBondContact O-CB 3.49Å; E409-R412 PolarHBondContact O-N 3.13Å; E409-R412 VanDerWaalsContact O-N 3.15Å; E409-V413 HydrophobicContact CG-CG2 4.24Å; E409-V413 WeakPolarHBondContact O-CG2 3.43Å; E409-V413 PolarHBondContact O-N 3.36Å; E409-V413 VanDerWaalsContact O-N 3.11Å |
| 410 | V | 89 | Confident | 86.6 | Confident | 7 Ų | 7 | 51.5 Ų | 51.5 | 4% | 0.042 | 26% | 0.256 | C | S | . | . | H | α-helix | trans | -66.3 | -41 | -180 | 179.7 | 0 | 0 | 0 | 0 | 110.8 | K371 F375 F398 L401 N408 R412 V413 C414 | K371-V410 HydrophobicContact CB-CG2 3.97Å; K371-V410 HydrophobicContact CD-CG2 4.14Å; K371-V410 HydrophobicContact CG-CG2 3.77Å; F375-V410 HydrophobicContact CB-CG1 4.01Å; F375-V410 HydrophobicContact CB-CG2 4.2Å; F375-V410 HydrophobicContact CD1-CG1 3.5Å; F375-V410 HydrophobicContact CD2-CB 4.26Å; F375-V410 HydrophobicContact CD2-CG1 3.55Å; F375-V410 HydrophobicContact CD2-CG2 3.64Å; F375-V410 HydrophobicContact CE1-CG1 3.73Å; F375-V410 HydrophobicContact CE2-CG1 3.78Å; F375-V410 HydrophobicContact CE2-CG2 4.23Å; F375-V410 HydrophobicContact CG-CB 4.35Å; F375-V410 HydrophobicContact CG-CG1 3.4Å; F375-V410 HydrophobicContact CG-CG2 4.03Å; F375-V410 HydrophobicContact CZ-CG1 3.87Å; F398-V410 HydrophobicContact CD2-CG1 3.66Å; F398-V410 HydrophobicContact CE2-CG1 3.97Å; L401-V410 HydrophobicContact CD1-CB 4.23Å; L401-V410 HydrophobicContact CD1-CG1 4.48Å; L401-V410 HydrophobicContact CD1-CG2 3.89Å; N408-V410 VanDerWaalsContact C-N 3.34Å; N408-V410 PolarHBondContact O-N 2.61Å; N408-V410 WeakPolarHBondContact OD1-CA 3.48Å; N408-V410 VanDerWaalsContact OD1-CB 3.3Å; N408-V410 WeakPolarHBondContact OD1-CB 3.3Å; N408-V410 PolarHBondContact OD1-N 2.91Å; V410-R412 VanDerWaalsContact C-N 3.3Å; V410-R412 PolarHBondContact O-N 3.25Å; V410-V413 PolarHBondContact O-N 3.36Å; V410-C414 PolarHBondContact O-N 3.08Å; V410-C414 PolarHBondContact O-SG 2.95Å; V410-C414 VanDerWaalsContact O-SG 3.35Å |
| 411 | F | 89.5 | Confident | 86.1 | Confident | 5.5 Ų | 5.5 | 53.3 Ų | 53.3 | 2% | 0.024 | 27% | 0.265 | C | S | . | . | H | α-helix | trans | -57 | -45.4 | 172.7 | -130.5 | -87.7 | 0 | 0 | 0 | 111.1 | F398 F402 Y406 N408 E409 V413 C414 L415 L427 L431 V449 R452 | F398-F411 HydrophobicContact CE1-CD2 4.17Å; F398-F411 HydrophobicContact CZ-CB 4.29Å; F398-F411 AromaticContact CZ-CD2 3.63Å; F398-F411 HydrophobicContact CZ-CD2 3.63Å; F398-F411 HydrophobicContact CZ-CE2 4.42Å; F398-F411 HydrophobicContact CZ-CG 4.38Å; F402-F411 HydrophobicContact CD2-CD2 4.25Å; F402-F411 AromaticContact CD2-CE2 3.95Å; F402-F411 HydrophobicContact CD2-CE2 3.95Å; F402-F411 AromaticContact CD2-CZ 3.95Å; F402-F411 HydrophobicContact CD2-CZ 3.95Å; F402-F411 HydrophobicContact CE2-CE2 4.49Å; F402-F411 HydrophobicContact CE2-CZ 4.31Å; Y406-F411 AromaticContact CD2-CE2 3.89Å; Y406-F411 HydrophobicContact CD2-CE2 3.89Å; Y406-F411 HydrophobicContact CD2-CZ 4.49Å; Y406-F411 AromaticContact CE2-CD2 3.97Å; Y406-F411 HydrophobicContact CE2-CD2 3.97Å; Y406-F411 AromaticContact CE2-CE2 3.42Å; Y406-F411 HydrophobicContact CE2-CE2 3.42Å; Y406-F411 VanDerWaalsContact CE2-CE2 3.42Å; Y406-F411 AromaticContact CE2-CZ 3.8Å; Y406-F411 HydrophobicContact CE2-CZ 3.8Å; N408-F411 PolarHBondContact O-N 3.15Å; N408-F411 PolarHBondContact OD1-N 3.33Å; E409-F411 VanDerWaalsContact C-N 3.35Å; E409-F411 PolarHBondContact O-N 3.16Å; F411-V413 VanDerWaalsContact C-N 3.29Å; F411-V413 PolarHBondContact O-N 3.26Å; F411-C414 PolarHBondContact O-N 3.13Å; F411-L415 HydrophobicContact CB-CD1 4.18Å; F411-L415 HydrophobicContact CD1-CD1 4.12Å; F411-L415 HydrophobicContact CE1-CD2 3.87Å; F411-L415 HydrophobicContact CZ-CD2 4.37Å; F411-L415 VanDerWaalsContact O-CB 3.3Å; F411-L415 WeakPolarHBondContact O-CB 3.47Å; F411-L415 VanDerWaalsContact O-CG 3.3Å; F411-L415 WeakPolarHBondContact O-CG 3.43Å; F411-L415 PolarHBondContact O-N 3.04Å; F411-L415 VanDerWaalsContact O-N 3.1Å; F411-L427 HydrophobicContact CD1-CD1 3.89Å; F411-L427 HydrophobicContact CD2-CD1 4.22Å; F411-L427 HydrophobicContact CE1-CD1 3.79Å; F411-L427 HydrophobicContact CE2-CD1 3.94Å; F411-L431 HydrophobicContact CE1-CD2 4.26Å; F411-L431 HydrophobicContact CE2-CD2 4.48Å; F411-L431 HydrophobicContact CZ-CD2 4.35Å; F411-V449 HydrophobicContact CE1-CG1 3.86Å; F411-V449 HydrophobicContact CE1-CG2 4.11Å; F411-V449 HydrophobicContact CE2-CG1 4.4Å; F411-V449 HydrophobicContact CE2-CG2 4.39Å; F411-V449 HydrophobicContact CZ-CG1 4.25Å; F411-V449 HydrophobicContact CZ-CG2 3.82Å; F411-R452 HydrophobicContact CE1-CG 4.05Å; F411-R452 HydrophobicContact CZ-CG 4.3Å |
| 412 | R | 87.6 | Confident | 85.7 | Confident | 162 Ų | 162 | 53.8 Ų | 53.8 | 61% | 0.611 | 27% | 0.269 | S | S | * | . | H | α-helix | trans | -62.1 | -41.9 | 177.9 | -120 | -178.7 | -3 | 165.3 | -0.5 | 112.3 | N408 E409 V410 C414 L415 D416 | N408-R412 WeakPolarHBondContact O-CB 3.35Å; N408-R412 PolarHBondContact O-N 3.24Å; E409-R412 WeakPolarHBondContact O-CB 3.49Å; E409-R412 PolarHBondContact O-N 3.13Å; E409-R412 VanDerWaalsContact O-N 3.15Å; V410-R412 VanDerWaalsContact C-N 3.3Å; V410-R412 PolarHBondContact O-N 3.25Å; R412-C414 VanDerWaalsContact C-N 3.35Å; R412-C414 PolarHBondContact O-N 3.09Å; R412-L415 PolarHBondContact O-N 3.1Å; R412-D416 WeakPolarHBondContact O-CB 3.49Å; R412-D416 PolarHBondContact O-N 3.11Å; R412-D416 VanDerWaalsContact O-N 3.11Å |
| 413 | V | 87.9 | Confident | 85.5 | Confident | 41 Ų | 41 | 54.2 Ų | 54.2 | 25% | 0.248 | 27% | 0.271 | C | S | . | . | H | α-helix | trans | -65 | -42.7 | 177.8 | 172.5 | 0 | 0 | 0 | 0 | 111.6 | E409 V410 F411 L415 A419 | E409-V413 HydrophobicContact CG-CG2 4.24Å; E409-V413 WeakPolarHBondContact O-CG2 3.43Å; E409-V413 PolarHBondContact O-N 3.36Å; E409-V413 VanDerWaalsContact O-N 3.11Å; V410-V413 PolarHBondContact O-N 3.36Å; F411-V413 VanDerWaalsContact C-N 3.29Å; F411-V413 PolarHBondContact O-N 3.26Å; V413-L415 VanDerWaalsContact C-N 3.35Å; V413-A419 WeakPolarHBondContact O-CB 3.36Å |
| 414 | C | 89.7 | Confident | 85.5 | Confident | 0 Ų | 0 | 54.4 Ų | 54.4 | 0% | 0 | 27% | 0.272 | C | S | . | . | H | α-helix | trans | -77.2 | -23.6 | -178.6 | -66.6 | 0 | 0 | 0 | 0 | 113.9 | F398 V410 F411 R412 H423 L427 | F398-C414 HydrophobicContact CE2-CB 3.98Å; V410-C414 PolarHBondContact O-N 3.08Å; V410-C414 PolarHBondContact O-SG 2.95Å; V410-C414 VanDerWaalsContact O-SG 3.35Å; F411-C414 PolarHBondContact O-N 3.13Å; R412-C414 VanDerWaalsContact C-N 3.35Å; R412-C414 PolarHBondContact O-N 3.09Å; C414-H423 HydrophobicContact CB-CB 4.46Å; C414-H423 PolarHBondContact SG-O 3.24Å; C414-H423 VanDerWaalsContact SG-O 3.41Å; C414-L427 HydrophobicContact CB-CB 3.88Å; C414-L427 HydrophobicContact CB-CD1 4.46Å; C414-L427 HydrophobicContact CB-CD2 4.16Å; C414-L427 HydrophobicContact CB-CG 4.36Å |
| 415 | L | 89.1 | Confident | 85.5 | Confident | 18.5 Ų | 18.5 | 53.2 Ų | 53.2 | 10% | 0.097 | 27% | 0.266 | C | S | . | . | H | α-helix | trans | -88.3 | -12.3 | 176.7 | -117.5 | 120 | 0 | 0 | 0 | 113 | F411 R412 V413 T417 L427 R452 E455 L456 I459 | F411-L415 HydrophobicContact CB-CD1 4.18Å; F411-L415 HydrophobicContact CD1-CD1 4.12Å; F411-L415 HydrophobicContact CE1-CD2 3.87Å; F411-L415 HydrophobicContact CZ-CD2 4.37Å; F411-L415 VanDerWaalsContact O-CB 3.3Å; F411-L415 WeakPolarHBondContact O-CB 3.47Å; F411-L415 VanDerWaalsContact O-CG 3.3Å; F411-L415 WeakPolarHBondContact O-CG 3.43Å; F411-L415 PolarHBondContact O-N 3.04Å; F411-L415 VanDerWaalsContact O-N 3.1Å; R412-L415 PolarHBondContact O-N 3.1Å; V413-L415 VanDerWaalsContact C-N 3.35Å; L415-T417 PolarHBondContact O-N 2.97Å; L415-L427 HydrophobicContact CB-CD2 4.39Å; L415-L427 HydrophobicContact CD1-CD2 3.78Å; L415-L427 HydrophobicContact CD2-CD2 3.38Å; L415-L427 HydrophobicContact CG-CD2 3.95Å; L415-R452 HydrophobicContact CD1-CB 4.13Å; L415-R452 HydrophobicContact CD1-CG 4.11Å; L415-R452 HydrophobicContact CD2-CB 4.04Å; L415-R452 HydrophobicContact CD2-CG 4.11Å; L415-E455 HydrophobicContact CB-CB 4.46Å; L415-E455 HydrophobicContact CD1-CB 4.03Å; L415-E455 HydrophobicContact CD2-CB 3.89Å; L415-E455 HydrophobicContact CD2-CG 4.03Å; L415-E455 HydrophobicContact CG-CB 4.09Å; L415-E455 HydrophobicContact CG-CG 4.18Å; L415-L456 HydrophobicContact CD1-CD2 4.25Å; L415-L456 HydrophobicContact CD2-CD2 4.31Å; L415-I459 HydrophobicContact CD1-CD1 4.18Å; L415-I459 HydrophobicContact CD2-CD1 3.75Å |
| 416 | D | 86.7 | Confident | 85.8 | Confident | 74.5 Ų | 74.5 | 48.2 Ų | 48.2 | 40% | 0.398 | 24% | 0.239 | S | C | . | . | S | Bend | trans | -57.8 | 141.5 | -179.2 | -169.6 | -87.9 | 0 | 0 | 0 | 111.9 | R412 H418 A419 | R412-D416 WeakPolarHBondContact O-CB 3.49Å; R412-D416 PolarHBondContact O-N 3.11Å; R412-D416 VanDerWaalsContact O-N 3.11Å; D416-H418 PolarHBondContact O-N 2.98Å; D416-H418 VanDerWaalsContact O-N 3.11Å; D416-H418 WeakPolarHBondContact OD1-CA 3.41Å; D416-H418 WeakPolarHBondContact OD1-CB 3.07Å; D416-H418 IonicContact OD1-CD2 2.72Å; D416-H418 IonicContact OD1-CG 2.7Å; D416-H418 PolarHBondContact OD1-N 3.13Å; D416-A419 HydrophobicContact CB-CB 4.23Å; D416-A419 WeakPolarHBondContact O-CB 3.46Å; D416-A419 PolarHBondContact O-N 3.32Å |
| 417 | T | 79.8 | Confident | 86.5 | Confident | 71.5 Ų | 71.5 | 45 Ų | 45 | 44% | 0.439 | 23% | 0.226 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -60.7 | -23.6 | 179.7 | 48.9 | 0 | 0 | 0 | 0 | 112.7 | L415 R424 | L415-T417 PolarHBondContact O-N 2.97Å; T417-R424 PolarHBondContact O-NH2 3.12Å |
| 418 | H | 82.2 | Confident | 87.4 | Confident | 165.5 Ų | 165.5 | 42.1 Ų | 42.1 | 77% | 0.766 | 21% | 0.211 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -100 | 8.8 | 176 | -55.6 | -60.2 | 0 | 0 | 0 | 113.7 | D416 T420 | D416-H418 PolarHBondContact O-N 2.98Å; D416-H418 VanDerWaalsContact O-N 3.11Å; D416-H418 WeakPolarHBondContact OD1-CA 3.41Å; D416-H418 WeakPolarHBondContact OD1-CB 3.07Å; D416-H418 IonicContact OD1-CD2 2.72Å; D416-H418 IonicContact OD1-CG 2.7Å; D416-H418 PolarHBondContact OD1-N 3.13Å; H418-T420 PolarHBondContact O-N 3.22Å |
| 419 | A | 86 | Confident | 88.1 | Confident | 14 Ų | 14 | 41 Ų | 41 | 12% | 0.116 | 20% | 0.204 | C | C | . | . | trans | -59.8 | 136.2 | 175.8 | 0 | 0 | 0 | 0 | 0 | 111.4 | V413 D416 H423 R424 | V413-A419 WeakPolarHBondContact O-CB 3.36Å; D416-A419 HydrophobicContact CB-CB 4.23Å; D416-A419 WeakPolarHBondContact O-CB 3.46Å; D416-A419 PolarHBondContact O-N 3.32Å; A419-H423 HydrophobicContact CB-CB 4.42Å; A419-R424 HydrophobicContact CB-CG 4.11Å; A419-R424 PolarHBondContact O-NE 3.11Å | ||
| 420 | T | 85.5 | Confident | 88.5 | Confident | 68.5 Ų | 68.5 | 35.5 Ų | 35.5 | 42% | 0.42 | 18% | 0.179 | S | C | . | . | trans | -69.4 | 155.1 | 177.9 | 70.1 | 0 | 0 | 0 | 0 | 111.3 | H418 P422 H423 R424 | H418-T420 PolarHBondContact O-N 3.22Å; T420-P422 VanDerWaalsContact C-CD 3.49Å; T420-P422 VanDerWaalsContact C-N 3.32Å; T420-H423 WeakPolarHBondContact O-CB 3.29Å; T420-H423 PolarHBondContact O-N 3.17Å; T420-H423 PolarHBondContact OG1-ND1 3.18Å; T420-R424 PolarHBondContact O-N 3.32Å; T420-R424 VanDerWaalsContact O-N 3.08Å | ||
| 421 | I | 84.2 | Confident | 88.8 | Confident | 40 Ų | 40 | 35.1 Ų | 35.1 | 21% | 0.205 | 18% | 0.177 | C | C | . | . | H | α-helix | trans | -51.8 | -43 | -178.4 | -61.5 | 169.6 | 0 | 0 | 0 | 112.7 | H423 R424 L425 S537 L540 | I421-H423 VanDerWaalsContact C-N 3.33Å; I421-H423 PolarHBondContact O-N 3.08Å; I421-R424 PolarHBondContact O-N 3.3Å; I421-L425 HydrophobicContact CG2-CD1 4.03Å; I421-L425 HydrophobicContact CG2-CG 4.34Å; I421-L425 WeakPolarHBondContact O-CB 3.37Å; I421-L425 PolarHBondContact O-N 3.04Å; I421-S537 WeakPolarHBondContact CD1-OG 3.47Å; I421-L540 HydrophobicContact CG2-CB 4.42Å; I421-L540 HydrophobicContact CG2-CD2 4.36Å |
| 422 | P | 84.8 | Confident | 89 | Confident | 19.5 Ų | 19.5 | 37 Ų | 37 | 13% | 0.127 | 18% | 0.184 | C | C | . | . | H | α-helix | trans | -57.3 | -40.2 | 174.3 | -28.4 | 36.4 | 0 | 0 | 0 | 114.3 | L385 P386 T420 L425 V426 | L385-P422 HydrophobicContact CD1-CG 3.75Å; L385-P422 HydrophobicContact CG-CG 4.33Å; P386-P422 HydrophobicContact CG-CB 4.13Å; T420-P422 VanDerWaalsContact C-CD 3.49Å; T420-P422 VanDerWaalsContact C-N 3.32Å; P422-L425 WeakPolarHBondContact O-CB 3.34Å; P422-L425 PolarHBondContact O-N 2.76Å; P422-V426 VanDerWaalsContact O-CG2 3.29Å; P422-V426 WeakPolarHBondContact O-CG2 3.4Å; P422-V426 PolarHBondContact O-N 2.82Å |
| 423 | H | 88.8 | Confident | 89.2 | Confident | 11 Ų | 11 | 31.4 Ų | 31.4 | 5% | 0.051 | 16% | 0.163 | C | C | . | . | H | α-helix | trans | -68.1 | -39.6 | 178.4 | -68.4 | 97.1 | 0 | 0 | 0 | 111.7 | C414 A419 T420 I421 V426 L427 | C414-H423 HydrophobicContact CB-CB 4.46Å; C414-H423 PolarHBondContact SG-O 3.24Å; C414-H423 VanDerWaalsContact SG-O 3.41Å; A419-H423 HydrophobicContact CB-CB 4.42Å; T420-H423 WeakPolarHBondContact O-CB 3.29Å; T420-H423 PolarHBondContact O-N 3.17Å; T420-H423 PolarHBondContact OG1-ND1 3.18Å; I421-H423 VanDerWaalsContact C-N 3.33Å; I421-H423 PolarHBondContact O-N 3.08Å; H423-V426 PolarHBondContact O-N 3.08Å; H423-L427 PolarHBondContact O-N 2.95Å |
| 424 | R | 91.2 | Very high | 89.5 | Confident | 20.5 Ų | 20.5 | 30.5 Ų | 30.5 | 8% | 0.077 | 16% | 0.156 | C | C | . | . | H | α-helix | trans | -65.2 | -40.7 | 173.9 | -64.8 | -177.4 | -179.4 | -161.2 | -2.4 | 111.3 | T417 A419 T420 I421 V426 L427 V428 E462 L540 | T417-R424 PolarHBondContact O-NH2 3.12Å; A419-R424 HydrophobicContact CB-CG 4.11Å; A419-R424 PolarHBondContact O-NE 3.11Å; T420-R424 PolarHBondContact O-N 3.32Å; T420-R424 VanDerWaalsContact O-N 3.08Å; I421-R424 PolarHBondContact O-N 3.3Å; R424-V426 PolarHBondContact O-N 2.93Å; R424-L427 WeakPolarHBondContact O-CB 3.44Å; R424-L427 PolarHBondContact O-N 3.09Å; R424-V428 WeakPolarHBondContact O-CG2 3.35Å; R424-V428 PolarHBondContact O-N 2.95Å; R424-E462 IonicContact CZ-OE2 3.25Å; R424-E462 IonicContact NH1-OE2 3.39Å; R424-E462 PolarHBondContact NH1-OE2 3.34Å; R424-E462 IonicContact NH2-OE2 3.5Å; R424-E462 PolarHBondContact NH2-OE2 3.28Å; R424-L540 HydrophobicContact CB-CD1 3.97Å; R424-L540 HydrophobicContact CB-CD2 3.79Å |
| 425 | L | 90.1 | Very high | 89.6 | Confident | 4.5 Ų | 4.5 | 31.9 Ų | 31.9 | 2% | 0.024 | 17% | 0.168 | C | C | . | . | H | α-helix | trans | -59.6 | -46.5 | 173.4 | -85.6 | 168.6 | 0 | 0 | 0 | 111.5 | I421 P422 L427 V428 M429 Q539 L540 | I421-L425 HydrophobicContact CG2-CD1 4.03Å; I421-L425 HydrophobicContact CG2-CG 4.34Å; I421-L425 WeakPolarHBondContact O-CB 3.37Å; I421-L425 PolarHBondContact O-N 3.04Å; P422-L425 WeakPolarHBondContact O-CB 3.34Å; P422-L425 PolarHBondContact O-N 2.76Å; L425-L427 VanDerWaalsContact C-N 3.33Å; L425-L427 PolarHBondContact O-N 3.03Å; L425-V428 PolarHBondContact O-N 3.24Å; L425-M429 HydrophobicContact CD2-SD 4.46Å; L425-M429 VanDerWaalsContact O-CB 3.28Å; L425-M429 WeakPolarHBondContact O-CB 3.45Å; L425-M429 VanDerWaalsContact O-CG 3.29Å; L425-M429 WeakPolarHBondContact O-CG 3.21Å; L425-M429 PolarHBondContact O-N 2.93Å; L425-Q539 HydrophobicContact CD2-CB 4.41Å; L425-Q539 HydrophobicContact CD2-CG 4.03Å; L425-L540 HydrophobicContact CD2-CB 4.01Å; L425-L540 HydrophobicContact CD2-CD1 4.2Å; L425-L540 HydrophobicContact CG-CB 4.21Å; L425-L540 HydrophobicContact CG-CD1 4.24Å |
| 426 | V | 91.2 | Very high | 89.7 | Confident | 0 Ų | 0 | 34.4 Ų | 34.4 | 0% | 0 | 18% | 0.184 | C | C | . | . | H | α-helix | trans | -59.2 | -46.3 | 176.9 | 171.4 | 0 | 0 | 0 | 0 | 111.1 | F375 L391 M394 I395 F398 P422 H423 R424 A430 | F375-V426 HydrophobicContact CE1-CG1 4.01Å; L391-V426 HydrophobicContact CD1-CG2 3.53Å; L391-V426 HydrophobicContact CG-CG2 4.44Å; M394-V426 HydrophobicContact CB-CG1 4.3Å; M394-V426 HydrophobicContact CB-CG2 3.67Å; M394-V426 HydrophobicContact CE-CG2 4.06Å; M394-V426 HydrophobicContact SD-CG2 4.46Å; I395-V426 HydrophobicContact CG1-CB 4.42Å; I395-V426 HydrophobicContact CG1-CG1 4.21Å; I395-V426 HydrophobicContact CG1-CG2 4.21Å; F398-V426 HydrophobicContact CB-CG1 3.78Å; F398-V426 HydrophobicContact CD2-CG1 4.07Å; F398-V426 HydrophobicContact CG-CG1 4.1Å; P422-V426 VanDerWaalsContact O-CG2 3.29Å; P422-V426 WeakPolarHBondContact O-CG2 3.4Å; P422-V426 PolarHBondContact O-N 2.82Å; H423-V426 PolarHBondContact O-N 3.08Å; R424-V426 PolarHBondContact O-N 2.93Å; V426-A430 WeakPolarHBondContact O-CB 3.48Å; V426-A430 PolarHBondContact O-N 3.02Å |
| 427 | L | 93.4 | Very high | 89.7 | Confident | 0 Ų | 0 | 33.4 Ų | 33.4 | 0% | 0 | 18% | 0.177 | C | C | . | . | H | α-helix | trans | -55.6 | -55.7 | 176.3 | 171.9 | 67.8 | 0 | 0 | 0 | 111.4 | F398 F411 C414 L415 H423 R424 L425 M429 A430 L431 L456 I459 | F398-L427 HydrophobicContact CE1-CD1 4.23Å; F398-L427 HydrophobicContact CE2-CD1 4.26Å; F398-L427 HydrophobicContact CZ-CD1 3.53Å; F411-L427 HydrophobicContact CD1-CD1 3.89Å; F411-L427 HydrophobicContact CD2-CD1 4.22Å; F411-L427 HydrophobicContact CE1-CD1 3.79Å; F411-L427 HydrophobicContact CE2-CD1 3.94Å; C414-L427 HydrophobicContact CB-CB 3.88Å; C414-L427 HydrophobicContact CB-CD1 4.46Å; C414-L427 HydrophobicContact CB-CD2 4.16Å; C414-L427 HydrophobicContact CB-CG 4.36Å; L415-L427 HydrophobicContact CB-CD2 4.39Å; L415-L427 HydrophobicContact CD1-CD2 3.78Å; L415-L427 HydrophobicContact CD2-CD2 3.38Å; L415-L427 HydrophobicContact CG-CD2 3.95Å; H423-L427 PolarHBondContact O-N 2.95Å; R424-L427 WeakPolarHBondContact O-CB 3.44Å; R424-L427 PolarHBondContact O-N 3.09Å; L425-L427 VanDerWaalsContact C-N 3.33Å; L425-L427 PolarHBondContact O-N 3.03Å; L427-M429 PolarHBondContact O-N 3.05Å; L427-A430 PolarHBondContact O-N 3.16Å; L427-L431 HydrophobicContact CD1-CD1 3.95Å; L427-L431 HydrophobicContact CD1-CG 4.19Å; L427-L431 HydrophobicContact CG-CD1 4.18Å; L427-L431 WeakPolarHBondContact O-CB 3.42Å; L427-L431 VanDerWaalsContact O-CG 3.29Å; L427-L431 WeakPolarHBondContact O-CG 3.31Å; L427-L431 PolarHBondContact O-N 3.2Å; L427-L456 HydrophobicContact CD2-CD2 4.2Å; L427-I459 HydrophobicContact CD2-CD1 4.27Å |
| 428 | V | 94 | Very high | 90.1 | Very high | 0 Ų | 0 | 35.9 Ų | 35.9 | 0% | 0 | 19% | 0.192 | C | C | . | . | H | α-helix | trans | -66.7 | -44 | -173.4 | 178.5 | 0 | 0 | 0 | 0 | 111.4 | R424 L425 A430 L431 Y432 L540 W543 L544 L547 | R424-V428 WeakPolarHBondContact O-CG2 3.35Å; R424-V428 PolarHBondContact O-N 2.95Å; L425-V428 PolarHBondContact O-N 3.24Å; V428-A430 VanDerWaalsContact C-N 3.33Å; V428-A430 PolarHBondContact O-N 3.07Å; V428-L431 PolarHBondContact O-N 2.99Å; V428-Y432 WeakPolarHBondContact O-CB 3.42Å; V428-Y432 PolarHBondContact O-N 2.95Å; V428-L540 HydrophobicContact CB-CD1 4.4Å; V428-L540 HydrophobicContact CG2-CD1 3.89Å; V428-W543 VanDerWaalsContact CG1-C 3.43Å; V428-W543 HydrophobicContact CG1-CB 3.77Å; V428-W543 WeakPolarHBondContact CG1-O 3.32Å; V428-L544 HydrophobicContact CB-CD2 4.45Å; V428-L544 HydrophobicContact CG1-CD2 4.04Å; V428-L544 HydrophobicContact CG1-CG 4.06Å; V428-L544 HydrophobicContact CG2-CD2 3.47Å; V428-L544 VanDerWaalsContact CG2-CD2 3.47Å; V428-L544 HydrophobicContact CG2-CG 3.91Å; V428-L547 HydrophobicContact CG1-CB 4.27Å; V428-L547 HydrophobicContact CG1-CD2 4.08Å |
| 429 | M | 93.9 | Very high | 90.4 | Very high | 21.5 Ų | 21.5 | 33 Ų | 33 | 11% | 0.106 | 17% | 0.174 | C | C | . | . | H | α-helix | trans | -68.3 | -33.4 | 177.9 | -67 | 179.6 | 71.4 | 0 | 0 | 112.1 | L391 I395 L425 L427 R433 I521 W543 | L391-M429 HydrophobicContact CD2-SD 3.95Å; I395-M429 HydrophobicContact CD1-CB 3.72Å; I395-M429 HydrophobicContact CD1-CE 3.72Å; I395-M429 HydrophobicContact CD1-CG 4.4Å; I395-M429 HydrophobicContact CD1-SD 3.84Å; I395-M429 HydrophobicContact CG1-CB 4.19Å; L425-M429 HydrophobicContact CD2-SD 4.46Å; L425-M429 VanDerWaalsContact O-CB 3.28Å; L425-M429 WeakPolarHBondContact O-CB 3.45Å; L425-M429 VanDerWaalsContact O-CG 3.29Å; L425-M429 WeakPolarHBondContact O-CG 3.21Å; L425-M429 PolarHBondContact O-N 2.93Å; L427-M429 PolarHBondContact O-N 3.05Å; M429-R433 WeakPolarHBondContact O-CB 3.36Å; M429-R433 PolarHBondContact O-N 3.13Å; M429-I521 HydrophobicContact CE-CG2 3.66Å; M429-I521 WeakPolarHBondContact O-CD1 3.27Å; M429-W543 HydrophobicContact CE-CD2 4.46Å; M429-W543 HydrophobicContact CE-CH2 4.44Å; M429-W543 HydrophobicContact CE-CZ2 3.84Å; M429-W543 HydrophobicContact CG-CB 4.31Å; M429-W543 HydrophobicContact CG-CD2 3.85Å; M429-W543 HydrophobicContact CG-CE3 4.36Å; M429-W543 HydrophobicContact CG-CG 3.76Å; M429-W543 HydrophobicContact SD-CD2 4.42Å; M429-W543 HydrophobicContact SD-CG 4.41Å |
| 430 | A | 93.9 | Very high | 90.6 | Very high | 0 Ų | 0 | 33.2 Ų | 33.2 | 0% | 0 | 17% | 0.174 | C | C | . | . | H | α-helix | trans | -68.2 | -44.3 | 173.6 | 0 | 0 | 0 | 0 | 0 | 111.9 | I395 F398 V399 V426 L427 V428 Y432 R433 I434 | I395-A430 HydrophobicContact CG2-CB 4.22Å; F398-A430 HydrophobicContact CB-CB 4.21Å; F398-A430 HydrophobicContact CD1-CB 3.34Å; F398-A430 HydrophobicContact CE1-CB 3.94Å; F398-A430 HydrophobicContact CG-CB 3.97Å; V399-A430 HydrophobicContact CG2-CB 3.62Å; V426-A430 WeakPolarHBondContact O-CB 3.48Å; V426-A430 PolarHBondContact O-N 3.02Å; L427-A430 PolarHBondContact O-N 3.16Å; V428-A430 VanDerWaalsContact C-N 3.33Å; V428-A430 PolarHBondContact O-N 3.07Å; A430-Y432 VanDerWaalsContact C-N 3.32Å; A430-Y432 PolarHBondContact O-N 2.91Å; A430-R433 WeakPolarHBondContact O-CB 3.22Å; A430-R433 PolarHBondContact O-N 3.27Å; A430-R433 VanDerWaalsContact O-N 3.14Å; A430-I434 WeakPolarHBondContact O-CD1 3.23Å; A430-I434 VanDerWaalsContact O-CG1 3.28Å; A430-I434 WeakPolarHBondContact O-CG1 3.4Å; A430-I434 PolarHBondContact O-N 3.44Å |
| 431 | L | 94.9 | Very high | 90.8 | Very high | 0 Ų | 0 | 34.9 Ų | 34.9 | 0% | 0 | 19% | 0.186 | C | C | . | . | H | α-helix | trans | -60.8 | -42.5 | 174.3 | -69.8 | 179 | 0 | 0 | 0 | 111.4 | F411 L427 V428 R433 I434 A435 I446 V449 L456 L547 | F411-L431 HydrophobicContact CE1-CD2 4.26Å; F411-L431 HydrophobicContact CE2-CD2 4.48Å; F411-L431 HydrophobicContact CZ-CD2 4.35Å; L427-L431 HydrophobicContact CD1-CD1 3.95Å; L427-L431 HydrophobicContact CD1-CG 4.19Å; L427-L431 HydrophobicContact CG-CD1 4.18Å; L427-L431 WeakPolarHBondContact O-CB 3.42Å; L427-L431 VanDerWaalsContact O-CG 3.29Å; L427-L431 WeakPolarHBondContact O-CG 3.31Å; L427-L431 PolarHBondContact O-N 3.2Å; V428-L431 PolarHBondContact O-N 2.99Å; L431-R433 VanDerWaalsContact C-N 3.33Å; L431-R433 PolarHBondContact O-N 3Å; L431-I434 HydrophobicContact CD2-CD1 4.41Å; L431-I434 PolarHBondContact O-N 3.09Å; L431-I434 VanDerWaalsContact O-N 3.17Å; L431-A435 WeakPolarHBondContact O-CB 3.4Å; L431-A435 PolarHBondContact O-N 3.35Å; L431-I446 WeakPolarHBondContact O-CD1 3.36Å; L431-V449 HydrophobicContact CD1-CG1 4.2Å; L431-V449 HydrophobicContact CD2-CB 4.41Å; L431-V449 HydrophobicContact CD2-CG1 3.99Å; L431-V449 HydrophobicContact CD2-CG2 3.84Å; L431-L456 HydrophobicContact CD1-CD1 4.15Å; L431-L456 HydrophobicContact CD1-CD2 4.15Å; L431-L547 HydrophobicContact CB-CD1 4.08Å; L431-L547 HydrophobicContact CB-CD2 3.79Å; L431-L547 HydrophobicContact CD1-CD2 4.11Å |
| 432 | Y | 94.6 | Very high | 91.1 | Very high | 45.5 Ų | 45.5 | 35.4 Ų | 35.4 | 18% | 0.178 | 19% | 0.185 | C | C | . | . | H | α-helix | trans | -58.6 | -44.8 | 173.2 | 179.9 | -87.5 | 0 | 0 | 0 | 111.4 | V428 A430 I434 A435 V436 I521 W543 R546 I550 | V428-Y432 WeakPolarHBondContact O-CB 3.42Å; V428-Y432 PolarHBondContact O-N 2.95Å; A430-Y432 VanDerWaalsContact C-N 3.32Å; A430-Y432 PolarHBondContact O-N 2.91Å; Y432-I434 VanDerWaalsContact C-N 3.34Å; Y432-I434 PolarHBondContact O-N 3.43Å; Y432-A435 PolarHBondContact O-N 3.21Å; Y432-V436 HydrophobicContact CD1-CG2 4.28Å; Y432-V436 HydrophobicContact CD2-CG2 4.45Å; Y432-V436 HydrophobicContact CE1-CB 4.48Å; Y432-V436 HydrophobicContact CE1-CG2 3.87Å; Y432-V436 HydrophobicContact CE2-CG2 4.07Å; Y432-V436 WeakPolarHBondContact O-CG2 3.28Å; Y432-V436 PolarHBondContact O-N 2.89Å; Y432-I521 HydrophobicContact CD1-CD1 3.96Å; Y432-I521 HydrophobicContact CD1-CG1 4.36Å; Y432-I521 HydrophobicContact CD1-CG2 4.46Å; Y432-W543 HydrophobicContact CD1-CE3 4.41Å; Y432-W543 AromaticContact CD1-CZ3 3.82Å; Y432-W543 HydrophobicContact CD1-CZ3 3.82Å; Y432-W543 HydrophobicContact CD2-CE3 4.4Å; Y432-W543 HydrophobicContact CD2-CZ3 4.33Å; Y432-W543 AromaticContact CE1-CZ3 3.85Å; Y432-W543 HydrophobicContact CE1-CZ3 3.85Å; Y432-W543 HydrophobicContact CE2-CZ3 4.33Å; Y432-W543 HydrophobicContact CG-CE3 4.24Å; Y432-W543 HydrophobicContact CG-CZ3 4.08Å; Y432-R546 HydrophobicContact CD2-CB 4.29Å; Y432-R546 HydrophobicContact CE2-CB 4.08Å; Y432-I550 HydrophobicContact CD2-CG1 4.17Å; Y432-I550 HydrophobicContact CE2-CG1 3.59Å |
| 433 | R | 92.7 | Very high | 91.4 | Very high | 44 Ų | 44 | 35 Ų | 35 | 17% | 0.166 | 18% | 0.181 | C | C | . | . | H | α-helix | trans | -61.8 | -41.3 | 176.1 | -166.3 | 171.1 | -128.7 | 171.7 | -0.7 | 112 | E396 V399 M429 A430 L431 A435 V436 Q437 G519 I521 | E396-R433 IonicContact OE1-NH1 3.49Å; E396-R433 IonicContact OE1-NH2 3.54Å; V399-R433 HydrophobicContact CG2-CB 4.14Å; M429-R433 WeakPolarHBondContact O-CB 3.36Å; M429-R433 PolarHBondContact O-N 3.13Å; A430-R433 WeakPolarHBondContact O-CB 3.22Å; A430-R433 PolarHBondContact O-N 3.27Å; A430-R433 VanDerWaalsContact O-N 3.14Å; L431-R433 VanDerWaalsContact C-N 3.33Å; L431-R433 PolarHBondContact O-N 3Å; R433-A435 VanDerWaalsContact C-N 3.27Å; R433-A435 PolarHBondContact O-N 2.82Å; R433-V436 PolarHBondContact O-N 2.95Å; R433-Q437 WeakPolarHBondContact O-CB 3.39Å; R433-Q437 PolarHBondContact O-N 3.09Å; R433-G519 PolarHBondContact NH2-O 3.06Å; R433-I521 HydrophobicContact CB-CD1 3.31Å; R433-I521 HydrophobicContact CG-CD1 3.56Å; R433-I521 HydrophobicContact CG-CG1 4.47Å |
| 434 | I | 93.4 | Very high | 91.5 | Very high | 21 Ų | 21 | 35.8 Ų | 35.8 | 11% | 0.108 | 19% | 0.187 | C | C | . | . | H | α-helix | trans | -63.9 | -38.5 | 177.7 | -69 | 159.2 | 0 | 0 | 0 | 110.8 | V399 F402 A430 L431 Y432 I446 | V399-I434 HydrophobicContact CG1-CG1 4.12Å; V399-I434 HydrophobicContact CG2-CD1 4.36Å; V399-I434 HydrophobicContact CG2-CG1 4.22Å; F402-I434 HydrophobicContact CB-CD1 4.12Å; F402-I434 HydrophobicContact CD1-CD1 3.53Å; F402-I434 VanDerWaalsContact CD1-CD1 3.47Å; F402-I434 HydrophobicContact CD1-CG1 4.2Å; F402-I434 HydrophobicContact CD1-CG2 4.3Å; F402-I434 HydrophobicContact CD2-CD1 4.28Å; F402-I434 HydrophobicContact CE1-CD1 3.97Å; F402-I434 HydrophobicContact CE1-CG1 4.5Å; F402-I434 HydrophobicContact CE1-CG2 3.96Å; F402-I434 HydrophobicContact CG-CD1 3.71Å; F402-I434 HydrophobicContact CZ-CD1 4.44Å; F402-I434 HydrophobicContact CZ-CG2 4.43Å; A430-I434 WeakPolarHBondContact O-CD1 3.23Å; A430-I434 VanDerWaalsContact O-CG1 3.28Å; A430-I434 WeakPolarHBondContact O-CG1 3.4Å; A430-I434 PolarHBondContact O-N 3.44Å; L431-I434 HydrophobicContact CD2-CD1 4.41Å; L431-I434 PolarHBondContact O-N 3.09Å; L431-I434 VanDerWaalsContact O-N 3.17Å; Y432-I434 VanDerWaalsContact C-N 3.34Å; Y432-I434 PolarHBondContact O-N 3.43Å; I434-I446 HydrophobicContact CG2-CB 4.12Å; I434-I446 HydrophobicContact CG2-CD1 4.22Å; I434-I446 HydrophobicContact CG2-CG1 4.26Å |
| 435 | A | 91.7 | Very high | 91.5 | Very high | 30.5 Ų | 30.5 | 40.4 Ų | 40.4 | 25% | 0.252 | 21% | 0.208 | S | C | . | . | H | α-helix | trans | -71.2 | -42.2 | 179.9 | 0 | 0 | 0 | 0 | 0 | 113.1 | L431 Y432 R433 I446 I550 E551 | L431-A435 WeakPolarHBondContact O-CB 3.4Å; L431-A435 PolarHBondContact O-N 3.35Å; Y432-A435 PolarHBondContact O-N 3.21Å; R433-A435 VanDerWaalsContact C-N 3.27Å; R433-A435 PolarHBondContact O-N 2.82Å; A435-I446 HydrophobicContact CB-CD1 3.7Å; A435-I550 HydrophobicContact CB-CG2 3.63Å; A435-E551 HydrophobicContact CB-CB 4.39Å |
| 436 | V | 90.3 | Very high | 91.5 | Very high | 70.5 Ų | 70.5 | 41 Ų | 41 | 43% | 0.427 | 21% | 0.211 | S | C | . | . | H | α-helix | trans | -87.9 | -32.7 | -173.2 | 178.5 | 0 | 0 | 0 | 0 | 113.1 | Y432 R433 I550 | Y432-V436 HydrophobicContact CD1-CG2 4.28Å; Y432-V436 HydrophobicContact CD2-CG2 4.45Å; Y432-V436 HydrophobicContact CE1-CB 4.48Å; Y432-V436 HydrophobicContact CE1-CG2 3.87Å; Y432-V436 HydrophobicContact CE2-CG2 4.07Å; Y432-V436 WeakPolarHBondContact O-CG2 3.28Å; Y432-V436 PolarHBondContact O-N 2.89Å; R433-V436 PolarHBondContact O-N 2.95Å; V436-I550 HydrophobicContact CG2-CB 4.48Å; V436-I550 HydrophobicContact CG2-CD1 4.29Å; V436-I550 HydrophobicContact CG2-CG1 4.03Å; V436-I550 HydrophobicContact CG2-CG2 3.74Å |
| 437 | Q | 88.4 | Confident | 91.4 | Very high | 53 Ų | 53 | 44.3 Ų | 44.3 | 25% | 0.248 | 23% | 0.228 | C | C | . | . | S | Bend | trans | -71.6 | 136.2 | -174.1 | -172.8 | 175 | 0.6 | 0 | 0 | 111.7 | R403 R433 R439 | R403-Q437 VanDerWaalsContact NH2-CD 3.32Å; R433-Q437 WeakPolarHBondContact O-CB 3.39Å; R433-Q437 PolarHBondContact O-N 3.09Å; Q437-R439 PolarHBondContact O-N 3.23Å; Q437-R439 VanDerWaalsContact O-N 3.16Å |
| 438 | T | 86.7 | Confident | 91.2 | Very high | 125 Ų | 125 | 47.5 Ų | 47.5 | 77% | 0.767 | 25% | 0.245 | S | C | * | . | P | Polyproline II helix | trans | -56.5 | 123.9 | 172.2 | -5.4 | 0 | 0 | 0 | 0 | 111 | W443 | T438-W443 WeakPolarHBondContact O-CZ3 3.36Š|
| 439 | R | 88.7 | Confident | 91 | Very high | 103 Ų | 103 | 47.6 Ų | 47.6 | 39% | 0.389 | 25% | 0.246 | S | C | . | . | P | Polyproline II helix | trans | -89.9 | 134.5 | -169.7 | -168.9 | -164.1 | 96.9 | 100.6 | 0.5 | 112 | Q437 P441 W443 P444 | Q437-R439 PolarHBondContact O-N 3.23Å; Q437-R439 VanDerWaalsContact O-N 3.16Å; R439-P441 PolarHBondContact NH1-O 3.15Å; R439-P441 PolarHBondContact NH2-O 3.31Å; R439-W443 HydrophobicContact CB-CE3 4.49Å; R439-W443 WeakPolarHBondContact CD-O 3.44Å; R439-W443 HydrophobicContact CG-CB 3.74Å; R439-W443 HydrophobicContact CG-CE3 4.2Å; R439-W443 VanDerWaalsContact CZ-C 3.46Å; R439-W443 PolarHBondContact NH1-O 3.17Å; R439-W443 PolarHBondContact NH2-O 3.11Å; R439-P444 PolarHBondContact NH1-O 3.49Å |
| 440 | L | 90.4 | Very high | 90.7 | Very high | 19 Ų | 19 | 48.7 Ų | 48.7 | 10% | 0.099 | 25% | 0.249 | C | C | . | . | P | Polyproline II helix | trans | -71.3 | 150.9 | 164.7 | -60.8 | -178.5 | 0 | 0 | 0 | 111.3 | P236 Y349 W442 W443 | P236-L440 HydrophobicContact CB-CD1 4.01Å; P236-L440 HydrophobicContact CB-CD2 3.57Å; P236-L440 HydrophobicContact CB-CG 4.47Å; P236-L440 HydrophobicContact CG-CD2 3.52Å; Y349-L440 HydrophobicContact CD1-CD1 4.03Å; Y349-L440 HydrophobicContact CE1-CD1 4.48Å; Y349-L440 HydrophobicContact CG-CD1 4.45Å; L440-W442 HydrophobicContact CB-CD2 4.22Å; L440-W442 HydrophobicContact CB-CE3 4.36Å; L440-W442 HydrophobicContact CB-CH2 4.27Å; L440-W442 HydrophobicContact CB-CZ2 4.03Å; L440-W442 HydrophobicContact CB-CZ3 4.38Å; L440-W442 HydrophobicContact CD1-CH2 3.93Å; L440-W442 HydrophobicContact CD1-CZ2 3.37Å; L440-W442 HydrophobicContact CG-CH2 4.44Å; L440-W442 HydrophobicContact CG-CZ2 4.24Å; L440-W442 PolarHBondContact O-N 3.21Å; L440-W443 HydrophobicContact CB-CD2 3.83Å; L440-W443 HydrophobicContact CB-CE3 4.3Å; L440-W443 HydrophobicContact CB-CG 4.07Å; L440-W443 HydrophobicContact CB-CZ2 4.3Å; L440-W443 HydrophobicContact CD1-CD2 4.4Å; L440-W443 HydrophobicContact CD1-CH2 4.06Å; L440-W443 HydrophobicContact CD1-CZ2 3.37Å; L440-W443 VanDerWaalsContact CD1-CZ2 3.41Å; L440-W443 HydrophobicContact CG-CD2 4.05Å; L440-W443 HydrophobicContact CG-CE3 4.31Å; L440-W443 HydrophobicContact CG-CH2 3.87Å; L440-W443 HydrophobicContact CG-CZ2 3.61Å; L440-W443 HydrophobicContact CG-CZ3 4.21Å; L440-W443 VanDerWaalsContact N-CE3 3.32Å; L440-W443 WeakPolarHBondContact O-CA 3.47Å; L440-W443 PolarHBondContact O-N 3.2Å; L440-W443 VanDerWaalsContact O-N 3.1Å |
| 441 | P | 89.8 | Confident | 90.3 | Very high | 103.5 Ų | 103.5 | 52.4 Ų | 52.4 | 67% | 0.672 | 28% | 0.275 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -54.6 | -31 | -174.3 | -28.5 | 35.3 | 0 | 0 | 0 | 115.3 | R439 | R439-P441 PolarHBondContact NH1-O 3.15Å; R439-P441 PolarHBondContact NH2-O 3.31Å |
| 442 | W | 89.8 | Confident | 90 | Very high | 51.5 Ų | 51.5 | 56.2 Ų | 56.2 | 20% | 0.195 | 29% | 0.289 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -96.7 | -6 | -179 | 60.7 | 86.6 | 0 | 0 | 0 | 114.9 | T348 Y349 I350 N351 L440 | T348-W442 PolarHBondContact O-NE1 3.08Å; Y349-W442 WeakPolarHBondContact O-CZ2 3.39Å; I350-W442 PolarHBondContact O-NE1 3.32Å; N351-W442 HydrophobicContact CB-CD2 4.12Å; N351-W442 HydrophobicContact CB-CE3 4.39Å; N351-W442 HydrophobicContact CB-CG 4.27Å; L440-W442 HydrophobicContact CB-CD2 4.22Å; L440-W442 HydrophobicContact CB-CE3 4.36Å; L440-W442 HydrophobicContact CB-CH2 4.27Å; L440-W442 HydrophobicContact CB-CZ2 4.03Å; L440-W442 HydrophobicContact CB-CZ3 4.38Å; L440-W442 HydrophobicContact CD1-CH2 3.93Å; L440-W442 HydrophobicContact CD1-CZ2 3.37Å; L440-W442 HydrophobicContact CG-CH2 4.44Å; L440-W442 HydrophobicContact CG-CZ2 4.24Å; L440-W442 PolarHBondContact O-N 3.21Å |
| 443 | W | 92.5 | Very high | 89.6 | Confident | 12 Ų | 12 | 54.5 Ų | 54.5 | 5% | 0.045 | 28% | 0.284 | C | S | . | . | trans | -39.4 | 137.5 | 159.4 | -44.8 | -22 | 0 | 0 | 0 | 114.4 | T348 Y349 R403 T438 R439 L440 | T348-W443 PolarHBondContact O-NE1 3.43Å; Y349-W443 HydrophobicContact CE2-CZ2 4.46Å; R403-W443 HydrophobicContact CB-CG 4.45Å; R403-W443 HydrophobicContact CG-CB 4.36Å; R403-W443 HydrophobicContact CG-CD2 4.25Å; R403-W443 HydrophobicContact CG-CG 4.03Å; R403-W443 VanDerWaalsContact CZ-CE3 3.46Å; R403-W443 VanDerWaalsContact CZ-CH2 3.43Å; R403-W443 VanDerWaalsContact NH2-CZ3 3.27Å; T438-W443 WeakPolarHBondContact O-CZ3 3.36Å; R439-W443 HydrophobicContact CB-CE3 4.49Å; R439-W443 WeakPolarHBondContact CD-O 3.44Å; R439-W443 HydrophobicContact CG-CB 3.74Å; R439-W443 HydrophobicContact CG-CE3 4.2Å; R439-W443 VanDerWaalsContact CZ-C 3.46Å; R439-W443 PolarHBondContact NH1-O 3.17Å; R439-W443 PolarHBondContact NH2-O 3.11Å; L440-W443 HydrophobicContact CB-CD2 3.83Å; L440-W443 HydrophobicContact CB-CE3 4.3Å; L440-W443 HydrophobicContact CB-CG 4.07Å; L440-W443 HydrophobicContact CB-CZ2 4.3Å; L440-W443 HydrophobicContact CD1-CD2 4.4Å; L440-W443 HydrophobicContact CD1-CH2 4.06Å; L440-W443 HydrophobicContact CD1-CZ2 3.37Å; L440-W443 VanDerWaalsContact CD1-CZ2 3.41Å; L440-W443 HydrophobicContact CG-CD2 4.05Å; L440-W443 HydrophobicContact CG-CE3 4.31Å; L440-W443 HydrophobicContact CG-CH2 3.87Å; L440-W443 HydrophobicContact CG-CZ2 3.61Å; L440-W443 HydrophobicContact CG-CZ3 4.21Å; L440-W443 VanDerWaalsContact N-CE3 3.32Å; L440-W443 WeakPolarHBondContact O-CA 3.47Å; L440-W443 PolarHBondContact O-N 3.2Å; L440-W443 VanDerWaalsContact O-N 3.1Å | ||
| 444 | P | 90.7 | Very high | 89.3 | Confident | 27.5 Ų | 27.5 | 57 Ų | 57 | 18% | 0.179 | 30% | 0.298 | C | S | . | . | trans | -66.7 | 150.1 | 160.2 | 11.4 | -8.1 | 0 | 0 | 0 | 110.7 | F402 R403 R439 L448 | F402-P444 HydrophobicContact CD1-CB 4.38Å; F402-P444 HydrophobicContact CD1-CG 3.93Å; F402-P444 HydrophobicContact CE1-CB 3.86Å; F402-P444 HydrophobicContact CE1-CG 3.8Å; F402-P444 HydrophobicContact CZ-CB 4.33Å; F402-P444 HydrophobicContact CZ-CG 4.35Å; F402-P444 WeakPolarHBondContact O-CG 3.35Å; R403-P444 WeakPolarHBondContact O-CD 3.34Å; R439-P444 PolarHBondContact NH1-O 3.49Å; P444-L448 HydrophobicContact CB-CD1 3.64Å | ||
| 445 | K | 89.8 | Confident | 89.1 | Confident | 117 Ų | 117 | 58.2 Ų | 58.2 | 51% | 0.509 | 30% | 0.303 | S | S | . | . | trans | -88.5 | 157.8 | 174 | -73.8 | -177.2 | -174.8 | 177.5 | 0 | 109.2 | F402 D447 L448 | F402-K445 WeakPolarHBondContact CZ-O 3.31Å; K445-D447 VanDerWaalsContact CB-CG 3.44Å; K445-D447 WeakPolarHBondContact CB-OD1 3.46Å; K445-D447 WeakPolarHBondContact CB-OD2 3.45Å; K445-D447 VanDerWaalsContact CD-OD2 3.3Å; K445-D447 WeakPolarHBondContact CD-OD2 3.46Å; K445-D447 PolarHBondContact O-N 3.16Å; K445-L448 PolarHBondContact O-N 3.32Å | ||
| 446 | I | 90.7 | Very high | 89.1 | Confident | 17 Ų | 17 | 56.8 Ų | 56.8 | 9% | 0.087 | 29% | 0.291 | C | S | . | . | G | 310 helix | trans | -68.2 | -17.1 | 178.5 | -163.4 | 160.1 | 0 | 0 | 0 | 112.9 | L431 I434 A435 L448 V449 Y450 E551 L554 | L431-I446 WeakPolarHBondContact O-CD1 3.36Å; I434-I446 HydrophobicContact CG2-CB 4.12Å; I434-I446 HydrophobicContact CG2-CD1 4.22Å; I434-I446 HydrophobicContact CG2-CG1 4.26Å; A435-I446 HydrophobicContact CB-CD1 3.7Å; I446-L448 PolarHBondContact O-N 3.19Å; I446-L448 VanDerWaalsContact O-N 3.14Å; I446-V449 HydrophobicContact CG1-CG2 4.44Å; I446-V449 VanDerWaalsContact O-CB 3.31Å; I446-V449 WeakPolarHBondContact O-CB 3.29Å; I446-V449 PolarHBondContact O-N 3.18Å; I446-Y450 HydrophobicContact CG2-CE1 4.46Å; I446-E551 HydrophobicContact CD1-CB 4.48Å; I446-E551 HydrophobicContact CD1-CG 4.17Å; I446-E551 HydrophobicContact CG2-CG 4.11Å; I446-E551 VanDerWaalsContact CG2-OE2 3.28Å; I446-E551 WeakPolarHBondContact CG2-OE2 3.41Å; I446-L554 HydrophobicContact CD1-CD1 3.98Å; I446-L554 HydrophobicContact CG1-CD1 4.36Å |
| 447 | D | 88.8 | Confident | 89.1 | Confident | 68 Ų | 68 | 53.8 Ų | 53.8 | 36% | 0.364 | 27% | 0.273 | S | S | . | . | G | 310 helix | trans | -56.7 | -25.8 | 175.7 | 56.3 | 9 | 0 | 0 | 0 | 113.9 | K445 V449 Y450 | K445-D447 VanDerWaalsContact CB-CG 3.44Å; K445-D447 WeakPolarHBondContact CB-OD1 3.46Å; K445-D447 WeakPolarHBondContact CB-OD2 3.45Å; K445-D447 VanDerWaalsContact CD-OD2 3.3Å; K445-D447 WeakPolarHBondContact CD-OD2 3.46Å; K445-D447 PolarHBondContact O-N 3.16Å; D447-V449 PolarHBondContact O-N 3.26Å; D447-V449 VanDerWaalsContact O-N 3.16Å; D447-Y450 VanDerWaalsContact CA-CD2 3.48Å; D447-Y450 VanDerWaalsContact CA-CE2 3.47Å; D447-Y450 HydrophobicContact CB-CD2 3.72Å; D447-Y450 HydrophobicContact CB-CE2 3.46Å; D447-Y450 VanDerWaalsContact CB-CE2 3.46Å; D447-Y450 HydrophobicContact CB-CG 4.48Å; D447-Y450 VanDerWaalsContact O-CB 3.23Å; D447-Y450 WeakPolarHBondContact O-CB 3.46Å; D447-Y450 WeakPolarHBondContact O-CD2 3.41Å; D447-Y450 VanDerWaalsContact O-CG 3.25Å; D447-Y450 PolarHBondContact O-N 3.37Å; D447-Y450 VanDerWaalsContact O-N 3.13Å |
| 448 | L | 89 | Confident | 89.2 | Confident | 69 Ų | 69 | 55.5 Ų | 55.5 | 36% | 0.361 | 28% | 0.28 | S | S | . | . | G | 310 helix | trans | -60.8 | -24.6 | 172.6 | -60.5 | -179.7 | 0 | 0 | 0 | 113 | Y406 P444 K445 I446 S451 | Y406-L448 HydrophobicContact CD1-CD1 3.85Å; Y406-L448 HydrophobicContact CD2-CB 4.06Å; Y406-L448 HydrophobicContact CD2-CD1 4.38Å; Y406-L448 HydrophobicContact CE1-CD1 4.33Å; Y406-L448 HydrophobicContact CE2-CB 4.14Å; Y406-L448 HydrophobicContact CG-CB 4.33Å; Y406-L448 HydrophobicContact CG-CD1 3.98Å; Y406-L448 PolarHBondContact OH-O 2.95Å; P444-L448 HydrophobicContact CB-CD1 3.64Å; K445-L448 PolarHBondContact O-N 3.32Å; I446-L448 PolarHBondContact O-N 3.19Å; I446-L448 VanDerWaalsContact O-N 3.14Å; L448-S451 PolarHBondContact O-OG 3.4Å |
| 449 | V | 90.1 | Very high | 89.5 | Confident | 1.5 Ų | 1.5 | 49.7 Ų | 49.7 | 1% | 0.009 | 25% | 0.245 | C | C | . | . | G | 310 helix | trans | -86.5 | -13.7 | -179 | -172.2 | 0 | 0 | 0 | 0 | 111.9 | F402 Y406 F411 L431 I446 D447 S451 R452 L456 L554 | F402-V449 HydrophobicContact CD2-CG2 4.47Å; F402-V449 HydrophobicContact CE2-CG2 3.62Å; F402-V449 HydrophobicContact CZ-CG2 3.99Å; Y406-V449 HydrophobicContact CE2-CG2 4.21Å; F411-V449 HydrophobicContact CE1-CG1 3.86Å; F411-V449 HydrophobicContact CE1-CG2 4.11Å; F411-V449 HydrophobicContact CE2-CG1 4.4Å; F411-V449 HydrophobicContact CE2-CG2 4.39Å; F411-V449 HydrophobicContact CZ-CG1 4.25Å; F411-V449 HydrophobicContact CZ-CG2 3.82Å; L431-V449 HydrophobicContact CD1-CG1 4.2Å; L431-V449 HydrophobicContact CD2-CB 4.41Å; L431-V449 HydrophobicContact CD2-CG1 3.99Å; L431-V449 HydrophobicContact CD2-CG2 3.84Å; I446-V449 HydrophobicContact CG1-CG2 4.44Å; I446-V449 VanDerWaalsContact O-CB 3.31Å; I446-V449 WeakPolarHBondContact O-CB 3.29Å; I446-V449 PolarHBondContact O-N 3.18Å; D447-V449 PolarHBondContact O-N 3.26Å; D447-V449 VanDerWaalsContact O-N 3.16Å; V449-S451 PolarHBondContact O-N 3.27Å; V449-S451 VanDerWaalsContact O-N 3.12Å; V449-R452 HydrophobicContact CG1-CB 4.38Å; V449-R452 WeakPolarHBondContact O-CA 3.12Å; V449-R452 VanDerWaalsContact O-CB 3.31Å; V449-R452 WeakPolarHBondContact O-CB 3.31Å; V449-R452 PolarHBondContact O-N 3.35Å; V449-L456 HydrophobicContact CG1-CD1 4.32Å; V449-L554 HydrophobicContact CB-CD2 3.94Å; V449-L554 HydrophobicContact CG1-CD2 3.79Å |
| 450 | Y | 88.9 | Confident | 89.7 | Confident | 43.5 Ų | 43.5 | 44.8 Ų | 44.8 | 17% | 0.171 | 23% | 0.227 | C | C | . | . | G | 310 helix | trans | -56.1 | -31.9 | -179.9 | -72.5 | -9 | 0 | 0 | 0 | 113.5 | I446 D447 R452 S453 E551 K553 L554 P558 | I446-Y450 HydrophobicContact CG2-CE1 4.46Å; D447-Y450 VanDerWaalsContact CA-CD2 3.48Å; D447-Y450 VanDerWaalsContact CA-CE2 3.47Å; D447-Y450 HydrophobicContact CB-CD2 3.72Å; D447-Y450 HydrophobicContact CB-CE2 3.46Å; D447-Y450 VanDerWaalsContact CB-CE2 3.46Å; D447-Y450 HydrophobicContact CB-CG 4.48Å; D447-Y450 VanDerWaalsContact O-CB 3.23Å; D447-Y450 WeakPolarHBondContact O-CB 3.46Å; D447-Y450 WeakPolarHBondContact O-CD2 3.41Å; D447-Y450 VanDerWaalsContact O-CG 3.25Å; D447-Y450 PolarHBondContact O-N 3.37Å; D447-Y450 VanDerWaalsContact O-N 3.13Å; Y450-R452 PolarHBondContact O-N 2.85Å; Y450-R452 VanDerWaalsContact O-N 3.08Å; Y450-S453 WeakPolarHBondContact O-CB 3.33Å; Y450-S453 PolarHBondContact O-N 3.03Å; Y450-E551 HydrophobicContact CE1-CG 4.1Å; Y450-E551 PolarHBondContact OH-OE1 3.15Å; Y450-K553 HydrophobicContact CD1-CB 4.29Å; Y450-K553 HydrophobicContact CE1-CB 3.69Å; Y450-K553 HydrophobicContact CE2-CB 4.36Å; Y450-K553 HydrophobicContact CE2-CD 4.07Å; Y450-K553 WeakPolarHBondContact OH-CD 3.44Å; Y450-L554 HydrophobicContact CD1-CD2 3.75Å; Y450-L554 HydrophobicContact CD1-CG 4.21Å; Y450-L554 HydrophobicContact CE1-CD2 4.19Å; Y450-L554 HydrophobicContact CE1-CG 4.22Å; Y450-P558 VanDerWaalsContact CB-CG 3.47Å; Y450-P558 HydrophobicContact CG-CG 4.08Å; Y450-P558 WeakPolarHBondContact O-CG 3.34Å |
| 451 | S | 85.5 | Confident | 89.7 | Confident | 78 Ų | 78 | 45.6 Ų | 45.6 | 55% | 0.545 | 23% | 0.231 | S | C | . | . | G | 310 helix | trans | -61.5 | -11.9 | 173 | 61.5 | 0 | 0 | 0 | 0 | 114.6 | L448 V449 | L448-S451 PolarHBondContact O-OG 3.4Å; V449-S451 PolarHBondContact O-N 3.27Å; V449-S451 VanDerWaalsContact O-N 3.12Å |
| 452 | R | 87 | Confident | 89.8 | Confident | 80.5 Ų | 80.5 | 43.7 Ų | 43.7 | 30% | 0.304 | 21% | 0.213 | S | C | . | . | G | 310 helix | trans | -110.9 | 17.9 | -177.4 | -54.6 | -63.6 | -178.3 | -178.4 | -3.4 | 113.6 | N408 F411 L415 V449 Y450 E454 E455 L456 | N408-R452 PolarHBondContact OD1-NH2 3.24Å; F411-R452 HydrophobicContact CE1-CG 4.05Å; F411-R452 HydrophobicContact CZ-CG 4.3Å; L415-R452 HydrophobicContact CD1-CB 4.13Å; L415-R452 HydrophobicContact CD1-CG 4.11Å; L415-R452 HydrophobicContact CD2-CB 4.04Å; L415-R452 HydrophobicContact CD2-CG 4.11Å; V449-R452 HydrophobicContact CG1-CB 4.38Å; V449-R452 WeakPolarHBondContact O-CA 3.12Å; V449-R452 VanDerWaalsContact O-CB 3.31Å; V449-R452 WeakPolarHBondContact O-CB 3.31Å; V449-R452 PolarHBondContact O-N 3.35Å; Y450-R452 PolarHBondContact O-N 2.85Å; Y450-R452 VanDerWaalsContact O-N 3.08Å; R452-E454 VanDerWaalsContact C-N 3.25Å; R452-E454 PolarHBondContact O-N 3.01Å; R452-E455 VanDerWaalsContact C-OE2 3.25Å; R452-E455 WeakPolarHBondContact CA-OE2 3.29Å; R452-E455 WeakPolarHBondContact CD-OE1 3.36Å; R452-E455 IonicContact CZ-OE1 3.6Å; R452-E455 IonicContact NE-OE1 3.38Å; R452-E455 IonicContact NH1-OE1 3.36Å; R452-E455 PolarHBondContact NH1-OE1 3.21Å; R452-E455 PolarHBondContact O-N 3.44Å; R452-L456 PolarHBondContact O-N 2.91Å |
| 453 | S | 87.7 | Confident | 89.8 | Confident | 9.5 Ų | 9.5 | 41.4 Ų | 41.4 | 7% | 0.066 | 21% | 0.205 | C | C | . | . | H | α-helix | trans | -61.2 | -34.9 | -177.6 | 61.8 | 0 | 0 | 0 | 0 | 112.6 | Y450 L456 V457 L554 P558 | Y450-S453 WeakPolarHBondContact O-CB 3.33Å; Y450-S453 PolarHBondContact O-N 3.03Å; S453-L456 PolarHBondContact O-N 3.11Å; S453-V457 WeakPolarHBondContact O-CG2 3.29Å; S453-V457 PolarHBondContact O-N 3.21Å; S453-L554 VanDerWaalsContact CA-O 3.26Å; S453-L554 WeakPolarHBondContact CA-O 3.43Å; S453-L554 WeakPolarHBondContact CB-O 3.43Å; S453-P558 WeakPolarHBondContact OG-CD 3.36Å |
| 454 | E | 85.8 | Confident | 89.7 | Confident | 96.5 Ų | 96.5 | 41.3 Ų | 41.3 | 45% | 0.451 | 21% | 0.205 | S | C | . | . | H | α-helix | trans | -66.6 | -44.9 | -176.9 | 179.8 | 160.4 | -130.8 | 0 | 0 | 111.6 | R452 L456 V457 Q458 R557 | R452-E454 VanDerWaalsContact C-N 3.25Å; R452-E454 PolarHBondContact O-N 3.01Å; E454-L456 VanDerWaalsContact C-N 3.29Å; E454-L456 PolarHBondContact O-N 3.35Å; E454-V457 PolarHBondContact O-N 3.27Å; E454-Q458 WeakPolarHBondContact O-CB 3.36Å; E454-Q458 WeakPolarHBondContact O-CG 3.32Å; E454-Q458 PolarHBondContact O-N 3.43Å; E454-R557 IonicContact OE1-CZ 3.42Å; E454-R557 IonicContact OE1-NH2 3.51Å; E454-R557 PolarHBondContact OE1-NH2 3.22Å |
| 455 | E | 89.5 | Confident | 89.6 | Confident | 46.5 Ų | 46.5 | 44.3 Ų | 44.3 | 22% | 0.217 | 22% | 0.219 | C | C | . | . | H | α-helix | trans | -62.4 | -37.6 | 175.5 | -58.6 | 97.3 | 132.1 | 0 | 0 | 111.2 | L415 R452 Q458 I459 | L415-E455 HydrophobicContact CB-CB 4.46Å; L415-E455 HydrophobicContact CD1-CB 4.03Å; L415-E455 HydrophobicContact CD2-CB 3.89Å; L415-E455 HydrophobicContact CD2-CG 4.03Å; L415-E455 HydrophobicContact CG-CB 4.09Å; L415-E455 HydrophobicContact CG-CG 4.18Å; R452-E455 VanDerWaalsContact C-OE2 3.25Å; R452-E455 WeakPolarHBondContact CA-OE2 3.29Å; R452-E455 WeakPolarHBondContact CD-OE1 3.36Å; R452-E455 IonicContact CZ-OE1 3.6Å; R452-E455 IonicContact NE-OE1 3.38Å; R452-E455 IonicContact NH1-OE1 3.36Å; R452-E455 PolarHBondContact NH1-OE1 3.21Å; R452-E455 PolarHBondContact O-N 3.44Å; E455-Q458 PolarHBondContact O-N 3.04Å; E455-I459 VanDerWaalsContact O-CG1 3.28Å; E455-I459 WeakPolarHBondContact O-CG1 3.34Å; E455-I459 PolarHBondContact O-N 3.26Å |
| 456 | L | 91 | Very high | 89.4 | Confident | 1 Ų | 1 | 43 Ų | 43 | 1% | 0.005 | 22% | 0.218 | C | C | . | . | H | α-helix | trans | -67.8 | -41 | 176.1 | -71.8 | 175.5 | 0 | 0 | 0 | 112.9 | L415 L427 L431 V449 R452 S453 E454 Q458 I459 F460 L554 F555 | L415-L456 HydrophobicContact CD1-CD2 4.25Å; L415-L456 HydrophobicContact CD2-CD2 4.31Å; L427-L456 HydrophobicContact CD2-CD2 4.2Å; L431-L456 HydrophobicContact CD1-CD1 4.15Å; L431-L456 HydrophobicContact CD1-CD2 4.15Å; V449-L456 HydrophobicContact CG1-CD1 4.32Å; R452-L456 PolarHBondContact O-N 2.91Å; S453-L456 PolarHBondContact O-N 3.11Å; E454-L456 VanDerWaalsContact C-N 3.29Å; E454-L456 PolarHBondContact O-N 3.35Å; L456-Q458 VanDerWaalsContact C-N 3.31Å; L456-I459 PolarHBondContact O-N 2.91Å; L456-F460 PolarHBondContact O-N 2.83Å; L456-L554 HydrophobicContact CD1-CB 4.07Å; L456-L554 HydrophobicContact CD1-CD1 4.44Å; L456-L554 HydrophobicContact CD1-CD2 3.93Å; L456-L554 HydrophobicContact CD1-CG 4.39Å; L456-F555 HydrophobicContact CB-CE1 4.44Å |
| 457 | V | 91 | Very high | 89.1 | Confident | 7.5 Ų | 7.5 | 42.6 Ų | 42.6 | 5% | 0.045 | 22% | 0.217 | C | C | . | . | H | α-helix | trans | -65.4 | -38.8 | 175 | 171.9 | 0 | 0 | 0 | 0 | 110.7 | S453 E454 F460 N461 F555 V585 | S453-V457 WeakPolarHBondContact O-CG2 3.29Å; S453-V457 PolarHBondContact O-N 3.21Å; E454-V457 PolarHBondContact O-N 3.27Å; V457-F460 WeakPolarHBondContact O-CB 3.38Å; V457-F460 PolarHBondContact O-N 3.06Å; V457-N461 PolarHBondContact O-N 3.29Å; V457-F555 HydrophobicContact CG2-CB 4.46Å; V457-F555 HydrophobicContact CG2-CD1 4.21Å; V457-V585 HydrophobicContact CG1-CG2 3.93Å; V457-V585 HydrophobicContact CG2-CG2 4.22Å |
| 458 | Q | 90 | Very high | 88.7 | Confident | 87.5 Ų | 87.5 | 41.1 Ų | 41.1 | 41% | 0.409 | 21% | 0.211 | S | C | . | . | H | α-helix | trans | -61.4 | -46.9 | 173.2 | -125.5 | 178.7 | -5.3 | 0 | 0 | 111.6 | E454 E455 L456 F460 N461 E462 | E454-Q458 WeakPolarHBondContact O-CB 3.36Å; E454-Q458 WeakPolarHBondContact O-CG 3.32Å; E454-Q458 PolarHBondContact O-N 3.43Å; E455-Q458 PolarHBondContact O-N 3.04Å; L456-Q458 VanDerWaalsContact C-N 3.31Å; Q458-F460 VanDerWaalsContact C-N 3.27Å; Q458-F460 PolarHBondContact O-N 3.13Å; Q458-N461 PolarHBondContact O-N 3.03Å; Q458-E462 HydrophobicContact CG-CG 4.37Å; Q458-E462 WeakPolarHBondContact CG-OE1 3.18Å; Q458-E462 PolarHBondContact NE2-OE1 2.64Å; Q458-E462 WeakPolarHBondContact O-CB 3.31Å; Q458-E462 WeakPolarHBondContact O-CG 3.35Å; Q458-E462 PolarHBondContact O-N 3.11Å |
| 459 | I | 92.2 | Very high | 88 | Confident | 5 Ų | 5 | 43.3 Ų | 43.3 | 3% | 0.026 | 22% | 0.219 | C | C | . | . | H | α-helix | trans | -58.7 | -41.7 | 175.7 | -69.6 | 165.7 | 0 | 0 | 0 | 110.7 | L415 L427 E455 L456 T463 L544 | L415-I459 HydrophobicContact CD1-CD1 4.18Å; L415-I459 HydrophobicContact CD2-CD1 3.75Å; L427-I459 HydrophobicContact CD2-CD1 4.27Å; E455-I459 VanDerWaalsContact O-CG1 3.28Å; E455-I459 WeakPolarHBondContact O-CG1 3.34Å; E455-I459 PolarHBondContact O-N 3.26Å; L456-I459 PolarHBondContact O-N 2.91Å; I459-T463 VanDerWaalsContact O-CB 3.27Å; I459-T463 WeakPolarHBondContact O-CB 3.29Å; I459-T463 PolarHBondContact O-N 3.04Å; I459-T463 PolarHBondContact O-OG1 3.4Å; I459-L544 HydrophobicContact CG2-CD1 4.03Å; I459-L544 HydrophobicContact CG2-CD2 4.41Å |
| 460 | F | 93.5 | Very high | 86.7 | Confident | 0 Ų | 0 | 44.8 Ų | 44.8 | 0% | 0 | 24% | 0.235 | C | C | . | . | H | α-helix | trans | -59.9 | -52.5 | 174.9 | 171.4 | -99 | 0 | 0 | 0 | 112.1 | L456 V457 Q458 E462 T463 L464 L541 L544 I545 M548 F555 V585 L589 | L456-F460 PolarHBondContact O-N 2.83Å; V457-F460 WeakPolarHBondContact O-CB 3.38Å; V457-F460 PolarHBondContact O-N 3.06Å; Q458-F460 VanDerWaalsContact C-N 3.27Å; Q458-F460 PolarHBondContact O-N 3.13Å; F460-E462 PolarHBondContact O-N 3.23Å; F460-T463 PolarHBondContact O-N 3.16Å; F460-L464 HydrophobicContact CE1-CD2 4.27Å; F460-L464 HydrophobicContact CZ-CD2 4.33Å; F460-L464 VanDerWaalsContact O-CB 3.25Å; F460-L464 WeakPolarHBondContact O-CB 3.34Å; F460-L464 PolarHBondContact O-N 3.2Å; F460-L541 HydrophobicContact CD2-CD1 3.82Å; F460-L541 HydrophobicContact CE2-CD1 3.71Å; F460-L544 HydrophobicContact CB-CD1 4.47Å; F460-L544 HydrophobicContact CD2-CB 4.34Å; F460-I545 HydrophobicContact CE2-CG1 4.17Å; F460-M548 HydrophobicContact CD2-CE 4.33Å; F460-M548 HydrophobicContact CE2-CE 4.24Å; F460-M548 HydrophobicContact CZ-CE 4.47Å; F460-F555 HydrophobicContact CB-CE1 4.43Å; F460-V585 HydrophobicContact CE1-CG1 4.33Å; F460-L589 HydrophobicContact CE2-CD2 4.12Å; F460-L589 HydrophobicContact CZ-CD2 3.9Å; F460-L589 HydrophobicContact CZ-CG 4.18Å |
| 461 | N | 91.1 | Very high | 85.2 | Confident | 36 Ų | 36 | 43.5 Ų | 43.5 | 19% | 0.193 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -63.4 | -42.8 | -178.3 | -74.5 | -21.2 | 0 | 0 | 0 | 112.5 | V457 Q458 L464 N465 | V457-N461 PolarHBondContact O-N 3.29Å; Q458-N461 PolarHBondContact O-N 3.03Å; N461-L464 PolarHBondContact O-N 3.24Å; N461-N465 WeakPolarHBondContact O-CB 3.42Å; N461-N465 VanDerWaalsContact O-CG 3.28Å; N461-N465 PolarHBondContact O-N 3Å; N461-N465 PolarHBondContact O-ND2 3Å; N461-N465 VanDerWaalsContact O-ND2 3.16Å |
| 462 | E | 90.3 | Very high | 83.7 | Confident | 63 Ų | 63 | 49.1 Ų | 49.1 | 29% | 0.294 | 24% | 0.243 | S | C | . | . | H | α-helix | trans | -60.5 | -47.7 | 174.3 | -74.2 | 177.8 | -175.8 | 0 | 0 | 111.6 | R424 Q458 F460 L464 N465 N466 | R424-E462 IonicContact CZ-OE2 3.25Å; R424-E462 IonicContact NH1-OE2 3.39Å; R424-E462 PolarHBondContact NH1-OE2 3.34Å; R424-E462 IonicContact NH2-OE2 3.5Å; R424-E462 PolarHBondContact NH2-OE2 3.28Å; Q458-E462 HydrophobicContact CG-CG 4.37Å; Q458-E462 WeakPolarHBondContact CG-OE1 3.18Å; Q458-E462 PolarHBondContact NE2-OE1 2.64Å; Q458-E462 WeakPolarHBondContact O-CB 3.31Å; Q458-E462 WeakPolarHBondContact O-CG 3.35Å; Q458-E462 PolarHBondContact O-N 3.11Å; F460-E462 PolarHBondContact O-N 3.23Å; E462-L464 VanDerWaalsContact C-N 3.35Å; E462-L464 PolarHBondContact O-N 3.13Å; E462-N465 PolarHBondContact O-N 2.98Å; E462-N466 VanDerWaalsContact O-CG 3.24Å; E462-N466 PolarHBondContact O-N 3.23Å; E462-N466 VanDerWaalsContact O-N 3.08Å; E462-N466 PolarHBondContact O-ND2 2.76Å |
| 463 | T | 91.3 | Very high | 81.6 | Confident | 3.5 Ų | 3.5 | 51.2 Ų | 51.2 | 2% | 0.021 | 26% | 0.26 | C | S | . | . | H | α-helix | trans | -66.3 | -41.8 | -178.3 | -52.7 | 0 | 0 | 0 | 0 | 110.8 | I459 F460 N465 N466 V467 S537 L540 L541 | I459-T463 VanDerWaalsContact O-CB 3.27Å; I459-T463 WeakPolarHBondContact O-CB 3.29Å; I459-T463 PolarHBondContact O-N 3.04Å; I459-T463 PolarHBondContact O-OG1 3.4Å; F460-T463 PolarHBondContact O-N 3.16Å; T463-N465 PolarHBondContact O-N 3.39Å; T463-N466 PolarHBondContact O-N 3.25Å; T463-V467 HydrophobicContact CG2-CG2 4.44Å; T463-V467 WeakPolarHBondContact O-CB 3.39Å; T463-V467 VanDerWaalsContact O-CG2 3.27Å; T463-V467 WeakPolarHBondContact O-CG2 3.45Å; T463-V467 PolarHBondContact O-N 3.14Å; T463-S537 VanDerWaalsContact CG2-O 3.31Å; T463-S537 WeakPolarHBondContact CG2-O 3.26Å; T463-L540 HydrophobicContact CG2-CB 4.1Å; T463-L540 HydrophobicContact CG2-CD2 3.95Å; T463-L540 HydrophobicContact CG2-CG 4Å; T463-L540 WeakPolarHBondContact OG1-CD2 3.32Å; T463-L541 HydrophobicContact CG2-CB 3.94Å |
| 464 | L | 90.6 | Very high | 79.5 | Confident | 9 Ų | 9 | 54.4 Ų | 54.4 | 5% | 0.047 | 29% | 0.287 | C | S | . | . | H | α-helix | trans | -58.3 | -50 | 175.2 | 178.5 | 67.9 | 0 | 0 | 0 | 111.2 | F460 N461 E462 N466 V467 C468 L541 L592 | F460-L464 HydrophobicContact CE1-CD2 4.27Å; F460-L464 HydrophobicContact CZ-CD2 4.33Å; F460-L464 VanDerWaalsContact O-CB 3.25Å; F460-L464 WeakPolarHBondContact O-CB 3.34Å; F460-L464 PolarHBondContact O-N 3.2Å; N461-L464 PolarHBondContact O-N 3.24Å; E462-L464 VanDerWaalsContact C-N 3.35Å; E462-L464 PolarHBondContact O-N 3.13Å; L464-N466 VanDerWaalsContact C-N 3.31Å; L464-N466 PolarHBondContact O-N 3.3Å; L464-V467 PolarHBondContact O-N 3.23Å; L464-C468 WeakPolarHBondContact O-CB 3.37Å; L464-C468 PolarHBondContact O-N 3.16Å; L464-C468 PolarHBondContact O-SG 3.19Å; L464-C468 VanDerWaalsContact O-SG 3.36Å; L464-L541 HydrophobicContact CB-CD1 4.35Å; L464-L541 HydrophobicContact CD1-CD2 4.04Å; L464-L592 HydrophobicContact CD1-CD1 3.89Å; L464-L592 HydrophobicContact CD1-CD2 3.63Å; L464-L592 HydrophobicContact CD1-CG 3.68Å |
| 465 | N | 88 | Confident | 77.2 | Confident | 90 Ų | 90 | 58.6 Ų | 58.6 | 48% | 0.481 | 30% | 0.304 | S | S | . | . | H | α-helix | trans | -58.7 | -43.4 | 178.6 | -77 | -34.1 | 0 | 0 | 0 | 111.9 | N461 E462 T463 C468 Q469 | N461-N465 WeakPolarHBondContact O-CB 3.42Å; N461-N465 VanDerWaalsContact O-CG 3.28Å; N461-N465 PolarHBondContact O-N 3Å; N461-N465 PolarHBondContact O-ND2 3Å; N461-N465 VanDerWaalsContact O-ND2 3.16Å; E462-N465 PolarHBondContact O-N 2.98Å; T463-N465 PolarHBondContact O-N 3.39Å; N465-C468 PolarHBondContact O-N 3.3Å; N465-Q469 WeakPolarHBondContact O-CB 3.48Å; N465-Q469 VanDerWaalsContact O-CG 3.24Å; N465-Q469 WeakPolarHBondContact O-CG 3.24Å; N465-Q469 PolarHBondContact O-N 3.14Å |
| 466 | N | 85.3 | Confident | 74.5 | Confident | 91 Ų | 91 | 62.4 Ų | 62.4 | 49% | 0.487 | 33% | 0.33 | S | S | . | . | H | α-helix | trans | -62.7 | -43.3 | 177.2 | -69 | -20.8 | 0 | 0 | 0 | 112.1 | E462 T463 L464 G470 | E462-N466 VanDerWaalsContact O-CG 3.24Å; E462-N466 PolarHBondContact O-N 3.23Å; E462-N466 VanDerWaalsContact O-N 3.08Å; E462-N466 PolarHBondContact O-ND2 2.76Å; T463-N466 PolarHBondContact O-N 3.25Å; L464-N466 VanDerWaalsContact C-N 3.31Å; L464-N466 PolarHBondContact O-N 3.3Å; N466-G470 PolarHBondContact O-N 3.22Å |
| 467 | V | 84.4 | Confident | 71.6 | Confident | 9 Ų | 9 | 69.5 Ų | 69.5 | 6% | 0.055 | 37% | 0.367 | C | S | . | . | H | α-helix | trans | -67.2 | -45.4 | 179.1 | 172.2 | 0 | 0 | 0 | 0 | 111.2 | T463 L464 G470 A471 R538 L541 M599 L602 | T463-V467 HydrophobicContact CG2-CG2 4.44Å; T463-V467 WeakPolarHBondContact O-CB 3.39Å; T463-V467 VanDerWaalsContact O-CG2 3.27Å; T463-V467 WeakPolarHBondContact O-CG2 3.45Å; T463-V467 PolarHBondContact O-N 3.14Å; L464-V467 PolarHBondContact O-N 3.23Å; V467-G470 PolarHBondContact O-N 3.2Å; V467-A471 PolarHBondContact O-N 3.3Å; V467-A471 VanDerWaalsContact O-N 3.1Å; V467-R538 HydrophobicContact CG1-CG 3.92Å; V467-R538 HydrophobicContact CG2-CG 4.15Å; V467-L541 HydrophobicContact CB-CD2 3.99Å; V467-L541 HydrophobicContact CG1-CD2 4.03Å; V467-L541 HydrophobicContact CG2-CB 4.4Å; V467-L541 HydrophobicContact CG2-CD2 3.99Å; V467-M599 HydrophobicContact CG1-CE 3.57Å; V467-M599 HydrophobicContact CG1-SD 3.79Å; V467-L602 HydrophobicContact CG1-CD1 4.34Å |
| 468 | C | 80.9 | Confident | 68.9 | Low | 36 Ų | 36 | 75 Ų | 75 | 24% | 0.243 | 40% | 0.403 | C | S | . | . | H | α-helix | trans | -67.5 | -36.4 | 179.2 | -68.7 | 0 | 0 | 0 | 0 | 112.7 | L464 N465 R472 | L464-C468 WeakPolarHBondContact O-CB 3.37Å; L464-C468 PolarHBondContact O-N 3.16Å; L464-C468 PolarHBondContact O-SG 3.19Å; L464-C468 VanDerWaalsContact O-SG 3.36Å; N465-C468 PolarHBondContact O-N 3.3Å; C468-R472 PolarHBondContact O-N 3.48Å |
| 469 | Q | 74.8 | Confident | 66 | Low | 114.5 Ų | 114.5 | 76.6 Ų | 76.6 | 54% | 0.535 | 42% | 0.424 | S | S | . | . | H | α-helix | trans | -70.7 | -40.7 | 173.9 | -72.2 | 179.7 | 20.8 | 0 | 0 | 112 | N465 A471 R472 N473 | N465-Q469 WeakPolarHBondContact O-CB 3.48Å; N465-Q469 VanDerWaalsContact O-CG 3.24Å; N465-Q469 WeakPolarHBondContact O-CG 3.24Å; N465-Q469 PolarHBondContact O-N 3.14Å; Q469-A471 VanDerWaalsContact C-N 3.31Å; Q469-A471 PolarHBondContact O-N 3.08Å; Q469-R472 PolarHBondContact O-N 3.18Å; Q469-N473 PolarHBondContact O-N 3.28Å |
| 470 | G | 62.4 | Low | 62.9 | Low | 33 Ų | 33 | 81.7 Ų | 81.7 | 34% | 0.34 | 46% | 0.46 | S | S | . | . | H | α-helix | trans | -61.7 | -37.2 | 177.6 | 0 | 0 | 0 | 0 | 0 | 113.2 | N466 V467 R472 N473 A474 | N466-G470 PolarHBondContact O-N 3.22Å; V467-G470 PolarHBondContact O-N 3.2Å; G470-R472 VanDerWaalsContact C-N 3.32Å; G470-R472 PolarHBondContact O-N 3.28Å; G470-N473 PolarHBondContact O-N 3.26Å; G470-A474 PolarHBondContact O-N 3.32Å |
| 471 | A | 56.8 | Low | 59.8 | Low | 16.5 Ų | 16.5 | 86.3 Ų | 86.3 | 14% | 0.136 | 50% | 0.498 | C | S | . | . | H | α-helix | trans | -63.4 | -39.6 | 176.1 | 0 | 0 | 0 | 0 | 0 | 112.8 | V467 Q469 N473 A474 E598 M599 | V467-A471 PolarHBondContact O-N 3.3Å; V467-A471 VanDerWaalsContact O-N 3.1Å; Q469-A471 VanDerWaalsContact C-N 3.31Å; Q469-A471 PolarHBondContact O-N 3.08Å; A471-N473 PolarHBondContact O-N 3.08Å; A471-A474 PolarHBondContact O-N 3.46Å; A471-E598 WeakPolarHBondContact CB-OE2 3.44Å; A471-M599 HydrophobicContact CB-CE 3.78Å |
| 472 | R | 53.4 | Low | 56.8 | Low | 195.5 Ų | 195.5 | 90.3 Ų | 90.3 | 74% | 0.738 | 53% | 0.529 | S | S | * | . | H | α-helix | trans | -66.6 | -33.6 | 177.4 | -71 | -179.8 | 179.3 | 162.3 | 1.9 | 113.3 | C468 Q469 G470 | C468-R472 PolarHBondContact O-N 3.48Å; Q469-R472 PolarHBondContact O-N 3.18Å; G470-R472 VanDerWaalsContact C-N 3.32Å; G470-R472 PolarHBondContact O-N 3.28Å |
| 473 | N | 43.7 | Very low | 53.9 | Low | 125.5 Ų | 125.5 | 94 Ų | 94 | 67% | 0.671 | 56% | 0.556 | S | S | * | * | H | α-helix | trans | -80.8 | -22.3 | -177.4 | -71 | -17.2 | 0 | 0 | 0 | 113.7 | Q469 G470 A471 F475 V476 | Q469-N473 PolarHBondContact O-N 3.28Å; G470-N473 PolarHBondContact O-N 3.26Å; A471-N473 PolarHBondContact O-N 3.08Å; N473-F475 PolarHBondContact O-N 3.18Å; N473-V476 PolarHBondContact O-N 3.42Å |
| 474 | A | 43 | Very low | 50.8 | Low | 76.5 Ų | 76.5 | 98.3 Ų | 98.3 | 63% | 0.632 | 59% | 0.592 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -70.8 | -11.9 | 179.2 | 0 | 0 | 0 | 0 | 0 | 113.9 | G470 A471 V476 | G470-A474 PolarHBondContact O-N 3.32Å; A471-A474 PolarHBondContact O-N 3.46Å; A474-V476 VanDerWaalsContact C-N 3.26Å; A474-V476 PolarHBondContact O-N 3.11Å; A474-V476 VanDerWaalsContact O-N 3.17Å |
| 475 | F | 37.6 | Very low | 47.9 | Very low | 184.5 Ų | 184.5 | 105.1 Ų | 105.1 | 81% | 0.809 | 63% | 0.627 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -84.7 | 4.1 | -175 | -144.7 | -95.1 | 0 | 0 | 0 | 114.9 | N473 L477 | N473-F475 PolarHBondContact O-N 3.18Å; F475-L477 PolarHBondContact O-N 3.21Å |
| 476 | V | 33.3 | Very low | 44.9 | Very low | 126 Ų | 126 | 105.9 Ų | 105.9 | 76% | 0.764 | 64% | 0.639 | S | S | * | * | trans | -91.8 | 31.2 | 178.6 | -168.6 | 0 | 0 | 0 | 0 | 112.4 | N473 A474 | N473-V476 PolarHBondContact O-N 3.42Å; A474-V476 VanDerWaalsContact C-N 3.26Å; A474-V476 PolarHBondContact O-N 3.11Å; A474-V476 VanDerWaalsContact O-N 3.17Å | ||
| 477 | L | 29.5 | Very low | 42.2 | Very low | 150 Ų | 150 | 106.2 Ų | 106.2 | 79% | 0.785 | 65% | 0.648 | S | S | * | * | S | Bend | trans | -121.7 | 121.7 | 167.5 | -83.8 | 158.2 | 0 | 0 | 0 | 109.4 | F475 S479 | F475-L477 PolarHBondContact O-N 3.21Å; L477-S479 PolarHBondContact O-N 3.11Å; L477-S479 VanDerWaalsContact O-N 3.17Å |
| 478 | P | 33.8 | Very low | 39.4 | Very low | 123 Ų | 123 | 112.8 Ų | 112.8 | 80% | 0.799 | 68% | 0.679 | S | S | * | * | trans | -74.9 | 115.6 | -168.3 | 28.3 | -32 | 0 | 0 | 0 | 111.3 | S480 | P478-S480 PolarHBondContact O-N 3.35Š| ||
| 479 | S | 30.2 | Very low | 36.8 | Very low | 120.5 Ų | 120.5 | 118.3 Ų | 118.3 | 84% | 0.843 | 70% | 0.702 | S | S | * | * | trans | -70.5 | 114.1 | 162.1 | 48.3 | 0 | 0 | 0 | 0 | 109.9 | L477 | L477-S479 PolarHBondContact O-N 3.11Å; L477-S479 VanDerWaalsContact O-N 3.17Å | ||
| 480 | S | 27.2 | Very low | 34.5 | Very low | 112 Ų | 112 | 117.7 Ų | 117.7 | 78% | 0.783 | 71% | 0.708 | S | S | * | * | trans | -97.7 | 138.8 | 164.8 | 48.4 | 0 | 0 | 0 | 0 | 110.3 | P478 | P478-S480 PolarHBondContact O-N 3.35Š| ||
| 481 | A | 27.4 | Very low | 32.9 | Very low | 96.5 Ų | 96.5 | 121.3 Ų | 121.3 | 80% | 0.798 | 72% | 0.719 | S | S | * | * | trans | 82.2 | 79.3 | 172.9 | 0 | 0 | 0 | 0 | 0 | 117.7 | T483 | A481-T483 PolarHBondContact O-N 3.41Š| ||
| 482 | S | 28.6 | Very low | 31.6 | Very low | 121.5 Ų | 121.5 | 128.8 Ų | 128.8 | 85% | 0.85 | 74% | 0.744 | S | S | * | * | trans | -125.2 | 116.3 | 136.6 | 46.6 | 0 | 0 | 0 | 0 | 110.5 | A484 | S482-A484 PolarHBondContact O-N 2.98Š| ||
| 483 | T | 29.1 | Very low | 30.4 | Very low | 140.5 Ų | 140.5 | 125.1 Ų | 125.1 | 86% | 0.862 | 74% | 0.743 | S | S | * | * | trans | -74 | 122.1 | -178.8 | -4.2 | 0 | 0 | 0 | 0 | 110.8 | A481 I485 | A481-T483 PolarHBondContact O-N 3.41Å; T483-I485 PolarHBondContact O-N 3.29Å; T483-I485 VanDerWaalsContact O-N 3.14Å | ||
| 484 | A | 27.2 | Very low | 29.6 | Very low | 93.5 Ų | 93.5 | 124.2 Ų | 124.2 | 77% | 0.773 | 74% | 0.742 | S | S | * | * | trans | -76.4 | 125.9 | 177.1 | 0 | 0 | 0 | 0 | 0 | 112.1 | S482 | S482-A484 PolarHBondContact O-N 2.98Š| ||
| 485 | I | 30.1 | Very low | 28.8 | Very low | 152.5 Ų | 152.5 | 128.4 Ų | 128.4 | 78% | 0.782 | 75% | 0.749 | S | S | * | * | trans | -110.1 | 107.1 | 157.3 | -59.6 | 177.3 | 0 | 0 | 0 | 108.4 | T483 S487 | T483-I485 PolarHBondContact O-N 3.29Å; T483-I485 VanDerWaalsContact O-N 3.14Å; I485-S487 PolarHBondContact O-N 3.06Å; I485-S487 VanDerWaalsContact O-N 3.14Å | ||
| 486 | S | 25.1 | Very low | 28.3 | Very low | 105.5 Ų | 105.5 | 125.2 Ų | 125.2 | 74% | 0.738 | 75% | 0.749 | S | S | * | * | trans | -9.3 | 114.8 | 149 | 173.8 | 0 | 0 | 0 | 0 | 117.1 | ||||
| 487 | S | 26.6 | Very low | 28 | Very low | 97 Ų | 97 | 126.6 Ų | 126.6 | 68% | 0.678 | 75% | 0.751 | S | S | * | * | trans | 179.1 | 96.1 | 156.6 | 63.9 | 0 | 0 | 0 | 0 | 112.8 | I485 M489 | I485-S487 PolarHBondContact O-N 3.06Å; I485-S487 VanDerWaalsContact O-N 3.14Å; S487-M489 PolarHBondContact O-N 2.65Å | ||
| 488 | H | 26.7 | Very low | 27.8 | Very low | 149 Ų | 149 | 127.1 Ų | 127.1 | 69% | 0.69 | 75% | 0.749 | S | S | * | * | -106.8 | 125.9 | 97.2 | -88.5 | -89.8 | 0 | 0 | 0 | 112.3 | N823 | H488-N823 PolarHBondContact NE2-ND2 3.04Å; H488-N823 PolarHBondContact NE2-OD1 3.45Å | |||
| 489 | M | 25.2 | Very low | 27.6 | Very low | 151 Ų | 151 | 130 Ų | 130 | 74% | 0.744 | 75% | 0.749 | S | S | * | * | trans | -72.1 | 129.6 | 169.2 | -83.7 | -110.2 | -100.5 | 0 | 0 | 115.3 | S487 | S487-M489 PolarHBondContact O-N 2.65Š| ||
| 490 | P | 27.8 | Very low | 27.4 | Very low | 102 Ų | 102 | 132.2 Ų | 132.2 | 66% | 0.662 | 75% | 0.748 | S | S | * | * | P | Polyproline II helix | trans | -77.7 | 153 | 172.8 | 9.9 | -1 | 0 | 0 | 0 | 112 | R492 | P490-R492 PolarHBondContact O-N 3.41Š|
| 491 | L | 28.7 | Very low | 27.4 | Very low | 108.5 Ų | 108.5 | 132.8 Ų | 132.8 | 57% | 0.568 | 75% | 0.747 | S | S | * | * | P | Polyproline II helix | trans | -69.7 | 117.7 | 162.7 | -77.3 | 162.4 | 0 | 0 | 0 | 109 | V493 R662 W663 | L491-V493 VanDerWaalsContact C-N 3.29Å; L491-V493 PolarHBondContact O-N 2.98Å; L491-R662 HydrophobicContact CD1-CB 4.09Å; L491-W663 HydrophobicContact CD1-CB 4.48Å |
| 492 | R | 28.5 | Very low | 27.5 | Very low | 174.5 Ų | 174.5 | 131.9 Ų | 131.9 | 66% | 0.658 | 75% | 0.747 | S | S | * | * | trans | -78.7 | 127.6 | -177.4 | -89.3 | -178.1 | 175.5 | 163.5 | -0.3 | 109 | P490 T494 E608 | P490-R492 PolarHBondContact O-N 3.41Å; R492-T494 PolarHBondContact O-N 3.1Å; R492-E608 PolarHBondContact N-OE1 3.07Å | ||
| 493 | V | 28.8 | Very low | 27.3 | Very low | 118 Ų | 118 | 133.9 Ų | 133.9 | 72% | 0.715 | 74% | 0.741 | S | S | * | * | -111.1 | 113.8 | 121.3 | 170 | 0 | 0 | 0 | 0 | 109.4 | L491 Q495 | L491-V493 VanDerWaalsContact C-N 3.29Å; L491-V493 PolarHBondContact O-N 2.98Å; V493-Q495 PolarHBondContact O-N 3.06Å | |||
| 494 | T | 26.6 | Very low | 27.2 | Very low | 106 Ų | 106 | 134 Ų | 134 | 65% | 0.65 | 74% | 0.735 | S | S | * | * | trans | -5.4 | 104.7 | 164.1 | 53.9 | 0 | 0 | 0 | 0 | 115.4 | R492 | R492-T494 PolarHBondContact O-N 3.1Š| ||
| 495 | Q | 26.2 | Very low | 27.1 | Very low | 165 Ų | 165 | 138.7 Ų | 138.7 | 77% | 0.771 | 74% | 0.738 | S | S | * | * | -113.4 | 128.1 | 96.7 | -70.3 | -178.1 | -7.1 | 0 | 0 | 108.9 | V493 L497 | V493-Q495 PolarHBondContact O-N 3.06Å; Q495-L497 PolarHBondContact O-N 3.44Å | |||
| 496 | S | 28.5 | Very low | 26.8 | Very low | 117 Ų | 117 | 139.1 Ų | 139.1 | 82% | 0.818 | 74% | 0.742 | S | S | * | * | G | 310 helix | trans | 19.9 | 74.3 | 148.5 | 69.1 | 0 | 0 | 0 | 0 | 117.1 | ||
| 497 | L | 25.3 | Very low | 26.8 | Very low | 155.5 Ų | 155.5 | 143.2 Ų | 143.2 | 81% | 0.814 | 75% | 0.747 | S | S | * | * | G | 310 helix | trans | -101.7 | 61.9 | -173.7 | -145.3 | 94 | 0 | 0 | 0 | 112.3 | Q495 K499 | Q495-L497 PolarHBondContact O-N 3.44Å; L497-K499 VanDerWaalsContact C-N 3.26Å; L497-K499 PolarHBondContact O-N 3.13Å |
| 498 | H | 26.8 | Very low | 26.7 | Very low | 159.5 Ų | 159.5 | 143.5 Ų | 143.5 | 74% | 0.738 | 75% | 0.749 | S | S | * | * | trans | -116.4 | 62.6 | 169 | -91.3 | 20.4 | 0 | 0 | 0 | 114.4 | M500 | H498-M500 PolarHBondContact O-N 2.7Š| ||
| 499 | K | 29.8 | Very low | 26.6 | Very low | 184 Ų | 184 | 143 Ų | 143 | 80% | 0.8 | 75% | 0.75 | S | S | * | * | G | 310 helix | trans | -2 | 72.5 | 160.2 | -74.2 | -177.8 | 177.5 | 178 | 0 | 116.7 | L497 | L497-K499 VanDerWaalsContact C-N 3.26Å; L497-K499 PolarHBondContact O-N 3.13Å |
| 500 | M | 25.6 | Very low | 26.6 | Very low | 166.5 Ų | 166.5 | 141.2 Ų | 141.2 | 82% | 0.82 | 75% | 0.747 | S | S | * | * | G | 310 helix | -139.9 | 59.9 | -97.1 | -118.5 | 179.7 | 126.8 | 0 | 0 | 111.7 | H498 | H498-M500 PolarHBondContact O-N 2.7Š| |
| 501 | T | 27.9 | Very low | 26.4 | Very low | 125 Ų | 125 | 141 Ų | 141 | 77% | 0.767 | 74% | 0.744 | S | S | * | * | trans | 129.7 | 108.6 | 158.3 | 61.8 | 0 | 0 | 0 | 0 | 117 | K503 | T501-K503 PolarHBondContact O-N 3.29Š| ||
| 502 | G | 28.3 | Very low | 26.2 | Very low | 77 Ų | 77 | 141.5 Ų | 141.5 | 79% | 0.794 | 76% | 0.755 | S | S | * | * | trans | -124.3 | 52.7 | 166.7 | 0 | 0 | 0 | 0 | 0 | 116.7 | ||||
| 503 | K | 25.3 | Very low | 26 | Very low | 164.5 Ų | 164.5 | 137.8 Ų | 137.8 | 72% | 0.715 | 76% | 0.756 | S | S | * | * | trans | -50.1 | 120.2 | 162.7 | -76.2 | -171.7 | -179.3 | -173.1 | 0 | 114.8 | T501 K505 | T501-K503 PolarHBondContact O-N 3.29Å; K503-K505 VanDerWaalsContact C-N 3.29Å; K503-K505 PolarHBondContact O-N 3.12Å | ||
| 504 | L | 25.3 | Very low | 25.8 | Very low | 143 Ų | 143 | 135.2 Ų | 135.2 | 75% | 0.749 | 75% | 0.753 | S | S | * | * | trans | -139.1 | 115.8 | 138 | -83.8 | 149.9 | 0 | 0 | 0 | 112.7 | D506 | L504-D506 PolarHBondContact O-N 2.62Š| ||
| 505 | K | 25.8 | Very low | 25.7 | Very low | 192 Ų | 192 | 135.7 Ų | 135.7 | 84% | 0.835 | 75% | 0.751 | S | S | * | * | trans | 12.7 | 111.7 | 152.6 | -110.3 | 174.7 | -179.2 | 178.9 | 0 | 113 | K503 K507 | K503-K505 VanDerWaalsContact C-N 3.29Å; K503-K505 PolarHBondContact O-N 3.12Å; K505-K507 PolarHBondContact O-N 2.96Å | ||
| 506 | D | 23.9 | Very low | 25.6 | Very low | 160 Ų | 160 | 131.6 Ų | 131.6 | 86% | 0.856 | 74% | 0.741 | S | S | * | * | trans | -45.4 | 99.3 | 159.2 | -72.3 | -45.5 | 0 | 0 | 0 | 112.8 | L504 S508 | L504-D506 PolarHBondContact O-N 2.62Å; D506-S508 PolarHBondContact O-N 3.21Å | ||
| 507 | K | 25.5 | Very low | 25.4 | Very low | 192 Ų | 192 | 132 Ų | 132 | 84% | 0.835 | 73% | 0.725 | S | S | * | * | trans | -112.8 | 101.9 | 145.8 | -94.9 | 179.7 | -179.6 | -175.9 | 0 | 106.5 | K505 I509 | K505-K507 PolarHBondContact O-N 2.96Å; K507-I509 PolarHBondContact O-N 3.49Å | ||
| 508 | S | 23.3 | Very low | 25.5 | Very low | 104.5 Ų | 104.5 | 129 Ų | 129 | 73% | 0.731 | 72% | 0.715 | S | S | * | * | trans | -34.3 | 121 | 163.9 | 0.4 | 0 | 0 | 0 | 0 | 110.2 | D506 T510 | D506-S508 PolarHBondContact O-N 3.21Å; S508-T510 PolarHBondContact O-N 3.45Å | ||
| 509 | I | 26.2 | Very low | 25.6 | Very low | 138.5 Ų | 138.5 | 124.5 Ų | 124.5 | 71% | 0.71 | 71% | 0.711 | S | S | * | * | trans | -107.6 | 98.4 | 156.1 | -71.1 | 146.3 | 0 | 0 | 0 | 105.8 | K507 V511 | K507-I509 PolarHBondContact O-N 3.49Å; I509-V511 HydrophobicContact CG2-CG2 3.71Å; I509-V511 PolarHBondContact O-N 3.32Å | ||
| 510 | T | 23.6 | Very low | 25.5 | Very low | 112 Ų | 112 | 119.4 Ų | 119.4 | 69% | 0.687 | 70% | 0.699 | S | S | * | * | trans | -17.4 | 93.6 | 145.1 | -41.2 | 0 | 0 | 0 | 0 | 111.1 | S508 C512 | S508-T510 PolarHBondContact O-N 3.45Å; T510-C512 PolarHBondContact O-N 3.05Å | ||
| 511 | V | 25.5 | Very low | 25.9 | Very low | 97.5 Ų | 97.5 | 115.9 Ų | 115.9 | 59% | 0.591 | 68% | 0.682 | S | S | * | * | trans | -68 | 128.1 | 161.2 | 176.4 | 0 | 0 | 0 | 0 | 107 | I509 S513 | I509-V511 HydrophobicContact CG2-CG2 3.71Å; I509-V511 PolarHBondContact O-N 3.32Å; V511-S513 PolarHBondContact O-N 3.43Å | ||
| 512 | C | 24.4 | Very low | 26 | Very low | 119.5 Ų | 119.5 | 112.8 Ų | 112.8 | 81% | 0.807 | 67% | 0.67 | S | S | * | * | S | Bend | trans | -81.6 | 96.9 | 177.5 | -65.4 | 0 | 0 | 0 | 0 | 112 | T510 G514 | T510-C512 PolarHBondContact O-N 3.05Å; C512-G514 PolarHBondContact O-N 2.75Å |
| 513 | S | 24.3 | Very low | 26.1 | Very low | 96 Ų | 96 | 111 Ų | 111 | 67% | 0.671 | 65% | 0.651 | S | S | * | * | trans | -85.5 | 81.8 | 178.3 | 54.9 | 0 | 0 | 0 | 0 | 112.5 | V511 L515 | V511-S513 PolarHBondContact O-N 3.43Å; S513-L515 PolarHBondContact O-N 2.97Å | ||
| 514 | G | 23.9 | Very low | 26.4 | Very low | 63.5 Ų | 63.5 | 110.3 Ų | 110.3 | 66% | 0.655 | 65% | 0.645 | S | S | * | * | trans | -127 | 68.5 | 173.4 | 0 | 0 | 0 | 0 | 0 | 115.1 | Q389 C512 | Q389-G514 PolarHBondContact NE2-O 2.86Å; C512-G514 PolarHBondContact O-N 2.75Å | ||
| 515 | L | 23.6 | Very low | 26.7 | Very low | 117 Ų | 117 | 107 Ų | 107 | 61% | 0.613 | 64% | 0.638 | S | S | * | * | trans | 133.6 | 83.9 | 156.5 | -66 | 169.4 | 0 | 0 | 0 | 116.1 | Q389 S513 | Q389-L515 PolarHBondContact NE2-O 3.18Å; S513-L515 PolarHBondContact O-N 2.97Å | ||
| 516 | S | 25 | Very low | 27.1 | Very low | 78.5 Ų | 78.5 | 103.6 Ų | 103.6 | 55% | 0.549 | 63% | 0.628 | S | S | . | * | trans | -126.5 | 122.2 | 151.9 | 65 | 0 | 0 | 0 | 0 | 111.4 | P518 | S516-P518 WeakPolarHBondContact O-CD 3.21Š| ||
| 517 | Y | 24.5 | Very low | 27.5 | Very low | 126.5 Ų | 126.5 | 101.5 Ų | 101.5 | 50% | 0.496 | 62% | 0.616 | S | S | . | * | trans | -81.9 | 140.1 | -178.4 | -94.2 | -93.5 | 0 | 0 | 0 | 111.6 | Q190 N222 S223 N226 G519 | Q190-Y517 HydrophobicContact CB-CD1 4.04Å; Q190-Y517 HydrophobicContact CB-CE1 3.58Å; Q190-Y517 HydrophobicContact CG-CD1 4.18Å; Q190-Y517 HydrophobicContact CG-CE1 3.25Å; Q190-Y517 PolarHBondContact NE2-OH 2.99Å; Q190-Y517 PolarHBondContact OE1-OH 3.21Å; N222-Y517 HydrophobicContact CB-CE2 3.83Å; N222-Y517 WeakPolarHBondContact CB-OH 3.23Å; N222-Y517 PolarHBondContact O-OH 3.28Å; N222-Y517 VanDerWaalsContact O-OH 3.09Å; S223-Y517 WeakPolarHBondContact CA-OH 3.32Å; S223-Y517 PolarHBondContact N-OH 3.47Å; S223-Y517 PolarHBondContact OG-OH 3.12Å; N226-Y517 HydrophobicContact CB-CD1 3.24Å; N226-Y517 HydrophobicContact CB-CE1 3.03Å; N226-Y517 HydrophobicContact CB-CG 4.21Å; N226-Y517 VanDerWaalsContact CG-CG 3.41Å; N226-Y517 WeakPolarHBondContact ND2-CD1 3.25Å; N226-Y517 WeakPolarHBondContact ND2-CD2 3.27Å; N226-Y517 WeakPolarHBondContact ND2-CE1 3.47Å; N226-Y517 WeakPolarHBondContact ND2-CE2 3.36Å; N226-Y517 VanDerWaalsContact OD1-CD1 3.25Å; N226-Y517 WeakPolarHBondContact OD1-CD1 3.24Å; Y517-G519 PolarHBondContact O-N 3.28Å; Y517-G519 VanDerWaalsContact O-N 3.1Å | ||
| 518 | P | 27.7 | Very low | 27.8 | Very low | 92.5 Ų | 92.5 | 97.4 Ų | 97.4 | 60% | 0.601 | 60% | 0.603 | S | S | * | * | trans | -75.9 | 104.1 | 176.6 | 32.2 | -30.6 | 0 | 0 | 0 | 108.6 | Y191 S516 | Y191-P518 HydrophobicContact CD1-CG 3.77Å; Y191-P518 HydrophobicContact CE1-CG 3.77Å; S516-P518 WeakPolarHBondContact O-CD 3.21Å | ||
| 519 | G | 27.5 | Very low | 28.2 | Very low | 63.5 Ų | 63.5 | 96.3 Ų | 96.3 | 66% | 0.655 | 60% | 0.595 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 166.4 | 40.8 | -178.7 | 0 | 0 | 0 | 0 | 0 | 113.2 | R433 Y517 I521 | R433-G519 PolarHBondContact NH2-O 3.06Å; Y517-G519 PolarHBondContact O-N 3.28Å; Y517-G519 VanDerWaalsContact O-N 3.1Å; G519-I521 PolarHBondContact O-N 2.95Å; G519-I521 VanDerWaalsContact O-N 3.15Å |
| 520 | S | 29.3 | Very low | 28.8 | Very low | 77 Ų | 77 | 94.2 Ų | 94.2 | 54% | 0.538 | 59% | 0.593 | S | S | . | * | S | Bend | trans | -77.8 | 131.3 | 173.6 | 178.1 | 0 | 0 | 0 | 0 | 112.3 | D392 A522 | D392-S520 PolarHBondContact OD1-OG 3.49Å; D392-S520 WeakPolarHBondContact OD2-CB 3.44Å; D392-S520 PolarHBondContact OD2-OG 3.02Å; S520-A522 PolarHBondContact O-N 3.48Å |
| 521 | I | 32.6 | Very low | 29.8 | Very low | 93 Ų | 93 | 91.7 Ų | 91.7 | 48% | 0.477 | 58% | 0.584 | S | S | . | * | S | Bend | trans | -98.6 | 50.5 | 165.9 | -65 | 174.8 | 0 | 0 | 0 | 110.1 | M429 Y432 R433 G519 G523 W543 | M429-I521 HydrophobicContact CE-CG2 3.66Å; M429-I521 WeakPolarHBondContact O-CD1 3.27Å; Y432-I521 HydrophobicContact CD1-CD1 3.96Å; Y432-I521 HydrophobicContact CD1-CG1 4.36Å; Y432-I521 HydrophobicContact CD1-CG2 4.46Å; R433-I521 HydrophobicContact CB-CD1 3.31Å; R433-I521 HydrophobicContact CG-CD1 3.56Å; R433-I521 HydrophobicContact CG-CG1 4.47Å; G519-I521 PolarHBondContact O-N 2.95Å; G519-I521 VanDerWaalsContact O-N 3.15Å; I521-G523 VanDerWaalsContact C-N 3.26Å; I521-G523 PolarHBondContact O-N 3.2Å; I521-W543 HydrophobicContact CG2-CH2 3.25Å; I521-W543 HydrophobicContact CG2-CZ2 3.69Å; I521-W543 HydrophobicContact CG2-CZ3 3.77Å |
| 522 | A | 31.1 | Very low | 31 | Very low | 61 Ų | 61 | 92.5 Ų | 92.5 | 50% | 0.504 | 58% | 0.581 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -74.1 | 72.8 | -178.2 | 0 | 0 | 0 | 0 | 0 | 112.5 | V388 S520 Y524 | V388-A522 HydrophobicContact CG1-CB 4.23Å; S520-A522 PolarHBondContact O-N 3.48Å; A522-Y524 PolarHBondContact O-N 3.43Å |
| 523 | G | 30.3 | Very low | 32.5 | Very low | 38 Ų | 38 | 91.9 Ų | 91.9 | 39% | 0.392 | 57% | 0.57 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -149.1 | 37.4 | 170.6 | 0 | 0 | 0 | 0 | 0 | 113.7 | N128 I521 | N128-G523 PolarHBondContact OD1-O 3.01Å; I521-G523 VanDerWaalsContact C-N 3.26Å; I521-G523 PolarHBondContact O-N 3.2Å |
| 524 | Y | 31.7 | Very low | 34.5 | Very low | 151.5 Ų | 151.5 | 89.8 Ų | 89.8 | 59% | 0.594 | 56% | 0.559 | S | S | * | * | trans | -164.4 | 67.7 | 166.8 | -80.3 | -77.2 | 0 | 0 | 0 | 110 | A522 I526 F542 W543 R546 | A522-Y524 PolarHBondContact O-N 3.43Å; Y524-I526 HydrophobicContact CD1-CD1 4.12Å; Y524-I526 PolarHBondContact O-N 3.37Å; Y524-F542 AromaticContact CD1-CE1 3.95Å; Y524-F542 HydrophobicContact CD1-CE1 3.95Å; Y524-F542 AromaticContact CD1-CZ 3.54Å; Y524-F542 HydrophobicContact CD1-CZ 3.54Å; Y524-F542 AromaticContact CE1-CZ 3.91Å; Y524-F542 HydrophobicContact CE1-CZ 3.91Å; Y524-F542 AromaticContact CG-CE1 3.98Å; Y524-F542 HydrophobicContact CG-CE1 3.98Å; Y524-F542 HydrophobicContact CG-CZ 4.03Å; Y524-W543 HydrophobicContact CD2-CH2 4.5Å; Y524-R546 VanDerWaalsContact CE1-NH2 3.35Å; Y524-R546 VanDerWaalsContact CZ-NH1 3.32Å; Y524-R546 PolarHBondContact OH-NH2 3.04Å | ||
| 525 | A | 32 | Very low | 36.7 | Very low | 74 Ų | 74 | 90 Ų | 90 | 61% | 0.612 | 55% | 0.547 | S | S | * | . | trans | -102 | 87.6 | 171.1 | 0 | 0 | 0 | 0 | 0 | 109.6 | V388 | V388-A525 HydrophobicContact CG1-CB 4.38Å; V388-A525 HydrophobicContact CG2-CB 3.76Å | ||
| 526 | I | 33.3 | Very low | 39.2 | Very low | 119 Ų | 119 | 84.6 Ų | 84.6 | 61% | 0.61 | 52% | 0.519 | S | S | * | . | trans | -98.1 | 121.9 | 171.3 | -58.2 | 176.1 | 0 | 0 | 0 | 108.1 | Y524 L528 | Y524-I526 HydrophobicContact CD1-CD1 4.12Å; Y524-I526 PolarHBondContact O-N 3.37Å; I526-L528 PolarHBondContact O-N 3.46Å | ||
| 527 | N | 31.5 | Very low | 42.1 | Very low | 115.5 Ų | 115.5 | 81.5 Ų | 81.5 | 62% | 0.618 | 50% | 0.497 | S | S | * | . | trans | 0.5 | 97.1 | 170.9 | -69.8 | -33.2 | 0 | 0 | 0 | 116.7 | S529 S530 | N527-S529 VanDerWaalsContact C-N 3.26Å; N527-S529 PolarHBondContact O-N 2.82Å; N527-S530 PolarHBondContact O-OG 3.47Å; N527-S530 VanDerWaalsContact O-OG 3.12Å | ||
| 528 | L | 32 | Very low | 45 | Very low | 106 Ų | 106 | 80 Ų | 80 | 56% | 0.555 | 49% | 0.491 | S | S | * | . | trans | -91 | 46.8 | 172.6 | -81.1 | 152 | 0 | 0 | 0 | 112 | L385 I526 S530 A531 T535 | L385-L528 HydrophobicContact CD2-CD1 3.61Å; I526-L528 PolarHBondContact O-N 3.46Å; L528-S530 VanDerWaalsContact C-N 3.33Å; L528-S530 PolarHBondContact O-N 3.32Å; L528-A531 PolarHBondContact O-N 3.09Å; L528-T535 HydrophobicContact CD2-CG2 4.2Å; L528-T535 WeakPolarHBondContact CD2-OG1 3.45Å | ||
| 529 | S | 32 | Very low | 47.8 | Very low | 81.5 Ų | 81.5 | 78.4 Ų | 78.4 | 57% | 0.57 | 48% | 0.475 | S | S | * | . | H | α-helix | trans | -104.2 | 47.2 | 170.2 | 55.8 | 0 | 0 | 0 | 0 | 113 | N527 A531 D533 | N527-S529 VanDerWaalsContact C-N 3.26Å; N527-S529 PolarHBondContact O-N 2.82Å; S529-A531 VanDerWaalsContact C-N 3.32Å; S529-A531 PolarHBondContact O-N 3.44Å; S529-A531 VanDerWaalsContact O-N 3.15Å; S529-D533 PolarHBondContact O-N 3.44Å |
| 530 | S | 40 | Very low | 50.8 | Low | 94.5 Ų | 94.5 | 75.5 Ų | 75.5 | 66% | 0.661 | 44% | 0.444 | S | S | * | . | H | α-helix | trans | -2 | -16.9 | 176.2 | 66.8 | 0 | 0 | 0 | 0 | 117.3 | N527 L528 E532 A534 | N527-S530 PolarHBondContact O-OG 3.47Å; N527-S530 VanDerWaalsContact O-OG 3.12Å; L528-S530 VanDerWaalsContact C-N 3.33Å; L528-S530 PolarHBondContact O-N 3.32Å; S530-E532 PolarHBondContact N-OE1 3.45Å; S530-A534 PolarHBondContact O-N 2.86Å |
| 531 | A | 43.1 | Very low | 53.8 | Low | 59.5 Ų | 59.5 | 71.8 Ų | 71.8 | 49% | 0.492 | 42% | 0.419 | S | S | . | . | trans | -89.6 | 1.5 | 174.6 | 0 | 0 | 0 | 0 | 0 | 112.1 | L528 S529 D533 A534 T535 | L528-A531 PolarHBondContact O-N 3.09Å; S529-A531 VanDerWaalsContact C-N 3.32Å; S529-A531 PolarHBondContact O-N 3.44Å; S529-A531 VanDerWaalsContact O-N 3.15Å; A531-D533 PolarHBondContact O-N 2.99Å; A531-A534 PolarHBondContact O-N 3.49Å; A531-T535 HydrophobicContact CB-CG2 4.31Å; A531-T535 WeakPolarHBondContact O-CG2 3.3Å; A531-T535 PolarHBondContact O-N 3.15Å; A531-T535 PolarHBondContact O-OG1 3.38Å | ||
| 532 | E | 51.8 | Low | 56.7 | Low | 116 Ų | 116 | 69.1 Ų | 69.1 | 54% | 0.542 | 40% | 0.404 | S | S | . | . | H | α-helix | trans | -72 | -35.1 | -162.7 | -68.6 | 176.6 | 176.2 | 0 | 0 | 114.2 | S530 A534 T535 S536 | S530-E532 PolarHBondContact N-OE1 3.45Å; E532-A534 VanDerWaalsContact C-N 3.32Å; E532-A534 PolarHBondContact O-N 2.84Å; E532-T535 PolarHBondContact O-N 2.87Å; E532-T535 PolarHBondContact O-OG1 3.12Å; E532-S536 PolarHBondContact O-N 2.97Å; E532-S536 PolarHBondContact O-OG 3.11Å; E532-S536 VanDerWaalsContact O-OG 3.04Å |
| 533 | D | 56 | Low | 59.7 | Low | 106 Ų | 106 | 67.2 Ų | 67.2 | 57% | 0.567 | 38% | 0.384 | S | S | * | . | H | α-helix | trans | -75.4 | -35.7 | 178.5 | -74.4 | -23.7 | 0 | 0 | 0 | 113 | S529 A531 S536 S537 | S529-D533 PolarHBondContact O-N 3.44Å; A531-D533 PolarHBondContact O-N 2.99Å; D533-S536 PolarHBondContact O-N 3.18Å; D533-S536 PolarHBondContact O-OG 3.39Å; D533-S536 VanDerWaalsContact O-OG 3.11Å; D533-S537 WeakPolarHBondContact O-CB 3.42Å; D533-S537 PolarHBondContact O-N 3.41Å; D533-S537 PolarHBondContact O-OG 3.08Å |
| 534 | A | 65.2 | Low | 62.7 | Low | 52.5 Ų | 52.5 | 65.4 Ų | 65.4 | 43% | 0.434 | 37% | 0.365 | S | S | . | . | H | α-helix | trans | -69.2 | -39.5 | 177.9 | 0 | 0 | 0 | 0 | 0 | 111.9 | S530 A531 E532 S537 R538 | S530-A534 PolarHBondContact O-N 2.86Å; A531-A534 PolarHBondContact O-N 3.49Å; E532-A534 VanDerWaalsContact C-N 3.32Å; E532-A534 PolarHBondContact O-N 2.84Å; A534-S537 PolarHBondContact O-N 2.89Å; A534-R538 WeakPolarHBondContact O-CB 3.37Å; A534-R538 VanDerWaalsContact O-CG 3.31Å; A534-R538 WeakPolarHBondContact O-CG 3.35Å; A534-R538 PolarHBondContact O-N 3.17Å; A534-R538 VanDerWaalsContact O-N 3.1Å |
| 535 | T | 71.1 | Confident | 65.8 | Low | 68 Ų | 68 | 58.2 Ų | 58.2 | 42% | 0.417 | 34% | 0.337 | S | S | . | . | H | α-helix | trans | -68 | -41.1 | 177.9 | 51.9 | 0 | 0 | 0 | 0 | 112.2 | L528 A531 E532 R538 Q539 | L528-T535 HydrophobicContact CD2-CG2 4.2Å; L528-T535 WeakPolarHBondContact CD2-OG1 3.45Å; A531-T535 HydrophobicContact CB-CG2 4.31Å; A531-T535 WeakPolarHBondContact O-CG2 3.3Å; A531-T535 PolarHBondContact O-N 3.15Å; A531-T535 PolarHBondContact O-OG1 3.38Å; E532-T535 PolarHBondContact O-N 2.87Å; E532-T535 PolarHBondContact O-OG1 3.12Å; T535-R538 WeakPolarHBondContact O-CB 3.47Å; T535-R538 PolarHBondContact O-N 3.16Å; T535-Q539 PolarHBondContact O-N 3.23Å |
| 536 | S | 76.6 | Confident | 68.7 | Low | 2 Ų | 2 | 56.9 Ų | 56.9 | 1% | 0.014 | 32% | 0.316 | C | S | . | . | H | α-helix | trans | -67.4 | -37.9 | 176.5 | 0.1 | 0 | 0 | 0 | 0 | 112.4 | E532 D533 Q539 L540 | E532-S536 PolarHBondContact O-N 2.97Å; E532-S536 PolarHBondContact O-OG 3.11Å; E532-S536 VanDerWaalsContact O-OG 3.04Å; D533-S536 PolarHBondContact O-N 3.18Å; D533-S536 PolarHBondContact O-OG 3.39Å; D533-S536 VanDerWaalsContact O-OG 3.11Å; S536-Q539 PolarHBondContact O-N 3.32Å; S536-L540 PolarHBondContact O-N 2.84Å |
| 537 | S | 84.4 | Confident | 71.6 | Confident | 13 Ų | 13 | 51.2 Ų | 51.2 | 9% | 0.091 | 29% | 0.287 | C | S | . | . | H | α-helix | trans | -64.6 | -39.8 | 173.5 | -59.5 | 0 | 0 | 0 | 0 | 112.3 | I421 T463 D533 A534 Q539 L540 L541 | I421-S537 WeakPolarHBondContact CD1-OG 3.47Å; T463-S537 VanDerWaalsContact CG2-O 3.31Å; T463-S537 WeakPolarHBondContact CG2-O 3.26Å; D533-S537 WeakPolarHBondContact O-CB 3.42Å; D533-S537 PolarHBondContact O-N 3.41Å; D533-S537 PolarHBondContact O-OG 3.08Å; A534-S537 PolarHBondContact O-N 2.89Å; S537-Q539 VanDerWaalsContact C-N 3.34Å; S537-Q539 PolarHBondContact O-N 3.47Å; S537-L540 PolarHBondContact O-N 3.11Å; S537-L541 PolarHBondContact O-N 3.19Å |
| 538 | R | 85.5 | Confident | 74.6 | Confident | 95.5 Ų | 95.5 | 45.7 Ų | 45.7 | 36% | 0.36 | 26% | 0.258 | S | S | . | . | H | α-helix | trans | -62.5 | -41.5 | 173.8 | -118.2 | -179.5 | -153.5 | 172.7 | 1.3 | 111.7 | V467 A534 T535 L541 F542 E598 M599 L602 | V467-R538 HydrophobicContact CG1-CG 3.92Å; V467-R538 HydrophobicContact CG2-CG 4.15Å; A534-R538 WeakPolarHBondContact O-CB 3.37Å; A534-R538 VanDerWaalsContact O-CG 3.31Å; A534-R538 WeakPolarHBondContact O-CG 3.35Å; A534-R538 PolarHBondContact O-N 3.17Å; A534-R538 VanDerWaalsContact O-N 3.1Å; T535-R538 WeakPolarHBondContact O-CB 3.47Å; T535-R538 PolarHBondContact O-N 3.16Å; R538-L541 PolarHBondContact O-N 3.05Å; R538-F542 WeakPolarHBondContact O-CB 3.28Å; R538-F542 PolarHBondContact O-N 3.21Å; R538-E598 PolarHBondContact NH2-O 3.3Å; R538-E598 VanDerWaalsContact NH2-O 3.11Å; R538-M599 HydrophobicContact CG-CE 4.43Å; R538-M599 HydrophobicContact CG-SD 4Å; R538-M599 VanDerWaalsContact CZ-CE 3.45Å; R538-M599 PolarHBondContact NE-SD 2.93Å; R538-M599 VanDerWaalsContact NH2-CE 3.32Å; R538-M599 PolarHBondContact NH2-SD 3.41Å; R538-L602 HydrophobicContact CB-CD1 4.49Å; R538-L602 HydrophobicContact CG-CD1 3.99Å; R538-L602 HydrophobicContact CG-CG 4.47Å |
| 539 | Q | 86.2 | Confident | 77.6 | Confident | 59 Ų | 59 | 42.1 Ų | 42.1 | 28% | 0.276 | 24% | 0.241 | S | C | . | . | H | α-helix | trans | -64.7 | -41.7 | 176 | -171.6 | -178.7 | 15.7 | 0 | 0 | 111.7 | L425 T535 S536 S537 L541 F542 W543 | L425-Q539 HydrophobicContact CD2-CB 4.41Å; L425-Q539 HydrophobicContact CD2-CG 4.03Å; T535-Q539 PolarHBondContact O-N 3.23Å; S536-Q539 PolarHBondContact O-N 3.32Å; S537-Q539 VanDerWaalsContact C-N 3.34Å; S537-Q539 PolarHBondContact O-N 3.47Å; Q539-L541 VanDerWaalsContact C-N 3.35Å; Q539-F542 WeakPolarHBondContact O-CB 3.43Å; Q539-F542 PolarHBondContact O-N 3.07Å; Q539-W543 VanDerWaalsContact O-CD1 3.25Å; Q539-W543 PolarHBondContact O-N 3.2Å; Q539-W543 VanDerWaalsContact O-N 3.09Å |
| 540 | L | 91 | Very high | 80.4 | Confident | 2 Ų | 2 | 41.8 Ų | 41.8 | 1% | 0.01 | 23% | 0.232 | C | C | . | . | H | α-helix | trans | -60.7 | -46.4 | 175.5 | 177.7 | 59.7 | 0 | 0 | 0 | 111 | I421 R424 L425 V428 T463 S536 S537 F542 W543 L544 | I421-L540 HydrophobicContact CG2-CB 4.42Å; I421-L540 HydrophobicContact CG2-CD2 4.36Å; R424-L540 HydrophobicContact CB-CD1 3.97Å; R424-L540 HydrophobicContact CB-CD2 3.79Å; L425-L540 HydrophobicContact CD2-CB 4.01Å; L425-L540 HydrophobicContact CD2-CD1 4.2Å; L425-L540 HydrophobicContact CG-CB 4.21Å; L425-L540 HydrophobicContact CG-CD1 4.24Å; V428-L540 HydrophobicContact CB-CD1 4.4Å; V428-L540 HydrophobicContact CG2-CD1 3.89Å; T463-L540 HydrophobicContact CG2-CB 4.1Å; T463-L540 HydrophobicContact CG2-CD2 3.95Å; T463-L540 HydrophobicContact CG2-CG 4Å; T463-L540 WeakPolarHBondContact OG1-CD2 3.32Å; S536-L540 PolarHBondContact O-N 2.84Å; S537-L540 PolarHBondContact O-N 3.11Å; L540-F542 VanDerWaalsContact C-N 3.34Å; L540-F542 PolarHBondContact O-N 3.15Å; L540-W543 PolarHBondContact O-N 3.3Å; L540-L544 HydrophobicContact CD1-CD1 4.22Å; L540-L544 HydrophobicContact CD1-CG 4.4Å; L540-L544 HydrophobicContact CG-CD1 3.96Å; L540-L544 WeakPolarHBondContact O-CG 3.42Å; L540-L544 PolarHBondContact O-N 3.45Å |
| 541 | L | 93.2 | Very high | 83 | Confident | 0 Ų | 0 | 38.8 Ų | 38.8 | 0% | 0 | 21% | 0.208 | C | C | . | . | H | α-helix | trans | -61.2 | -43.4 | 177.4 | -172.1 | 57.5 | 0 | 0 | 0 | 112 | F460 T463 L464 V467 S537 R538 Q539 W543 L544 I545 L592 L602 | F460-L541 HydrophobicContact CD2-CD1 3.82Å; F460-L541 HydrophobicContact CE2-CD1 3.71Å; T463-L541 HydrophobicContact CG2-CB 3.94Å; L464-L541 HydrophobicContact CB-CD1 4.35Å; L464-L541 HydrophobicContact CD1-CD2 4.04Å; V467-L541 HydrophobicContact CB-CD2 3.99Å; V467-L541 HydrophobicContact CG1-CD2 4.03Å; V467-L541 HydrophobicContact CG2-CB 4.4Å; V467-L541 HydrophobicContact CG2-CD2 3.99Å; S537-L541 PolarHBondContact O-N 3.19Å; R538-L541 PolarHBondContact O-N 3.05Å; Q539-L541 VanDerWaalsContact C-N 3.35Å; L541-W543 VanDerWaalsContact C-N 3.33Å; L541-W543 PolarHBondContact O-N 3.17Å; L541-L544 PolarHBondContact O-N 3.13Å; L541-I545 HydrophobicContact CD1-CD1 4.31Å; L541-I545 HydrophobicContact CD1-CG1 4.45Å; L541-I545 HydrophobicContact CG-CD1 4.05Å; L541-I545 VanDerWaalsContact O-CG1 3.27Å; L541-I545 WeakPolarHBondContact O-CG1 3.36Å; L541-I545 PolarHBondContact O-N 3.46Å; L541-L592 HydrophobicContact CD2-CD1 4.07Å; L541-L592 HydrophobicContact CD2-CD2 4.1Å; L541-L592 HydrophobicContact CG-CD1 4.45Å; L541-L602 HydrophobicContact CB-CD2 4.39Å; L541-L602 HydrophobicContact CD2-CD1 4.14Å; L541-L602 HydrophobicContact CG-CD2 4.36Å |
| 542 | F | 92.7 | Very high | 85.3 | Confident | 37 Ų | 37 | 36.5 Ų | 36.5 | 16% | 0.162 | 19% | 0.188 | C | C | . | . | H | α-helix | trans | -55.5 | -48.5 | 175.3 | 176.7 | -91 | 0 | 0 | 0 | 111.9 | Y524 R538 Q539 L540 L544 I545 R546 L602 E605 | Y524-F542 AromaticContact CD1-CE1 3.95Å; Y524-F542 HydrophobicContact CD1-CE1 3.95Å; Y524-F542 AromaticContact CD1-CZ 3.54Å; Y524-F542 HydrophobicContact CD1-CZ 3.54Å; Y524-F542 AromaticContact CE1-CZ 3.91Å; Y524-F542 HydrophobicContact CE1-CZ 3.91Å; Y524-F542 AromaticContact CG-CE1 3.98Å; Y524-F542 HydrophobicContact CG-CE1 3.98Å; Y524-F542 HydrophobicContact CG-CZ 4.03Å; R538-F542 WeakPolarHBondContact O-CB 3.28Å; R538-F542 PolarHBondContact O-N 3.21Å; Q539-F542 WeakPolarHBondContact O-CB 3.43Å; Q539-F542 PolarHBondContact O-N 3.07Å; L540-F542 VanDerWaalsContact C-N 3.34Å; L540-F542 PolarHBondContact O-N 3.15Å; F542-L544 PolarHBondContact O-N 3.49Å; F542-I545 PolarHBondContact O-N 2.9Å; F542-R546 HydrophobicContact CD1-CG 4.23Å; F542-R546 HydrophobicContact CE1-CG 4.1Å; F542-R546 HydrophobicContact CZ-CG 4.04Å; F542-R546 WeakPolarHBondContact O-CB 3.35Å; F542-R546 WeakPolarHBondContact O-CG 3.23Å; F542-R546 PolarHBondContact O-N 3.16Å; F542-L602 HydrophobicContact CB-CD2 3.77Å; F542-L602 HydrophobicContact CD2-CD2 4.32Å; F542-E605 HydrophobicContact CD2-CG 3.86Å; F542-E605 HydrophobicContact CE2-CG 3.51Å; F542-E605 VanDerWaalsContact CE2-CG 3.45Å; F542-E605 HydrophobicContact CZ-CG 4.37Å |
| 543 | W | 93.1 | Very high | 87.1 | Confident | 20.5 Ų | 20.5 | 35.2 Ų | 35.2 | 8% | 0.078 | 18% | 0.18 | C | C | . | . | H | α-helix | trans | -70.6 | -30.8 | 179.9 | -76.7 | 112.3 | 0 | 0 | 0 | 113.4 | V428 M429 Y432 I521 Y524 Q539 L540 L541 R546 L547 | V428-W543 VanDerWaalsContact CG1-C 3.43Å; V428-W543 HydrophobicContact CG1-CB 3.77Å; V428-W543 WeakPolarHBondContact CG1-O 3.32Å; M429-W543 HydrophobicContact CE-CD2 4.46Å; M429-W543 HydrophobicContact CE-CH2 4.44Å; M429-W543 HydrophobicContact CE-CZ2 3.84Å; M429-W543 HydrophobicContact CG-CB 4.31Å; M429-W543 HydrophobicContact CG-CD2 3.85Å; M429-W543 HydrophobicContact CG-CE3 4.36Å; M429-W543 HydrophobicContact CG-CG 3.76Å; M429-W543 HydrophobicContact SD-CD2 4.42Å; M429-W543 HydrophobicContact SD-CG 4.41Å; Y432-W543 HydrophobicContact CD1-CE3 4.41Å; Y432-W543 AromaticContact CD1-CZ3 3.82Å; Y432-W543 HydrophobicContact CD1-CZ3 3.82Å; Y432-W543 HydrophobicContact CD2-CE3 4.4Å; Y432-W543 HydrophobicContact CD2-CZ3 4.33Å; Y432-W543 AromaticContact CE1-CZ3 3.85Å; Y432-W543 HydrophobicContact CE1-CZ3 3.85Å; Y432-W543 HydrophobicContact CE2-CZ3 4.33Å; Y432-W543 HydrophobicContact CG-CE3 4.24Å; Y432-W543 HydrophobicContact CG-CZ3 4.08Å; I521-W543 HydrophobicContact CG2-CH2 3.25Å; I521-W543 HydrophobicContact CG2-CZ2 3.69Å; I521-W543 HydrophobicContact CG2-CZ3 3.77Å; Y524-W543 HydrophobicContact CD2-CH2 4.5Å; Q539-W543 VanDerWaalsContact O-CD1 3.25Å; Q539-W543 PolarHBondContact O-N 3.2Å; Q539-W543 VanDerWaalsContact O-N 3.09Å; L540-W543 PolarHBondContact O-N 3.3Å; L541-W543 VanDerWaalsContact C-N 3.33Å; L541-W543 PolarHBondContact O-N 3.17Å; W543-R546 HydrophobicContact CE3-CB 4.31Å; W543-R546 PolarHBondContact O-N 3.39Å; W543-L547 WeakPolarHBondContact O-CB 3.36Å; W543-L547 PolarHBondContact O-N 2.92Å |
| 544 | L | 95.3 | Very high | 88.8 | Confident | 0 Ų | 0 | 30.2 Ų | 30.2 | 0% | 0 | 15% | 0.153 | C | C | . | . | H | α-helix | trans | -64 | -46 | 173.2 | -77.5 | 162 | 0 | 0 | 0 | 111.1 | V428 I459 F460 L540 L541 F542 R546 L547 M548 F555 | V428-L544 HydrophobicContact CB-CD2 4.45Å; V428-L544 HydrophobicContact CG1-CD2 4.04Å; V428-L544 HydrophobicContact CG1-CG 4.06Å; V428-L544 HydrophobicContact CG2-CD2 3.47Å; V428-L544 VanDerWaalsContact CG2-CD2 3.47Å; V428-L544 HydrophobicContact CG2-CG 3.91Å; I459-L544 HydrophobicContact CG2-CD1 4.03Å; I459-L544 HydrophobicContact CG2-CD2 4.41Å; F460-L544 HydrophobicContact CB-CD1 4.47Å; F460-L544 HydrophobicContact CD2-CB 4.34Å; L540-L544 HydrophobicContact CD1-CD1 4.22Å; L540-L544 HydrophobicContact CD1-CG 4.4Å; L540-L544 HydrophobicContact CG-CD1 3.96Å; L540-L544 WeakPolarHBondContact O-CG 3.42Å; L540-L544 PolarHBondContact O-N 3.45Å; L541-L544 PolarHBondContact O-N 3.13Å; F542-L544 PolarHBondContact O-N 3.49Å; L544-R546 VanDerWaalsContact C-N 3.34Å; L544-R546 PolarHBondContact O-N 2.95Å; L544-L547 PolarHBondContact O-N 3.31Å; L544-M548 WeakPolarHBondContact O-CB 3.38Å; L544-M548 PolarHBondContact O-N 3.17Å; L544-F555 HydrophobicContact CD2-CE1 4.33Å; L544-F555 HydrophobicContact CD2-CZ 4.22Å |
| 545 | I | 95.5 | Very high | 90 | Very high | 0 Ų | 0 | 27.7 Ų | 27.7 | 0% | 0 | 13% | 0.132 | C | C | . | . | H | α-helix | trans | -63.4 | -43 | 177.1 | -63.4 | 168.8 | 0 | 0 | 0 | 110.1 | F460 L541 F542 L547 M548 C549 L589 L592 L602 E605 A609 | F460-I545 HydrophobicContact CE2-CG1 4.17Å; L541-I545 HydrophobicContact CD1-CD1 4.31Å; L541-I545 HydrophobicContact CD1-CG1 4.45Å; L541-I545 HydrophobicContact CG-CD1 4.05Å; L541-I545 VanDerWaalsContact O-CG1 3.27Å; L541-I545 WeakPolarHBondContact O-CG1 3.36Å; L541-I545 PolarHBondContact O-N 3.46Å; F542-I545 PolarHBondContact O-N 2.9Å; I545-L547 VanDerWaalsContact C-N 3.34Å; I545-L547 PolarHBondContact O-N 3.27Å; I545-M548 VanDerWaalsContact O-CB 3.29Å; I545-M548 WeakPolarHBondContact O-CB 3.29Å; I545-M548 PolarHBondContact O-N 2.92Å; I545-M548 VanDerWaalsContact O-N 3.17Å; I545-C549 PolarHBondContact O-N 3.36Å; I545-C549 PolarHBondContact O-SG 3.37Å; I545-C549 VanDerWaalsContact O-SG 3.32Å; I545-L589 HydrophobicContact CD1-CD2 4.28Å; I545-L589 HydrophobicContact CG1-CD2 3.97Å; I545-L589 HydrophobicContact CG2-CD2 4.38Å; I545-L592 HydrophobicContact CD1-CD1 3.57Å; I545-L602 HydrophobicContact CD1-CD2 4.16Å; I545-E605 HydrophobicContact CB-CB 4.36Å; I545-E605 VanDerWaalsContact CG2-C 3.46Å; I545-E605 HydrophobicContact CG2-CB 3.73Å; I545-E605 VanDerWaalsContact CG2-O 3.28Å; I545-E605 WeakPolarHBondContact CG2-O 3.42Å; I545-A609 HydrophobicContact CG2-CB 3.65Å |
| 546 | R | 93 | Very high | 90.7 | Very high | 47.5 Ų | 47.5 | 24.7 Ų | 24.7 | 18% | 0.179 | 11% | 0.114 | C | C | . | . | H | α-helix | trans | -62.1 | -41.2 | 174.7 | -81 | -121.4 | 175.9 | -173.3 | -5.8 | 113.6 | Y432 Y524 F542 W543 L544 M548 C549 I550 E605 | Y432-R546 HydrophobicContact CD2-CB 4.29Å; Y432-R546 HydrophobicContact CE2-CB 4.08Å; Y524-R546 VanDerWaalsContact CE1-NH2 3.35Å; Y524-R546 VanDerWaalsContact CZ-NH1 3.32Å; Y524-R546 PolarHBondContact OH-NH2 3.04Å; F542-R546 HydrophobicContact CD1-CG 4.23Å; F542-R546 HydrophobicContact CE1-CG 4.1Å; F542-R546 HydrophobicContact CZ-CG 4.04Å; F542-R546 WeakPolarHBondContact O-CB 3.35Å; F542-R546 WeakPolarHBondContact O-CG 3.23Å; F542-R546 PolarHBondContact O-N 3.16Å; W543-R546 HydrophobicContact CE3-CB 4.31Å; W543-R546 PolarHBondContact O-N 3.39Å; L544-R546 VanDerWaalsContact C-N 3.34Å; L544-R546 PolarHBondContact O-N 2.95Å; R546-M548 VanDerWaalsContact C-N 3.33Å; R546-M548 PolarHBondContact O-N 3.13Å; R546-C549 WeakPolarHBondContact O-CB 3.46Å; R546-C549 PolarHBondContact O-N 3.28Å; R546-I550 WeakPolarHBondContact O-CG1 3.28Å; R546-I550 PolarHBondContact O-N 3.25Å; R546-I550 VanDerWaalsContact O-N 3.12Å; R546-E605 VanDerWaalsContact CD-OE2 3.26Å; R546-E605 WeakPolarHBondContact CD-OE2 3.3Å; R546-E605 WeakPolarHBondContact CG-OE2 3.38Å; R546-E605 IonicContact CZ-OE1 3.09Å; R546-E605 IonicContact CZ-OE2 3.66Å; R546-E605 VanDerWaalsContact CZ-OE2 3.23Å; R546-E605 IonicContact NE-OE1 3.05Å; R546-E605 PolarHBondContact NE-OE1 3.3Å; R546-E605 IonicContact NE-OE2 2.84Å; R546-E605 PolarHBondContact NE-OE2 3.2Å; R546-E605 IonicContact NH1-OE2 3.52Å; R546-E605 IonicContact NH2-OE1 2.69Å; R546-E605 PolarHBondContact NH2-OE1 3.16Å; R546-E605 IonicContact NH2-OE2 3.51Å |
| 547 | L | 94.7 | Very high | 90.4 | Very high | 0 Ų | 0 | 27.8 Ų | 27.8 | 0% | 0 | 13% | 0.125 | C | C | . | . | H | α-helix | trans | -62 | -40.3 | 174.8 | 179.9 | 59.9 | 0 | 0 | 0 | 110.6 | V428 L431 W543 L544 I545 C549 I550 E551 L554 F555 | V428-L547 HydrophobicContact CG1-CB 4.27Å; V428-L547 HydrophobicContact CG1-CD2 4.08Å; L431-L547 HydrophobicContact CB-CD1 4.08Å; L431-L547 HydrophobicContact CB-CD2 3.79Å; L431-L547 HydrophobicContact CD1-CD2 4.11Å; W543-L547 WeakPolarHBondContact O-CB 3.36Å; W543-L547 PolarHBondContact O-N 2.92Å; L544-L547 PolarHBondContact O-N 3.31Å; I545-L547 VanDerWaalsContact C-N 3.34Å; I545-L547 PolarHBondContact O-N 3.27Å; L547-C549 VanDerWaalsContact C-N 3.32Å; L547-C549 PolarHBondContact O-N 3.32Å; L547-I550 PolarHBondContact O-N 3.39Å; L547-I550 VanDerWaalsContact O-N 3.12Å; L547-E551 HydrophobicContact CD1-CB 4.43Å; L547-E551 PolarHBondContact O-N 3.28Å; L547-L554 HydrophobicContact CD1-CD1 4Å; L547-L554 HydrophobicContact CD2-CD1 4.1Å; L547-L554 HydrophobicContact CG-CD1 4.06Å; L547-F555 HydrophobicContact CB-CE2 4.36Å; L547-F555 HydrophobicContact CB-CZ 4.44Å; L547-F555 HydrophobicContact CD2-CE2 4.38Å; L547-F555 HydrophobicContact CD2-CZ 4.37Å; L547-F555 HydrophobicContact CG-CE2 4.08Å; L547-F555 HydrophobicContact CG-CZ 4.37Å |
| 548 | M | 94.6 | Very high | 89 | Confident | 0 Ų | 0 | 29.2 Ų | 29.2 | 0% | 0 | 13% | 0.134 | C | C | . | . | H | α-helix | trans | -62.2 | -39.1 | 175.7 | -169.3 | -173.4 | -62.5 | 0 | 0 | 112.5 | F460 L544 I545 R546 I550 P552 F555 V585 L589 A609 L613 | F460-M548 HydrophobicContact CD2-CE 4.33Å; F460-M548 HydrophobicContact CE2-CE 4.24Å; F460-M548 HydrophobicContact CZ-CE 4.47Å; L544-M548 WeakPolarHBondContact O-CB 3.38Å; L544-M548 PolarHBondContact O-N 3.17Å; I545-M548 VanDerWaalsContact O-CB 3.29Å; I545-M548 WeakPolarHBondContact O-CB 3.29Å; I545-M548 PolarHBondContact O-N 2.92Å; I545-M548 VanDerWaalsContact O-N 3.17Å; R546-M548 VanDerWaalsContact C-N 3.33Å; R546-M548 PolarHBondContact O-N 3.13Å; M548-I550 VanDerWaalsContact C-N 3.31Å; M548-I550 PolarHBondContact O-N 3.14Å; M548-P552 VanDerWaalsContact O-CA 3.25Å; M548-P552 WeakPolarHBondContact O-CA 3.42Å; M548-P552 WeakPolarHBondContact O-CB 3.25Å; M548-P552 WeakPolarHBondContact O-CD 3.47Å; M548-F555 VanDerWaalsContact CA-CE2 3.47Å; M548-F555 HydrophobicContact CB-CD2 3.61Å; M548-F555 HydrophobicContact CB-CE2 3.63Å; M548-F555 HydrophobicContact CB-CG 4.24Å; M548-F555 HydrophobicContact CB-CZ 4.26Å; M548-F555 HydrophobicContact CE-CB 4.17Å; M548-F555 HydrophobicContact CE-CD1 3.63Å; M548-F555 HydrophobicContact CE-CD2 4.25Å; M548-F555 HydrophobicContact CE-CE1 4.02Å; M548-F555 HydrophobicContact CE-CG 3.75Å; M548-F555 HydrophobicContact CE-CZ 4.48Å; M548-F555 HydrophobicContact CG-CB 4.15Å; M548-F555 HydrophobicContact CG-CD2 3.64Å; M548-F555 HydrophobicContact CG-CE2 4.2Å; M548-F555 HydrophobicContact CG-CG 3.92Å; M548-V585 HydrophobicContact CE-CG1 3.49Å; M548-V585 VanDerWaalsContact CE-CG1 3.47Å; M548-V585 HydrophobicContact SD-CG1 3.84Å; M548-L589 HydrophobicContact SD-CD1 3.79Å; M548-L589 HydrophobicContact SD-CD2 4.47Å; M548-A609 HydrophobicContact SD-CB 4.14Å; M548-L613 HydrophobicContact CG-CD2 4.12Å; M548-L613 HydrophobicContact CG-CG 4.38Å; M548-L613 HydrophobicContact SD-CD1 3.78Å; M548-L613 HydrophobicContact SD-CD2 4.38Å; M548-L613 HydrophobicContact SD-CG 4.27Å |
| 549 | C | 93.8 | Very high | 87.2 | Confident | 29.5 Ų | 29.5 | 27.4 Ų | 27.4 | 20% | 0.199 | 14% | 0.139 | C | C | . | . | H | α-helix | trans | -64.1 | -34.2 | 175.1 | -64.8 | 0 | 0 | 0 | 0 | 113.1 | I545 R546 L547 A609 C612 | I545-C549 PolarHBondContact O-N 3.36Å; I545-C549 PolarHBondContact O-SG 3.37Å; I545-C549 VanDerWaalsContact O-SG 3.32Å; R546-C549 WeakPolarHBondContact O-CB 3.46Å; R546-C549 PolarHBondContact O-N 3.28Å; L547-C549 VanDerWaalsContact C-N 3.32Å; L547-C549 PolarHBondContact O-N 3.32Å; C549-A609 WeakPolarHBondContact SG-CA 3.41Å; C549-A609 PolarHBondContact SG-N 3.02Å; C549-A609 VanDerWaalsContact SG-N 3.41Å; C549-C612 PolarHBondContact O-SG 3.02Å |
| 550 | I | 92.2 | Very high | 85.4 | Confident | 76 Ų | 76 | 32.6 Ų | 32.6 | 39% | 0.39 | 16% | 0.164 | S | C | . | . | H | α-helix | trans | -87.2 | -41.1 | -177.3 | -63 | -58.6 | 0 | 0 | 0 | 112 | Y432 A435 V436 R546 L547 M548 | Y432-I550 HydrophobicContact CD2-CG1 4.17Å; Y432-I550 HydrophobicContact CE2-CG1 3.59Å; A435-I550 HydrophobicContact CB-CG2 3.63Å; V436-I550 HydrophobicContact CG2-CB 4.48Å; V436-I550 HydrophobicContact CG2-CD1 4.29Å; V436-I550 HydrophobicContact CG2-CG1 4.03Å; V436-I550 HydrophobicContact CG2-CG2 3.74Å; R546-I550 WeakPolarHBondContact O-CG1 3.28Å; R546-I550 PolarHBondContact O-N 3.25Å; R546-I550 VanDerWaalsContact O-N 3.12Å; L547-I550 PolarHBondContact O-N 3.39Å; L547-I550 VanDerWaalsContact O-N 3.12Å; M548-I550 VanDerWaalsContact C-N 3.31Å; M548-I550 PolarHBondContact O-N 3.14Å |
| 551 | E | 93.1 | Very high | 83 | Confident | 31.5 Ų | 31.5 | 38.7 Ų | 38.7 | 15% | 0.147 | 20% | 0.196 | C | C | . | . | trans | -133.9 | 72.8 | -176 | -170.9 | 62.5 | -121.8 | 0 | 0 | 110.2 | A435 I446 Y450 L547 K553 L554 | A435-E551 HydrophobicContact CB-CB 4.39Å; I446-E551 HydrophobicContact CD1-CB 4.48Å; I446-E551 HydrophobicContact CD1-CG 4.17Å; I446-E551 HydrophobicContact CG2-CG 4.11Å; I446-E551 VanDerWaalsContact CG2-OE2 3.28Å; I446-E551 WeakPolarHBondContact CG2-OE2 3.41Å; Y450-E551 HydrophobicContact CE1-CG 4.1Å; Y450-E551 PolarHBondContact OH-OE1 3.15Å; L547-E551 HydrophobicContact CD1-CB 4.43Å; L547-E551 PolarHBondContact O-N 3.28Å; E551-K553 PolarHBondContact O-N 3.1Å; E551-K553 VanDerWaalsContact O-N 3.17Å; E551-L554 HydrophobicContact CB-CD1 3.94Å; E551-L554 HydrophobicContact CB-CG 4.43Å; E551-L554 HydrophobicContact CG-CD1 3.67Å; E551-L554 HydrophobicContact CG-CG 3.76Å; E551-L554 PolarHBondContact O-N 3.14Å; E551-L554 VanDerWaalsContact O-N 3.17Å | ||
| 552 | P | 92.7 | Very high | 80.6 | Confident | 11 Ų | 11 | 42.7 Ų | 42.7 | 7% | 0.071 | 23% | 0.23 | C | C | . | . | G | 310 helix | trans | -62.6 | -25.4 | -174.5 | 23.6 | -34.1 | 0 | 0 | 0 | 113.1 | M548 L554 F555 L556 L613 N618 | M548-P552 VanDerWaalsContact O-CA 3.25Å; M548-P552 WeakPolarHBondContact O-CA 3.42Å; M548-P552 WeakPolarHBondContact O-CB 3.25Å; M548-P552 WeakPolarHBondContact O-CD 3.47Å; P552-L554 PolarHBondContact O-N 2.93Å; P552-L554 VanDerWaalsContact O-N 3.15Å; P552-F555 PolarHBondContact O-N 3.44Å; P552-L556 HydrophobicContact CB-CD1 4.24Å; P552-L556 WeakPolarHBondContact O-CG 2.94Å; P552-L556 PolarHBondContact O-N 2.82Å; P552-L613 HydrophobicContact CB-CD2 3.83Å; P552-N618 WeakPolarHBondContact CG-OD1 3.4Å |
| 553 | K | 89.7 | Confident | 78.3 | Confident | 88.5 Ų | 88.5 | 45.5 Ų | 45.5 | 39% | 0.385 | 26% | 0.259 | S | S | . | . | G | 310 helix | trans | -59.4 | -24.9 | 177.9 | -64 | -175.3 | 176.5 | 175.4 | 0 | 113.7 | Y450 E551 F555 L556 L621 | Y450-K553 HydrophobicContact CD1-CB 4.29Å; Y450-K553 HydrophobicContact CE1-CB 3.69Å; Y450-K553 HydrophobicContact CE2-CB 4.36Å; Y450-K553 HydrophobicContact CE2-CD 4.07Å; Y450-K553 WeakPolarHBondContact OH-CD 3.44Å; E551-K553 PolarHBondContact O-N 3.1Å; E551-K553 VanDerWaalsContact O-N 3.17Å; K553-F555 PolarHBondContact O-N 3.08Å; K553-L556 PolarHBondContact O-N 2.9Å; K553-L556 VanDerWaalsContact O-O 3.14Å; K553-L621 HydrophobicContact CD-CD1 4.28Å; K553-L621 HydrophobicContact CG-CD1 3.75Å |
| 554 | L | 90.7 | Very high | 75.8 | Confident | 0 Ų | 0 | 49 Ų | 49 | 0% | 0 | 29% | 0.287 | C | S | . | . | G | 310 helix | trans | -67.4 | -19.7 | 174.4 | -72.4 | 168.8 | 0 | 0 | 0 | 113 | I446 V449 Y450 S453 L456 L547 E551 P552 | I446-L554 HydrophobicContact CD1-CD1 3.98Å; I446-L554 HydrophobicContact CG1-CD1 4.36Å; V449-L554 HydrophobicContact CB-CD2 3.94Å; V449-L554 HydrophobicContact CG1-CD2 3.79Å; Y450-L554 HydrophobicContact CD1-CD2 3.75Å; Y450-L554 HydrophobicContact CD1-CG 4.21Å; Y450-L554 HydrophobicContact CE1-CD2 4.19Å; Y450-L554 HydrophobicContact CE1-CG 4.22Å; S453-L554 VanDerWaalsContact CA-O 3.26Å; S453-L554 WeakPolarHBondContact CA-O 3.43Å; S453-L554 WeakPolarHBondContact CB-O 3.43Å; L456-L554 HydrophobicContact CD1-CB 4.07Å; L456-L554 HydrophobicContact CD1-CD1 4.44Å; L456-L554 HydrophobicContact CD1-CD2 3.93Å; L456-L554 HydrophobicContact CD1-CG 4.39Å; L547-L554 HydrophobicContact CD1-CD1 4Å; L547-L554 HydrophobicContact CD2-CD1 4.1Å; L547-L554 HydrophobicContact CG-CD1 4.06Å; E551-L554 HydrophobicContact CB-CD1 3.94Å; E551-L554 HydrophobicContact CB-CG 4.43Å; E551-L554 HydrophobicContact CG-CD1 3.67Å; E551-L554 HydrophobicContact CG-CG 3.76Å; E551-L554 PolarHBondContact O-N 3.14Å; E551-L554 VanDerWaalsContact O-N 3.17Å; P552-L554 PolarHBondContact O-N 2.93Å; P552-L554 VanDerWaalsContact O-N 3.15Å |
| 555 | F | 91.4 | Very high | 73.2 | Confident | 0 Ų | 0 | 51.9 Ų | 51.9 | 0% | 0 | 31% | 0.311 | C | S | . | . | G | 310 helix | trans | -114.5 | -5.9 | -177.6 | -60.3 | -89.3 | 0 | 0 | 0 | 112.9 | L456 V457 F460 L544 L547 M548 P552 K553 | L456-F555 HydrophobicContact CB-CE1 4.44Å; V457-F555 HydrophobicContact CG2-CB 4.46Å; V457-F555 HydrophobicContact CG2-CD1 4.21Å; F460-F555 HydrophobicContact CB-CE1 4.43Å; L544-F555 HydrophobicContact CD2-CE1 4.33Å; L544-F555 HydrophobicContact CD2-CZ 4.22Å; L547-F555 HydrophobicContact CB-CE2 4.36Å; L547-F555 HydrophobicContact CB-CZ 4.44Å; L547-F555 HydrophobicContact CD2-CE2 4.38Å; L547-F555 HydrophobicContact CD2-CZ 4.37Å; L547-F555 HydrophobicContact CG-CE2 4.08Å; L547-F555 HydrophobicContact CG-CZ 4.37Å; M548-F555 VanDerWaalsContact CA-CE2 3.47Å; M548-F555 HydrophobicContact CB-CD2 3.61Å; M548-F555 HydrophobicContact CB-CE2 3.63Å; M548-F555 HydrophobicContact CB-CG 4.24Å; M548-F555 HydrophobicContact CB-CZ 4.26Å; M548-F555 HydrophobicContact CE-CB 4.17Å; M548-F555 HydrophobicContact CE-CD1 3.63Å; M548-F555 HydrophobicContact CE-CD2 4.25Å; M548-F555 HydrophobicContact CE-CE1 4.02Å; M548-F555 HydrophobicContact CE-CG 3.75Å; M548-F555 HydrophobicContact CE-CZ 4.48Å; M548-F555 HydrophobicContact CG-CB 4.15Å; M548-F555 HydrophobicContact CG-CD2 3.64Å; M548-F555 HydrophobicContact CG-CE2 4.2Å; M548-F555 HydrophobicContact CG-CG 3.92Å; P552-F555 PolarHBondContact O-N 3.44Å; K553-F555 PolarHBondContact O-N 3.08Å |
| 556 | L | 85.9 | Confident | 70.7 | Confident | 5 Ų | 5 | 57.9 Ų | 57.9 | 3% | 0.026 | 35% | 0.347 | C | S | . | . | S | Bend | trans | -105.5 | 57.4 | 178.4 | -65.8 | 175 | 0 | 0 | 0 | 111.1 | P552 K553 P558 T582 L613 N618 L621 | P552-L556 HydrophobicContact CB-CD1 4.24Å; P552-L556 WeakPolarHBondContact O-CG 2.94Å; P552-L556 PolarHBondContact O-N 2.82Å; K553-L556 PolarHBondContact O-N 2.9Å; K553-L556 VanDerWaalsContact O-O 3.14Å; L556-P558 WeakPolarHBondContact O-CD 3.33Å; L556-T582 HydrophobicContact CD2-CG2 3.75Å; L556-L613 HydrophobicContact CD1-CD2 4.01Å; L556-L613 HydrophobicContact CD2-CD2 4.08Å; L556-L613 HydrophobicContact CG-CD2 4.03Å; L556-N618 HydrophobicContact CD1-CB 4.16Å; L556-L621 HydrophobicContact CB-CB 4.42Å; L556-L621 HydrophobicContact CD1-CB 4.34Å; L556-L621 HydrophobicContact CD1-CD1 4.44Å |
| 557 | R | 70.2 | Confident | 68.3 | Low | 68.5 Ų | 68.5 | 63.3 Ų | 63.3 | 26% | 0.258 | 38% | 0.378 | S | S | . | . | trans | 4.7 | 96.6 | -176 | -88.9 | -177.3 | 171.7 | 167.1 | -4.7 | 113.5 | E454 E577 R578 | E454-R557 IonicContact OE1-CZ 3.42Å; E454-R557 IonicContact OE1-NH2 3.51Å; E454-R557 PolarHBondContact OE1-NH2 3.22Å; R557-E577 PolarHBondContact NH1-O 3.06Å; R557-R578 HydrophobicContact CB-CG 4.1Å | ||
| 558 | P | 54.4 | Low | 65.5 | Low | 42 Ų | 42 | 67 Ų | 67 | 27% | 0.273 | 40% | 0.404 | S | S | . | . | P | Polyproline II helix | trans | -74.8 | 142.6 | 173.5 | 24.4 | -21 | 0 | 0 | 0 | 110.7 | Y450 S453 L556 Q560 | Y450-P558 VanDerWaalsContact CB-CG 3.47Å; Y450-P558 HydrophobicContact CG-CG 4.08Å; Y450-P558 WeakPolarHBondContact O-CG 3.34Å; S453-P558 WeakPolarHBondContact OG-CD 3.36Å; L556-P558 WeakPolarHBondContact O-CD 3.33Å; P558-Q560 PolarHBondContact O-N 3.33Å; P558-Q560 VanDerWaalsContact O-N 3.12Å |
| 559 | A | 48.5 | Very low | 63.1 | Low | 56.5 Ų | 56.5 | 73.4 Ų | 73.4 | 47% | 0.467 | 44% | 0.443 | S | S | . | . | P | Polyproline II helix | trans | -51.7 | 123.4 | -178.4 | 0 | 0 | 0 | 0 | 0 | 112 | D561 L624 | A559-D561 PolarHBondContact O-N 2.92Å; A559-D561 VanDerWaalsContact O-N 3.08Å; A559-L624 HydrophobicContact CB-CD1 4.08Å |
| 560 | Q | 46.9 | Very low | 60.8 | Low | 170 Ų | 170 | 76.7 Ų | 76.7 | 79% | 0.794 | 46% | 0.462 | S | S | * | . | S | Bend | trans | -62 | 118.4 | 159.9 | -77.8 | -176.7 | -8.6 | 0 | 0 | 108.1 | P558 | P558-Q560 PolarHBondContact O-N 3.33Å; P558-Q560 VanDerWaalsContact O-N 3.12Å |
| 561 | D | 42.1 | Very low | 58.4 | Low | 128.5 Ų | 128.5 | 82.5 Ų | 82.5 | 69% | 0.687 | 48% | 0.479 | S | S | * | . | trans | 34.8 | 96.6 | 170.1 | -63 | -30.8 | 0 | 0 | 0 | 117.1 | A559 A563 S564 | A559-D561 PolarHBondContact O-N 2.92Å; A559-D561 VanDerWaalsContact O-N 3.08Å; D561-A563 PolarHBondContact O-N 3.02Å; D561-S564 PolarHBondContact O-N 3.02Å; D561-S564 VanDerWaalsContact O-N 3.12Å | ||
| 562 | A | 41.9 | Very low | 56.2 | Low | 85 Ų | 85 | 89.6 Ų | 89.6 | 70% | 0.702 | 51% | 0.512 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -52.5 | -10.5 | 164.5 | 0 | 0 | 0 | 0 | 0 | 114.3 | S564 | A562-S564 VanDerWaalsContact C-N 3.33Š|
| 563 | A | 45.1 | Very low | 54 | Low | 95 Ų | 95 | 96.1 Ų | 96.1 | 79% | 0.785 | 54% | 0.541 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -74.6 | -22.6 | 173.8 | 0 | 0 | 0 | 0 | 0 | 114 | D561 | D561-A563 PolarHBondContact O-N 3.02Š|
| 564 | S | 40.7 | Very low | 52.1 | Low | 94.5 Ų | 94.5 | 94.6 Ų | 94.6 | 66% | 0.661 | 54% | 0.542 | S | S | * | . | S | Bend | trans | -102.8 | -11.2 | -179.1 | -165.4 | 0 | 0 | 0 | 0 | 113.9 | D561 A562 V566 I567 | D561-S564 PolarHBondContact O-N 3.02Å; D561-S564 VanDerWaalsContact O-N 3.12Å; A562-S564 VanDerWaalsContact C-N 3.33Å; S564-V566 PolarHBondContact O-N 3.46Å; S564-V566 VanDerWaalsContact O-N 3.16Å; S564-I567 PolarHBondContact O-N 3.29Å; S564-I567 VanDerWaalsContact O-N 3.16Å |
| 565 | A | 39.7 | Very low | 50.1 | Low | 61 Ų | 61 | 96.7 Ų | 96.7 | 50% | 0.504 | 56% | 0.555 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -87.9 | 2 | -173.9 | 0 | 0 | 0 | 0 | 0 | 114.4 | I567 | A565-I567 VanDerWaalsContact C-N 3.27Å; A565-I567 PolarHBondContact O-N 3.12Å |
| 566 | V | 43.7 | Very low | 48.3 | Very low | 126.5 Ų | 126.5 | 104 Ų | 104 | 77% | 0.767 | 59% | 0.589 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -73.9 | -16.9 | 173.9 | 179.5 | 0 | 0 | 0 | 0 | 111.9 | S564 | S564-V566 PolarHBondContact O-N 3.46Å; S564-V566 VanDerWaalsContact O-N 3.16Å |
| 567 | I | 42 | Very low | 46.8 | Very low | 159.5 Ų | 159.5 | 109.4 Ų | 109.4 | 82% | 0.818 | 61% | 0.614 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -123.5 | 20.3 | -179.2 | -53.7 | 178.2 | 0 | 0 | 0 | 112.5 | S564 A565 V569 | S564-I567 PolarHBondContact O-N 3.29Å; S564-I567 VanDerWaalsContact O-N 3.16Å; A565-I567 VanDerWaalsContact C-N 3.27Å; A565-I567 PolarHBondContact O-N 3.12Å; I567-V569 PolarHBondContact O-N 3.28Å |
| 568 | S | 36.3 | Very low | 46 | Very low | 79 Ų | 79 | 109.1 Ų | 109.1 | 55% | 0.552 | 61% | 0.613 | S | S | * | * | trans | -120.6 | 86.2 | 171.4 | 66.9 | 0 | 0 | 0 | 0 | 111.8 | V570 | S568-V570 VanDerWaalsContact C-N 3.31Å; S568-V570 PolarHBondContact O-N 3Å | ||
| 569 | V | 44.6 | Very low | 46.3 | Very low | 133 Ų | 133 | 108.5 Ų | 108.5 | 81% | 0.806 | 61% | 0.609 | S | S | * | * | trans | -65.6 | 59.8 | 169.2 | 175.6 | 0 | 0 | 0 | 0 | 110.2 | I567 R571 | I567-V569 PolarHBondContact O-N 3.28Å; V569-R571 PolarHBondContact O-N 3.15Å | ||
| 570 | V | 44.7 | Very low | 47.3 | Very low | 99 Ų | 99 | 108.2 Ų | 108.2 | 60% | 0.6 | 60% | 0.604 | S | S | * | * | trans | -92.7 | 68.8 | -179.6 | -172.4 | 0 | 0 | 0 | 0 | 110.7 | S568 E572 S574 V575 | S568-V570 VanDerWaalsContact C-N 3.31Å; S568-V570 PolarHBondContact O-N 3Å; V570-E572 PolarHBondContact O-N 3.39Å; V570-S574 WeakPolarHBondContact CG1-OG 3.36Å; V570-V575 HydrophobicContact CB-CG2 4.41Å; V570-V575 HydrophobicContact CG1-CG2 3.55Å | ||
| 571 | R | 42.9 | Very low | 48.9 | Very low | 197.5 Ų | 197.5 | 100.4 Ų | 100.4 | 75% | 0.745 | 57% | 0.568 | S | S | * | * | trans | -96.1 | 115.8 | 171.8 | -79.9 | -176.3 | 172.9 | 156.5 | -2.2 | 110.2 | V569 Q573 S574 | V569-R571 PolarHBondContact O-N 3.15Å; R571-Q573 PolarHBondContact O-N 3.11Å; R571-Q573 VanDerWaalsContact O-N 3.07Å; R571-S574 PolarHBondContact O-N 3Å; R571-S574 PolarHBondContact O-OG 2.96Å | ||
| 572 | E | 46.3 | Very low | 51 | Low | 181 Ų | 181 | 94.5 Ų | 94.5 | 85% | 0.846 | 54% | 0.537 | S | S | * | . | H | α-helix | trans | -53.1 | -26.3 | 176.4 | -73.9 | 175.8 | 156.4 | 0 | 0 | 113.2 | V570 S574 V575 E576 | V570-E572 PolarHBondContact O-N 3.39Å; E572-S574 VanDerWaalsContact C-N 3.29Å; E572-S574 PolarHBondContact O-N 3.09Å; E572-V575 WeakPolarHBondContact O-CB 3.1Å; E572-V575 PolarHBondContact O-N 3.17Å; E572-E576 PolarHBondContact O-N 3.34Å |
| 573 | Q | 46.5 | Very low | 53.2 | Low | 148.5 Ų | 148.5 | 91.2 Ų | 91.2 | 69% | 0.694 | 51% | 0.509 | S | S | * | . | H | α-helix | trans | -63.6 | -27.7 | 179.1 | -72.6 | 176.5 | -19.6 | 0 | 0 | 114.5 | R571 V575 E577 | R571-Q573 PolarHBondContact O-N 3.11Å; R571-Q573 VanDerWaalsContact O-N 3.07Å; Q573-V575 VanDerWaalsContact C-N 3.28Å; Q573-V575 PolarHBondContact O-N 3.42Å; Q573-E577 WeakPolarHBondContact O-CG 3.44Å; Q573-E577 PolarHBondContact O-N 3.45Å |
| 574 | S | 48.7 | Very low | 55.2 | Low | 56 Ų | 56 | 91 Ų | 91 | 39% | 0.392 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -82.7 | -9.2 | -179 | 63 | 0 | 0 | 0 | 0 | 114.5 | V570 R571 E572 | V570-S574 WeakPolarHBondContact CG1-OG 3.36Å; R571-S574 PolarHBondContact O-N 3Å; R571-S574 PolarHBondContact O-OG 2.96Å; E572-S574 VanDerWaalsContact C-N 3.29Å; E572-S574 PolarHBondContact O-N 3.09Å |
| 575 | V | 50.1 | Low | 57.7 | Low | 45.5 Ų | 45.5 | 86.6 Ų | 86.6 | 28% | 0.276 | 46% | 0.461 | S | S | . | . | H | α-helix | trans | -80.9 | -37.9 | 178.5 | -177.1 | 0 | 0 | 0 | 0 | 110.9 | V570 E572 Q573 E577 R578 S579 Q623 A625 | V570-V575 HydrophobicContact CB-CG2 4.41Å; V570-V575 HydrophobicContact CG1-CG2 3.55Å; E572-V575 WeakPolarHBondContact O-CB 3.1Å; E572-V575 PolarHBondContact O-N 3.17Å; Q573-V575 VanDerWaalsContact C-N 3.28Å; Q573-V575 PolarHBondContact O-N 3.42Å; V575-E577 PolarHBondContact O-N 3.31Å; V575-R578 PolarHBondContact O-N 3.25Å; V575-S579 PolarHBondContact O-N 3.24Å; V575-Q623 PolarHBondContact O-NE2 3.49Å; V575-A625 HydrophobicContact CB-CB 4.48Å; V575-A625 HydrophobicContact CG1-CB 3.91Å; V575-A625 HydrophobicContact CG2-CB 3.69Å |
| 576 | E | 53.7 | Low | 60.2 | Low | 151.5 Ų | 151.5 | 83.7 Ų | 83.7 | 71% | 0.708 | 44% | 0.437 | S | S | * | . | H | α-helix | trans | -66.6 | -36.9 | 177.4 | -71.6 | -176 | 160.3 | 0 | 0 | 112.5 | E572 R578 S579 S580 | E572-E576 PolarHBondContact O-N 3.34Å; E576-R578 VanDerWaalsContact C-N 3.35Å; E576-R578 PolarHBondContact O-N 3.19Å; E576-S579 PolarHBondContact O-N 3.04Å; E576-S579 PolarHBondContact O-OG 3.05Å; E576-S580 PolarHBondContact O-N 3.43Å |
| 577 | E | 53.9 | Low | 62.5 | Low | 119.5 Ų | 119.5 | 80 Ų | 80 | 56% | 0.558 | 41% | 0.413 | S | S | * | . | H | α-helix | trans | -64.6 | -28.4 | -179.7 | -71.3 | 179.1 | 177.1 | 0 | 0 | 113.7 | R557 Q573 V575 S580 C581 | R557-E577 PolarHBondContact NH1-O 3.06Å; Q573-E577 WeakPolarHBondContact O-CG 3.44Å; Q573-E577 PolarHBondContact O-N 3.45Å; V575-E577 PolarHBondContact O-N 3.31Å; E577-S580 PolarHBondContact O-OG 3.32Å; E577-C581 PolarHBondContact O-N 3.48Å |
| 578 | R | 54.3 | Low | 64.9 | Low | 62.5 Ų | 62.5 | 72.8 Ų | 72.8 | 24% | 0.236 | 38% | 0.378 | C | S | . | . | H | α-helix | trans | -75.4 | -43.7 | 179 | -101.5 | -176.5 | -120.1 | 176.6 | 1.1 | 112.4 | R557 V575 E576 S580 C581 T582 | R557-R578 HydrophobicContact CB-CG 4.1Å; V575-R578 PolarHBondContact O-N 3.25Å; E576-R578 VanDerWaalsContact C-N 3.35Å; E576-R578 PolarHBondContact O-N 3.19Å; R578-S580 PolarHBondContact O-N 2.9Å; R578-C581 PolarHBondContact O-N 2.99Å; R578-T582 PolarHBondContact O-N 3.03Å |
| 579 | S | 59.3 | Low | 67.6 | Low | 28.5 Ų | 28.5 | 69 Ų | 69 | 20% | 0.199 | 35% | 0.351 | C | S | . | . | H | α-helix | trans | -64.9 | -31.1 | 175 | 132.9 | 0 | 0 | 0 | 0 | 111.5 | V575 E576 S583 S633 | V575-S579 PolarHBondContact O-N 3.24Å; E576-S579 PolarHBondContact O-N 3.04Å; E576-S579 PolarHBondContact O-OG 3.05Å; S579-S583 VanDerWaalsContact O-CB 3.24Å; S579-S583 WeakPolarHBondContact O-CB 3.28Å; S579-S583 PolarHBondContact O-N 3.21Å; S579-S583 VanDerWaalsContact O-N 3.11Å; S579-S633 PolarHBondContact OG-OG 3.38Å |
| 580 | S | 70 | Confident | 69.9 | Low | 51 Ų | 51 | 63 Ų | 63 | 36% | 0.357 | 32% | 0.315 | S | S | . | . | H | α-helix | trans | -60.4 | -45.1 | 174.9 | 151.6 | 0 | 0 | 0 | 0 | 111.5 | E576 E577 R578 S583 E584 | E576-S580 PolarHBondContact O-N 3.43Å; E577-S580 PolarHBondContact O-OG 3.32Å; R578-S580 PolarHBondContact O-N 2.9Å; S580-S583 WeakPolarHBondContact O-CB 3.25Å; S580-S583 PolarHBondContact O-N 3.25Å; S580-E584 WeakPolarHBondContact O-CB 3.43Å; S580-E584 VanDerWaalsContact O-CG 3.27Å; S580-E584 WeakPolarHBondContact O-CG 3.28Å; S580-E584 PolarHBondContact O-N 2.92Å; S580-E584 PolarHBondContact OG-OE1 3.15Å; S580-E584 VanDerWaalsContact OG-OE1 3.08Å |
| 581 | C | 79.7 | Confident | 72.1 | Confident | 6.5 Ų | 6.5 | 60.3 Ų | 60.3 | 4% | 0.044 | 30% | 0.3 | C | S | . | . | H | α-helix | trans | -64.8 | -48.3 | -176.7 | -175.9 | 0 | 0 | 0 | 0 | 112.8 | E577 R578 S583 E584 V585 | E577-C581 PolarHBondContact O-N 3.48Å; R578-C581 PolarHBondContact O-N 2.99Å; C581-S583 VanDerWaalsContact C-N 3.31Å; C581-S583 PolarHBondContact O-N 3.36Å; C581-E584 PolarHBondContact O-N 3.22Å; C581-V585 WeakPolarHBondContact O-CG2 3.02Å; C581-V585 PolarHBondContact O-N 3.25Å |
| 582 | T | 86.5 | Confident | 74.4 | Confident | 3 Ų | 3 | 51.2 Ų | 51.2 | 2% | 0.018 | 27% | 0.267 | C | S | . | . | H | α-helix | trans | -63.3 | -40.4 | 176 | -55.7 | 0 | 0 | 0 | 0 | 111.2 | L556 R578 V585 V586 W622 I637 | L556-T582 HydrophobicContact CD2-CG2 3.75Å; R578-T582 PolarHBondContact O-N 3.03Å; T582-V585 PolarHBondContact O-N 2.87Å; T582-V586 HydrophobicContact CG2-CG2 4.4Å; T582-V586 WeakPolarHBondContact O-CB 3.27Å; T582-V586 VanDerWaalsContact O-CG2 3.32Å; T582-V586 WeakPolarHBondContact O-CG2 3.44Å; T582-V586 PolarHBondContact O-N 3.24Å; T582-W622 HydrophobicContact CG2-CD2 3.84Å; T582-W622 HydrophobicContact CG2-CE3 4.4Å; T582-W622 HydrophobicContact CG2-CG 3.9Å; T582-W622 HydrophobicContact CG2-CZ2 4.47Å; T582-I637 HydrophobicContact CG2-CD1 4.09Å |
| 583 | S | 87.8 | Confident | 76.6 | Confident | 17.5 Ų | 17.5 | 42.7 Ų | 42.7 | 12% | 0.122 | 23% | 0.227 | C | C | . | . | H | α-helix | trans | -61.1 | -43.7 | 175.3 | -176.7 | 0 | 0 | 0 | 0 | 111.9 | S579 S580 C581 V586 N587 Q640 | S579-S583 VanDerWaalsContact O-CB 3.24Å; S579-S583 WeakPolarHBondContact O-CB 3.28Å; S579-S583 PolarHBondContact O-N 3.21Å; S579-S583 VanDerWaalsContact O-N 3.11Å; S580-S583 WeakPolarHBondContact O-CB 3.25Å; S580-S583 PolarHBondContact O-N 3.25Å; C581-S583 VanDerWaalsContact C-N 3.31Å; C581-S583 PolarHBondContact O-N 3.36Å; S583-V586 PolarHBondContact O-N 3Å; S583-N587 WeakPolarHBondContact O-CB 3.36Å; S583-N587 PolarHBondContact O-N 3Å; S583-N587 PolarHBondContact O-ND2 3.17Å; S583-N587 PolarHBondContact OG-ND2 3.14Å; S583-N587 VanDerWaalsContact OG-ND2 3.11Å; S583-Q640 PolarHBondContact OG-OE1 2.93Å |
| 584 | E | 88.2 | Confident | 78.5 | Confident | 90.5 Ų | 90.5 | 37 Ų | 37 | 42% | 0.423 | 20% | 0.202 | S | C | . | . | H | α-helix | trans | -60.2 | -46.7 | 176.4 | -77.3 | 167.4 | -144.3 | 0 | 0 | 112.1 | S580 C581 N587 G588 | S580-E584 WeakPolarHBondContact O-CB 3.43Å; S580-E584 VanDerWaalsContact O-CG 3.27Å; S580-E584 WeakPolarHBondContact O-CG 3.28Å; S580-E584 PolarHBondContact O-N 2.92Å; S580-E584 PolarHBondContact OG-OE1 3.15Å; S580-E584 VanDerWaalsContact OG-OE1 3.08Å; C581-E584 PolarHBondContact O-N 3.22Å; E584-N587 PolarHBondContact O-N 3.02Å; E584-G588 PolarHBondContact O-N 2.92Å |
| 585 | V | 92.1 | Very high | 80.2 | Confident | 2.5 Ų | 2.5 | 36.5 Ų | 36.5 | 2% | 0.015 | 20% | 0.199 | C | C | . | . | H | α-helix | trans | -61.4 | -49.9 | 177.5 | 173.2 | 0 | 0 | 0 | 0 | 110.6 | V457 F460 M548 C581 T582 N587 G588 L589 L613 | V457-V585 HydrophobicContact CG1-CG2 3.93Å; V457-V585 HydrophobicContact CG2-CG2 4.22Å; F460-V585 HydrophobicContact CE1-CG1 4.33Å; M548-V585 HydrophobicContact CE-CG1 3.49Å; M548-V585 VanDerWaalsContact CE-CG1 3.47Å; M548-V585 HydrophobicContact SD-CG1 3.84Å; C581-V585 WeakPolarHBondContact O-CG2 3.02Å; C581-V585 PolarHBondContact O-N 3.25Å; T582-V585 PolarHBondContact O-N 2.87Å; V585-N587 PolarHBondContact O-N 3.04Å; V585-G588 PolarHBondContact O-N 3.33Å; V585-L589 HydrophobicContact CG1-CD1 4.42Å; V585-L589 WeakPolarHBondContact O-CG 3.37Å; V585-L589 PolarHBondContact O-N 3.4Å; V585-L613 HydrophobicContact CG1-CD1 4.16Å |
| 586 | V | 93.3 | Very high | 81.5 | Confident | 0 Ų | 0 | 34.9 Ų | 34.9 | 0% | 0 | 19% | 0.189 | C | C | . | . | H | α-helix | trans | -61.6 | -46.9 | 179.2 | 173 | 0 | 0 | 0 | 0 | 110.6 | T582 S583 G588 L589 V590 L613 I637 L641 | T582-V586 HydrophobicContact CG2-CG2 4.4Å; T582-V586 WeakPolarHBondContact O-CB 3.27Å; T582-V586 VanDerWaalsContact O-CG2 3.32Å; T582-V586 WeakPolarHBondContact O-CG2 3.44Å; T582-V586 PolarHBondContact O-N 3.24Å; S583-V586 PolarHBondContact O-N 3Å; V586-G588 VanDerWaalsContact C-N 3.29Å; V586-G588 PolarHBondContact O-N 3.03Å; V586-L589 CarbonylContact O-C 3.5Å; V586-L589 WeakPolarHBondContact O-CA 3.25Å; V586-L589 WeakPolarHBondContact O-CB 3.15Å; V586-L589 PolarHBondContact O-N 3.1Å; V586-V590 HydrophobicContact CG1-CG2 4.27Å; V586-V590 VanDerWaalsContact O-CG2 3.29Å; V586-V590 WeakPolarHBondContact O-CG2 3.25Å; V586-V590 PolarHBondContact O-N 3.07Å; V586-L613 HydrophobicContact CG2-CD1 4.06Å; V586-I637 HydrophobicContact CB-CG2 3.92Å; V586-I637 HydrophobicContact CG1-CG2 3.75Å; V586-I637 HydrophobicContact CG2-CG2 4.01Å; V586-L641 HydrophobicContact CG1-CD1 3.94Å; V586-L641 HydrophobicContact CG1-CD2 4.47Å |
| 587 | N | 91.4 | Very high | 82.4 | Confident | 48 Ų | 48 | 31.4 Ų | 31.4 | 26% | 0.257 | 19% | 0.194 | S | C | . | . | H | α-helix | trans | -60.6 | -37.5 | 177.4 | -76.1 | -38.3 | 0 | 0 | 0 | 112.1 | S583 E584 V585 V590 S591 Q640 | S583-N587 WeakPolarHBondContact O-CB 3.36Å; S583-N587 PolarHBondContact O-N 3Å; S583-N587 PolarHBondContact O-ND2 3.17Å; S583-N587 PolarHBondContact OG-ND2 3.14Å; S583-N587 VanDerWaalsContact OG-ND2 3.11Å; E584-N587 PolarHBondContact O-N 3.02Å; V585-N587 PolarHBondContact O-N 3.04Å; N587-V590 PolarHBondContact O-N 3.21Å; N587-S591 PolarHBondContact O-N 3.15Å; N587-Q640 PolarHBondContact ND2-NE2 3.35Å; N587-Q640 PolarHBondContact ND2-OE1 3.27Å; N587-Q640 VanDerWaalsContact ND2-OE1 3.14Å; N587-Q640 VanDerWaalsContact OD1-CD 3.32Å; N587-Q640 PolarHBondContact OD1-NE2 2.93Å; N587-Q640 PolarHBondContact OD1-OE1 3.12Å |
| 588 | G | 92 | Very high | 83.5 | Confident | 8 Ų | 8 | 30.9 Ų | 30.9 | 8% | 0.082 | 19% | 0.192 | C | C | . | . | H | α-helix | trans | -60.3 | -46.5 | 172.6 | 0 | 0 | 0 | 0 | 0 | 112.5 | E584 V585 V586 S591 | E584-G588 PolarHBondContact O-N 2.92Å; V585-G588 PolarHBondContact O-N 3.33Å; V586-G588 VanDerWaalsContact C-N 3.29Å; V586-G588 PolarHBondContact O-N 3.03Å; G588-S591 WeakPolarHBondContact O-CB 3.49Å; G588-S591 PolarHBondContact O-N 3.35Å; G588-S591 PolarHBondContact O-OG 3.18Å |
| 589 | L | 94.9 | Very high | 84.8 | Confident | 0 Ų | 0 | 28.8 Ų | 28.8 | 0% | 0 | 19% | 0.185 | C | C | . | . | H | α-helix | trans | -63.5 | -41.9 | 174.6 | -63.7 | 171.8 | 0 | 0 | 0 | 112.2 | F460 I545 M548 V585 V586 S591 L592 I593 A606 A609 V610 L613 | F460-L589 HydrophobicContact CE2-CD2 4.12Å; F460-L589 HydrophobicContact CZ-CD2 3.9Å; F460-L589 HydrophobicContact CZ-CG 4.18Å; I545-L589 HydrophobicContact CD1-CD2 4.28Å; I545-L589 HydrophobicContact CG1-CD2 3.97Å; I545-L589 HydrophobicContact CG2-CD2 4.38Å; M548-L589 HydrophobicContact SD-CD1 3.79Å; M548-L589 HydrophobicContact SD-CD2 4.47Å; V585-L589 HydrophobicContact CG1-CD1 4.42Å; V585-L589 WeakPolarHBondContact O-CG 3.37Å; V585-L589 PolarHBondContact O-N 3.4Å; V586-L589 CarbonylContact O-C 3.5Å; V586-L589 WeakPolarHBondContact O-CA 3.25Å; V586-L589 WeakPolarHBondContact O-CB 3.15Å; V586-L589 PolarHBondContact O-N 3.1Å; L589-S591 VanDerWaalsContact C-N 3.27Å; L589-S591 PolarHBondContact O-N 2.97Å; L589-L592 WeakPolarHBondContact O-CB 3.33Å; L589-L592 PolarHBondContact O-N 3.09Å; L589-L592 VanDerWaalsContact O-N 3.08Å; L589-I593 WeakPolarHBondContact O-CG1 3.29Å; L589-I593 PolarHBondContact O-N 3.14Å; L589-I593 VanDerWaalsContact O-N 3.11Å; L589-A606 HydrophobicContact CB-CB 4.3Å; L589-A606 HydrophobicContact CD2-CB 4.09Å; L589-A609 HydrophobicContact CD1-CB 3.88Å; L589-A609 HydrophobicContact CD2-CB 4.21Å; L589-V610 HydrophobicContact CB-CG2 3.69Å; L589-V610 HydrophobicContact CD1-CG2 3.76Å; L589-V610 HydrophobicContact CG-CG2 4.4Å; L589-L613 HydrophobicContact CD1-CD1 3.96Å |
| 590 | V | 92.7 | Very high | 85.9 | Confident | 5.5 Ų | 5.5 | 31.2 Ų | 31.2 | 3% | 0.033 | 20% | 0.2 | C | C | . | . | H | α-helix | trans | -59.5 | -38 | 177.1 | 175.2 | 0 | 0 | 0 | 0 | 111.4 | V586 N587 L592 I593 V594 L641 H644 V645 | V586-V590 HydrophobicContact CG1-CG2 4.27Å; V586-V590 VanDerWaalsContact O-CG2 3.29Å; V586-V590 WeakPolarHBondContact O-CG2 3.25Å; V586-V590 PolarHBondContact O-N 3.07Å; N587-V590 PolarHBondContact O-N 3.21Å; V590-L592 PolarHBondContact O-N 3.32Å; V590-I593 PolarHBondContact O-N 2.99Å; V590-I593 VanDerWaalsContact O-N 3.15Å; V590-V594 HydrophobicContact CG1-CG2 4.13Å; V590-V594 WeakPolarHBondContact O-CB 3.42Å; V590-V594 WeakPolarHBondContact O-CG2 3.47Å; V590-V594 PolarHBondContact O-N 3.16Å; V590-L641 HydrophobicContact CB-CD1 4.37Å; V590-L641 HydrophobicContact CG1-CD1 4.2Å; V590-L641 HydrophobicContact CG2-CB 4.13Å; V590-L641 HydrophobicContact CG2-CD1 3.35Å; V590-L641 VanDerWaalsContact CG2-CD1 3.43Å; V590-L641 HydrophobicContact CG2-CG 3.86Å; V590-H644 HydrophobicContact CG1-CB 4.18Å; V590-V645 HydrophobicContact CG1-CG2 4.35Å |
| 591 | S | 90.8 | Very high | 86.5 | Confident | 43.5 Ų | 43.5 | 34.8 Ų | 34.8 | 30% | 0.304 | 21% | 0.211 | S | C | . | . | H | α-helix | trans | -59.6 | -33.9 | 176.1 | 81.5 | 0 | 0 | 0 | 0 | 112.8 | N587 G588 L589 S595 | N587-S591 PolarHBondContact O-N 3.15Å; G588-S591 WeakPolarHBondContact O-CB 3.49Å; G588-S591 PolarHBondContact O-N 3.35Å; G588-S591 PolarHBondContact O-OG 3.18Å; L589-S591 VanDerWaalsContact C-N 3.27Å; L589-S591 PolarHBondContact O-N 2.97Å; S591-S595 WeakPolarHBondContact O-CB 3.31Å; S591-S595 PolarHBondContact O-N 3.15Å; S591-S595 VanDerWaalsContact O-N 3.16Å; S591-S595 PolarHBondContact O-OG 3.4Å |
| 592 | L | 91.4 | Very high | 86.9 | Confident | 7 Ų | 7 | 34.7 Ų | 34.7 | 4% | 0.037 | 21% | 0.21 | C | C | . | . | H | α-helix | trans | -73.2 | -41.7 | 175.2 | -62.3 | 173.6 | 0 | 0 | 0 | 112 | L464 L541 I545 L589 V590 V594 S595 S596 A603 A606 | L464-L592 HydrophobicContact CD1-CD1 3.89Å; L464-L592 HydrophobicContact CD1-CD2 3.63Å; L464-L592 HydrophobicContact CD1-CG 3.68Å; L541-L592 HydrophobicContact CD2-CD1 4.07Å; L541-L592 HydrophobicContact CD2-CD2 4.1Å; L541-L592 HydrophobicContact CG-CD1 4.45Å; I545-L592 HydrophobicContact CD1-CD1 3.57Å; L589-L592 WeakPolarHBondContact O-CB 3.33Å; L589-L592 PolarHBondContact O-N 3.09Å; L589-L592 VanDerWaalsContact O-N 3.08Å; V590-L592 PolarHBondContact O-N 3.32Å; L592-V594 VanDerWaalsContact C-N 3.29Å; L592-V594 PolarHBondContact O-N 3.19Å; L592-S595 CarbonylContact O-C 3.45Å; L592-S595 PolarHBondContact O-N 3.39Å; L592-S595 VanDerWaalsContact O-N 3.11Å; L592-S596 PolarHBondContact O-N 3.07Å; L592-A603 WeakPolarHBondContact O-CB 3.32Å; L592-A606 HydrophobicContact CB-CB 3.96Å; L592-A606 HydrophobicContact CD1-CB 4.18Å |
| 593 | I | 90.9 | Very high | 87.1 | Confident | 1 Ų | 1 | 34.6 Ų | 34.6 | 1% | 0.005 | 21% | 0.21 | C | C | . | . | H | α-helix | trans | -60.4 | -43.3 | 177.4 | -61 | 174.3 | 0 | 0 | 0 | 110.2 | L589 V590 S595 S596 A606 M607 V610 W663 | L589-I593 WeakPolarHBondContact O-CG1 3.29Å; L589-I593 PolarHBondContact O-N 3.14Å; L589-I593 VanDerWaalsContact O-N 3.11Å; V590-I593 PolarHBondContact O-N 2.99Å; V590-I593 VanDerWaalsContact O-N 3.15Å; I593-S595 VanDerWaalsContact C-N 3.29Å; I593-S595 PolarHBondContact O-N 3.08Å; I593-S596 WeakPolarHBondContact O-CB 3.42Å; I593-S596 PolarHBondContact O-N 3.16Å; I593-A606 HydrophobicContact CD1-CB 4.5Å; I593-A606 HydrophobicContact CG1-CB 3.92Å; I593-M607 HydrophobicContact CB-CG 4.47Å; I593-M607 HydrophobicContact CD1-CB 4.46Å; I593-M607 HydrophobicContact CD1-CG 3.77Å; I593-M607 HydrophobicContact CG1-CG 3.77Å; I593-M607 HydrophobicContact CG2-CG 4Å; I593-M607 HydrophobicContact CG2-SD 4.41Å; I593-V610 HydrophobicContact CD1-CG2 4.07Å; I593-W663 HydrophobicContact CD1-CH2 3.76Å; I593-W663 HydrophobicContact CD1-CZ2 3.57Å |
| 594 | V | 87 | Confident | 87.2 | Confident | 28.5 Ų | 28.5 | 37.4 Ų | 37.4 | 17% | 0.173 | 22% | 0.221 | C | C | . | . | H | α-helix | trans | -70.4 | -25.8 | 180 | 169.7 | 0 | 0 | 0 | 0 | 112.5 | V590 L592 S596 K648 | V590-V594 HydrophobicContact CG1-CG2 4.13Å; V590-V594 WeakPolarHBondContact O-CB 3.42Å; V590-V594 WeakPolarHBondContact O-CG2 3.47Å; V590-V594 PolarHBondContact O-N 3.16Å; L592-V594 VanDerWaalsContact C-N 3.29Å; L592-V594 PolarHBondContact O-N 3.19Å; V594-S596 VanDerWaalsContact C-N 3.33Å; V594-K648 HydrophobicContact CB-CG 4.45Å; V594-K648 HydrophobicContact CG1-CD 3.6Å; V594-K648 VanDerWaalsContact CG1-CE 3.43Å; V594-K648 HydrophobicContact CG1-CG 3.66Å; V594-K648 HydrophobicContact CG2-CG 4.03Å |
| 595 | S | 83.7 | Confident | 87.3 | Confident | 46.5 Ų | 46.5 | 34.4 Ų | 34.4 | 33% | 0.325 | 21% | 0.207 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -94 | 25.9 | 175.2 | -66.8 | 0 | 0 | 0 | 0 | 113.4 | S591 L592 I593 G597 E598 M599 | S591-S595 WeakPolarHBondContact O-CB 3.31Å; S591-S595 PolarHBondContact O-N 3.15Å; S591-S595 VanDerWaalsContact O-N 3.16Å; S591-S595 PolarHBondContact O-OG 3.4Å; L592-S595 CarbonylContact O-C 3.45Å; L592-S595 PolarHBondContact O-N 3.39Å; L592-S595 VanDerWaalsContact O-N 3.11Å; I593-S595 VanDerWaalsContact C-N 3.29Å; I593-S595 PolarHBondContact O-N 3.08Å; S595-G597 PolarHBondContact O-N 3.18Å; S595-E598 PolarHBondContact O-N 3.27Å; S595-M599 PolarHBondContact O-N 3.15Å |
| 596 | S | 77.3 | Confident | 87.4 | Confident | 11 Ų | 11 | 34.3 Ų | 34.3 | 8% | 0.077 | 21% | 0.206 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -57.1 | -24.5 | -176.3 | 66.6 | 0 | 0 | 0 | 0 | 114.8 | L592 I593 V594 E598 P600 N656 | L592-S596 PolarHBondContact O-N 3.07Å; I593-S596 WeakPolarHBondContact O-CB 3.42Å; I593-S596 PolarHBondContact O-N 3.16Å; V594-S596 VanDerWaalsContact C-N 3.33Å; S596-E598 VanDerWaalsContact C-N 3.31Å; S596-E598 PolarHBondContact O-N 3.16Å; S596-P600 WeakPolarHBondContact O-CA 3.35Å; S596-N656 WeakPolarHBondContact CB-OD1 3.35Å; S596-N656 PolarHBondContact OG-OD1 2.86Å |
| 597 | G | 73.1 | Confident | 87.5 | Confident | 79 Ų | 79 | 34.6 Ų | 34.6 | 81% | 0.814 | 21% | 0.208 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -66.3 | -28.4 | 175.3 | 0 | 0 | 0 | 0 | 0 | 114.3 | S595 | S595-G597 PolarHBondContact O-N 3.18Š|
| 598 | E | 77.5 | Confident | 87.7 | Confident | 108 Ų | 108 | 36.2 Ų | 36.2 | 51% | 0.505 | 21% | 0.213 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -92.6 | -35.4 | -179.2 | -63.5 | 176.2 | -177.6 | 0 | 0 | 111.9 | A471 R538 S595 S596 | A471-E598 WeakPolarHBondContact CB-OE2 3.44Å; R538-E598 PolarHBondContact NH2-O 3.3Å; R538-E598 VanDerWaalsContact NH2-O 3.11Å; S595-E598 PolarHBondContact O-N 3.27Å; S596-E598 VanDerWaalsContact C-N 3.31Å; S596-E598 PolarHBondContact O-N 3.16Å |
| 599 | M | 82.2 | Confident | 87.8 | Confident | 19.5 Ų | 19.5 | 35.8 Ų | 35.8 | 10% | 0.096 | 21% | 0.209 | C | C | . | . | trans | -140.6 | 69.4 | -170.4 | -55.7 | -133.5 | -170 | 0 | 0 | 111.9 | V467 A471 R538 S595 E601 L602 A603 | V467-M599 HydrophobicContact CG1-CE 3.57Å; V467-M599 HydrophobicContact CG1-SD 3.79Å; A471-M599 HydrophobicContact CB-CE 3.78Å; R538-M599 HydrophobicContact CG-CE 4.43Å; R538-M599 HydrophobicContact CG-SD 4Å; R538-M599 VanDerWaalsContact CZ-CE 3.45Å; R538-M599 PolarHBondContact NE-SD 2.93Å; R538-M599 VanDerWaalsContact NH2-CE 3.32Å; R538-M599 PolarHBondContact NH2-SD 3.41Å; S595-M599 PolarHBondContact O-N 3.15Å; M599-E601 VanDerWaalsContact C-N 3.34Å; M599-E601 PolarHBondContact O-N 3.05Å; M599-L602 HydrophobicContact CB-CB 4.22Å; M599-L602 HydrophobicContact CB-CD1 4.32Å; M599-L602 PolarHBondContact O-N 3.08Å; M599-L602 HydrophobicContact SD-CD1 3.63Å; M599-A603 WeakPolarHBondContact O-CB 3.34Å; M599-A603 PolarHBondContact O-N 3.13Å | ||
| 600 | P | 81.7 | Confident | 87.9 | Confident | 78.5 Ų | 78.5 | 35.8 Ų | 35.8 | 51% | 0.51 | 21% | 0.209 | S | C | . | . | H | α-helix | trans | -63.3 | -36.5 | -172.4 | 24.9 | -34.1 | 0 | 0 | 0 | 113.1 | S596 A603 Q604 | S596-P600 WeakPolarHBondContact O-CA 3.35Å; P600-A603 PolarHBondContact O-N 3.22Å; P600-Q604 PolarHBondContact O-N 3.13Å |
| 601 | E | 82.7 | Confident | 88.1 | Confident | 126.333 Ų | 126.333 | 36.5 Ų | 36.5 | 59% | 0.59 | 21% | 0.213 | S | C | * | . | H | α-helix | trans | -64.5 | -43.8 | 178.6 | -60.6 | 145.2 | 177.7 | 0 | 0 | 111.9 | M599 Q604 E605 | M599-E601 VanDerWaalsContact C-N 3.34Å; M599-E601 PolarHBondContact O-N 3.05Å; E601-Q604 PolarHBondContact O-N 3.18Å; E601-E605 WeakPolarHBondContact O-CG 3.36Å; E601-E605 PolarHBondContact O-N 3.19Å |
| 602 | L | 88.9 | Confident | 88.3 | Confident | 5 Ų | 5 | 35.1 Ų | 35.1 | 3% | 0.026 | 20% | 0.203 | C | C | . | . | H | α-helix | trans | -70.3 | -36.8 | 177 | -74.6 | 174.4 | 0 | 0 | 0 | 111.8 | V467 R538 L541 F542 I545 M599 Q604 E605 A606 | V467-L602 HydrophobicContact CG1-CD1 4.34Å; R538-L602 HydrophobicContact CB-CD1 4.49Å; R538-L602 HydrophobicContact CG-CD1 3.99Å; R538-L602 HydrophobicContact CG-CG 4.47Å; L541-L602 HydrophobicContact CB-CD2 4.39Å; L541-L602 HydrophobicContact CD2-CD1 4.14Å; L541-L602 HydrophobicContact CG-CD2 4.36Å; F542-L602 HydrophobicContact CB-CD2 3.77Å; F542-L602 HydrophobicContact CD2-CD2 4.32Å; I545-L602 HydrophobicContact CD1-CD2 4.16Å; M599-L602 HydrophobicContact CB-CB 4.22Å; M599-L602 HydrophobicContact CB-CD1 4.32Å; M599-L602 PolarHBondContact O-N 3.08Å; M599-L602 HydrophobicContact SD-CD1 3.63Å; L602-Q604 VanDerWaalsContact C-N 3.33Å; L602-Q604 PolarHBondContact O-N 3.45Å; L602-E605 PolarHBondContact O-N 3.28Å; L602-A606 VanDerWaalsContact O-CB 3.25Å; L602-A606 WeakPolarHBondContact O-CB 3.24Å; L602-A606 PolarHBondContact O-N 3.29Å |
| 603 | A | 89.5 | Confident | 88.5 | Confident | 0.666667 Ų | 0.666667 | 34.8 Ų | 34.8 | 1% | 0.006 | 20% | 0.201 | C | C | . | . | H | α-helix | trans | -61.9 | -41.8 | 176.1 | 0 | 0 | 0 | 0 | 0 | 111.5 | L592 M599 P600 A606 M607 | L592-A603 WeakPolarHBondContact O-CB 3.32Å; M599-A603 WeakPolarHBondContact O-CB 3.34Å; M599-A603 PolarHBondContact O-N 3.13Å; P600-A603 PolarHBondContact O-N 3.22Å; A603-A606 PolarHBondContact O-N 3.27Å; A603-M607 VanDerWaalsContact O-CG 3.28Å; A603-M607 WeakPolarHBondContact O-CG 3.41Å; A603-M607 PolarHBondContact O-N 3.04Å |
| 604 | Q | 89.4 | Confident | 88.7 | Confident | 76 Ų | 76 | 34.8 Ų | 34.8 | 36% | 0.355 | 20% | 0.201 | S | C | . | . | H | α-helix | trans | -63.2 | -47.3 | 176.4 | -174.8 | 93.1 | 20.1 | 0 | 0 | 112 | P600 E601 L602 A606 M607 E608 | P600-Q604 PolarHBondContact O-N 3.13Å; E601-Q604 PolarHBondContact O-N 3.18Å; L602-Q604 VanDerWaalsContact C-N 3.33Å; L602-Q604 PolarHBondContact O-N 3.45Å; Q604-A606 VanDerWaalsContact C-N 3.31Å; Q604-A606 PolarHBondContact O-N 3.28Å; Q604-M607 HydrophobicContact CB-CE 4.47Å; Q604-M607 WeakPolarHBondContact O-CB 3.35Å; Q604-M607 PolarHBondContact O-N 3.12Å; Q604-E608 PolarHBondContact O-N 3.13Å; Q604-E608 VanDerWaalsContact O-N 3.13Å |
| 605 | E | 90.3 | Very high | 89.2 | Confident | 27.6667 Ų | 27.6667 | 36.4 Ų | 36.4 | 13% | 0.129 | 21% | 0.207 | C | C | . | . | H | α-helix | trans | -65.3 | -36.4 | 177.1 | -63.7 | -74.1 | 165.3 | 0 | 0 | 111.5 | F542 I545 R546 E601 L602 M607 E608 A609 | F542-E605 HydrophobicContact CD2-CG 3.86Å; F542-E605 HydrophobicContact CE2-CG 3.51Å; F542-E605 VanDerWaalsContact CE2-CG 3.45Å; F542-E605 HydrophobicContact CZ-CG 4.37Å; I545-E605 HydrophobicContact CB-CB 4.36Å; I545-E605 VanDerWaalsContact CG2-C 3.46Å; I545-E605 HydrophobicContact CG2-CB 3.73Å; I545-E605 VanDerWaalsContact CG2-O 3.28Å; I545-E605 WeakPolarHBondContact CG2-O 3.42Å; R546-E605 VanDerWaalsContact CD-OE2 3.26Å; R546-E605 WeakPolarHBondContact CD-OE2 3.3Å; R546-E605 WeakPolarHBondContact CG-OE2 3.38Å; R546-E605 IonicContact CZ-OE1 3.09Å; R546-E605 IonicContact CZ-OE2 3.66Å; R546-E605 VanDerWaalsContact CZ-OE2 3.23Å; R546-E605 IonicContact NE-OE1 3.05Å; R546-E605 PolarHBondContact NE-OE1 3.3Å; R546-E605 IonicContact NE-OE2 2.84Å; R546-E605 PolarHBondContact NE-OE2 3.2Å; R546-E605 IonicContact NH1-OE2 3.52Å; R546-E605 IonicContact NH2-OE1 2.69Å; R546-E605 PolarHBondContact NH2-OE1 3.16Å; R546-E605 IonicContact NH2-OE2 3.51Å; E601-E605 WeakPolarHBondContact O-CG 3.36Å; E601-E605 PolarHBondContact O-N 3.19Å; L602-E605 PolarHBondContact O-N 3.28Å; E605-M607 VanDerWaalsContact C-N 3.35Å; E605-M607 PolarHBondContact O-N 2.88Å; E605-E608 PolarHBondContact O-N 3Å; E605-A609 WeakPolarHBondContact O-CB 3.33Å; E605-A609 PolarHBondContact O-N 3Å |
| 606 | A | 94.3 | Very high | 89.7 | Confident | 0 Ų | 0 | 34.8 Ų | 34.8 | 0% | 0 | 20% | 0.196 | C | C | . | . | H | α-helix | trans | -65 | -39 | 175.8 | 0 | 0 | 0 | 0 | 0 | 112 | L589 L592 I593 L602 A603 Q604 A609 V610 | L589-A606 HydrophobicContact CB-CB 4.3Å; L589-A606 HydrophobicContact CD2-CB 4.09Å; L592-A606 HydrophobicContact CB-CB 3.96Å; L592-A606 HydrophobicContact CD1-CB 4.18Å; I593-A606 HydrophobicContact CD1-CB 4.5Å; I593-A606 HydrophobicContact CG1-CB 3.92Å; L602-A606 VanDerWaalsContact O-CB 3.25Å; L602-A606 WeakPolarHBondContact O-CB 3.24Å; L602-A606 PolarHBondContact O-N 3.29Å; A603-A606 PolarHBondContact O-N 3.27Å; Q604-A606 VanDerWaalsContact C-N 3.31Å; Q604-A606 PolarHBondContact O-N 3.28Å; A606-A609 PolarHBondContact O-N 3.19Å; A606-V610 VanDerWaalsContact O-CG2 3.31Å; A606-V610 WeakPolarHBondContact O-CG2 3.34Å; A606-V610 PolarHBondContact O-N 3.19Å |
| 607 | M | 95.8 | Very high | 90.4 | Very high | 7 Ų | 7 | 40.6 Ų | 40.6 | 3% | 0.034 | 22% | 0.222 | C | C | . | . | H | α-helix | trans | -59.4 | -46 | 172.5 | -75.2 | 177.4 | 42.2 | 0 | 0 | 111.4 | I593 A603 Q604 E605 V610 L611 V660 W663 | I593-M607 HydrophobicContact CB-CG 4.47Å; I593-M607 HydrophobicContact CD1-CB 4.46Å; I593-M607 HydrophobicContact CD1-CG 3.77Å; I593-M607 HydrophobicContact CG1-CG 3.77Å; I593-M607 HydrophobicContact CG2-CG 4Å; I593-M607 HydrophobicContact CG2-SD 4.41Å; A603-M607 VanDerWaalsContact O-CG 3.28Å; A603-M607 WeakPolarHBondContact O-CG 3.41Å; A603-M607 PolarHBondContact O-N 3.04Å; Q604-M607 HydrophobicContact CB-CE 4.47Å; Q604-M607 WeakPolarHBondContact O-CB 3.35Å; Q604-M607 PolarHBondContact O-N 3.12Å; E605-M607 VanDerWaalsContact C-N 3.35Å; E605-M607 PolarHBondContact O-N 2.88Å; M607-V610 PolarHBondContact O-N 3.33Å; M607-L611 PolarHBondContact O-N 2.93Å; M607-L611 VanDerWaalsContact O-N 3.1Å; M607-V660 HydrophobicContact CE-CG2 4.24Å; M607-V660 HydrophobicContact SD-CG2 4.31Å; M607-W663 HydrophobicContact CB-CD2 4.49Å; M607-W663 HydrophobicContact CB-CG 4.24Å; M607-W663 HydrophobicContact CE-CB 3.19Å; M607-W663 HydrophobicContact CE-CD2 3.91Å; M607-W663 HydrophobicContact CE-CE3 4.45Å; M607-W663 HydrophobicContact CE-CG 3.34Å; M607-W663 HydrophobicContact CG-CD2 4.24Å; M607-W663 HydrophobicContact CG-CG 4.26Å; M607-W663 HydrophobicContact CG-CZ2 4.48Å; M607-W663 PolarHBondContact O-NE1 3.37Å; M607-W663 HydrophobicContact SD-CB 4.35Å; M607-W663 HydrophobicContact SD-CD2 4.37Å; M607-W663 HydrophobicContact SD-CG 4.12Å |
| 608 | E | 94.8 | Very high | 91.3 | Very high | 80.6667 Ų | 80.6667 | 37.6 Ų | 37.6 | 38% | 0.377 | 19% | 0.187 | S | C | . | . | H | α-helix | trans | -64.2 | -40.9 | 176.5 | -66.9 | -91 | 174.8 | 0 | 0 | 112.2 | R492 Q604 E605 V610 L611 C612 | R492-E608 PolarHBondContact N-OE1 3.07Å; Q604-E608 PolarHBondContact O-N 3.13Å; Q604-E608 VanDerWaalsContact O-N 3.13Å; E605-E608 PolarHBondContact O-N 3Å; E608-V610 PolarHBondContact O-N 3.15Å; E608-L611 PolarHBondContact O-N 3.11Å; E608-C612 WeakPolarHBondContact O-CB 3.38Å; E608-C612 PolarHBondContact O-N 3.08Å |
| 609 | A | 95.4 | Very high | 92 | Very high | 0 Ų | 0 | 32.4 Ų | 32.4 | 0% | 0 | 16% | 0.163 | C | C | . | . | H | α-helix | trans | -62.9 | -44.2 | 176.9 | 0 | 0 | 0 | 0 | 0 | 112 | I545 M548 C549 L589 E605 A606 L611 C612 L613 | I545-A609 HydrophobicContact CG2-CB 3.65Å; M548-A609 HydrophobicContact SD-CB 4.14Å; C549-A609 WeakPolarHBondContact SG-CA 3.41Å; C549-A609 PolarHBondContact SG-N 3.02Å; C549-A609 VanDerWaalsContact SG-N 3.41Å; L589-A609 HydrophobicContact CD1-CB 3.88Å; L589-A609 HydrophobicContact CD2-CB 4.21Å; E605-A609 WeakPolarHBondContact O-CB 3.33Å; E605-A609 PolarHBondContact O-N 3Å; A606-A609 PolarHBondContact O-N 3.19Å; A609-L611 VanDerWaalsContact C-N 3.33Å; A609-L611 PolarHBondContact O-N 3.22Å; A609-C612 WeakPolarHBondContact O-CB 3.33Å; A609-C612 PolarHBondContact O-N 3.29Å; A609-L613 WeakPolarHBondContact O-CG 3.36Å; A609-L613 PolarHBondContact O-N 3.12Å |
| 610 | V | 96.8 | Very high | 92.3 | Very high | 0 Ų | 0 | 36 Ų | 36 | 0% | 0 | 18% | 0.179 | C | C | . | . | H | α-helix | trans | -60.4 | -43.8 | 175.2 | 172.6 | 0 | 0 | 0 | 0 | 111 | L589 I593 A606 M607 E608 C612 L613 H614 L641 W663 L667 | L589-V610 HydrophobicContact CB-CG2 3.69Å; L589-V610 HydrophobicContact CD1-CG2 3.76Å; L589-V610 HydrophobicContact CG-CG2 4.4Å; I593-V610 HydrophobicContact CD1-CG2 4.07Å; A606-V610 VanDerWaalsContact O-CG2 3.31Å; A606-V610 WeakPolarHBondContact O-CG2 3.34Å; A606-V610 PolarHBondContact O-N 3.19Å; M607-V610 PolarHBondContact O-N 3.33Å; E608-V610 PolarHBondContact O-N 3.15Å; V610-C612 VanDerWaalsContact C-N 3.32Å; V610-C612 PolarHBondContact O-N 3.19Å; V610-L613 PolarHBondContact O-N 3.3Å; V610-H614 WeakPolarHBondContact O-CB 3.35Å; V610-H614 PolarHBondContact O-N 3.2Å; V610-H614 VanDerWaalsContact O-N 3.09Å; V610-H614 PolarHBondContact O-ND1 3.15Å; V610-L641 HydrophobicContact CG1-CD1 3.51Å; V610-L641 VanDerWaalsContact CG1-CD1 3.48Å; V610-L641 HydrophobicContact CG1-CD2 3.5Å; V610-L641 VanDerWaalsContact CG1-CD2 3.5Å; V610-L641 HydrophobicContact CG2-CD1 4.37Å; V610-W663 HydrophobicContact CB-CZ2 3.87Å; V610-W663 HydrophobicContact CG1-CH2 4.41Å; V610-W663 HydrophobicContact CG1-CZ2 3.65Å; V610-W663 HydrophobicContact CG2-CZ2 4.36Å; V610-L667 HydrophobicContact CG1-CD1 3.96Å |
| 611 | L | 97 | Very high | 92.6 | Very high | 20 Ų | 20 | 34.4 Ų | 34.4 | 11% | 0.105 | 17% | 0.166 | C | C | . | . | H | α-helix | trans | -60.9 | -43 | 176.1 | -75.2 | -177.7 | 0 | 0 | 0 | 111.8 | M607 E608 A609 H614 Q615 Q666 L667 Y670 | M607-L611 PolarHBondContact O-N 2.93Å; M607-L611 VanDerWaalsContact O-N 3.1Å; E608-L611 PolarHBondContact O-N 3.11Å; A609-L611 VanDerWaalsContact C-N 3.33Å; A609-L611 PolarHBondContact O-N 3.22Å; L611-H614 PolarHBondContact O-N 3.34Å; L611-Q615 PolarHBondContact O-N 3.14Å; L611-Q666 HydrophobicContact CD1-CB 4.33Å; L611-Q666 HydrophobicContact CD1-CG 4.06Å; L611-Q666 HydrophobicContact CD2-CB 3.98Å; L611-Q666 HydrophobicContact CD2-CG 3.93Å; L611-L667 HydrophobicContact CD2-CB 4.06Å; L611-L667 HydrophobicContact CD2-CD1 4.33Å; L611-Y670 HydrophobicContact CB-CE2 4.15Å; L611-Y670 HydrophobicContact CD2-CD2 4.2Å; L611-Y670 HydrophobicContact CD2-CE2 4.16Å |
| 612 | C | 95.6 | Very high | 92.8 | Very high | 14.6667 Ų | 14.6667 | 28.6 Ų | 28.6 | 10% | 0.099 | 14% | 0.139 | C | C | . | . | H | α-helix | trans | -59.3 | -49.6 | 176.1 | -177.4 | 0 | 0 | 0 | 0 | 111.1 | C549 E608 A609 V610 H614 Q615 N618 | C549-C612 PolarHBondContact O-SG 3.02Å; E608-C612 WeakPolarHBondContact O-CB 3.38Å; E608-C612 PolarHBondContact O-N 3.08Å; A609-C612 WeakPolarHBondContact O-CB 3.33Å; A609-C612 PolarHBondContact O-N 3.29Å; V610-C612 VanDerWaalsContact C-N 3.32Å; V610-C612 PolarHBondContact O-N 3.19Å; C612-H614 PolarHBondContact O-N 2.96Å; C612-Q615 WeakPolarHBondContact O-CB 3.37Å; C612-Q615 PolarHBondContact O-N 3.37Å; C612-Q615 VanDerWaalsContact O-N 3.14Å; C612-N618 PolarHBondContact O-ND2 3.26Å |
| 613 | L | 94.5 | Very high | 92.3 | Very high | 0.666667 Ų | 0.666667 | 28.8 Ų | 28.8 | 0% | 0.003 | 14% | 0.14 | C | C | . | . | H | α-helix | trans | -62.5 | -27.2 | 179.3 | -66.8 | 179.3 | 0 | 0 | 0 | 113.6 | M548 P552 L556 V585 V586 L589 A609 V610 W622 | M548-L613 HydrophobicContact CG-CD2 4.12Å; M548-L613 HydrophobicContact CG-CG 4.38Å; M548-L613 HydrophobicContact SD-CD1 3.78Å; M548-L613 HydrophobicContact SD-CD2 4.38Å; M548-L613 HydrophobicContact SD-CG 4.27Å; P552-L613 HydrophobicContact CB-CD2 3.83Å; L556-L613 HydrophobicContact CD1-CD2 4.01Å; L556-L613 HydrophobicContact CD2-CD2 4.08Å; L556-L613 HydrophobicContact CG-CD2 4.03Å; V585-L613 HydrophobicContact CG1-CD1 4.16Å; V586-L613 HydrophobicContact CG2-CD1 4.06Å; L589-L613 HydrophobicContact CD1-CD1 3.96Å; A609-L613 WeakPolarHBondContact O-CG 3.36Å; A609-L613 PolarHBondContact O-N 3.12Å; V610-L613 PolarHBondContact O-N 3.3Å; L613-W622 WeakPolarHBondContact O-CZ2 3.41Å; L613-W622 PolarHBondContact O-NE1 3.05Å; L613-W622 VanDerWaalsContact O-NE1 3.15Å |
| 614 | H | 95.8 | Very high | 91.4 | Very high | 1.33333 Ų | 1.33333 | 33.3 Ų | 33.3 | 1% | 0.006 | 16% | 0.163 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -90.8 | -0.8 | 178.9 | -75.3 | 73.9 | 0 | 0 | 0 | 114.2 | V610 L611 C612 V619 W622 L667 Y670 | V610-H614 WeakPolarHBondContact O-CB 3.35Å; V610-H614 PolarHBondContact O-N 3.2Å; V610-H614 VanDerWaalsContact O-N 3.09Å; V610-H614 PolarHBondContact O-ND1 3.15Å; L611-H614 PolarHBondContact O-N 3.34Å; C612-H614 PolarHBondContact O-N 2.96Å; H614-V619 WeakPolarHBondContact O-CG2 3.34Å; H614-W622 AromaticContact CD2-CH2 3.76Å; H614-W622 AromaticContact CE1-CH2 3.88Å; H614-W622 AromaticContact NE2-CH2 3.57Å; H614-L667 HydrophobicContact CB-CD1 3.75Å; H614-L667 VanDerWaalsContact CD2-CD1 3.47Å; H614-L667 WeakPolarHBondContact CD2-CD1 3.45Å; H614-L667 VanDerWaalsContact CG-CD1 3.43Å; H614-Y670 WeakPolarHBondContact O-CB 3.26Å |
| 615 | Q | 96.1 | Very high | 90.6 | Very high | 62 Ų | 62 | 32.4 Ų | 32.4 | 29% | 0.29 | 17% | 0.168 | S | C | . | . | S | Bend | trans | -59.3 | 140.2 | 170.8 | -70.2 | -179.2 | -18.3 | 0 | 0 | 110 | L611 C612 E617 N618 V619 Y670 | L611-Q615 PolarHBondContact O-N 3.14Å; C612-Q615 WeakPolarHBondContact O-CB 3.37Å; C612-Q615 PolarHBondContact O-N 3.37Å; C612-Q615 VanDerWaalsContact O-N 3.14Å; Q615-E617 VanDerWaalsContact C-N 3.26Å; Q615-E617 PolarHBondContact O-N 3.16Å; Q615-E617 VanDerWaalsContact O-N 3.11Å; Q615-N618 WeakPolarHBondContact O-CA 3.46Å; Q615-N618 PolarHBondContact O-N 3.01Å; Q615-V619 PolarHBondContact O-N 3.01Å; Q615-Y670 HydrophobicContact CG-CD2 4.4Å; Q615-Y670 HydrophobicContact CG-CE1 4.41Å; Q615-Y670 HydrophobicContact CG-CE2 4.01Å |
| 616 | P | 94.2 | Very high | 90.2 | Very high | 13.6667 Ų | 13.6667 | 33.4 Ų | 33.4 | 9% | 0.089 | 18% | 0.178 | C | C | . | . | H | α-helix | trans | -50.9 | -42.1 | -172.9 | -29.7 | 35.4 | 0 | 0 | 0 | 114.2 | N618 V619 E620 L673 F674 | P616-N618 VanDerWaalsContact C-N 3.26Å; P616-N618 PolarHBondContact O-N 3.03Å; P616-V619 PolarHBondContact O-N 3.03Å; P616-E620 PolarHBondContact O-N 3.01Å; P616-L673 HydrophobicContact CG-CB 4.06Å; P616-L673 HydrophobicContact CG-CD2 3.73Å; P616-L673 HydrophobicContact CG-CG 3.89Å; P616-F674 HydrophobicContact CB-CB 4.3Å; P616-F674 HydrophobicContact CB-CD2 4.14Å; P616-F674 HydrophobicContact CG-CB 4.44Å |
| 617 | E | 91.9 | Very high | 89.9 | Confident | 132.667 Ų | 132.667 | 37 Ų | 37 | 62% | 0.62 | 20% | 0.197 | S | C | * | . | H | α-helix | trans | -65.3 | -27.6 | -179.8 | -54.8 | 107.5 | -171.3 | 0 | 0 | 113.1 | Q615 | Q615-E617 VanDerWaalsContact C-N 3.26Å; Q615-E617 PolarHBondContact O-N 3.16Å; Q615-E617 VanDerWaalsContact O-N 3.11Å |
| 618 | N | 92.6 | Very high | 89.5 | Confident | 14.3333 Ų | 14.3333 | 38.4 Ų | 38.4 | 8% | 0.077 | 21% | 0.208 | C | C | . | . | H | α-helix | trans | -87.3 | -33 | 177.3 | -66.8 | -38.3 | 0 | 0 | 0 | 111.7 | P552 L556 C612 Q615 P616 E620 L621 W622 | P552-N618 WeakPolarHBondContact CG-OD1 3.4Å; L556-N618 HydrophobicContact CD1-CB 4.16Å; C612-N618 PolarHBondContact O-ND2 3.26Å; Q615-N618 WeakPolarHBondContact O-CA 3.46Å; Q615-N618 PolarHBondContact O-N 3.01Å; P616-N618 VanDerWaalsContact C-N 3.26Å; P616-N618 PolarHBondContact O-N 3.03Å; N618-E620 VanDerWaalsContact C-N 3.27Å; N618-E620 PolarHBondContact O-N 3.4Å; N618-L621 WeakPolarHBondContact O-CB 3.38Å; N618-L621 PolarHBondContact O-N 3.1Å; N618-L621 VanDerWaalsContact O-N 3.09Å; N618-W622 PolarHBondContact O-NE1 3.08Å |
| 619 | V | 92.3 | Very high | 89 | Confident | 0.333333 Ų | 0.333333 | 35.1 Ų | 35.1 | 0% | 0.002 | 19% | 0.194 | C | C | . | . | H | α-helix | trans | -61.2 | -37.7 | 174.6 | 176.9 | 0 | 0 | 0 | 0 | 111 | H614 Q615 P616 L621 W622 T630 L634 F674 | H614-V619 WeakPolarHBondContact O-CG2 3.34Å; Q615-V619 PolarHBondContact O-N 3.01Å; P616-V619 PolarHBondContact O-N 3.03Å; V619-L621 PolarHBondContact O-N 3.22Å; V619-W622 HydrophobicContact CB-CD2 4.49Å; V619-W622 HydrophobicContact CG1-CD2 4.25Å; V619-W622 HydrophobicContact CG1-CE3 4.34Å; V619-W622 HydrophobicContact CG2-CH2 4.38Å; V619-W622 HydrophobicContact CG2-CZ2 3.88Å; V619-W622 WeakPolarHBondContact O-CB 3.33Å; V619-W622 PolarHBondContact O-N 3.07Å; V619-T630 HydrophobicContact CG1-CG2 4.11Å; V619-T630 WeakPolarHBondContact O-CG2 3.31Å; V619-L634 HydrophobicContact CG1-CB 4.23Å; V619-L634 HydrophobicContact CG1-CD1 4.12Å; V619-L634 HydrophobicContact CG1-CD2 4.36Å; V619-L634 HydrophobicContact CG1-CG 4.45Å; V619-L634 HydrophobicContact CG2-CD1 4.31Å; V619-F674 HydrophobicContact CB-CD2 3.83Å; V619-F674 HydrophobicContact CB-CE2 3.87Å; V619-F674 HydrophobicContact CB-CG 4.4Å; V619-F674 HydrophobicContact CB-CZ 4.47Å; V619-F674 HydrophobicContact CG1-CD1 4.19Å; V619-F674 HydrophobicContact CG1-CD2 3.8Å; V619-F674 HydrophobicContact CG1-CE1 3.99Å; V619-F674 HydrophobicContact CG1-CE2 3.62Å; V619-F674 HydrophobicContact CG1-CG 4.08Å; V619-F674 HydrophobicContact CG1-CZ 3.72Å |
| 620 | E | 89.3 | Confident | 88.8 | Confident | 94.3333 Ų | 94.3333 | 35.3 Ų | 35.3 | 44% | 0.441 | 20% | 0.195 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -54.4 | -25.5 | 173.9 | -70.9 | -178.5 | -175 | 0 | 0 | 113.5 | P616 N618 F674 | P616-E620 PolarHBondContact O-N 3.01Å; N618-E620 VanDerWaalsContact C-N 3.27Å; N618-E620 PolarHBondContact O-N 3.4Å; E620-F674 HydrophobicContact CG-CE2 3.84Å |
| 621 | L | 86.8 | Confident | 88.5 | Confident | 45.6667 Ų | 45.6667 | 35.3 Ų | 35.3 | 24% | 0.239 | 20% | 0.195 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -87.1 | -10.4 | -178.7 | -54.9 | 176.4 | 0 | 0 | 0 | 113.7 | K553 L556 N618 V619 Q623 L624 | K553-L621 HydrophobicContact CD-CD1 4.28Å; K553-L621 HydrophobicContact CG-CD1 3.75Å; L556-L621 HydrophobicContact CB-CB 4.42Å; L556-L621 HydrophobicContact CD1-CB 4.34Å; L556-L621 HydrophobicContact CD1-CD1 4.44Å; N618-L621 WeakPolarHBondContact O-CB 3.38Å; N618-L621 PolarHBondContact O-N 3.1Å; N618-L621 VanDerWaalsContact O-N 3.09Å; V619-L621 PolarHBondContact O-N 3.22Å; L621-Q623 VanDerWaalsContact C-N 3.33Å; L621-Q623 PolarHBondContact O-N 3.01Å; L621-L624 HydrophobicContact CD2-CD2 4.38Å |
| 622 | W | 87.9 | Confident | 88.2 | Confident | 4.66667 Ų | 4.66667 | 39 Ų | 39 | 2% | 0.018 | 21% | 0.212 | C | C | . | . | S | Bend | trans | -64.4 | -38.6 | -176.1 | -67.3 | 10.1 | 0 | 0 | 0 | 111.9 | T582 L613 H614 N618 V619 L634 I637 | T582-W622 HydrophobicContact CG2-CD2 3.84Å; T582-W622 HydrophobicContact CG2-CE3 4.4Å; T582-W622 HydrophobicContact CG2-CG 3.9Å; T582-W622 HydrophobicContact CG2-CZ2 4.47Å; L613-W622 WeakPolarHBondContact O-CZ2 3.41Å; L613-W622 PolarHBondContact O-NE1 3.05Å; L613-W622 VanDerWaalsContact O-NE1 3.15Å; H614-W622 AromaticContact CD2-CH2 3.76Å; H614-W622 AromaticContact CE1-CH2 3.88Å; H614-W622 AromaticContact NE2-CH2 3.57Å; N618-W622 PolarHBondContact O-NE1 3.08Å; V619-W622 HydrophobicContact CB-CD2 4.49Å; V619-W622 HydrophobicContact CG1-CD2 4.25Å; V619-W622 HydrophobicContact CG1-CE3 4.34Å; V619-W622 HydrophobicContact CG2-CH2 4.38Å; V619-W622 HydrophobicContact CG2-CZ2 3.88Å; V619-W622 WeakPolarHBondContact O-CB 3.33Å; V619-W622 PolarHBondContact O-N 3.07Å; W622-L634 HydrophobicContact CH2-CD1 4.1Å; W622-L634 HydrophobicContact CZ3-CB 4.39Å; W622-L634 HydrophobicContact CZ3-CD1 4.08Å; W622-I637 HydrophobicContact CE3-CD1 3.87Å; W622-I637 HydrophobicContact CH2-CB 4.4Å; W622-I637 HydrophobicContact CH2-CG2 4.17Å; W622-I637 HydrophobicContact CZ3-CB 3.92Å; W622-I637 HydrophobicContact CZ3-CD1 3.84Å; W622-I637 HydrophobicContact CZ3-CG1 4.41Å; W622-I637 HydrophobicContact CZ3-CG2 4.15Å |
| 623 | Q | 78 | Confident | 87.9 | Confident | 9 Ų | 9 | 38.7 Ų | 38.7 | 4% | 0.042 | 21% | 0.21 | C | C | . | . | trans | -143.6 | 92.2 | 179.7 | -138.3 | 100.2 | -35.7 | 0 | 0 | 112.1 | V575 L621 A625 A629 T630 S633 | V575-Q623 PolarHBondContact O-NE2 3.49Å; L621-Q623 VanDerWaalsContact C-N 3.33Å; L621-Q623 PolarHBondContact O-N 3.01Å; Q623-A625 HydrophobicContact CG-CB 4.37Å; Q623-A625 PolarHBondContact O-N 3.22Å; Q623-A625 VanDerWaalsContact O-N 3.12Å; Q623-A629 HydrophobicContact CB-CB 4.37Å; Q623-A629 HydrophobicContact CG-CB 3.6Å; Q623-A629 PolarHBondContact OE1-O 3.4Å; Q623-T630 PolarHBondContact O-OG1 2.92Å; Q623-S633 PolarHBondContact NE2-OG 3.19Å; Q623-S633 PolarHBondContact OE1-OG 3.02Å | ||
| 624 | L | 70.6 | Confident | 87.9 | Confident | 95.6667 Ų | 95.6667 | 38.7 Ų | 38.7 | 50% | 0.501 | 21% | 0.21 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -69.5 | -7.8 | -178.5 | -64.4 | 169.5 | 0 | 0 | 0 | 114.7 | A559 L621 | A559-L624 HydrophobicContact CB-CD1 4.08Å; L621-L624 HydrophobicContact CD2-CD2 4.38Å |
| 625 | A | 72.4 | Confident | 87.8 | Confident | 56 Ų | 56 | 38.8 Ų | 38.8 | 46% | 0.463 | 21% | 0.211 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -74.4 | -40.1 | -174.6 | 0 | 0 | 0 | 0 | 0 | 113.1 | V575 Q623 | V575-A625 HydrophobicContact CB-CB 4.48Å; V575-A625 HydrophobicContact CG1-CB 3.91Å; V575-A625 HydrophobicContact CG2-CB 3.69Å; Q623-A625 HydrophobicContact CG-CB 4.37Å; Q623-A625 PolarHBondContact O-N 3.22Å; Q623-A625 VanDerWaalsContact O-N 3.12Å |
| 626 | S | 82.1 | Confident | 87.6 | Confident | 48.3333 Ų | 48.3333 | 39.2 Ų | 39.2 | 34% | 0.338 | 21% | 0.212 | S | C | . | . | trans | -162.1 | 147.1 | 174.5 | 70.3 | 0 | 0 | 0 | 0 | 110.7 | S628 A629 T630 | S626-S628 VanDerWaalsContact C-N 3.26Å; S626-S628 PolarHBondContact O-N 3.19Å; S626-S628 PolarHBondContact OG-OG 3.03Å; S626-S628 VanDerWaalsContact OG-OG 3.13Å; S626-A629 WeakPolarHBondContact O-CB 2.96Å; S626-A629 PolarHBondContact O-N 3.17Å; S626-A629 VanDerWaalsContact O-N 3.16Å; S626-A629 VanDerWaalsContact OG-CB 3.23Å; S626-A629 WeakPolarHBondContact OG-CB 3.21Å; S626-A629 PolarHBondContact OG-N 3.37Å; S626-T630 PolarHBondContact O-N 3.04Å; S626-T630 VanDerWaalsContact O-N 3.13Å; S626-T630 PolarHBondContact O-OG1 3.17Å | ||
| 627 | L | 87.5 | Confident | 87.5 | Confident | 75 Ų | 75 | 38.6 Ų | 38.6 | 39% | 0.393 | 21% | 0.209 | S | C | . | . | H | α-helix | trans | -61.8 | -34.6 | 178.2 | -172.7 | 67.9 | 0 | 0 | 0 | 112.3 | A629 T630 V631 F674 H678 I681 | L627-A629 VanDerWaalsContact C-N 3.35Å; L627-A629 PolarHBondContact O-N 3.11Å; L627-T630 WeakPolarHBondContact O-CB 3.36Å; L627-T630 PolarHBondContact O-N 3.12Å; L627-V631 WeakPolarHBondContact O-CG2 3.34Å; L627-V631 PolarHBondContact O-N 3.34Å; L627-F674 HydrophobicContact CD1-CZ 4.44Å; L627-H678 HydrophobicContact CD2-CB 4.35Å; L627-H678 WeakPolarHBondContact CD2-ND1 3.36Å; L627-I681 HydrophobicContact CB-CD1 4.17Å; L627-I681 HydrophobicContact CD2-CD1 3.48Å; L627-I681 VanDerWaalsContact CD2-CD1 3.48Å; L627-I681 HydrophobicContact CD2-CG1 4.5Å; L627-I681 HydrophobicContact CG-CD1 3.53Å |
| 628 | S | 87.3 | Confident | 87.6 | Confident | 36.6667 Ų | 36.6667 | 32.4 Ų | 32.4 | 26% | 0.256 | 18% | 0.179 | S | C | . | . | H | α-helix | trans | -61.9 | -41.7 | 175.2 | 54.5 | 0 | 0 | 0 | 0 | 112.4 | S626 T630 V631 Q632 Y684 | S626-S628 VanDerWaalsContact C-N 3.26Å; S626-S628 PolarHBondContact O-N 3.19Å; S626-S628 PolarHBondContact OG-OG 3.03Å; S626-S628 VanDerWaalsContact OG-OG 3.13Å; S628-T630 VanDerWaalsContact C-N 3.33Å; S628-T630 PolarHBondContact O-N 3.16Å; S628-V631 PolarHBondContact O-N 2.95Å; S628-Q632 WeakPolarHBondContact O-CB 3.33Å; S628-Q632 PolarHBondContact O-N 3.4Å; S628-Y684 VanDerWaalsContact O-CD1 3.23Å; S628-Y684 WeakPolarHBondContact O-CD1 3.47Å |
| 629 | A | 85.3 | Confident | 87.7 | Confident | 12.3333 Ų | 12.3333 | 31.7 Ų | 31.7 | 10% | 0.102 | 18% | 0.176 | C | C | . | . | H | α-helix | trans | -66.6 | -38.7 | 175.4 | 0 | 0 | 0 | 0 | 0 | 110.9 | Q623 S626 L627 V631 Q632 S633 | Q623-A629 HydrophobicContact CB-CB 4.37Å; Q623-A629 HydrophobicContact CG-CB 3.6Å; Q623-A629 PolarHBondContact OE1-O 3.4Å; S626-A629 WeakPolarHBondContact O-CB 2.96Å; S626-A629 PolarHBondContact O-N 3.17Å; S626-A629 VanDerWaalsContact O-N 3.16Å; S626-A629 VanDerWaalsContact OG-CB 3.23Å; S626-A629 WeakPolarHBondContact OG-CB 3.21Å; S626-A629 PolarHBondContact OG-N 3.37Å; L627-A629 VanDerWaalsContact C-N 3.35Å; L627-A629 PolarHBondContact O-N 3.11Å; A629-V631 VanDerWaalsContact C-N 3.28Å; A629-V631 PolarHBondContact O-N 2.8Å; A629-Q632 CarbonylContact O-C 3.48Å; A629-Q632 WeakPolarHBondContact O-CA 3.31Å; A629-Q632 VanDerWaalsContact O-CB 3.29Å; A629-Q632 WeakPolarHBondContact O-CB 3.42Å; A629-Q632 PolarHBondContact O-N 3.23Å; A629-S633 WeakPolarHBondContact O-CB 3.32Å; A629-S633 PolarHBondContact O-N 3.1Å; A629-S633 PolarHBondContact O-OG 3.18Å |
| 630 | T | 90 | Very high | 87.8 | Confident | 3.66667 Ų | 3.66667 | 34.2 Ų | 34.2 | 2% | 0.022 | 19% | 0.188 | C | C | . | . | H | α-helix | trans | -58.6 | -47.1 | 173.8 | -48.6 | 0 | 0 | 0 | 0 | 112 | V619 Q623 S626 L627 S628 Q632 S633 L634 F674 | V619-T630 HydrophobicContact CG1-CG2 4.11Å; V619-T630 WeakPolarHBondContact O-CG2 3.31Å; Q623-T630 PolarHBondContact O-OG1 2.92Å; S626-T630 PolarHBondContact O-N 3.04Å; S626-T630 VanDerWaalsContact O-N 3.13Å; S626-T630 PolarHBondContact O-OG1 3.17Å; L627-T630 WeakPolarHBondContact O-CB 3.36Å; L627-T630 PolarHBondContact O-N 3.12Å; S628-T630 VanDerWaalsContact C-N 3.33Å; S628-T630 PolarHBondContact O-N 3.16Å; T630-Q632 VanDerWaalsContact C-N 3.34Å; T630-Q632 PolarHBondContact O-N 3.05Å; T630-S633 PolarHBondContact O-N 3.03Å; T630-L634 WeakPolarHBondContact O-CB 3.49Å; T630-L634 PolarHBondContact O-N 3.06Å; T630-F674 HydrophobicContact CG2-CE1 4.48Å; T630-F674 HydrophobicContact CG2-CZ 3.85Å |
| 631 | V | 91.8 | Very high | 88.1 | Confident | 0 Ų | 0 | 29.7 Ų | 29.7 | 0% | 0 | 17% | 0.167 | C | C | . | . | H | α-helix | trans | -62.5 | -41.8 | 177.3 | 177.1 | 0 | 0 | 0 | 0 | 111 | L627 S628 A629 S633 L634 W635 F674 L675 I681 Y684 | L627-V631 WeakPolarHBondContact O-CG2 3.34Å; L627-V631 PolarHBondContact O-N 3.34Å; S628-V631 PolarHBondContact O-N 2.95Å; A629-V631 VanDerWaalsContact C-N 3.28Å; A629-V631 PolarHBondContact O-N 2.8Å; V631-S633 PolarHBondContact O-N 3.22Å; V631-L634 WeakPolarHBondContact O-CB 3.36Å; V631-L634 PolarHBondContact O-N 3.4Å; V631-W635 PolarHBondContact O-N 3.32Å; V631-F674 HydrophobicContact CG2-CE1 3.92Å; V631-L675 HydrophobicContact CG1-CD2 4.19Å; V631-I681 HydrophobicContact CG2-CD1 3.76Å; V631-I681 HydrophobicContact CG2-CG1 4.14Å; V631-Y684 WeakPolarHBondContact CG1-O 3.42Å |
| 632 | Q | 90.3 | Very high | 88.5 | Confident | 97.6667 Ų | 97.6667 | 27.7 Ų | 27.7 | 46% | 0.456 | 16% | 0.156 | S | C | . | . | H | α-helix | trans | -62.2 | -43.3 | 175.8 | -174.5 | 175.9 | 2.5 | 0 | 0 | 112.2 | S628 A629 T630 L634 W635 H636 Y684 | S628-Q632 WeakPolarHBondContact O-CB 3.33Å; S628-Q632 PolarHBondContact O-N 3.4Å; A629-Q632 CarbonylContact O-C 3.48Å; A629-Q632 WeakPolarHBondContact O-CA 3.31Å; A629-Q632 VanDerWaalsContact O-CB 3.29Å; A629-Q632 WeakPolarHBondContact O-CB 3.42Å; A629-Q632 PolarHBondContact O-N 3.23Å; T630-Q632 VanDerWaalsContact C-N 3.34Å; T630-Q632 PolarHBondContact O-N 3.05Å; Q632-L634 VanDerWaalsContact C-N 3.34Å; Q632-W635 PolarHBondContact O-N 3.02Å; Q632-H636 WeakPolarHBondContact O-CB 3.29Å; Q632-H636 PolarHBondContact O-N 3.39Å; Q632-Y684 HydrophobicContact CB-CD1 4.12Å; Q632-Y684 HydrophobicContact CB-CE1 4.32Å |
| 633 | S | 89.5 | Confident | 88.9 | Confident | 8.33333 Ų | 8.33333 | 29.7 Ų | 29.7 | 6% | 0.058 | 17% | 0.165 | C | C | . | . | H | α-helix | trans | -66.2 | -36.9 | 175.5 | -68 | 0 | 0 | 0 | 0 | 112.1 | S579 Q623 A629 T630 V631 H636 I637 | S579-S633 PolarHBondContact OG-OG 3.38Å; Q623-S633 PolarHBondContact NE2-OG 3.19Å; Q623-S633 PolarHBondContact OE1-OG 3.02Å; A629-S633 WeakPolarHBondContact O-CB 3.32Å; A629-S633 PolarHBondContact O-N 3.1Å; A629-S633 PolarHBondContact O-OG 3.18Å; T630-S633 PolarHBondContact O-N 3.03Å; V631-S633 PolarHBondContact O-N 3.22Å; S633-H636 PolarHBondContact O-N 3.06Å; S633-I637 WeakPolarHBondContact O-CB 3.23Å; S633-I637 VanDerWaalsContact O-CG1 3.32Å; S633-I637 WeakPolarHBondContact O-CG1 3.41Å; S633-I637 PolarHBondContact O-N 3.09Å |
| 634 | L | 93.7 | Very high | 89.6 | Confident | 0.333333 Ų | 0.333333 | 33.1 Ų | 33.1 | 0% | 0.002 | 18% | 0.181 | C | C | . | . | H | α-helix | trans | -57.2 | -52 | 170.8 | 178.4 | 64.6 | 0 | 0 | 0 | 110.8 | V619 W622 T630 V631 Q632 H636 S638 R671 F674 L675 | V619-L634 HydrophobicContact CG1-CB 4.23Å; V619-L634 HydrophobicContact CG1-CD1 4.12Å; V619-L634 HydrophobicContact CG1-CD2 4.36Å; V619-L634 HydrophobicContact CG1-CG 4.45Å; V619-L634 HydrophobicContact CG2-CD1 4.31Å; W622-L634 HydrophobicContact CH2-CD1 4.1Å; W622-L634 HydrophobicContact CZ3-CB 4.39Å; W622-L634 HydrophobicContact CZ3-CD1 4.08Å; T630-L634 WeakPolarHBondContact O-CB 3.49Å; T630-L634 PolarHBondContact O-N 3.06Å; V631-L634 WeakPolarHBondContact O-CB 3.36Å; V631-L634 PolarHBondContact O-N 3.4Å; Q632-L634 VanDerWaalsContact C-N 3.34Å; L634-H636 VanDerWaalsContact C-N 3.34Å; L634-H636 PolarHBondContact O-N 3.14Å; L634-S638 VanDerWaalsContact O-CB 3.25Å; L634-S638 WeakPolarHBondContact O-CB 3.4Å; L634-S638 PolarHBondContact O-N 3.29Å; L634-S638 VanDerWaalsContact O-N 3.1Å; L634-S638 PolarHBondContact O-OG 3.15Å; L634-R671 HydrophobicContact CD1-CG 4.34Å; L634-R671 HydrophobicContact CD2-CG 4.08Å; L634-R671 HydrophobicContact CG-CG 4.24Å; L634-F674 HydrophobicContact CD2-CB 4.18Å; L634-F674 HydrophobicContact CD2-CD1 3.32Å; L634-F674 HydrophobicContact CD2-CE1 3.95Å; L634-F674 HydrophobicContact CD2-CG 3.99Å; L634-L675 HydrophobicContact CD2-CD2 4.25Å; L634-L675 HydrophobicContact CD2-CG 4.35Å |
| 635 | W | 93.5 | Very high | 90.8 | Very high | 3.66667 Ų | 3.66667 | 28.6 Ų | 28.6 | 1% | 0.014 | 16% | 0.157 | C | C | . | . | H | α-helix | trans | -56 | -50.9 | 177.2 | -81.1 | 113.2 | 0 | 0 | 0 | 111.7 | V631 Q632 S638 S639 R671 L675 A682 Y684 C691 E727 R731 | V631-W635 PolarHBondContact O-N 3.32Å; Q632-W635 PolarHBondContact O-N 3.02Å; W635-S638 PolarHBondContact O-OG 3.48Å; W635-S639 WeakPolarHBondContact O-CB 3.4Å; W635-S639 PolarHBondContact O-N 3.11Å; W635-S639 VanDerWaalsContact O-N 3.14Å; W635-S639 PolarHBondContact O-OG 2.98Å; W635-R671 VanDerWaalsContact CE3-CZ 3.44Å; W635-R671 VanDerWaalsContact CZ3-NH1 3.28Å; W635-R671 PolarHBondContact O-NH2 2.85Å; W635-L675 HydrophobicContact CH2-CD1 3.8Å; W635-L675 HydrophobicContact CZ2-CD1 3.46Å; W635-L675 VanDerWaalsContact CZ2-CD1 3.46Å; W635-L675 HydrophobicContact CZ2-CD2 3.99Å; W635-L675 HydrophobicContact CZ2-CG 4.39Å; W635-A682 PolarHBondContact NE1-O 3.31Å; W635-Y684 VanDerWaalsContact CD1-O 3.23Å; W635-C691 HydrophobicContact CE3-CB 4.34Å; W635-E727 HydrophobicContact CH2-CG 4.2Å; W635-E727 WeakPolarHBondContact CH2-OE1 3.46Å; W635-E727 WeakPolarHBondContact CZ3-OE1 2.98Å; W635-R731 HydrophobicContact CZ2-CG 4.4Å |
| 636 | H | 91.5 | Very high | 92 | Very high | 71 Ų | 71 | 25.9 Ų | 25.9 | 33% | 0.329 | 14% | 0.135 | S | C | . | . | H | α-helix | trans | -64.6 | -55.2 | -176.1 | -173 | 74.2 | 0 | 0 | 0 | 112.9 | Q632 S633 L634 S639 Q640 D688 | Q632-H636 WeakPolarHBondContact O-CB 3.29Å; Q632-H636 PolarHBondContact O-N 3.39Å; S633-H636 PolarHBondContact O-N 3.06Å; L634-H636 VanDerWaalsContact C-N 3.34Å; L634-H636 PolarHBondContact O-N 3.14Å; H636-S639 PolarHBondContact O-N 2.96Å; H636-Q640 WeakPolarHBondContact O-CB 3.39Å; H636-Q640 PolarHBondContact O-N 3.32Å; H636-D688 IonicContact ND1-OD2 3.29Å; H636-D688 PolarHBondContact ND1-OD2 3.44Å |
| 637 | I | 92.6 | Very high | 92.7 | Very high | 1.33333 Ų | 1.33333 | 27.1 Ų | 27.1 | 1% | 0.007 | 14% | 0.135 | C | C | . | . | H | α-helix | trans | -66.4 | -46.5 | -174.9 | -64.5 | 171.5 | 0 | 0 | 0 | 110.8 | T582 V586 W622 S633 S639 Q640 L641 | T582-I637 HydrophobicContact CG2-CD1 4.09Å; V586-I637 HydrophobicContact CB-CG2 3.92Å; V586-I637 HydrophobicContact CG1-CG2 3.75Å; V586-I637 HydrophobicContact CG2-CG2 4.01Å; W622-I637 HydrophobicContact CE3-CD1 3.87Å; W622-I637 HydrophobicContact CH2-CB 4.4Å; W622-I637 HydrophobicContact CH2-CG2 4.17Å; W622-I637 HydrophobicContact CZ3-CB 3.92Å; W622-I637 HydrophobicContact CZ3-CD1 3.84Å; W622-I637 HydrophobicContact CZ3-CG1 4.41Å; W622-I637 HydrophobicContact CZ3-CG2 4.15Å; S633-I637 WeakPolarHBondContact O-CB 3.23Å; S633-I637 VanDerWaalsContact O-CG1 3.32Å; S633-I637 WeakPolarHBondContact O-CG1 3.41Å; S633-I637 PolarHBondContact O-N 3.09Å; I637-S639 VanDerWaalsContact C-N 3.34Å; I637-S639 PolarHBondContact O-N 3.21Å; I637-Q640 PolarHBondContact O-N 3.27Å; I637-L641 WeakPolarHBondContact O-CB 3.34Å; I637-L641 PolarHBondContact O-N 3.05Å; I637-L641 VanDerWaalsContact O-N 3.1Å |
| 638 | S | 94.5 | Very high | 92.9 | Very high | 1.33333 Ų | 1.33333 | 26.3 Ų | 26.3 | 1% | 0.009 | 13% | 0.129 | C | C | . | . | H | α-helix | trans | -65.4 | -39.9 | 179.3 | 66.5 | 0 | 0 | 0 | 0 | 111.5 | L634 W635 L641 L642 R671 | L634-S638 VanDerWaalsContact O-CB 3.25Å; L634-S638 WeakPolarHBondContact O-CB 3.4Å; L634-S638 PolarHBondContact O-N 3.29Å; L634-S638 VanDerWaalsContact O-N 3.1Å; L634-S638 PolarHBondContact O-OG 3.15Å; W635-S638 PolarHBondContact O-OG 3.48Å; S638-L641 WeakPolarHBondContact O-CB 3.12Å; S638-L641 PolarHBondContact O-N 3.21Å; S638-L642 WeakPolarHBondContact O-CB 3.34Å; S638-L642 WeakPolarHBondContact O-CG 3.35Å; S638-L642 PolarHBondContact O-N 3.1Å; S638-R671 WeakPolarHBondContact OG-CD 3.3Å; S638-R671 PolarHBondContact OG-NE 3.38Å; S638-R671 PolarHBondContact OG-NH1 3.49Å; S638-R671 PolarHBondContact OG-NH2 3.26Å |
| 639 | S | 95.2 | Very high | 93.3 | Very high | 1 Ų | 1 | 24.6 Ų | 24.6 | 1% | 0.007 | 12% | 0.117 | C | C | . | . | H | α-helix | trans | -69.2 | -37.6 | 177.7 | -67.6 | 0 | 0 | 0 | 0 | 112.8 | W635 H636 I637 L641 L642 F643 R671 C691 A694 | W635-S639 WeakPolarHBondContact O-CB 3.4Å; W635-S639 PolarHBondContact O-N 3.11Å; W635-S639 VanDerWaalsContact O-N 3.14Å; W635-S639 PolarHBondContact O-OG 2.98Å; H636-S639 PolarHBondContact O-N 2.96Å; I637-S639 VanDerWaalsContact C-N 3.34Å; I637-S639 PolarHBondContact O-N 3.21Å; S639-L641 VanDerWaalsContact C-N 3.33Å; S639-L641 PolarHBondContact O-N 3.16Å; S639-L642 PolarHBondContact O-N 3.16Å; S639-F643 VanDerWaalsContact O-CB 3.31Å; S639-F643 WeakPolarHBondContact O-CB 3.44Å; S639-F643 PolarHBondContact O-N 2.92Å; S639-R671 PolarHBondContact OG-NH2 3.26Å; S639-C691 WeakPolarHBondContact OG-CA 3.4Å; S639-C691 PolarHBondContact OG-SG 3.04Å; S639-C691 VanDerWaalsContact OG-SG 3.41Å; S639-A694 VanDerWaalsContact O-CB 3.25Å; S639-A694 WeakPolarHBondContact O-CB 3.4Å |
| 640 | Q | 93.6 | Very high | 93.7 | Very high | 52.3333 Ų | 52.3333 | 24.7 Ų | 24.7 | 25% | 0.245 | 12% | 0.115 | C | C | . | . | H | α-helix | trans | -59 | -47 | 173.5 | -171.2 | 178.8 | 10.1 | 0 | 0 | 111.3 | S583 N587 H636 I637 F643 H644 L690 | S583-Q640 PolarHBondContact OG-OE1 2.93Å; N587-Q640 PolarHBondContact ND2-NE2 3.35Å; N587-Q640 PolarHBondContact ND2-OE1 3.27Å; N587-Q640 VanDerWaalsContact ND2-OE1 3.14Å; N587-Q640 VanDerWaalsContact OD1-CD 3.32Å; N587-Q640 PolarHBondContact OD1-NE2 2.93Å; N587-Q640 PolarHBondContact OD1-OE1 3.12Å; H636-Q640 WeakPolarHBondContact O-CB 3.39Å; H636-Q640 PolarHBondContact O-N 3.32Å; I637-Q640 PolarHBondContact O-N 3.27Å; Q640-F643 PolarHBondContact O-N 2.97Å; Q640-H644 PolarHBondContact O-N 2.97Å; Q640-H644 VanDerWaalsContact O-N 3.13Å; Q640-H644 PolarHBondContact O-ND1 3.42Å; Q640-L690 HydrophobicContact CB-CD2 3.91Å; Q640-L690 HydrophobicContact CG-CD2 4.44Å |
| 641 | L | 95.2 | Very high | 93.8 | Very high | 0 Ų | 0 | 29.4 Ų | 29.4 | 0% | 0 | 14% | 0.137 | C | C | . | . | H | α-helix | trans | -60.9 | -51.2 | 176.1 | 169.8 | 129.3 | 0 | 0 | 0 | 111.6 | V586 V590 V610 I637 S638 S639 F643 H644 V645 W663 L664 L667 | V586-L641 HydrophobicContact CG1-CD1 3.94Å; V586-L641 HydrophobicContact CG1-CD2 4.47Å; V590-L641 HydrophobicContact CB-CD1 4.37Å; V590-L641 HydrophobicContact CG1-CD1 4.2Å; V590-L641 HydrophobicContact CG2-CB 4.13Å; V590-L641 HydrophobicContact CG2-CD1 3.35Å; V590-L641 VanDerWaalsContact CG2-CD1 3.43Å; V590-L641 HydrophobicContact CG2-CG 3.86Å; V610-L641 HydrophobicContact CG1-CD1 3.51Å; V610-L641 VanDerWaalsContact CG1-CD1 3.48Å; V610-L641 HydrophobicContact CG1-CD2 3.5Å; V610-L641 VanDerWaalsContact CG1-CD2 3.5Å; V610-L641 HydrophobicContact CG2-CD1 4.37Å; I637-L641 WeakPolarHBondContact O-CB 3.34Å; I637-L641 PolarHBondContact O-N 3.05Å; I637-L641 VanDerWaalsContact O-N 3.1Å; S638-L641 WeakPolarHBondContact O-CB 3.12Å; S638-L641 PolarHBondContact O-N 3.21Å; S639-L641 VanDerWaalsContact C-N 3.33Å; S639-L641 PolarHBondContact O-N 3.16Å; L641-F643 VanDerWaalsContact C-N 3.3Å; L641-F643 PolarHBondContact O-N 2.96Å; L641-H644 PolarHBondContact O-N 3.03Å; L641-V645 HydrophobicContact CD1-CG2 3.73Å; L641-V645 HydrophobicContact CD2-CG2 4.28Å; L641-V645 WeakPolarHBondContact O-CG2 3.38Å; L641-V645 PolarHBondContact O-N 3.1Å; L641-W663 HydrophobicContact CD1-CH2 3.82Å; L641-W663 HydrophobicContact CD1-CZ2 4.37Å; L641-W663 HydrophobicContact CD1-CZ3 4.29Å; L641-W663 HydrophobicContact CD2-CH2 3.79Å; L641-W663 HydrophobicContact CD2-CZ3 4.06Å; L641-W663 HydrophobicContact CG-CH2 4.16Å; L641-L664 HydrophobicContact CD2-CD2 4.47Å; L641-L667 HydrophobicContact CD1-CD2 4.3Å; L641-L667 HydrophobicContact CD2-CD1 4.08Å; L641-L667 HydrophobicContact CD2-CD2 3.39Å; L641-L667 VanDerWaalsContact CD2-CD2 3.43Å; L641-L667 HydrophobicContact CD2-CG 4.4Å; L641-L667 HydrophobicContact CG-CD2 4.19Å |
| 642 | L | 96.2 | Very high | 93.8 | Very high | 3.33333 Ų | 3.33333 | 29.6 Ų | 29.6 | 2% | 0.017 | 14% | 0.138 | C | C | . | . | H | α-helix | trans | -56.3 | -46.8 | 179.3 | -75.2 | 171.5 | 0 | 0 | 0 | 110.5 | S638 S639 H644 V645 C646 L664 L667 L668 A694 | S638-L642 WeakPolarHBondContact O-CB 3.34Å; S638-L642 WeakPolarHBondContact O-CG 3.35Å; S638-L642 PolarHBondContact O-N 3.1Å; S639-L642 PolarHBondContact O-N 3.16Å; L642-H644 PolarHBondContact O-N 3.13Å; L642-V645 PolarHBondContact O-N 3.13Å; L642-C646 WeakPolarHBondContact O-CB 3.38Å; L642-C646 PolarHBondContact O-N 3.21Å; L642-C646 PolarHBondContact O-SG 3.08Å; L642-L664 HydrophobicContact CD2-CD2 3.65Å; L642-L667 HydrophobicContact CD2-CD2 4.23Å; L642-L667 HydrophobicContact CG-CD2 4.49Å; L642-L668 HydrophobicContact CD1-CD2 3.7Å; L642-L668 HydrophobicContact CD2-CD2 4.1Å; L642-L668 HydrophobicContact CD2-CG 4.34Å; L642-L668 HydrophobicContact CG-CD2 4.49Å; L642-A694 HydrophobicContact CB-CB 4.2Å |
| 643 | F | 95.7 | Very high | 93.6 | Very high | 46.6667 Ų | 46.6667 | 30 Ų | 30 | 21% | 0.205 | 14% | 0.14 | C | C | . | . | H | α-helix | trans | -57.4 | -50.5 | 178.8 | -178.2 | -90 | 0 | 0 | 0 | 111.8 | S639 Q640 L641 C646 Q647 L690 Q693 A694 K697 | S639-F643 VanDerWaalsContact O-CB 3.31Å; S639-F643 WeakPolarHBondContact O-CB 3.44Å; S639-F643 PolarHBondContact O-N 2.92Å; Q640-F643 PolarHBondContact O-N 2.97Å; L641-F643 VanDerWaalsContact C-N 3.3Å; L641-F643 PolarHBondContact O-N 2.96Å; F643-C646 PolarHBondContact O-N 3.07Å; F643-Q647 VanDerWaalsContact O-CB 3.28Å; F643-Q647 WeakPolarHBondContact O-CB 3.31Å; F643-Q647 PolarHBondContact O-N 3.21Å; F643-L690 HydrophobicContact CB-CD1 4.32Å; F643-L690 HydrophobicContact CG-CD1 4.4Å; F643-Q693 HydrophobicContact CD2-CB 4.13Å; F643-Q693 HydrophobicContact CE2-CB 4.11Å; F643-A694 HydrophobicContact CB-CB 4.11Å; F643-K697 HydrophobicContact CD2-CG 3.96Å; F643-K697 HydrophobicContact CE2-CG 3.96Å |
| 644 | H | 94.2 | Very high | 93.5 | Very high | 81.3333 Ų | 81.3333 | 29.7 Ų | 29.7 | 38% | 0.377 | 14% | 0.137 | S | C | . | . | H | α-helix | trans | -64.7 | -44.9 | -177.3 | -120.2 | 75 | 0 | 0 | 0 | 112.5 | V590 Q640 L641 L642 Q647 K648 | V590-H644 HydrophobicContact CG1-CB 4.18Å; Q640-H644 PolarHBondContact O-N 2.97Å; Q640-H644 VanDerWaalsContact O-N 3.13Å; Q640-H644 PolarHBondContact O-ND1 3.42Å; L641-H644 PolarHBondContact O-N 3.03Å; L642-H644 PolarHBondContact O-N 3.13Å; H644-Q647 PolarHBondContact O-N 3.13Å; H644-K648 WeakPolarHBondContact O-CG 3.4Å; H644-K648 PolarHBondContact O-N 3.19Å; H644-K648 VanDerWaalsContact O-N 3.14Å |
| 645 | V | 95.8 | Very high | 92.9 | Very high | 0 Ų | 0 | 31.4 Ų | 31.4 | 0% | 0 | 16% | 0.155 | C | C | . | . | H | α-helix | trans | -69.5 | -44 | 179.8 | 177.7 | 0 | 0 | 0 | 0 | 110.9 | V590 L641 L642 Q647 K648 L649 L654 V660 W663 L664 | V590-V645 HydrophobicContact CG1-CG2 4.35Å; L641-V645 HydrophobicContact CD1-CG2 3.73Å; L641-V645 HydrophobicContact CD2-CG2 4.28Å; L641-V645 WeakPolarHBondContact O-CG2 3.38Å; L641-V645 PolarHBondContact O-N 3.1Å; L642-V645 PolarHBondContact O-N 3.13Å; V645-Q647 VanDerWaalsContact C-N 3.31Å; V645-Q647 PolarHBondContact O-N 3.09Å; V645-K648 PolarHBondContact O-N 3.21Å; V645-K648 VanDerWaalsContact O-N 3.11Å; V645-L649 HydrophobicContact CG1-CD1 4.32Å; V645-L649 HydrophobicContact CG1-CG 4.48Å; V645-L649 WeakPolarHBondContact O-CG 3.19Å; V645-L649 PolarHBondContact O-N 3.22Å; V645-L654 HydrophobicContact CG1-CD1 4.24Å; V645-V660 HydrophobicContact CG1-CG1 3.5Å; V645-V660 VanDerWaalsContact CG1-CG1 3.45Å; V645-W663 HydrophobicContact CB-CZ3 4.43Å; V645-W663 HydrophobicContact CG1-CZ3 4.11Å; V645-W663 HydrophobicContact CG2-CH2 4.24Å; V645-W663 HydrophobicContact CG2-CZ3 4.01Å; V645-L664 HydrophobicContact CB-CD2 4.37Å; V645-L664 HydrophobicContact CG1-CD1 4.14Å; V645-L664 HydrophobicContact CG1-CD2 4.1Å; V645-L664 HydrophobicContact CG1-CG 4.31Å |
| 646 | C | 97.1 | Very high | 92.5 | Very high | 0 Ų | 0 | 32.7 Ų | 32.7 | 0% | 0 | 16% | 0.162 | C | C | . | . | H | α-helix | trans | -62 | -39.3 | 176.5 | -69.5 | 0 | 0 | 0 | 0 | 111.5 | L642 F643 K648 L649 L650 K697 V701 | L642-C646 WeakPolarHBondContact O-CB 3.38Å; L642-C646 PolarHBondContact O-N 3.21Å; L642-C646 PolarHBondContact O-SG 3.08Å; F643-C646 PolarHBondContact O-N 3.07Å; C646-K648 VanDerWaalsContact C-N 3.31Å; C646-K648 PolarHBondContact O-N 3.33Å; C646-L649 PolarHBondContact O-N 2.92Å; C646-L650 WeakPolarHBondContact O-CG 3.36Å; C646-L650 PolarHBondContact O-N 3.11Å; C646-K697 HydrophobicContact CB-CB 3.91Å; C646-V701 HydrophobicContact CB-CG2 3.76Å |
| 647 | Q | 95.4 | Very high | 92.4 | Very high | 72.3333 Ų | 72.3333 | 29.8 Ų | 29.8 | 34% | 0.338 | 15% | 0.149 | S | C | . | . | H | α-helix | trans | -59 | -43.8 | 173.7 | -172.3 | 172.8 | 11.2 | 0 | 0 | 111 | F643 H644 V645 L650 H651 | F643-Q647 VanDerWaalsContact O-CB 3.28Å; F643-Q647 WeakPolarHBondContact O-CB 3.31Å; F643-Q647 PolarHBondContact O-N 3.21Å; H644-Q647 PolarHBondContact O-N 3.13Å; V645-Q647 VanDerWaalsContact C-N 3.31Å; V645-Q647 PolarHBondContact O-N 3.09Å; Q647-L650 PolarHBondContact O-N 3.39Å; Q647-H651 PolarHBondContact O-N 3.22Å; Q647-H651 VanDerWaalsContact O-N 3.09Å; Q647-H651 PolarHBondContact O-ND1 3.09Å |
| 648 | K | 93.6 | Very high | 92.3 | Very high | 60 Ų | 60 | 30.4 Ų | 30.4 | 26% | 0.261 | 15% | 0.153 | S | C | . | . | H | α-helix | trans | -68.4 | -34.2 | 178.6 | -68.4 | -75.8 | 175.1 | 167.4 | 0 | 113.5 | V594 H644 V645 C646 H651 F652 Q653 L654 | V594-K648 HydrophobicContact CB-CG 4.45Å; V594-K648 HydrophobicContact CG1-CD 3.6Å; V594-K648 VanDerWaalsContact CG1-CE 3.43Å; V594-K648 HydrophobicContact CG1-CG 3.66Å; V594-K648 HydrophobicContact CG2-CG 4.03Å; H644-K648 WeakPolarHBondContact O-CG 3.4Å; H644-K648 PolarHBondContact O-N 3.19Å; H644-K648 VanDerWaalsContact O-N 3.14Å; V645-K648 PolarHBondContact O-N 3.21Å; V645-K648 VanDerWaalsContact O-N 3.11Å; C646-K648 VanDerWaalsContact C-N 3.31Å; C646-K648 PolarHBondContact O-N 3.33Å; K648-H651 PolarHBondContact O-N 3.47Å; K648-F652 PolarHBondContact O-N 3.28Å; K648-Q653 HydrophobicContact CD-CB 4.2Å; K648-Q653 PolarHBondContact O-N 2.84Å; K648-L654 HydrophobicContact CB-CD1 3.96Å; K648-L654 HydrophobicContact CB-CD2 4.34Å; K648-L654 HydrophobicContact CB-CG 3.99Å |
| 649 | L | 94.5 | Very high | 92.1 | Very high | 0 Ų | 0 | 34.1 Ų | 34.1 | 0% | 0 | 17% | 0.171 | C | C | . | . | H | α-helix | trans | -63.9 | -45.7 | 171.1 | -73.5 | 172.4 | 0 | 0 | 0 | 111.7 | V645 C646 H651 F652 L654 F657 V660 L661 L664 V701 Y705 | V645-L649 HydrophobicContact CG1-CD1 4.32Å; V645-L649 HydrophobicContact CG1-CG 4.48Å; V645-L649 WeakPolarHBondContact O-CG 3.19Å; V645-L649 PolarHBondContact O-N 3.22Å; C646-L649 PolarHBondContact O-N 2.92Å; L649-H651 VanDerWaalsContact C-N 3.29Å; L649-H651 PolarHBondContact O-N 3.01Å; L649-F652 WeakPolarHBondContact O-CA 3.45Å; L649-F652 WeakPolarHBondContact O-CD1 3.05Å; L649-F652 PolarHBondContact O-N 2.84Å; L649-L654 HydrophobicContact CD2-CB 4.3Å; L649-L654 HydrophobicContact CD2-CD1 3.88Å; L649-L654 HydrophobicContact CG-CD1 3.96Å; L649-F657 HydrophobicContact CD2-CB 3.89Å; L649-V660 HydrophobicContact CD1-CG1 4.17Å; L649-V660 HydrophobicContact CD2-CB 4.37Å; L649-V660 HydrophobicContact CD2-CG1 4.2Å; L649-V660 HydrophobicContact CG-CG1 4.39Å; L649-L661 HydrophobicContact CD1-CD2 3.98Å; L649-L664 HydrophobicContact CD1-CD1 3.54Å; L649-V701 HydrophobicContact CB-CG1 4.38Å; L649-V701 HydrophobicContact CB-CG2 4.04Å; L649-V701 HydrophobicContact CD1-CG1 3.9Å; L649-V701 HydrophobicContact CD1-CG2 4.49Å; L649-Y705 HydrophobicContact CB-CE2 4.06Å; L649-Y705 HydrophobicContact CD2-CE2 4.42Å; L649-Y705 WeakPolarHBondContact CD2-OH 3.33Å; L649-Y705 PolarHBondContact O-OH 3.02Å |
| 650 | L | 94.3 | Very high | 92.1 | Very high | 15 Ų | 15 | 34.1 Ų | 34.1 | 8% | 0.079 | 17% | 0.17 | C | C | . | . | H | α-helix | trans | -65.9 | -29.5 | 178.4 | -68.9 | 172 | 0 | 0 | 0 | 113.4 | C646 Q647 F652 K697 T700 V701 V704 | C646-L650 WeakPolarHBondContact O-CG 3.36Å; C646-L650 PolarHBondContact O-N 3.11Å; Q647-L650 PolarHBondContact O-N 3.39Å; L650-F652 WeakPolarHBondContact O-CD2 3.38Å; L650-F652 WeakPolarHBondContact O-CE2 3.39Å; L650-F652 PolarHBondContact O-N 2.87Å; L650-K697 HydrophobicContact CD1-CD 3.79Å; L650-T700 HydrophobicContact CD1-CG2 4Å; L650-T700 HydrophobicContact CD2-CG2 3.64Å; L650-T700 HydrophobicContact CG-CG2 4.49Å; L650-V701 HydrophobicContact CD1-CG2 4.2Å; L650-V701 HydrophobicContact CD2-CB 4.48Å; L650-V701 HydrophobicContact CD2-CG2 3.77Å; L650-V701 HydrophobicContact CG-CG2 3.61Å; L650-V704 HydrophobicContact CD2-CB 4.33Å; L650-V704 HydrophobicContact CD2-CG2 4Å |
| 651 | H | 91.8 | Very high | 92.2 | Very high | 101 Ų | 101 | 31.6 Ų | 31.6 | 47% | 0.468 | 16% | 0.159 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -84.7 | 3.5 | 171.9 | -66.5 | 88.9 | 0 | 0 | 0 | 113 | Q647 K648 L649 Q653 | Q647-H651 PolarHBondContact O-N 3.22Å; Q647-H651 VanDerWaalsContact O-N 3.09Å; Q647-H651 PolarHBondContact O-ND1 3.09Å; K648-H651 PolarHBondContact O-N 3.47Å; L649-H651 VanDerWaalsContact C-N 3.29Å; L649-H651 PolarHBondContact O-N 3.01Å; H651-Q653 HydrophobicContact CB-CG 3.91Å; H651-Q653 WeakPolarHBondContact O-CG 3.34Å; H651-Q653 PolarHBondContact O-N 3.19Å |
| 652 | F | 90.9 | Very high | 92.2 | Very high | 4.33333 Ų | 4.33333 | 35.7 Ų | 35.7 | 2% | 0.019 | 17% | 0.174 | C | C | . | . | T | Hydrogen-bonded Turn | trans | 54 | 38.6 | -178.5 | -53.1 | -71.5 | 0 | 0 | 0 | 113.1 | K648 L649 L650 L654 V704 W707 Y789 M814 L815 Q818 M819 | K648-F652 PolarHBondContact O-N 3.28Å; L649-F652 WeakPolarHBondContact O-CA 3.45Å; L649-F652 WeakPolarHBondContact O-CD1 3.05Å; L649-F652 PolarHBondContact O-N 2.84Å; L650-F652 WeakPolarHBondContact O-CD2 3.38Å; L650-F652 WeakPolarHBondContact O-CE2 3.39Å; L650-F652 PolarHBondContact O-N 2.87Å; F652-L654 VanDerWaalsContact C-N 3.31Å; F652-L654 PolarHBondContact O-N 3.39Å; F652-V704 HydrophobicContact CE1-CG1 4.01Å; F652-V704 HydrophobicContact CZ-CG1 3.8Å; F652-W707 HydrophobicContact CE1-CH2 4.25Å; F652-W707 AromaticContact CZ-CH2 3.83Å; F652-W707 HydrophobicContact CZ-CH2 4.14Å; F652-W707 HydrophobicContact CZ-CZ2 4.3Å; F652-Y789 HydrophobicContact CE2-CD2 4.45Å; F652-Y789 HydrophobicContact CE2-CE1 4.36Å; F652-Y789 AromaticContact CE2-CE2 3.65Å; F652-Y789 HydrophobicContact CE2-CE2 3.65Å; F652-Y789 AromaticContact CE2-CZ 3.63Å; F652-Y789 WeakPolarHBondContact CE2-OH 3.32Å; F652-Y789 AromaticContact CZ-CE2 3.86Å; F652-Y789 HydrophobicContact CZ-CE2 4.1Å; F652-M814 HydrophobicContact CB-CE 4.43Å; F652-M814 HydrophobicContact CD2-CE 4.37Å; F652-L815 HydrophobicContact CD1-CD1 4.4Å; F652-L815 HydrophobicContact CD1-CD2 4.38Å; F652-L815 HydrophobicContact CD2-CD1 3.61Å; F652-L815 HydrophobicContact CD2-CD2 3.87Å; F652-L815 HydrophobicContact CD2-CG 4.32Å; F652-L815 HydrophobicContact CE1-CD1 4.22Å; F652-L815 HydrophobicContact CE1-CD2 4.08Å; F652-L815 HydrophobicContact CE2-CD1 3.4Å; F652-L815 VanDerWaalsContact CE2-CD1 3.4Å; F652-L815 HydrophobicContact CE2-CD2 3.49Å; F652-L815 VanDerWaalsContact CE2-CD2 3.41Å; F652-L815 HydrophobicContact CE2-CG 4.26Å; F652-L815 HydrophobicContact CG-CD1 4.12Å; F652-L815 HydrophobicContact CG-CD2 4.3Å; F652-L815 HydrophobicContact CZ-CD1 3.73Å; F652-L815 HydrophobicContact CZ-CD2 3.6Å; F652-Q818 HydrophobicContact CB-CB 4.28Å; F652-Q818 HydrophobicContact CB-CG 4.39Å; F652-Q818 PolarHBondContact O-NE2 3.07Å; F652-Q818 PolarHBondContact O-OE1 3.14Å; F652-M819 HydrophobicContact CD1-CE 4.17Å; F652-M819 HydrophobicContact CD1-CG 4.41Å; F652-M819 HydrophobicContact CD1-SD 3.84Å; F652-M819 HydrophobicContact CE1-CE 3.47Å; F652-M819 HydrophobicContact CE1-CG 4.22Å; F652-M819 HydrophobicContact CE1-SD 3.82Å; F652-M819 VanDerWaalsContact CE1-SD 3.52Å; F652-M819 HydrophobicContact CZ-CE 3.78Å |
| 653 | Q | 87.8 | Confident | 92.2 | Very high | 107 Ų | 107 | 35.9 Ų | 35.9 | 50% | 0.5 | 18% | 0.175 | S | C | . | . | trans | -93.5 | -4.3 | -176.5 | -66.8 | -177 | -15.1 | 0 | 0 | 113.6 | K648 H651 | K648-Q653 HydrophobicContact CD-CB 4.2Å; K648-Q653 PolarHBondContact O-N 2.84Å; H651-Q653 HydrophobicContact CB-CG 3.91Å; H651-Q653 WeakPolarHBondContact O-CG 3.34Å; H651-Q653 PolarHBondContact O-N 3.19Å | ||
| 654 | L | 87 | Confident | 92.2 | Very high | 1.66667 Ų | 1.66667 | 33.7 Ų | 33.7 | 1% | 0.009 | 17% | 0.165 | C | C | . | . | trans | -107.8 | 102.9 | -177.5 | -59.3 | 178.3 | 0 | 0 | 0 | 110.6 | V645 K648 L649 F652 N656 F657 V660 | V645-L654 HydrophobicContact CG1-CD1 4.24Å; K648-L654 HydrophobicContact CB-CD1 3.96Å; K648-L654 HydrophobicContact CB-CD2 4.34Å; K648-L654 HydrophobicContact CB-CG 3.99Å; L649-L654 HydrophobicContact CD2-CB 4.3Å; L649-L654 HydrophobicContact CD2-CD1 3.88Å; L649-L654 HydrophobicContact CG-CD1 3.96Å; F652-L654 VanDerWaalsContact C-N 3.31Å; F652-L654 PolarHBondContact O-N 3.39Å; L654-N656 PolarHBondContact O-N 3.41Å; L654-N656 VanDerWaalsContact O-N 3.15Å; L654-F657 PolarHBondContact O-N 3.35Å; L654-F657 VanDerWaalsContact O-N 3.13Å; L654-V660 HydrophobicContact CD1-CB 4.49Å; L654-V660 HydrophobicContact CD1-CG1 4Å; L654-V660 HydrophobicContact CD1-CG2 4.25Å | ||
| 655 | G | 79.4 | Confident | 92.4 | Very high | 36.3333 Ų | 36.3333 | 33.2 Ų | 33.2 | 38% | 0.375 | 16% | 0.16 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -66.1 | -16 | -179.2 | 0 | 0 | 0 | 0 | 0 | 114.7 | ||
| 656 | N | 85.3 | Confident | 92.5 | Very high | 31.6667 Ų | 31.6667 | 35.9 Ų | 35.9 | 17% | 0.169 | 17% | 0.172 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -104.8 | 32.5 | 175.1 | 65.6 | -35.1 | 0 | 0 | 0 | 112.5 | S596 L654 S658 E659 V660 | S596-N656 WeakPolarHBondContact CB-OD1 3.35Å; S596-N656 PolarHBondContact OG-OD1 2.86Å; L654-N656 PolarHBondContact O-N 3.41Å; L654-N656 VanDerWaalsContact O-N 3.15Å; N656-S658 VanDerWaalsContact C-N 3.28Å; N656-S658 PolarHBondContact O-N 3.05Å; N656-S658 VanDerWaalsContact O-N 3.09Å; N656-E659 HydrophobicContact CB-CB 4.49Å; N656-E659 WeakPolarHBondContact CB-OE2 3.15Å; N656-E659 WeakPolarHBondContact O-CB 3.35Å; N656-E659 PolarHBondContact O-N 3.31Å; N656-V660 WeakPolarHBondContact O-CG2 3.39Å; N656-V660 PolarHBondContact O-N 3.23Å; N656-V660 VanDerWaalsContact O-N 3.09Å |
| 657 | F | 90.7 | Very high | 92.5 | Very high | 8.66667 Ų | 8.66667 | 36 Ų | 36 | 4% | 0.038 | 17% | 0.173 | C | C | . | . | H | α-helix | trans | -48 | -39.7 | -175 | 64.6 | -85.9 | 0 | 0 | 0 | 114.7 | L649 L654 E659 V660 L661 Y705 D710 A713 Q818 | L649-F657 HydrophobicContact CD2-CB 3.89Å; L654-F657 PolarHBondContact O-N 3.35Å; L654-F657 VanDerWaalsContact O-N 3.13Å; F657-E659 VanDerWaalsContact C-N 3.31Å; F657-E659 PolarHBondContact O-N 3.2Å; F657-V660 PolarHBondContact O-N 3.23Å; F657-L661 HydrophobicContact CD2-CD1 4.45Å; F657-L661 WeakPolarHBondContact O-CB 3.29Å; F657-L661 VanDerWaalsContact O-CG 3.3Å; F657-L661 WeakPolarHBondContact O-CG 3.36Å; F657-L661 PolarHBondContact O-N 3.22Å; F657-Y705 HydrophobicContact CB-CE1 3.98Å; F657-Y705 AromaticContact CD2-CD1 3.98Å; F657-Y705 HydrophobicContact CD2-CD1 4.01Å; F657-Y705 AromaticContact CD2-CE1 3.42Å; F657-Y705 HydrophobicContact CD2-CE1 3.42Å; F657-Y705 VanDerWaalsContact CD2-CE1 3.45Å; F657-Y705 HydrophobicContact CE2-CD1 4.44Å; F657-Y705 HydrophobicContact CE2-CE1 4.17Å; F657-Y705 AromaticContact CG-CE1 3.86Å; F657-Y705 HydrophobicContact CG-CE1 3.86Å; F657-D710 HydrophobicContact CE2-CB 4.14Å; F657-D710 HydrophobicContact CZ-CB 4.26Å; F657-A713 HydrophobicContact CD2-CB 4.12Å; F657-A713 HydrophobicContact CE2-CB 3.75Å; F657-Q818 VanDerWaalsContact CD1-O 3.27Å; F657-Q818 WeakPolarHBondContact CD1-O 3.43Å; F657-Q818 WeakPolarHBondContact CE1-O 3.32Å; F657-Q818 WeakPolarHBondContact CZ-O 3.32Å |
| 658 | S | 90.3 | Very high | 92.6 | Very high | 15.3333 Ų | 15.3333 | 32.8 Ų | 32.8 | 11% | 0.107 | 16% | 0.158 | C | C | . | . | H | α-helix | trans | -64.4 | -37.1 | -179.7 | -140.7 | 0 | 0 | 0 | 0 | 112.2 | N656 R662 D710 | N656-S658 VanDerWaalsContact C-N 3.28Å; N656-S658 PolarHBondContact O-N 3.05Å; N656-S658 VanDerWaalsContact O-N 3.09Å; S658-R662 PolarHBondContact O-N 3.2Å; S658-R662 PolarHBondContact O-NE 3.38Å; S658-D710 VanDerWaalsContact CB-OD2 3.25Å; S658-D710 WeakPolarHBondContact CB-OD2 3.34Å; S658-D710 PolarHBondContact OG-OD2 3.29Å |
| 659 | E | 90.6 | Very high | 92.8 | Very high | 79 Ų | 79 | 32.4 Ų | 32.4 | 37% | 0.369 | 16% | 0.158 | S | C | . | . | H | α-helix | trans | -71 | -42.8 | 173.3 | -67.2 | 167.2 | -177.3 | 0 | 0 | 111.4 | N656 F657 L661 R662 W663 | N656-E659 HydrophobicContact CB-CB 4.49Å; N656-E659 WeakPolarHBondContact CB-OE2 3.15Å; N656-E659 WeakPolarHBondContact O-CB 3.35Å; N656-E659 PolarHBondContact O-N 3.31Å; F657-E659 VanDerWaalsContact C-N 3.31Å; F657-E659 PolarHBondContact O-N 3.2Å; E659-L661 VanDerWaalsContact C-N 3.34Å; E659-L661 PolarHBondContact O-N 2.95Å; E659-R662 VanDerWaalsContact CG-NH2 3.35Å; E659-R662 PolarHBondContact O-N 3.45Å; E659-W663 VanDerWaalsContact O-CB 3.31Å; E659-W663 WeakPolarHBondContact O-CB 3.36Å; E659-W663 PolarHBondContact O-N 3.15Å |
| 660 | V | 93.9 | Very high | 93 | Very high | 0 Ų | 0 | 34.5 Ų | 34.5 | 0% | 0 | 17% | 0.167 | C | C | . | . | H | α-helix | trans | -62.7 | -40.9 | 177.9 | 178.2 | 0 | 0 | 0 | 0 | 111.4 | M607 V645 L649 L654 N656 F657 R662 W663 L664 | M607-V660 HydrophobicContact CE-CG2 4.24Å; M607-V660 HydrophobicContact SD-CG2 4.31Å; V645-V660 HydrophobicContact CG1-CG1 3.5Å; V645-V660 VanDerWaalsContact CG1-CG1 3.45Å; L649-V660 HydrophobicContact CD1-CG1 4.17Å; L649-V660 HydrophobicContact CD2-CB 4.37Å; L649-V660 HydrophobicContact CD2-CG1 4.2Å; L649-V660 HydrophobicContact CG-CG1 4.39Å; L654-V660 HydrophobicContact CD1-CB 4.49Å; L654-V660 HydrophobicContact CD1-CG1 4Å; L654-V660 HydrophobicContact CD1-CG2 4.25Å; N656-V660 WeakPolarHBondContact O-CG2 3.39Å; N656-V660 PolarHBondContact O-N 3.23Å; N656-V660 VanDerWaalsContact O-N 3.09Å; F657-V660 PolarHBondContact O-N 3.23Å; V660-R662 VanDerWaalsContact C-N 3.34Å; V660-R662 PolarHBondContact O-N 3.22Å; V660-W663 HydrophobicContact CG1-CE3 4.32Å; V660-W663 WeakPolarHBondContact O-CB 3.44Å; V660-W663 PolarHBondContact O-N 3.31Å; V660-L664 HydrophobicContact CG1-CD1 4.47Å; V660-L664 HydrophobicContact CG1-CG 4.46Å; V660-L664 WeakPolarHBondContact O-CB 3.34Å; V660-L664 WeakPolarHBondContact O-CG 3.43Å; V660-L664 PolarHBondContact O-N 3.24Å |
| 661 | L | 95.6 | Very high | 93.1 | Very high | 0 Ų | 0 | 34.3 Ų | 34.3 | 0% | 0 | 17% | 0.165 | C | C | . | . | H | α-helix | trans | -62.6 | -42.1 | 175.3 | -73.8 | 171.8 | 0 | 0 | 0 | 111.7 | L649 F657 E659 W663 L664 R665 V701 Y705 A713 T716 L720 | L649-L661 HydrophobicContact CD1-CD2 3.98Å; F657-L661 HydrophobicContact CD2-CD1 4.45Å; F657-L661 WeakPolarHBondContact O-CB 3.29Å; F657-L661 VanDerWaalsContact O-CG 3.3Å; F657-L661 WeakPolarHBondContact O-CG 3.36Å; F657-L661 PolarHBondContact O-N 3.22Å; E659-L661 VanDerWaalsContact C-N 3.34Å; E659-L661 PolarHBondContact O-N 2.95Å; L661-W663 VanDerWaalsContact C-N 3.31Å; L661-W663 PolarHBondContact O-N 3.11Å; L661-L664 PolarHBondContact O-N 3.26Å; L661-R665 PolarHBondContact O-N 3.49Å; L661-V701 HydrophobicContact CD2-CG1 3.7Å; L661-Y705 HydrophobicContact CD1-CD1 3.79Å; L661-Y705 HydrophobicContact CD1-CD2 4.45Å; L661-Y705 HydrophobicContact CD1-CE1 4.25Å; L661-Y705 HydrophobicContact CD1-CG 3.88Å; L661-A713 HydrophobicContact CD1-CB 3.97Å; L661-T716 HydrophobicContact CB-CG2 3.8Å; L661-T716 WeakPolarHBondContact O-CG2 3.39Å; L661-L720 HydrophobicContact CD2-CD1 4.04Å |
| 662 | R | 95.2 | Very high | 93.3 | Very high | 87 Ų | 87 | 29.8 Ų | 29.8 | 33% | 0.328 | 14% | 0.144 | S | C | . | . | H | α-helix | trans | -65 | -38.7 | 176.3 | -106.4 | -176.8 | -77.3 | 104.5 | -3.1 | 111.6 | L491 S658 E659 V660 R665 Q666 T716 | L491-R662 HydrophobicContact CD1-CB 4.09Å; S658-R662 PolarHBondContact O-N 3.2Å; S658-R662 PolarHBondContact O-NE 3.38Å; E659-R662 VanDerWaalsContact CG-NH2 3.35Å; E659-R662 PolarHBondContact O-N 3.45Å; V660-R662 VanDerWaalsContact C-N 3.34Å; V660-R662 PolarHBondContact O-N 3.22Å; R662-R665 WeakPolarHBondContact O-CB 3.43Å; R662-R665 PolarHBondContact O-N 3.15Å; R662-Q666 PolarHBondContact O-N 2.89Å; R662-Q666 VanDerWaalsContact O-N 3.11Å; R662-T716 HydrophobicContact CG-CG2 3.98Å |
| 663 | W | 96.3 | Very high | 93.6 | Very high | 7.33333 Ų | 7.33333 | 32.9 Ų | 32.9 | 3% | 0.028 | 16% | 0.16 | C | C | . | . | H | α-helix | trans | -66.1 | -45.5 | 175.4 | 170.7 | 85.3 | 0 | 0 | 0 | 112.3 | L491 I593 M607 V610 L641 V645 E659 V660 L661 R665 Q666 L667 | L491-W663 HydrophobicContact CD1-CB 4.48Å; I593-W663 HydrophobicContact CD1-CH2 3.76Å; I593-W663 HydrophobicContact CD1-CZ2 3.57Å; M607-W663 HydrophobicContact CB-CD2 4.49Å; M607-W663 HydrophobicContact CB-CG 4.24Å; M607-W663 HydrophobicContact CE-CB 3.19Å; M607-W663 HydrophobicContact CE-CD2 3.91Å; M607-W663 HydrophobicContact CE-CE3 4.45Å; M607-W663 HydrophobicContact CE-CG 3.34Å; M607-W663 HydrophobicContact CG-CD2 4.24Å; M607-W663 HydrophobicContact CG-CG 4.26Å; M607-W663 HydrophobicContact CG-CZ2 4.48Å; M607-W663 PolarHBondContact O-NE1 3.37Å; M607-W663 HydrophobicContact SD-CB 4.35Å; M607-W663 HydrophobicContact SD-CD2 4.37Å; M607-W663 HydrophobicContact SD-CG 4.12Å; V610-W663 HydrophobicContact CB-CZ2 3.87Å; V610-W663 HydrophobicContact CG1-CH2 4.41Å; V610-W663 HydrophobicContact CG1-CZ2 3.65Å; V610-W663 HydrophobicContact CG2-CZ2 4.36Å; L641-W663 HydrophobicContact CD1-CH2 3.82Å; L641-W663 HydrophobicContact CD1-CZ2 4.37Å; L641-W663 HydrophobicContact CD1-CZ3 4.29Å; L641-W663 HydrophobicContact CD2-CH2 3.79Å; L641-W663 HydrophobicContact CD2-CZ3 4.06Å; L641-W663 HydrophobicContact CG-CH2 4.16Å; V645-W663 HydrophobicContact CB-CZ3 4.43Å; V645-W663 HydrophobicContact CG1-CZ3 4.11Å; V645-W663 HydrophobicContact CG2-CH2 4.24Å; V645-W663 HydrophobicContact CG2-CZ3 4.01Å; E659-W663 VanDerWaalsContact O-CB 3.31Å; E659-W663 WeakPolarHBondContact O-CB 3.36Å; E659-W663 PolarHBondContact O-N 3.15Å; V660-W663 HydrophobicContact CG1-CE3 4.32Å; V660-W663 WeakPolarHBondContact O-CB 3.44Å; V660-W663 PolarHBondContact O-N 3.31Å; L661-W663 VanDerWaalsContact C-N 3.31Å; L661-W663 PolarHBondContact O-N 3.11Å; W663-R665 VanDerWaalsContact C-N 3.27Å; W663-R665 PolarHBondContact O-N 3.34Å; W663-Q666 PolarHBondContact O-N 2.93Å; W663-Q666 VanDerWaalsContact O-N 3.11Å; W663-L667 HydrophobicContact CH2-CD2 4.46Å; W663-L667 WeakPolarHBondContact O-CB 3.39Å; W663-L667 PolarHBondContact O-N 3.07Å |
| 664 | L | 97.4 | Very high | 94 | Very high | 0 Ų | 0 | 27.8 Ų | 27.8 | 0% | 0 | 14% | 0.137 | C | C | . | . | H | α-helix | trans | -57 | -42.2 | 173.2 | -76.6 | 176.9 | 0 | 0 | 0 | 111.3 | L641 L642 V645 L649 V660 L661 Q666 L667 L668 | L641-L664 HydrophobicContact CD2-CD2 4.47Å; L642-L664 HydrophobicContact CD2-CD2 3.65Å; V645-L664 HydrophobicContact CB-CD2 4.37Å; V645-L664 HydrophobicContact CG1-CD1 4.14Å; V645-L664 HydrophobicContact CG1-CD2 4.1Å; V645-L664 HydrophobicContact CG1-CG 4.31Å; L649-L664 HydrophobicContact CD1-CD1 3.54Å; V660-L664 HydrophobicContact CG1-CD1 4.47Å; V660-L664 HydrophobicContact CG1-CG 4.46Å; V660-L664 WeakPolarHBondContact O-CB 3.34Å; V660-L664 WeakPolarHBondContact O-CG 3.43Å; V660-L664 PolarHBondContact O-N 3.24Å; L661-L664 PolarHBondContact O-N 3.26Å; L664-Q666 PolarHBondContact O-N 3.06Å; L664-L667 HydrophobicContact CD2-CD2 4.46Å; L664-L667 WeakPolarHBondContact O-CB 3.36Å; L664-L667 PolarHBondContact O-N 3.02Å; L664-L668 VanDerWaalsContact O-CG 3.3Å; L664-L668 WeakPolarHBondContact O-CG 3.38Å; L664-L668 PolarHBondContact O-N 3.09Å |
| 665 | R | 97.6 | Very high | 94.4 | Very high | 71 Ų | 71 | 27.7 Ų | 27.7 | 27% | 0.268 | 14% | 0.136 | S | C | . | . | H | α-helix | trans | -59.8 | -47.3 | 175.3 | -174.1 | -175.3 | 69.6 | -171.7 | 2.5 | 111.5 | L661 R662 W663 L667 L668 I669 T716 S719 L720 V723 | L661-R665 PolarHBondContact O-N 3.49Å; R662-R665 WeakPolarHBondContact O-CB 3.43Å; R662-R665 PolarHBondContact O-N 3.15Å; W663-R665 VanDerWaalsContact C-N 3.27Å; W663-R665 PolarHBondContact O-N 3.34Å; R665-L667 VanDerWaalsContact C-N 3.33Å; R665-L667 PolarHBondContact O-N 3.46Å; R665-L668 PolarHBondContact O-N 3.05Å; R665-I669 HydrophobicContact CG-CD1 4.12Å; R665-I669 VanDerWaalsContact O-CG1 3.29Å; R665-I669 WeakPolarHBondContact O-CG1 3.36Å; R665-I669 PolarHBondContact O-N 2.96Å; R665-T716 HydrophobicContact CB-CG2 4.46Å; R665-S719 WeakPolarHBondContact CD-OG 3.37Å; R665-S719 PolarHBondContact NH1-OG 3.1Å; R665-L720 VanDerWaalsContact CA-CD2 3.48Å; R665-L720 HydrophobicContact CB-CD2 3.73Å; R665-L720 HydrophobicContact CB-CG 4.28Å; R665-L720 HydrophobicContact CG-CD2 4.24Å; R665-V723 HydrophobicContact CG-CG2 4.11Å |
| 666 | Q | 97.5 | Very high | 95.1 | Very high | 57 Ų | 57 | 31.1 Ų | 31.1 | 27% | 0.266 | 14% | 0.143 | S | C | . | . | H | α-helix | trans | -64.5 | -38.5 | 179.1 | -171.1 | 58.9 | 51.7 | 0 | 0 | 112.2 | L611 R662 W663 L664 I669 Y670 | L611-Q666 HydrophobicContact CD1-CB 4.33Å; L611-Q666 HydrophobicContact CD1-CG 4.06Å; L611-Q666 HydrophobicContact CD2-CB 3.98Å; L611-Q666 HydrophobicContact CD2-CG 3.93Å; R662-Q666 PolarHBondContact O-N 2.89Å; R662-Q666 VanDerWaalsContact O-N 3.11Å; W663-Q666 PolarHBondContact O-N 2.93Å; W663-Q666 VanDerWaalsContact O-N 3.11Å; L664-Q666 PolarHBondContact O-N 3.06Å; Q666-I669 PolarHBondContact O-N 3.2Å; Q666-Y670 HydrophobicContact CG-CD2 4.46Å; Q666-Y670 HydrophobicContact CG-CE2 4.03Å; Q666-Y670 VanDerWaalsContact NE2-CE1 3.33Å; Q666-Y670 VanDerWaalsContact NE2-CZ 3.34Å; Q666-Y670 PolarHBondContact O-N 3.2Å; Q666-Y670 VanDerWaalsContact O-N 3.07Å |
| 667 | L | 97.1 | Very high | 95.5 | Very high | 2.33333 Ų | 2.33333 | 34.3 Ų | 34.3 | 1% | 0.012 | 16% | 0.161 | C | C | . | . | H | α-helix | trans | -60.1 | -47.3 | 175.7 | -175.7 | 72.5 | 0 | 0 | 0 | 111.5 | V610 L611 H614 L641 L642 W663 L664 R665 I669 Y670 R671 | V610-L667 HydrophobicContact CG1-CD1 3.96Å; L611-L667 HydrophobicContact CD2-CB 4.06Å; L611-L667 HydrophobicContact CD2-CD1 4.33Å; H614-L667 HydrophobicContact CB-CD1 3.75Å; H614-L667 VanDerWaalsContact CD2-CD1 3.47Å; H614-L667 WeakPolarHBondContact CD2-CD1 3.45Å; H614-L667 VanDerWaalsContact CG-CD1 3.43Å; L641-L667 HydrophobicContact CD1-CD2 4.3Å; L641-L667 HydrophobicContact CD2-CD1 4.08Å; L641-L667 HydrophobicContact CD2-CD2 3.39Å; L641-L667 VanDerWaalsContact CD2-CD2 3.43Å; L641-L667 HydrophobicContact CD2-CG 4.4Å; L641-L667 HydrophobicContact CG-CD2 4.19Å; L642-L667 HydrophobicContact CD2-CD2 4.23Å; L642-L667 HydrophobicContact CG-CD2 4.49Å; W663-L667 HydrophobicContact CH2-CD2 4.46Å; W663-L667 WeakPolarHBondContact O-CB 3.39Å; W663-L667 PolarHBondContact O-N 3.07Å; L664-L667 HydrophobicContact CD2-CD2 4.46Å; L664-L667 WeakPolarHBondContact O-CB 3.36Å; L664-L667 PolarHBondContact O-N 3.02Å; R665-L667 VanDerWaalsContact C-N 3.33Å; R665-L667 PolarHBondContact O-N 3.46Å; L667-I669 VanDerWaalsContact C-N 3.34Å; L667-Y670 PolarHBondContact O-N 2.76Å; L667-R671 PolarHBondContact O-N 3.24Å |
| 668 | L | 97.8 | Very high | 95.6 | Very high | 3.33333 Ų | 3.33333 | 35.7 Ų | 35.7 | 2% | 0.017 | 17% | 0.167 | C | C | . | . | H | α-helix | trans | -66.9 | -34.8 | 177.7 | -68.8 | 168.7 | 0 | 0 | 0 | 112.2 | L642 L664 R665 Y670 R671 N672 L698 L720 V723 | L642-L668 HydrophobicContact CD1-CD2 3.7Å; L642-L668 HydrophobicContact CD2-CD2 4.1Å; L642-L668 HydrophobicContact CD2-CG 4.34Å; L642-L668 HydrophobicContact CG-CD2 4.49Å; L664-L668 VanDerWaalsContact O-CG 3.3Å; L664-L668 WeakPolarHBondContact O-CG 3.38Å; L664-L668 PolarHBondContact O-N 3.09Å; R665-L668 PolarHBondContact O-N 3.05Å; L668-Y670 PolarHBondContact O-N 3.24Å; L668-R671 VanDerWaalsContact CD2-NH2 3.31Å; L668-R671 WeakPolarHBondContact O-CB 3.41Å; L668-R671 PolarHBondContact O-N 3.2Å; L668-N672 WeakPolarHBondContact O-CB 3.46Å; L668-N672 VanDerWaalsContact O-CG 3.31Å; L668-N672 PolarHBondContact O-N 3.24Å; L668-N672 PolarHBondContact O-OD1 3.22Å; L668-L698 HydrophobicContact CD1-CD1 4.32Å; L668-L698 HydrophobicContact CD1-CD2 3.51Å; L668-L698 VanDerWaalsContact CD1-CD2 3.49Å; L668-L698 HydrophobicContact CD2-CD2 4.34Å; L668-L720 HydrophobicContact CD1-CD2 3.64Å; L668-V723 HydrophobicContact CB-CG1 3.49Å; L668-V723 VanDerWaalsContact CB-CG1 3.48Å |
| 669 | I | 97.9 | Very high | 95.6 | Very high | 52 Ų | 52 | 40.6 Ų | 40.6 | 27% | 0.267 | 18% | 0.183 | S | C | . | . | H | α-helix | trans | -60.2 | -45.6 | 172.2 | -71.6 | 165.5 | 0 | 0 | 0 | 110.6 | R665 Q666 L667 R671 N672 L673 V723 | R665-I669 HydrophobicContact CG-CD1 4.12Å; R665-I669 VanDerWaalsContact O-CG1 3.29Å; R665-I669 WeakPolarHBondContact O-CG1 3.36Å; R665-I669 PolarHBondContact O-N 2.96Å; Q666-I669 PolarHBondContact O-N 3.2Å; L667-I669 VanDerWaalsContact C-N 3.34Å; I669-R671 VanDerWaalsContact C-N 3.35Å; I669-R671 PolarHBondContact O-N 3.27Å; I669-N672 PolarHBondContact O-N 3.36Å; I669-L673 HydrophobicContact CG2-CD1 3.97Å; I669-L673 HydrophobicContact CG2-CG 4.42Å; I669-L673 WeakPolarHBondContact O-CB 3.41Å; I669-L673 VanDerWaalsContact O-CG 3.29Å; I669-L673 WeakPolarHBondContact O-CG 3.46Å; I669-L673 PolarHBondContact O-N 2.95Å; I669-V723 HydrophobicContact CG1-CG1 4.34Å; I669-V723 HydrophobicContact CG1-CG2 4.01Å |
| 670 | Y | 97.8 | Very high | 95.6 | Very high | 45.3333 Ų | 45.3333 | 45.7 Ų | 45.7 | 18% | 0.178 | 21% | 0.207 | C | C | . | . | H | α-helix | trans | -65.4 | -38.7 | 177 | -68.1 | -32.4 | 0 | 0 | 0 | 112.8 | L611 H614 Q615 Q666 L667 L668 L673 F674 | L611-Y670 HydrophobicContact CB-CE2 4.15Å; L611-Y670 HydrophobicContact CD2-CD2 4.2Å; L611-Y670 HydrophobicContact CD2-CE2 4.16Å; H614-Y670 WeakPolarHBondContact O-CB 3.26Å; Q615-Y670 HydrophobicContact CG-CD2 4.4Å; Q615-Y670 HydrophobicContact CG-CE1 4.41Å; Q615-Y670 HydrophobicContact CG-CE2 4.01Å; Q666-Y670 HydrophobicContact CG-CD2 4.46Å; Q666-Y670 HydrophobicContact CG-CE2 4.03Å; Q666-Y670 VanDerWaalsContact NE2-CE1 3.33Å; Q666-Y670 VanDerWaalsContact NE2-CZ 3.34Å; Q666-Y670 PolarHBondContact O-N 3.2Å; Q666-Y670 VanDerWaalsContact O-N 3.07Å; L667-Y670 PolarHBondContact O-N 2.76Å; L668-Y670 PolarHBondContact O-N 3.24Å; Y670-L673 HydrophobicContact CD1-CD1 4.21Å; Y670-L673 PolarHBondContact O-N 2.94Å; Y670-F674 PolarHBondContact O-N 3.34Å |
| 671 | R | 96.2 | Very high | 95.5 | Very high | 9.66667 Ų | 9.66667 | 48.3 Ų | 48.3 | 4% | 0.036 | 22% | 0.22 | C | C | . | . | H | α-helix | trans | -58.2 | -50.1 | 172.3 | -170.8 | -172.5 | 169 | 172.4 | 17.8 | 111.3 | L634 W635 S638 S639 L667 L668 I669 L673 F674 L675 E727 | L634-R671 HydrophobicContact CD1-CG 4.34Å; L634-R671 HydrophobicContact CD2-CG 4.08Å; L634-R671 HydrophobicContact CG-CG 4.24Å; W635-R671 VanDerWaalsContact CE3-CZ 3.44Å; W635-R671 VanDerWaalsContact CZ3-NH1 3.28Å; W635-R671 PolarHBondContact O-NH2 2.85Å; S638-R671 WeakPolarHBondContact OG-CD 3.3Å; S638-R671 PolarHBondContact OG-NE 3.38Å; S638-R671 PolarHBondContact OG-NH1 3.49Å; S638-R671 PolarHBondContact OG-NH2 3.26Å; S639-R671 PolarHBondContact OG-NH2 3.26Å; L667-R671 PolarHBondContact O-N 3.24Å; L668-R671 VanDerWaalsContact CD2-NH2 3.31Å; L668-R671 WeakPolarHBondContact O-CB 3.41Å; L668-R671 PolarHBondContact O-N 3.2Å; I669-R671 VanDerWaalsContact C-N 3.35Å; I669-R671 PolarHBondContact O-N 3.27Å; R671-L673 VanDerWaalsContact C-N 3.34Å; R671-L673 PolarHBondContact O-N 3.27Å; R671-F674 PolarHBondContact O-N 3.11Å; R671-L675 HydrophobicContact CG-CD1 4.08Å; R671-L675 HydrophobicContact CG-CG 4.49Å; R671-L675 WeakPolarHBondContact O-CB 3.23Å; R671-L675 VanDerWaalsContact O-CG 3.31Å; R671-L675 WeakPolarHBondContact O-CG 3.4Å; R671-L675 PolarHBondContact O-N 3.14Å; R671-E727 WeakPolarHBondContact CD-OE2 3.47Å; R671-E727 IonicContact CZ-OE2 3.39Å; R671-E727 IonicContact NE-OE2 3.08Å; R671-E727 IonicContact NH1-OE1 2.95Å; R671-E727 IonicContact NH1-OE2 3.49Å; R671-E727 PolarHBondContact NH1-OE2 3Å; R671-E727 IonicContact NH2-OE1 2.78Å; R671-E727 PolarHBondContact NH2-OE1 3.35Å; R671-E727 IonicContact NH2-OE2 2.8Å; R671-E727 PolarHBondContact NH2-OE2 3.39Å |
| 672 | N | 96.7 | Very high | 95.2 | Very high | 7.33333 Ų | 7.33333 | 48.3 Ų | 48.3 | 4% | 0.039 | 22% | 0.221 | C | C | . | . | H | α-helix | trans | -62.2 | -40.9 | 178.7 | -73.8 | 3.5 | 0 | 0 | 0 | 111.8 | L668 I669 F674 L675 M676 V723 E727 I730 | L668-N672 WeakPolarHBondContact O-CB 3.46Å; L668-N672 VanDerWaalsContact O-CG 3.31Å; L668-N672 PolarHBondContact O-N 3.24Å; L668-N672 PolarHBondContact O-OD1 3.22Å; I669-N672 PolarHBondContact O-N 3.36Å; N672-F674 PolarHBondContact O-N 3.17Å; N672-L675 PolarHBondContact O-N 3.18Å; N672-M676 VanDerWaalsContact O-CB 3.24Å; N672-M676 WeakPolarHBondContact O-CB 3.37Å; N672-M676 PolarHBondContact O-N 3.21Å; N672-V723 WeakPolarHBondContact ND2-CG1 3.27Å; N672-V723 PolarHBondContact ND2-O 2.82Å; N672-E727 PolarHBondContact ND2-N 3.22Å; N672-E727 VanDerWaalsContact OD1-CB 3.27Å; N672-E727 WeakPolarHBondContact OD1-CB 3.37Å; N672-E727 VanDerWaalsContact OD1-CG 3.31Å; N672-E727 WeakPolarHBondContact OD1-CG 3.38Å; N672-I730 HydrophobicContact CB-CD1 3.84Å; N672-I730 WeakPolarHBondContact O-CD1 3.45Å |
| 673 | L | 97.1 | Very high | 95 | Very high | 69.3333 Ų | 69.3333 | 47.3 Ų | 47.3 | 36% | 0.363 | 22% | 0.222 | S | C | . | . | H | α-helix | trans | -60.4 | -44.7 | 176.5 | -104.1 | 140.3 | 0 | 0 | 0 | 111.8 | P616 I669 Y670 R671 M676 N677 | P616-L673 HydrophobicContact CG-CB 4.06Å; P616-L673 HydrophobicContact CG-CD2 3.73Å; P616-L673 HydrophobicContact CG-CG 3.89Å; I669-L673 HydrophobicContact CG2-CD1 3.97Å; I669-L673 HydrophobicContact CG2-CG 4.42Å; I669-L673 WeakPolarHBondContact O-CB 3.41Å; I669-L673 VanDerWaalsContact O-CG 3.29Å; I669-L673 WeakPolarHBondContact O-CG 3.46Å; I669-L673 PolarHBondContact O-N 2.95Å; Y670-L673 HydrophobicContact CD1-CD1 4.21Å; Y670-L673 PolarHBondContact O-N 2.94Å; R671-L673 VanDerWaalsContact C-N 3.34Å; R671-L673 PolarHBondContact O-N 3.27Å; L673-M676 HydrophobicContact CD1-CE 4.12Å; L673-M676 HydrophobicContact CD2-CE 4.32Å; L673-M676 PolarHBondContact O-N 3.04Å; L673-N677 VanDerWaalsContact O-CG 3.28Å; L673-N677 PolarHBondContact O-N 3.06Å; L673-N677 VanDerWaalsContact O-N 3.1Å; L673-N677 PolarHBondContact O-OD1 3.37Å |
| 674 | F | 96.1 | Very high | 94.6 | Very high | 0 Ų | 0 | 52.6 Ų | 52.6 | 0% | 0 | 24% | 0.243 | C | C | . | . | H | α-helix | trans | -64.6 | -46.7 | 175.6 | -176.8 | -89 | 0 | 0 | 0 | 111.9 | P616 V619 E620 L627 T630 V631 L634 Y670 R671 N672 M676 N677 H678 | P616-F674 HydrophobicContact CB-CB 4.3Å; P616-F674 HydrophobicContact CB-CD2 4.14Å; P616-F674 HydrophobicContact CG-CB 4.44Å; V619-F674 HydrophobicContact CB-CD2 3.83Å; V619-F674 HydrophobicContact CB-CE2 3.87Å; V619-F674 HydrophobicContact CB-CG 4.4Å; V619-F674 HydrophobicContact CB-CZ 4.47Å; V619-F674 HydrophobicContact CG1-CD1 4.19Å; V619-F674 HydrophobicContact CG1-CD2 3.8Å; V619-F674 HydrophobicContact CG1-CE1 3.99Å; V619-F674 HydrophobicContact CG1-CE2 3.62Å; V619-F674 HydrophobicContact CG1-CG 4.08Å; V619-F674 HydrophobicContact CG1-CZ 3.72Å; E620-F674 HydrophobicContact CG-CE2 3.84Å; L627-F674 HydrophobicContact CD1-CZ 4.44Å; T630-F674 HydrophobicContact CG2-CE1 4.48Å; T630-F674 HydrophobicContact CG2-CZ 3.85Å; V631-F674 HydrophobicContact CG2-CE1 3.92Å; L634-F674 HydrophobicContact CD2-CB 4.18Å; L634-F674 HydrophobicContact CD2-CD1 3.32Å; L634-F674 HydrophobicContact CD2-CE1 3.95Å; L634-F674 HydrophobicContact CD2-CG 3.99Å; Y670-F674 PolarHBondContact O-N 3.34Å; R671-F674 PolarHBondContact O-N 3.11Å; N672-F674 PolarHBondContact O-N 3.17Å; F674-M676 VanDerWaalsContact C-N 3.29Å; F674-M676 PolarHBondContact O-N 3.23Å; F674-N677 PolarHBondContact O-N 3.31Å; F674-H678 AromaticContact CD1-CD2 3.98Å; F674-H678 AromaticContact CE1-CD2 3.67Å; F674-H678 AromaticContact CE2-CD2 3.68Å; F674-H678 AromaticContact CE2-NE2 3.67Å; F674-H678 AromaticContact CZ-CD2 3.5Å; F674-H678 VanDerWaalsContact CZ-CD2 3.49Å; F674-H678 WeakPolarHBondContact CZ-CD2 3.27Å; F674-H678 AromaticContact CZ-NE2 3.82Å; F674-H678 PolarHBondContact O-CD2 3.28Å; F674-H678 VanDerWaalsContact O-CD2 3.3Å; F674-H678 PolarHBondContact O-N 3.25Å |
| 675 | L | 95.3 | Very high | 93.9 | Very high | 0 Ų | 0 | 53.8 Ų | 53.8 | 0% | 0 | 26% | 0.255 | C | S | . | . | H | α-helix | trans | -61.9 | -37.1 | 178.1 | -69 | 174.6 | 0 | 0 | 0 | 112 | V631 L634 W635 R671 N672 H678 R679 A682 E727 I730 | V631-L675 HydrophobicContact CG1-CD2 4.19Å; L634-L675 HydrophobicContact CD2-CD2 4.25Å; L634-L675 HydrophobicContact CD2-CG 4.35Å; W635-L675 HydrophobicContact CH2-CD1 3.8Å; W635-L675 HydrophobicContact CZ2-CD1 3.46Å; W635-L675 VanDerWaalsContact CZ2-CD1 3.46Å; W635-L675 HydrophobicContact CZ2-CD2 3.99Å; W635-L675 HydrophobicContact CZ2-CG 4.39Å; R671-L675 HydrophobicContact CG-CD1 4.08Å; R671-L675 HydrophobicContact CG-CG 4.49Å; R671-L675 WeakPolarHBondContact O-CB 3.23Å; R671-L675 VanDerWaalsContact O-CG 3.31Å; R671-L675 WeakPolarHBondContact O-CG 3.4Å; R671-L675 PolarHBondContact O-N 3.14Å; N672-L675 PolarHBondContact O-N 3.18Å; L675-H678 CarbonylContact O-C 3.45Å; L675-H678 PolarHBondContact O-N 3.24Å; L675-H678 VanDerWaalsContact O-N 3.16Å; L675-R679 VanDerWaalsContact O-CA 3.3Å; L675-R679 WeakPolarHBondContact O-CA 3.38Å; L675-R679 PolarHBondContact O-N 3.04Å; L675-A682 HydrophobicContact CB-CB 4.33Å; L675-A682 HydrophobicContact CD2-CB 4.14Å; L675-E727 HydrophobicContact CD1-CG 4.37Å; L675-I730 HydrophobicContact CB-CG2 3.93Å |
| 676 | M | 94.3 | Very high | 93.3 | Very high | 106.667 Ų | 106.667 | 51 Ų | 51 | 53% | 0.525 | 25% | 0.246 | S | C | . | . | H | α-helix | trans | -66.2 | -40.7 | 177.1 | -171.9 | 168.6 | 73.3 | 0 | 0 | 111.7 | N672 L673 F674 H678 R679 I730 | N672-M676 VanDerWaalsContact O-CB 3.24Å; N672-M676 WeakPolarHBondContact O-CB 3.37Å; N672-M676 PolarHBondContact O-N 3.21Å; L673-M676 HydrophobicContact CD1-CE 4.12Å; L673-M676 HydrophobicContact CD2-CE 4.32Å; L673-M676 PolarHBondContact O-N 3.04Å; F674-M676 VanDerWaalsContact C-N 3.29Å; F674-M676 PolarHBondContact O-N 3.23Å; M676-H678 PolarHBondContact O-N 3.16Å; M676-R679 PolarHBondContact O-N 3.25Å; M676-I730 HydrophobicContact CB-CD1 4Å; M676-I730 HydrophobicContact CB-CG1 4.26Å |
| 677 | N | 94.2 | Very high | 92.6 | Very high | 99.6667 Ų | 99.6667 | 50.9 Ų | 50.9 | 53% | 0.533 | 26% | 0.261 | S | S | . | . | H | α-helix | trans | -63.6 | -22.2 | 173.9 | -69.2 | -11.5 | 0 | 0 | 0 | 112.7 | L673 F674 | L673-N677 VanDerWaalsContact O-CG 3.28Å; L673-N677 PolarHBondContact O-N 3.06Å; L673-N677 VanDerWaalsContact O-N 3.1Å; L673-N677 PolarHBondContact O-OD1 3.37Å; F674-N677 PolarHBondContact O-N 3.31Å |
| 678 | H | 92.5 | Very high | 92.1 | Very high | 36.3333 Ų | 36.3333 | 53.9 Ų | 53.9 | 17% | 0.168 | 28% | 0.277 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -125.5 | 39 | -178.3 | -57.1 | -58.1 | 0 | 0 | 0 | 112.7 | L627 F674 L675 M676 E680 I681 A682 | L627-H678 HydrophobicContact CD2-CB 4.35Å; L627-H678 WeakPolarHBondContact CD2-ND1 3.36Å; F674-H678 AromaticContact CD1-CD2 3.98Å; F674-H678 AromaticContact CE1-CD2 3.67Å; F674-H678 AromaticContact CE2-CD2 3.68Å; F674-H678 AromaticContact CE2-NE2 3.67Å; F674-H678 AromaticContact CZ-CD2 3.5Å; F674-H678 VanDerWaalsContact CZ-CD2 3.49Å; F674-H678 WeakPolarHBondContact CZ-CD2 3.27Å; F674-H678 AromaticContact CZ-NE2 3.82Å; F674-H678 PolarHBondContact O-CD2 3.28Å; F674-H678 VanDerWaalsContact O-CD2 3.3Å; F674-H678 PolarHBondContact O-N 3.25Å; L675-H678 CarbonylContact O-C 3.45Å; L675-H678 PolarHBondContact O-N 3.24Å; L675-H678 VanDerWaalsContact O-N 3.16Å; M676-H678 PolarHBondContact O-N 3.16Å; H678-E680 PolarHBondContact O-N 3.25Å; H678-E680 VanDerWaalsContact O-N 3.09Å; H678-I681 HydrophobicContact CB-CD1 4.46Å; H678-I681 HydrophobicContact CB-CG1 4.19Å; H678-I681 WeakPolarHBondContact O-CG1 3.38Å; H678-I681 PolarHBondContact O-N 3.24Å; H678-I681 VanDerWaalsContact O-N 3.1Å; H678-A682 PolarHBondContact O-N 2.83Å |
| 679 | R | 91 | Very high | 91.7 | Very high | 119.667 Ų | 119.667 | 59.1 Ų | 59.1 | 45% | 0.452 | 30% | 0.304 | S | S | . | . | G | 310 helix | trans | -52.1 | -38.1 | -170.3 | -168.2 | 176.9 | -176.7 | -172.8 | 0.2 | 114.2 | L675 M676 I681 A682 E729 I730 C732 F733 | L675-R679 VanDerWaalsContact O-CA 3.3Å; L675-R679 WeakPolarHBondContact O-CA 3.38Å; L675-R679 PolarHBondContact O-N 3.04Å; M676-R679 PolarHBondContact O-N 3.25Å; R679-I681 PolarHBondContact O-N 3.3Å; R679-I681 VanDerWaalsContact O-N 3.15Å; R679-A682 WeakPolarHBondContact O-CB 3.45Å; R679-A682 PolarHBondContact O-N 3.02Å; R679-A682 VanDerWaalsContact O-N 3.16Å; R679-E729 PolarHBondContact NH2-O 3.19Å; R679-E729 VanDerWaalsContact NH2-O 3.07Å; R679-I730 HydrophobicContact CG-CG2 4.31Å; R679-I730 WeakPolarHBondContact CG-O 3.33Å; R679-I730 PolarHBondContact NE-O 3.28Å; R679-I730 VanDerWaalsContact NE-O 3.11Å; R679-C732 PolarHBondContact NH2-O 3.11Å; R679-C732 VanDerWaalsContact NH2-O 3.11Å; R679-F733 HydrophobicContact CG-CE1 4.26Å |
| 680 | E | 90.2 | Very high | 91.4 | Very high | 185.333 Ų | 185.333 | 58.2 Ų | 58.2 | 87% | 0.866 | 30% | 0.299 | S | S | * | . | G | 310 helix | trans | -58.7 | -28.5 | -177.1 | -61.5 | -177.4 | -179.3 | 0 | 0 | 113.8 | H678 | H678-E680 PolarHBondContact O-N 3.25Å; H678-E680 VanDerWaalsContact O-N 3.09Å |
| 681 | I | 90.7 | Very high | 91.1 | Very high | 54.6667 Ų | 54.6667 | 56.5 Ų | 56.5 | 28% | 0.28 | 29% | 0.294 | S | S | . | . | G | 310 helix | trans | -119.9 | 11.9 | -178.9 | 57.3 | 167.6 | 0 | 0 | 0 | 112.3 | L627 V631 H678 R679 N683 Y684 | L627-I681 HydrophobicContact CB-CD1 4.17Å; L627-I681 HydrophobicContact CD2-CD1 3.48Å; L627-I681 VanDerWaalsContact CD2-CD1 3.48Å; L627-I681 HydrophobicContact CD2-CG1 4.5Å; L627-I681 HydrophobicContact CG-CD1 3.53Å; V631-I681 HydrophobicContact CG2-CD1 3.76Å; V631-I681 HydrophobicContact CG2-CG1 4.14Å; H678-I681 HydrophobicContact CB-CD1 4.46Å; H678-I681 HydrophobicContact CB-CG1 4.19Å; H678-I681 WeakPolarHBondContact O-CG1 3.38Å; H678-I681 PolarHBondContact O-N 3.24Å; H678-I681 VanDerWaalsContact O-N 3.1Å; R679-I681 PolarHBondContact O-N 3.3Å; R679-I681 VanDerWaalsContact O-N 3.15Å; I681-N683 PolarHBondContact O-N 3.36Å; I681-Y684 VanDerWaalsContact O-CB 3.24Å; I681-Y684 WeakPolarHBondContact O-CB 3.35Å; I681-Y684 PolarHBondContact O-N 3.05Å |
| 682 | A | 91.3 | Very high | 90.8 | Very high | 0.666667 Ų | 0.666667 | 61.9 Ų | 61.9 | 1% | 0.006 | 32% | 0.317 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -57.9 | -26.2 | -174.7 | 0 | 0 | 0 | 0 | 0 | 113.5 | W635 L675 H678 R679 Y684 I730 | W635-A682 PolarHBondContact NE1-O 3.31Å; L675-A682 HydrophobicContact CB-CB 4.33Å; L675-A682 HydrophobicContact CD2-CB 4.14Å; H678-A682 PolarHBondContact O-N 2.83Å; R679-A682 WeakPolarHBondContact O-CB 3.45Å; R679-A682 PolarHBondContact O-N 3.02Å; R679-A682 VanDerWaalsContact O-N 3.16Å; A682-Y684 VanDerWaalsContact C-N 3.35Å; A682-I730 HydrophobicContact CB-CG2 4.21Å |
| 683 | N | 90.1 | Very high | 90.7 | Very high | 65.6667 Ų | 65.6667 | 65 Ų | 65 | 35% | 0.351 | 33% | 0.332 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -81.3 | -9.9 | 178.4 | -71.6 | -44 | 0 | 0 | 0 | 114.3 | I681 G685 S686 R731 | I681-N683 PolarHBondContact O-N 3.36Å; N683-G685 PolarHBondContact O-N 2.94Å; N683-G685 VanDerWaalsContact O-N 3.16Å; N683-S686 WeakPolarHBondContact CA-OG 3.5Å; N683-S686 WeakPolarHBondContact O-CB 3.32Å; N683-S686 PolarHBondContact O-N 3.15Å; N683-S686 VanDerWaalsContact O-N 3.09Å; N683-S686 PolarHBondContact O-OG 3.19Å; N683-R731 PolarHBondContact ND2-O 3.14Å; N683-R731 VanDerWaalsContact OD1-CB 3.26Å; N683-R731 WeakPolarHBondContact OD1-CB 3.42Å; N683-R731 WeakPolarHBondContact OD1-CG 3.41Å; N683-R731 PolarHBondContact OD1-NE 2.81Å; N683-R731 VanDerWaalsContact OD1-NE 3.17Å; N683-R731 PolarHBondContact OD1-O 3.46Å |
| 684 | Y | 87.6 | Confident | 90.6 | Very high | 119 Ų | 119 | 61.8 Ų | 61.8 | 47% | 0.467 | 32% | 0.315 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -67.2 | 112.6 | -175.9 | -162.6 | -89.1 | 0 | 0 | 0 | 111.2 | S628 V631 Q632 W635 I681 A682 | S628-Y684 VanDerWaalsContact O-CD1 3.23Å; S628-Y684 WeakPolarHBondContact O-CD1 3.47Å; V631-Y684 WeakPolarHBondContact CG1-O 3.42Å; Q632-Y684 HydrophobicContact CB-CD1 4.12Å; Q632-Y684 HydrophobicContact CB-CE1 4.32Å; W635-Y684 VanDerWaalsContact CD1-O 3.23Å; I681-Y684 VanDerWaalsContact O-CB 3.24Å; I681-Y684 WeakPolarHBondContact O-CB 3.35Å; I681-Y684 PolarHBondContact O-N 3.05Å; A682-Y684 VanDerWaalsContact C-N 3.35Å |
| 685 | G | 83.1 | Confident | 90.5 | Very high | 25 Ų | 25 | 63.7 Ų | 63.7 | 26% | 0.258 | 33% | 0.331 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 89.9 | -12.7 | -174.8 | 0 | 0 | 0 | 0 | 0 | 115.3 | N683 G687 D688 | N683-G685 PolarHBondContact O-N 2.94Å; N683-G685 VanDerWaalsContact O-N 3.16Å; G685-G687 PolarHBondContact O-N 3.11Å; G685-G687 VanDerWaalsContact O-N 3.09Å; G685-D688 PolarHBondContact O-N 3.29Å |
| 686 | S | 85.3 | Confident | 90.4 | Very high | 12.3333 Ų | 12.3333 | 67.2 Ų | 67.2 | 9% | 0.086 | 35% | 0.347 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -66 | -14.5 | -178.5 | 72.5 | 0 | 0 | 0 | 0 | 114.8 | N683 D688 R731 | N683-S686 WeakPolarHBondContact CA-OG 3.5Å; N683-S686 WeakPolarHBondContact O-CB 3.32Å; N683-S686 PolarHBondContact O-N 3.15Å; N683-S686 VanDerWaalsContact O-N 3.09Å; N683-S686 PolarHBondContact O-OG 3.19Å; S686-D688 VanDerWaalsContact C-N 3.32Å; S686-R731 PolarHBondContact OG-NH2 3.05Å; S686-R731 VanDerWaalsContact OG-NH2 3.13Å |
| 687 | G | 83.1 | Confident | 90.5 | Very high | 55 Ų | 55 | 65.1 Ų | 65.1 | 57% | 0.567 | 34% | 0.335 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -80.2 | -6.1 | 178.9 | 0 | 0 | 0 | 0 | 0 | 115 | G685 | G685-G687 PolarHBondContact O-N 3.11Å; G685-G687 VanDerWaalsContact O-N 3.09Å |
| 688 | D | 85.7 | Confident | 90.7 | Very high | 65 Ų | 65 | 60.6 Ų | 60.6 | 35% | 0.348 | 31% | 0.311 | S | S | . | . | trans | -55.8 | 138.7 | 176.8 | -173 | -1.8 | 0 | 0 | 0 | 110.7 | H636 G685 S686 L690 C691 K692 | H636-D688 IonicContact ND1-OD2 3.29Å; H636-D688 PolarHBondContact ND1-OD2 3.44Å; G685-D688 PolarHBondContact O-N 3.29Å; S686-D688 VanDerWaalsContact C-N 3.32Å; D688-L690 PolarHBondContact O-N 3.13Å; D688-L690 PolarHBondContact OD1-N 3.23Å; D688-C691 HydrophobicContact CB-CB 4.44Å; D688-C691 WeakPolarHBondContact O-CB 3.47Å; D688-C691 PolarHBondContact O-N 3.07Å; D688-C691 VanDerWaalsContact O-N 3.08Å; D688-K692 PolarHBondContact O-N 3.06Å | ||
| 689 | L | 90.1 | Very high | 90.8 | Very high | 112.333 Ų | 112.333 | 59.6 Ų | 59.6 | 59% | 0.588 | 31% | 0.306 | S | S | * | . | H | α-helix | trans | -57.6 | -37.6 | 178.7 | -179.3 | 63.3 | 0 | 0 | 0 | 111 | C691 K692 Q693 | L689-C691 VanDerWaalsContact C-N 3.3Å; L689-C691 PolarHBondContact O-N 3.31Å; L689-K692 PolarHBondContact O-N 3.38Å; L689-Q693 HydrophobicContact CD1-CG 4.45Å; L689-Q693 HydrophobicContact CG-CG 4.42Å; L689-Q693 WeakPolarHBondContact O-CG 3.39Å; L689-Q693 PolarHBondContact O-N 3.43Å |
| 690 | L | 90.9 | Very high | 91.1 | Very high | 33.3333 Ų | 33.3333 | 54 Ų | 54 | 18% | 0.175 | 29% | 0.286 | C | S | . | . | H | α-helix | trans | -61.9 | -38.2 | 177.2 | -180 | 63 | 0 | 0 | 0 | 111.9 | Q640 F643 D688 K692 Q693 A694 | Q640-L690 HydrophobicContact CB-CD2 3.91Å; Q640-L690 HydrophobicContact CG-CD2 4.44Å; F643-L690 HydrophobicContact CB-CD1 4.32Å; F643-L690 HydrophobicContact CG-CD1 4.4Å; D688-L690 PolarHBondContact O-N 3.13Å; D688-L690 PolarHBondContact OD1-N 3.23Å; L690-K692 VanDerWaalsContact C-N 3.34Å; L690-K692 PolarHBondContact O-N 3.35Å; L690-Q693 PolarHBondContact O-N 2.88Å; L690-A694 VanDerWaalsContact O-CB 3.25Å; L690-A694 WeakPolarHBondContact O-CB 3.36Å; L690-A694 PolarHBondContact O-N 3.09Å |
| 691 | C | 91.2 | Very high | 91.4 | Very high | 8.66667 Ų | 8.66667 | 45.2 Ų | 45.2 | 6% | 0.059 | 24% | 0.244 | C | C | . | . | H | α-helix | trans | -63.4 | -43.3 | 177.7 | -64.7 | 0 | 0 | 0 | 0 | 111.5 | W635 S639 D688 L689 A694 A695 | W635-C691 HydrophobicContact CE3-CB 4.34Å; S639-C691 WeakPolarHBondContact OG-CA 3.4Å; S639-C691 PolarHBondContact OG-SG 3.04Å; S639-C691 VanDerWaalsContact OG-SG 3.41Å; D688-C691 HydrophobicContact CB-CB 4.44Å; D688-C691 WeakPolarHBondContact O-CB 3.47Å; D688-C691 PolarHBondContact O-N 3.07Å; D688-C691 VanDerWaalsContact O-N 3.08Å; L689-C691 VanDerWaalsContact C-N 3.3Å; L689-C691 PolarHBondContact O-N 3.31Å; C691-A694 PolarHBondContact O-N 3.04Å; C691-A695 WeakPolarHBondContact O-CB 3.41Å; C691-A695 PolarHBondContact O-N 3.42Å |
| 692 | K | 90.8 | Very high | 91.7 | Very high | 123.333 Ų | 123.333 | 42.6 Ų | 42.6 | 54% | 0.536 | 23% | 0.231 | S | C | . | . | H | α-helix | trans | -63 | -49.1 | 175.5 | -65 | -179.3 | -179.6 | 178.6 | 0 | 111.4 | D688 L689 L690 A694 A695 E696 | D688-K692 PolarHBondContact O-N 3.06Å; L689-K692 PolarHBondContact O-N 3.38Å; L690-K692 VanDerWaalsContact C-N 3.34Å; L690-K692 PolarHBondContact O-N 3.35Å; K692-A694 VanDerWaalsContact C-N 3.32Å; K692-A694 PolarHBondContact O-N 3.2Å; K692-A695 PolarHBondContact O-N 3.22Å; K692-E696 WeakPolarHBondContact O-CG 3.45Å; K692-E696 PolarHBondContact O-N 3.33Å |
| 693 | Q | 94.2 | Very high | 92 | Very high | 74 Ų | 74 | 42.6 Ų | 42.6 | 35% | 0.346 | 23% | 0.231 | S | C | . | . | H | α-helix | trans | -60.5 | -40.3 | 178.3 | -72 | 177.8 | -17.6 | 0 | 0 | 112.5 | F643 L689 L690 K697 | F643-Q693 HydrophobicContact CD2-CB 4.13Å; F643-Q693 HydrophobicContact CE2-CB 4.11Å; L689-Q693 HydrophobicContact CD1-CG 4.45Å; L689-Q693 HydrophobicContact CG-CG 4.42Å; L689-Q693 WeakPolarHBondContact O-CG 3.39Å; L689-Q693 PolarHBondContact O-N 3.43Å; L690-Q693 PolarHBondContact O-N 2.88Å; Q693-K697 WeakPolarHBondContact O-CB 3.44Å; Q693-K697 VanDerWaalsContact O-CG 3.26Å; Q693-K697 WeakPolarHBondContact O-CG 3.35Å; Q693-K697 PolarHBondContact O-N 3.2Å |
| 694 | A | 95.3 | Very high | 92.3 | Very high | 0.333333 Ų | 0.333333 | 39.6 Ų | 39.6 | 0% | 0.003 | 22% | 0.215 | C | C | . | . | H | α-helix | trans | -65 | -42.9 | 176.8 | 0 | 0 | 0 | 0 | 0 | 111.9 | S639 L642 F643 L690 C691 K692 K697 L698 | S639-A694 VanDerWaalsContact O-CB 3.25Å; S639-A694 WeakPolarHBondContact O-CB 3.4Å; L642-A694 HydrophobicContact CB-CB 4.2Å; F643-A694 HydrophobicContact CB-CB 4.11Å; L690-A694 VanDerWaalsContact O-CB 3.25Å; L690-A694 WeakPolarHBondContact O-CB 3.36Å; L690-A694 PolarHBondContact O-N 3.09Å; C691-A694 PolarHBondContact O-N 3.04Å; K692-A694 VanDerWaalsContact C-N 3.32Å; K692-A694 PolarHBondContact O-N 3.2Å; A694-K697 PolarHBondContact O-N 3.26Å; A694-L698 WeakPolarHBondContact O-CB 3.48Å; A694-L698 PolarHBondContact O-N 3.05Å |
| 695 | A | 93.5 | Very high | 92.6 | Very high | 40.6667 Ų | 40.6667 | 34 Ų | 34 | 34% | 0.336 | 19% | 0.193 | S | C | . | . | H | α-helix | trans | -63.1 | -45.1 | 176.3 | 0 | 0 | 0 | 0 | 0 | 111.8 | C691 K692 K697 L698 E699 | C691-A695 WeakPolarHBondContact O-CB 3.41Å; C691-A695 PolarHBondContact O-N 3.42Å; K692-A695 PolarHBondContact O-N 3.22Å; A695-K697 VanDerWaalsContact C-N 3.33Å; A695-K697 PolarHBondContact O-N 3.04Å; A695-L698 PolarHBondContact O-N 3.38Å; A695-E699 WeakPolarHBondContact O-CB 3.38Å; A695-E699 PolarHBondContact O-N 3.17Å |
| 696 | E | 93.9 | Very high | 93.2 | Very high | 73.6667 Ų | 73.6667 | 32.8 Ų | 32.8 | 34% | 0.344 | 18% | 0.181 | S | C | . | . | H | α-helix | trans | -60.5 | -41.7 | 175.4 | -70.5 | 176.4 | 163.5 | 0 | 0 | 112 | K692 E699 T700 T777 | K692-E696 WeakPolarHBondContact O-CG 3.45Å; K692-E696 PolarHBondContact O-N 3.33Å; E696-E699 WeakPolarHBondContact O-CB 3.4Å; E696-E699 PolarHBondContact O-N 3.08Å; E696-T700 WeakPolarHBondContact O-CB 3.48Å; E696-T700 PolarHBondContact O-N 3.17Å; E696-T700 PolarHBondContact O-OG1 3.06Å; E696-T777 HydrophobicContact CG-CG2 4.38Å; E696-T777 WeakPolarHBondContact OE1-CB 3.48Å; E696-T777 PolarHBondContact OE1-OG1 3.21Å |
| 697 | K | 96.4 | Very high | 93.7 | Very high | 62.6667 Ų | 62.6667 | 32.2 Ų | 32.2 | 27% | 0.272 | 18% | 0.177 | S | C | . | . | H | α-helix | trans | -67 | -40.9 | 176.4 | -71.2 | -65 | 177.2 | -162.8 | 0 | 112.3 | F643 C646 L650 Q693 A694 A695 E699 T700 V701 | F643-K697 HydrophobicContact CD2-CG 3.96Å; F643-K697 HydrophobicContact CE2-CG 3.96Å; C646-K697 HydrophobicContact CB-CB 3.91Å; L650-K697 HydrophobicContact CD1-CD 3.79Å; Q693-K697 WeakPolarHBondContact O-CB 3.44Å; Q693-K697 VanDerWaalsContact O-CG 3.26Å; Q693-K697 WeakPolarHBondContact O-CG 3.35Å; Q693-K697 PolarHBondContact O-N 3.2Å; A694-K697 PolarHBondContact O-N 3.26Å; A695-K697 VanDerWaalsContact C-N 3.33Å; A695-K697 PolarHBondContact O-N 3.04Å; K697-E699 VanDerWaalsContact C-N 3.35Å; K697-T700 WeakPolarHBondContact O-CB 3.44Å; K697-T700 PolarHBondContact O-N 3.2Å; K697-V701 WeakPolarHBondContact O-CG2 3.33Å; K697-V701 PolarHBondContact O-N 3.18Å |
| 698 | L | 97.1 | Very high | 94.1 | Very high | 5 Ų | 5 | 29.6 Ų | 29.6 | 3% | 0.026 | 15% | 0.15 | C | C | . | . | H | α-helix | trans | -61.6 | -44.9 | 174.9 | 175.8 | 64.9 | 0 | 0 | 0 | 111.1 | L668 A694 A695 T700 V701 C702 L720 M724 | L668-L698 HydrophobicContact CD1-CD1 4.32Å; L668-L698 HydrophobicContact CD1-CD2 3.51Å; L668-L698 VanDerWaalsContact CD1-CD2 3.49Å; L668-L698 HydrophobicContact CD2-CD2 4.34Å; A694-L698 WeakPolarHBondContact O-CB 3.48Å; A694-L698 PolarHBondContact O-N 3.05Å; A695-L698 PolarHBondContact O-N 3.38Å; L698-T700 VanDerWaalsContact C-N 3.34Å; L698-T700 PolarHBondContact O-N 3.14Å; L698-V701 WeakPolarHBondContact O-CB 3.22Å; L698-V701 PolarHBondContact O-N 3.28Å; L698-C702 PolarHBondContact O-N 3.3Å; L698-C702 PolarHBondContact O-SG 3.01Å; L698-L720 HydrophobicContact CD1-CD1 4.42Å; L698-L720 HydrophobicContact CD1-CD2 4.48Å; L698-M724 HydrophobicContact CD2-CG 3.97Å; L698-M724 HydrophobicContact CD2-SD 3.87Å; L698-M724 HydrophobicContact CG-SD 4.04Å |
| 699 | E | 95.7 | Very high | 94.4 | Very high | 14.6667 Ų | 14.6667 | 28.1 Ų | 28.1 | 7% | 0.069 | 14% | 0.142 | C | C | . | . | H | α-helix | trans | -59.6 | -46.2 | 176 | -173.2 | -171 | -159.7 | 0 | 0 | 111.2 | A695 E696 K697 V701 C702 F703 F721 M724 H744 T776 G778 | A695-E699 WeakPolarHBondContact O-CB 3.38Å; A695-E699 PolarHBondContact O-N 3.17Å; E696-E699 WeakPolarHBondContact O-CB 3.4Å; E696-E699 PolarHBondContact O-N 3.08Å; K697-E699 VanDerWaalsContact C-N 3.35Å; E699-V701 VanDerWaalsContact C-N 3.33Å; E699-V701 PolarHBondContact O-N 3.35Å; E699-C702 WeakPolarHBondContact O-CB 3.35Å; E699-C702 PolarHBondContact O-N 3.22Å; E699-C702 VanDerWaalsContact O-N 3.12Å; E699-F703 HydrophobicContact CG-CD2 3.96Å; E699-F703 HydrophobicContact CG-CE2 3.7Å; E699-F703 WeakPolarHBondContact O-CD2 3.45Å; E699-F703 PolarHBondContact O-N 3.31Å; E699-F703 WeakPolarHBondContact OE1-CE2 3.5Å; E699-F721 HydrophobicContact CG-CE1 4.27Å; E699-M724 HydrophobicContact CB-CE 4.29Å; E699-M724 HydrophobicContact CG-CE 4.32Å; E699-H744 IonicContact OE1-CD2 2.71Å; E699-H744 IonicContact OE1-CE1 3.1Å; E699-H744 PolarHBondContact OE1-CE1 3.4Å; E699-H744 IonicContact OE1-NE2 3.46Å; E699-H744 PolarHBondContact OE1-NE2 3.26Å; E699-H744 VanDerWaalsContact OE1-NE2 3.1Å; E699-T776 VanDerWaalsContact CD-OG1 3.25Å; E699-T776 WeakPolarHBondContact OE1-CB 3.38Å; E699-T776 WeakPolarHBondContact OE1-CG2 3.35Å; E699-T776 PolarHBondContact OE1-OG1 3.36Å; E699-T776 WeakPolarHBondContact OE2-CB 3.4Å; E699-T776 PolarHBondContact OE2-OG1 3.11Å; E699-T776 VanDerWaalsContact OE2-OG1 3.11Å; E699-G778 WeakPolarHBondContact OE2-CA 3.38Å; E699-G778 PolarHBondContact OE2-N 3.22Å; E699-G778 VanDerWaalsContact OE2-N 3.08Å |
| 700 | T | 97 | Very high | 94.3 | Very high | 3 Ų | 3 | 23.4 Ų | 23.4 | 2% | 0.018 | 12% | 0.117 | C | C | . | . | H | α-helix | trans | -57.7 | -45.3 | 175.7 | -52 | 0 | 0 | 0 | 0 | 111.2 | L650 E696 K697 L698 C702 F703 V704 G778 Q781 A782 | L650-T700 HydrophobicContact CD1-CG2 4Å; L650-T700 HydrophobicContact CD2-CG2 3.64Å; L650-T700 HydrophobicContact CG-CG2 4.49Å; E696-T700 WeakPolarHBondContact O-CB 3.48Å; E696-T700 PolarHBondContact O-N 3.17Å; E696-T700 PolarHBondContact O-OG1 3.06Å; K697-T700 WeakPolarHBondContact O-CB 3.44Å; K697-T700 PolarHBondContact O-N 3.2Å; L698-T700 VanDerWaalsContact C-N 3.34Å; L698-T700 PolarHBondContact O-N 3.14Å; T700-C702 VanDerWaalsContact C-N 3.33Å; T700-C702 PolarHBondContact O-N 3.13Å; T700-F703 PolarHBondContact O-N 2.98Å; T700-V704 HydrophobicContact CG2-CG2 4.37Å; T700-V704 WeakPolarHBondContact O-CB 3.37Å; T700-V704 WeakPolarHBondContact O-CG2 3.48Å; T700-V704 PolarHBondContact O-N 3.14Å; T700-G778 VanDerWaalsContact OG1-CA 3.31Å; T700-G778 WeakPolarHBondContact OG1-CA 3.28Å; T700-G778 PolarHBondContact OG1-O 2.83Å; T700-Q781 HydrophobicContact CG2-CB 4.07Å; T700-Q781 HydrophobicContact CG2-CG 3.82Å; T700-A782 HydrophobicContact CG2-CB 3.99Å |
| 701 | V | 97.5 | Very high | 94.1 | Very high | 0 Ų | 0 | 24.6 Ų | 24.6 | 0% | 0 | 12% | 0.124 | C | C | . | . | H | α-helix | trans | -58.2 | -47.1 | 175.4 | 166.5 | 0 | 0 | 0 | 0 | 110.3 | C646 L649 L650 L661 K697 L698 E699 F703 V704 Y705 | C646-V701 HydrophobicContact CB-CG2 3.76Å; L649-V701 HydrophobicContact CB-CG1 4.38Å; L649-V701 HydrophobicContact CB-CG2 4.04Å; L649-V701 HydrophobicContact CD1-CG1 3.9Å; L649-V701 HydrophobicContact CD1-CG2 4.49Å; L650-V701 HydrophobicContact CD1-CG2 4.2Å; L650-V701 HydrophobicContact CD2-CB 4.48Å; L650-V701 HydrophobicContact CD2-CG2 3.77Å; L650-V701 HydrophobicContact CG-CG2 3.61Å; L661-V701 HydrophobicContact CD2-CG1 3.7Å; K697-V701 WeakPolarHBondContact O-CG2 3.33Å; K697-V701 PolarHBondContact O-N 3.18Å; L698-V701 WeakPolarHBondContact O-CB 3.22Å; L698-V701 PolarHBondContact O-N 3.28Å; E699-V701 VanDerWaalsContact C-N 3.33Å; E699-V701 PolarHBondContact O-N 3.35Å; V701-F703 VanDerWaalsContact C-N 3.34Å; V701-F703 PolarHBondContact O-N 3.22Å; V701-V704 PolarHBondContact O-N 3.33Å; V701-Y705 HydrophobicContact CG1-CD2 3.8Å; V701-Y705 HydrophobicContact CG1-CE2 4.09Å; V701-Y705 WeakPolarHBondContact O-CD2 3.31Å; V701-Y705 PolarHBondContact O-N 3.19Å |
| 702 | C | 96.4 | Very high | 93.9 | Very high | 0 Ų | 0 | 28.5 Ų | 28.5 | 0% | 0 | 14% | 0.144 | C | C | . | . | H | α-helix | trans | -57.1 | -49.4 | -179.8 | -64.4 | 0 | 0 | 0 | 0 | 110.7 | L698 E699 T700 Y705 L706 L720 F721 M724 | L698-C702 PolarHBondContact O-N 3.3Å; L698-C702 PolarHBondContact O-SG 3.01Å; E699-C702 WeakPolarHBondContact O-CB 3.35Å; E699-C702 PolarHBondContact O-N 3.22Å; E699-C702 VanDerWaalsContact O-N 3.12Å; T700-C702 VanDerWaalsContact C-N 3.33Å; T700-C702 PolarHBondContact O-N 3.13Å; C702-Y705 PolarHBondContact O-N 3.19Å; C702-L706 WeakPolarHBondContact O-CG 3.3Å; C702-L706 PolarHBondContact O-N 3.34Å; C702-L720 WeakPolarHBondContact SG-CB 3.38Å; C702-F721 HydrophobicContact CB-CD1 4.46Å; C702-F721 HydrophobicContact CB-CD2 4.09Å; C702-F721 HydrophobicContact CB-CE1 3.97Å; C702-F721 HydrophobicContact CB-CE2 3.53Å; C702-F721 VanDerWaalsContact CB-CE2 3.47Å; C702-F721 HydrophobicContact CB-CG 4.45Å; C702-F721 HydrophobicContact CB-CZ 3.46Å; C702-F721 VanDerWaalsContact CB-CZ 3.46Å; C702-M724 HydrophobicContact CB-CE 4.47Å |
| 703 | F | 96.4 | Very high | 93.9 | Very high | 1.33333 Ų | 1.33333 | 22.6 Ų | 22.6 | 1% | 0.006 | 12% | 0.118 | C | C | . | . | H | α-helix | trans | -62.5 | -45.2 | 177.3 | -78.5 | -61.7 | 0 | 0 | 0 | 113.8 | E699 T700 V701 Y705 L706 F721 H744 L747 L769 L772 C779 A782 F845 | E699-F703 HydrophobicContact CG-CD2 3.96Å; E699-F703 HydrophobicContact CG-CE2 3.7Å; E699-F703 WeakPolarHBondContact O-CD2 3.45Å; E699-F703 PolarHBondContact O-N 3.31Å; E699-F703 WeakPolarHBondContact OE1-CE2 3.5Å; T700-F703 PolarHBondContact O-N 2.98Å; V701-F703 VanDerWaalsContact C-N 3.34Å; V701-F703 PolarHBondContact O-N 3.22Å; F703-Y705 VanDerWaalsContact C-N 3.33Å; F703-Y705 PolarHBondContact O-N 3.19Å; F703-L706 HydrophobicContact CD1-CD1 4.07Å; F703-L706 WeakPolarHBondContact O-CB 3.37Å; F703-L706 PolarHBondContact O-N 3.16Å; F703-F721 HydrophobicContact CD1-CE2 4.41Å; F703-F721 AromaticContact CD1-CZ 3.81Å; F703-F721 HydrophobicContact CD1-CZ 3.88Å; F703-F721 HydrophobicContact CD2-CE1 4.41Å; F703-F721 AromaticContact CD2-CZ 3.96Å; F703-F721 HydrophobicContact CD2-CZ 3.98Å; F703-F721 HydrophobicContact CE1-CE1 4.4Å; F703-F721 HydrophobicContact CE1-CE2 4.49Å; F703-F721 AromaticContact CE1-CZ 3.81Å; F703-F721 HydrophobicContact CE1-CZ 3.81Å; F703-F721 AromaticContact CE2-CE1 3.97Å; F703-F721 HydrophobicContact CE2-CE1 4.04Å; F703-F721 AromaticContact CE2-CZ 3.9Å; F703-F721 HydrophobicContact CE2-CZ 3.9Å; F703-F721 AromaticContact CG-CZ 3.92Å; F703-F721 HydrophobicContact CG-CZ 3.97Å; F703-F721 AromaticContact CZ-CE1 3.96Å; F703-F721 HydrophobicContact CZ-CE1 4.07Å; F703-F721 AromaticContact CZ-CZ 3.82Å; F703-F721 HydrophobicContact CZ-CZ 3.82Å; F703-H744 AromaticContact CE2-NE2 3.96Å; F703-H744 AromaticContact CZ-CE1 3.88Å; F703-H744 AromaticContact CZ-NE2 3.73Å; F703-L747 HydrophobicContact CE1-CD1 3.79Å; F703-L747 HydrophobicContact CE1-CD2 4.06Å; F703-L747 HydrophobicContact CZ-CD1 4.05Å; F703-L769 HydrophobicContact CD1-CD2 4.04Å; F703-L769 HydrophobicContact CE1-CD2 3.78Å; F703-L772 HydrophobicContact CE1-CD1 4.01Å; F703-L772 HydrophobicContact CZ-CD1 4.26Å; F703-C779 HydrophobicContact CD2-CB 4.06Å; F703-C779 HydrophobicContact CE2-CB 3.56Å; F703-C779 HydrophobicContact CZ-CB 3.93Å; F703-A782 HydrophobicContact CB-CB 3.51Å; F703-A782 VanDerWaalsContact CB-CB 3.48Å; F703-A782 HydrophobicContact CG-CB 4.35Å; F703-F845 HydrophobicContact CB-CE2 4.04Å; F703-F845 HydrophobicContact CB-CZ 4.02Å; F703-F845 AromaticContact CD1-CE2 3.9Å; F703-F845 HydrophobicContact CD1-CE2 3.9Å; F703-F845 HydrophobicContact CD1-CZ 4.35Å; F703-F845 HydrophobicContact CG-CE2 4.35Å; F703-F845 HydrophobicContact CG-CZ 4.44Å |
| 704 | V | 96.5 | Very high | 93.8 | Very high | 1.66667 Ų | 1.66667 | 19.1 Ų | 19.1 | 1% | 0.01 | 10% | 0.102 | C | C | . | . | H | α-helix | trans | -61.1 | -40.9 | 179.9 | 163.7 | 0 | 0 | 0 | 0 | 111.5 | L650 F652 T700 V701 L706 W707 A782 M819 | L650-V704 HydrophobicContact CD2-CB 4.33Å; L650-V704 HydrophobicContact CD2-CG2 4Å; F652-V704 HydrophobicContact CE1-CG1 4.01Å; F652-V704 HydrophobicContact CZ-CG1 3.8Å; T700-V704 HydrophobicContact CG2-CG2 4.37Å; T700-V704 WeakPolarHBondContact O-CB 3.37Å; T700-V704 WeakPolarHBondContact O-CG2 3.48Å; T700-V704 PolarHBondContact O-N 3.14Å; V701-V704 PolarHBondContact O-N 3.33Å; V704-L706 VanDerWaalsContact C-N 3.3Å; V704-L706 PolarHBondContact O-N 3.34Å; V704-W707 HydrophobicContact CB-CZ2 4.41Å; V704-W707 HydrophobicContact CG1-CH2 4.26Å; V704-W707 HydrophobicContact CG1-CZ2 3.68Å; V704-W707 VanDerWaalsContact O-CD1 3.27Å; V704-W707 PolarHBondContact O-NE1 3.15Å; V704-W707 VanDerWaalsContact O-NE1 3.14Å; V704-A782 HydrophobicContact CG2-CB 4.04Å; V704-M819 HydrophobicContact CG1-CE 3.87Å |
| 705 | Y | 95.7 | Very high | 93.6 | Very high | 1.66667 Ų | 1.66667 | 21.6 Ų | 21.6 | 1% | 0.007 | 11% | 0.114 | C | C | . | . | H | α-helix | trans | -79.2 | -8.1 | -178.7 | -80.5 | -88.8 | 0 | 0 | 0 | 114.1 | L649 F657 L661 V701 C702 F703 W707 S708 A713 M819 | L649-Y705 HydrophobicContact CB-CE2 4.06Å; L649-Y705 HydrophobicContact CD2-CE2 4.42Å; L649-Y705 WeakPolarHBondContact CD2-OH 3.33Å; L649-Y705 PolarHBondContact O-OH 3.02Å; F657-Y705 HydrophobicContact CB-CE1 3.98Å; F657-Y705 AromaticContact CD2-CD1 3.98Å; F657-Y705 HydrophobicContact CD2-CD1 4.01Å; F657-Y705 AromaticContact CD2-CE1 3.42Å; F657-Y705 HydrophobicContact CD2-CE1 3.42Å; F657-Y705 VanDerWaalsContact CD2-CE1 3.45Å; F657-Y705 HydrophobicContact CE2-CD1 4.44Å; F657-Y705 HydrophobicContact CE2-CE1 4.17Å; F657-Y705 AromaticContact CG-CE1 3.86Å; F657-Y705 HydrophobicContact CG-CE1 3.86Å; L661-Y705 HydrophobicContact CD1-CD1 3.79Å; L661-Y705 HydrophobicContact CD1-CD2 4.45Å; L661-Y705 HydrophobicContact CD1-CE1 4.25Å; L661-Y705 HydrophobicContact CD1-CG 3.88Å; V701-Y705 HydrophobicContact CG1-CD2 3.8Å; V701-Y705 HydrophobicContact CG1-CE2 4.09Å; V701-Y705 WeakPolarHBondContact O-CD2 3.31Å; V701-Y705 PolarHBondContact O-N 3.19Å; C702-Y705 PolarHBondContact O-N 3.19Å; F703-Y705 VanDerWaalsContact C-N 3.33Å; F703-Y705 PolarHBondContact O-N 3.19Å; Y705-W707 PolarHBondContact O-N 3.11Å; Y705-S708 VanDerWaalsContact O-CB 3.24Å; Y705-S708 WeakPolarHBondContact O-CB 3.4Å; Y705-S708 PolarHBondContact O-N 3.18Å; Y705-A713 HydrophobicContact CD1-CB 4.38Å; Y705-M819 HydrophobicContact CD1-CE 4.33Å; Y705-M819 HydrophobicContact CD1-SD 4.16Å; Y705-M819 HydrophobicContact CE1-CE 4.37Å; Y705-M819 HydrophobicContact CE1-SD 3.97Å |
| 706 | L | 94.9 | Very high | 93.6 | Very high | 0.333333 Ų | 0.333333 | 19.9 Ų | 19.9 | 0% | 0.002 | 10% | 0.1 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -63.4 | -26.7 | 172.7 | -67.3 | -177.1 | 0 | 0 | 0 | 113.4 | C702 F703 V704 A717 L718 F721 L747 R758 Q762 I765 L769 | C702-L706 WeakPolarHBondContact O-CG 3.3Å; C702-L706 PolarHBondContact O-N 3.34Å; F703-L706 HydrophobicContact CD1-CD1 4.07Å; F703-L706 WeakPolarHBondContact O-CB 3.37Å; F703-L706 PolarHBondContact O-N 3.16Å; V704-L706 VanDerWaalsContact C-N 3.3Å; V704-L706 PolarHBondContact O-N 3.34Å; L706-A717 HydrophobicContact CD2-CB 4.14Å; L706-L718 HydrophobicContact CD2-CD2 3.54Å; L706-L718 HydrophobicContact CD2-CG 3.72Å; L706-F721 HydrophobicContact CD1-CE2 4.26Å; L706-F721 HydrophobicContact CD2-CE2 4.48Å; L706-L747 HydrophobicContact CD1-CD2 4.08Å; L706-R758 PolarHBondContact O-NH2 3.17Å; L706-Q762 PolarHBondContact O-OE1 3.03Å; L706-I765 HydrophobicContact CB-CG2 4.11Å; L706-I765 HydrophobicContact CD1-CG2 4.01Å; L706-I765 HydrophobicContact CD2-CD1 4.47Å; L706-I765 HydrophobicContact CG-CG2 4.44Å; L706-L769 HydrophobicContact CD1-CD1 4.38Å; L706-L769 HydrophobicContact CD1-CD2 3.97Å; L706-L769 HydrophobicContact CD1-CG 4.49Å |
| 707 | W | 94.8 | Very high | 93.6 | Very high | 0.333333 Ų | 0.333333 | 16.4 Ų | 16.4 | 0% | 0.001 | 8% | 0.084 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -96 | 3.1 | 177.9 | 50.6 | -105.6 | 0 | 0 | 0 | 113.9 | F652 V704 Y705 T786 Y789 L815 M819 L838 N841 M842 F845 | F652-W707 HydrophobicContact CE1-CH2 4.25Å; F652-W707 AromaticContact CZ-CH2 3.83Å; F652-W707 HydrophobicContact CZ-CH2 4.14Å; F652-W707 HydrophobicContact CZ-CZ2 4.3Å; V704-W707 HydrophobicContact CB-CZ2 4.41Å; V704-W707 HydrophobicContact CG1-CH2 4.26Å; V704-W707 HydrophobicContact CG1-CZ2 3.68Å; V704-W707 VanDerWaalsContact O-CD1 3.27Å; V704-W707 PolarHBondContact O-NE1 3.15Å; V704-W707 VanDerWaalsContact O-NE1 3.14Å; Y705-W707 PolarHBondContact O-N 3.11Å; W707-T786 HydrophobicContact CZ2-CG2 4.36Å; W707-T786 PolarHBondContact NE1-OG1 3.32Å; W707-T786 VanDerWaalsContact NE1-OG1 3.08Å; W707-Y789 HydrophobicContact CH2-CD2 4.23Å; W707-Y789 HydrophobicContact CZ2-CD2 4.31Å; W707-L815 HydrophobicContact CH2-CD1 4.46Å; W707-L815 HydrophobicContact CH2-CD2 3.98Å; W707-L815 HydrophobicContact CZ3-CD2 4.18Å; W707-M819 HydrophobicContact CD2-CE 4.29Å; W707-M819 HydrophobicContact CE3-CE 3.77Å; W707-M819 VanDerWaalsContact CE3-CE 3.42Å; W707-M819 HydrophobicContact CH2-CE 3.46Å; W707-M819 VanDerWaalsContact CH2-CE 3.43Å; W707-M819 HydrophobicContact CZ2-CE 4.15Å; W707-M819 HydrophobicContact CZ3-CE 3.26Å; W707-M819 HydrophobicContact CZ3-CG 3.95Å; W707-M819 HydrophobicContact CZ3-SD 4.25Å; W707-L838 HydrophobicContact CE3-CD1 3.62Å; W707-L838 HydrophobicContact CZ3-CD1 3.85Å; W707-L838 HydrophobicContact CZ3-CG 4.47Å; W707-L838 WeakPolarHBondContact O-CD1 3.16Å; W707-N841 HydrophobicContact CB-CB 3.72Å; W707-N841 WeakPolarHBondContact O-CB 3.39Å; W707-N841 PolarHBondContact O-ND2 3.31Å; W707-N841 VanDerWaalsContact O-ND2 3.08Å; W707-M842 HydrophobicContact CD2-CG 3.72Å; W707-M842 HydrophobicContact CE3-CG 3.68Å; W707-M842 HydrophobicContact CE3-SD 4.3Å; W707-M842 HydrophobicContact CG-CG 4.17Å; W707-M842 HydrophobicContact CH2-CG 4.42Å; W707-M842 HydrophobicContact CH2-SD 4.14Å; W707-M842 HydrophobicContact CZ2-CG 4.44Å; W707-M842 HydrophobicContact CZ2-SD 4.47Å; W707-M842 HydrophobicContact CZ3-CG 4.03Å; W707-M842 HydrophobicContact CZ3-SD 4.02Å; W707-F845 AromaticContact CD1-CG 3.91Å |
| 708 | S | 92.8 | Very high | 93.5 | Very high | 0 Ų | 0 | 13.4 Ų | 13.4 | 0% | 0 | 7% | 0.071 | C | C | . | . | trans | -56 | 146.9 | 173.3 | -180 | 0 | 0 | 0 | 0 | 112.5 | Y705 D710 R758 M819 | Y705-S708 VanDerWaalsContact O-CB 3.24Å; Y705-S708 WeakPolarHBondContact O-CB 3.4Å; Y705-S708 PolarHBondContact O-N 3.18Å; S708-D710 VanDerWaalsContact C-N 3.27Å; S708-D710 PolarHBondContact O-N 3.41Å; S708-D710 PolarHBondContact OG-N 3.07Å; S708-D710 VanDerWaalsContact OG-N 3.17Å; S708-R758 VanDerWaalsContact O-CZ 3.23Å; S708-R758 PolarHBondContact O-NE 3.31Å; S708-R758 PolarHBondContact O-NH2 3.07Å; S708-M819 PolarHBondContact OG-O 3.24Å | ||
| 709 | L | 91.1 | Very high | 93.3 | Very high | 33.3333 Ų | 33.3333 | 14.3 Ų | 14.3 | 18% | 0.175 | 8% | 0.077 | C | C | . | . | S | Bend | trans | -77.7 | -15 | 174.1 | -61.9 | 179 | 0 | 0 | 0 | 112.6 | M819 M820 M834 K837 L838 | L709-M819 VanDerWaalsContact CB-O 3.31Å; L709-M819 WeakPolarHBondContact CB-O 3.34Å; L709-M819 PolarHBondContact N-O 3.09Å; L709-M820 HydrophobicContact CB-CG 4.33Å; L709-M820 HydrophobicContact CD1-CG 3.97Å; L709-M820 HydrophobicContact CD1-SD 4.38Å; L709-M834 HydrophobicContact CD1-CB 4.2Å; L709-K837 HydrophobicContact CD2-CB 3.87Å; L709-L838 HydrophobicContact CD1-CB 4.19Å; L709-L838 HydrophobicContact CD2-CB 4.42Å; L709-L838 HydrophobicContact CG-CB 4.29Å; L709-L838 HydrophobicContact CG-CD1 4.21Å |
| 710 | D | 88.2 | Confident | 93.3 | Very high | 13 Ų | 13 | 13.6 Ų | 13.6 | 7% | 0.07 | 7% | 0.074 | C | C | . | . | trans | -76.6 | 118.8 | 172.7 | -176.9 | -10.1 | 0 | 0 | 0 | 110.4 | F657 S658 S708 D712 A713 A714 | F657-D710 HydrophobicContact CE2-CB 4.14Å; F657-D710 HydrophobicContact CZ-CB 4.26Å; S658-D710 VanDerWaalsContact CB-OD2 3.25Å; S658-D710 WeakPolarHBondContact CB-OD2 3.34Å; S658-D710 PolarHBondContact OG-OD2 3.29Å; S708-D710 VanDerWaalsContact C-N 3.27Å; S708-D710 PolarHBondContact O-N 3.41Å; S708-D710 PolarHBondContact OG-N 3.07Å; S708-D710 VanDerWaalsContact OG-N 3.17Å; D710-D712 VanDerWaalsContact C-N 3.34Å; D710-D712 WeakPolarHBondContact OD1-CA 3.46Å; D710-D712 WeakPolarHBondContact OD1-CB 3.23Å; D710-D712 PolarHBondContact OD1-N 3.1Å; D710-A713 HydrophobicContact CB-CB 3.89Å; D710-A713 PolarHBondContact O-N 3.37Å; D710-A713 PolarHBondContact OD1-N 3.26Å; D710-A714 PolarHBondContact O-N 3.21Å | ||
| 711 | N | 87 | Confident | 93.2 | Very high | 59.3333 Ų | 59.3333 | 13.5 Ų | 13.5 | 32% | 0.317 | 7% | 0.073 | S | C | . | . | H | α-helix | trans | -62.9 | -41.1 | 177 | -73.1 | -45.1 | 0 | 0 | 0 | 111.6 | A713 A714 I715 R758 | N711-A713 VanDerWaalsContact C-N 3.32Å; N711-A713 PolarHBondContact O-N 3.12Å; N711-A714 PolarHBondContact O-N 2.98Å; N711-I715 WeakPolarHBondContact O-CB 3.43Å; N711-I715 VanDerWaalsContact O-CG1 3.26Å; N711-I715 WeakPolarHBondContact O-CG1 3.32Å; N711-I715 PolarHBondContact O-N 3.23Å; N711-R758 VanDerWaalsContact OD1-CA 3.3Å; N711-R758 WeakPolarHBondContact OD1-CA 3.27Å; N711-R758 VanDerWaalsContact OD1-CB 3.28Å; N711-R758 WeakPolarHBondContact OD1-CB 3.35Å; N711-R758 WeakPolarHBondContact OD1-CD 3.39Å |
| 712 | D | 86.6 | Confident | 93 | Very high | 90.3333 Ų | 90.3333 | 16.8 Ų | 16.8 | 48% | 0.483 | 9% | 0.086 | S | C | . | . | H | α-helix | trans | -67.7 | -38.7 | -175.7 | -70.1 | -17.7 | 0 | 0 | 0 | 110.1 | D710 T716 | D710-D712 VanDerWaalsContact C-N 3.34Å; D710-D712 WeakPolarHBondContact OD1-CA 3.46Å; D710-D712 WeakPolarHBondContact OD1-CB 3.23Å; D710-D712 PolarHBondContact OD1-N 3.1Å; D712-T716 WeakPolarHBondContact O-CB 3.32Å; D712-T716 PolarHBondContact O-N 3.03Å; D712-T716 PolarHBondContact O-OG1 3.19Å |
| 713 | A | 91.3 | Very high | 92.9 | Very high | 0 Ų | 0 | 17.1 Ų | 17.1 | 0% | 0 | 9% | 0.088 | C | C | . | . | H | α-helix | trans | -63.1 | -46.8 | 174.4 | 0 | 0 | 0 | 0 | 0 | 112.1 | F657 L661 Y705 D710 N711 T716 A717 | F657-A713 HydrophobicContact CD2-CB 4.12Å; F657-A713 HydrophobicContact CE2-CB 3.75Å; L661-A713 HydrophobicContact CD1-CB 3.97Å; Y705-A713 HydrophobicContact CD1-CB 4.38Å; D710-A713 HydrophobicContact CB-CB 3.89Å; D710-A713 PolarHBondContact O-N 3.37Å; D710-A713 PolarHBondContact OD1-N 3.26Å; N711-A713 VanDerWaalsContact C-N 3.32Å; N711-A713 PolarHBondContact O-N 3.12Å; A713-T716 PolarHBondContact O-N 3.12Å; A713-A717 WeakPolarHBondContact O-CB 3.4Å; A713-A717 PolarHBondContact O-N 2.85Å |
| 714 | A | 91.9 | Very high | 92.8 | Very high | 0 Ų | 0 | 18.1 Ų | 18.1 | 0% | 0 | 9% | 0.092 | C | C | . | . | H | α-helix | trans | -64.4 | -43.7 | 179.1 | 0 | 0 | 0 | 0 | 0 | 112 | D710 N711 T716 A717 L718 L761 I765 | D710-A714 PolarHBondContact O-N 3.21Å; N711-A714 PolarHBondContact O-N 2.98Å; A714-T716 VanDerWaalsContact C-N 3.33Å; A714-T716 PolarHBondContact O-N 3Å; A714-A717 PolarHBondContact O-N 3.4Å; A714-L718 WeakPolarHBondContact O-CG 3.34Å; A714-L718 PolarHBondContact O-N 3.26Å; A714-L761 HydrophobicContact CB-CD2 4.46Å; A714-I765 HydrophobicContact CB-CD1 4.43Å |
| 715 | I | 91 | Very high | 92.7 | Very high | 51.6667 Ų | 51.6667 | 18 Ų | 18 | 27% | 0.265 | 9% | 0.092 | S | C | . | . | H | α-helix | trans | -64.9 | -39.7 | 176 | -68 | 167.9 | 0 | 0 | 0 | 110.7 | N711 L718 S719 T751 T755 L761 | N711-I715 WeakPolarHBondContact O-CB 3.43Å; N711-I715 VanDerWaalsContact O-CG1 3.26Å; N711-I715 WeakPolarHBondContact O-CG1 3.32Å; N711-I715 PolarHBondContact O-N 3.23Å; I715-L718 PolarHBondContact O-N 3.19Å; I715-S719 WeakPolarHBondContact O-CB 3.37Å; I715-S719 PolarHBondContact O-N 3.08Å; I715-S719 PolarHBondContact O-OG 3.5Å; I715-T751 HydrophobicContact CG2-CG2 4.21Å; I715-T755 HydrophobicContact CD1-CG2 4.2Å; I715-L761 HydrophobicContact CD1-CD2 4.39Å; I715-L761 HydrophobicContact CG1-CD2 3.98Å |
| 716 | T | 92.9 | Very high | 92.5 | Very high | 6.33333 Ų | 6.33333 | 21.6 Ų | 21.6 | 4% | 0.039 | 11% | 0.109 | C | C | . | . | H | α-helix | trans | -65.8 | -41.1 | 177.5 | -57.5 | 0 | 0 | 0 | 0 | 111.1 | L661 R662 R665 D712 A713 A714 L718 S719 L720 | L661-T716 HydrophobicContact CB-CG2 3.8Å; L661-T716 WeakPolarHBondContact O-CG2 3.39Å; R662-T716 HydrophobicContact CG-CG2 3.98Å; R665-T716 HydrophobicContact CB-CG2 4.46Å; D712-T716 WeakPolarHBondContact O-CB 3.32Å; D712-T716 PolarHBondContact O-N 3.03Å; D712-T716 PolarHBondContact O-OG1 3.19Å; A713-T716 PolarHBondContact O-N 3.12Å; A714-T716 VanDerWaalsContact C-N 3.33Å; A714-T716 PolarHBondContact O-N 3Å; T716-L718 PolarHBondContact O-N 3.25Å; T716-S719 WeakPolarHBondContact CA-OG 3.41Å; T716-S719 CarbonylContact O-C 3.4Å; T716-S719 WeakPolarHBondContact O-CB 3.46Å; T716-S719 PolarHBondContact O-N 3.33Å; T716-S719 VanDerWaalsContact O-N 3.14Å; T716-S719 PolarHBondContact O-OG 3.32Å; T716-L720 WeakPolarHBondContact O-CG 3.4Å; T716-L720 PolarHBondContact O-N 3.05Å |
| 717 | A | 94.9 | Very high | 92.4 | Very high | 0 Ų | 0 | 22.3 Ų | 22.3 | 0% | 0 | 11% | 0.112 | C | C | . | . | H | α-helix | trans | -60.3 | -42.7 | 173 | 0 | 0 | 0 | 0 | 0 | 112.5 | L706 A713 A714 S719 L720 F721 | L706-A717 HydrophobicContact CD2-CB 4.14Å; A713-A717 WeakPolarHBondContact O-CB 3.4Å; A713-A717 PolarHBondContact O-N 2.85Å; A714-A717 PolarHBondContact O-N 3.4Å; A717-S719 VanDerWaalsContact C-N 3.31Å; A717-S719 PolarHBondContact O-N 3.18Å; A717-L720 WeakPolarHBondContact O-CB 3.35Å; A717-L720 PolarHBondContact O-N 3.03Å; A717-F721 WeakPolarHBondContact O-CD2 3.38Å; A717-F721 PolarHBondContact O-N 3.2Å |
| 718 | L | 93.6 | Very high | 92.3 | Very high | 0 Ų | 0 | 22.8 Ų | 22.8 | 0% | 0 | 12% | 0.116 | C | C | . | . | H | α-helix | trans | -61.7 | -39.5 | 172.9 | -68.6 | 170.1 | 0 | 0 | 0 | 112.2 | L706 A714 I715 T716 L720 F721 R722 L747 A748 A750 T751 L761 I765 | L706-L718 HydrophobicContact CD2-CD2 3.54Å; L706-L718 HydrophobicContact CD2-CG 3.72Å; A714-L718 WeakPolarHBondContact O-CG 3.34Å; A714-L718 PolarHBondContact O-N 3.26Å; I715-L718 PolarHBondContact O-N 3.19Å; T716-L718 PolarHBondContact O-N 3.25Å; L718-L720 VanDerWaalsContact C-N 3.32Å; L718-L720 PolarHBondContact O-N 3Å; L718-F721 WeakPolarHBondContact O-CB 3.28Å; L718-F721 PolarHBondContact O-N 3.38Å; L718-R722 PolarHBondContact O-N 2.95Å; L718-L747 HydrophobicContact CD2-CD1 4.04Å; L718-L747 HydrophobicContact CD2-CD2 4.48Å; L718-L747 HydrophobicContact CD2-CG 3.83Å; L718-L747 WeakPolarHBondContact CD2-O 3.49Å; L718-A748 VanDerWaalsContact O-CB 3.3Å; L718-A748 WeakPolarHBondContact O-CB 3.47Å; L718-A750 HydrophobicContact CD1-CB 3.93Å; L718-A750 HydrophobicContact CD2-CB 4.2Å; L718-T751 HydrophobicContact CB-CG2 3.48Å; L718-T751 VanDerWaalsContact CB-CG2 3.44Å; L718-T751 HydrophobicContact CD1-CG2 3.87Å; L718-T751 VanDerWaalsContact CD1-CG2 3.48Å; L718-T751 HydrophobicContact CG-CG2 4.33Å; L718-L761 HydrophobicContact CD1-CD1 4.43Å; L718-I765 HydrophobicContact CD1-CD1 4.16Å; L718-I765 HydrophobicContact CD1-CG1 4.05Å; L718-I765 HydrophobicContact CD2-CG1 4.46Å |
| 719 | S | 93.2 | Very high | 92.2 | Very high | 23.3333 Ų | 23.3333 | 26.6 Ų | 26.6 | 16% | 0.163 | 13% | 0.134 | C | C | . | . | H | α-helix | trans | -69.9 | -27.8 | 175.8 | 99.2 | 0 | 0 | 0 | 0 | 113.1 | R665 I715 T716 A717 F721 R722 V723 | R665-S719 WeakPolarHBondContact CD-OG 3.37Å; R665-S719 PolarHBondContact NH1-OG 3.1Å; I715-S719 WeakPolarHBondContact O-CB 3.37Å; I715-S719 PolarHBondContact O-N 3.08Å; I715-S719 PolarHBondContact O-OG 3.5Å; T716-S719 WeakPolarHBondContact CA-OG 3.41Å; T716-S719 CarbonylContact O-C 3.4Å; T716-S719 WeakPolarHBondContact O-CB 3.46Å; T716-S719 PolarHBondContact O-N 3.33Å; T716-S719 VanDerWaalsContact O-N 3.14Å; T716-S719 PolarHBondContact O-OG 3.32Å; A717-S719 VanDerWaalsContact C-N 3.31Å; A717-S719 PolarHBondContact O-N 3.18Å; S719-F721 VanDerWaalsContact C-N 3.33Å; S719-R722 VanDerWaalsContact O-CB 3.32Å; S719-R722 WeakPolarHBondContact O-CB 3.37Å; S719-R722 PolarHBondContact O-N 3.34Å; S719-V723 WeakPolarHBondContact O-CG2 3.38Å; S719-V723 PolarHBondContact O-N 3.06Å; S719-V723 VanDerWaalsContact O-N 3.14Å |
| 720 | L | 96 | Very high | 92.2 | Very high | 0 Ų | 0 | 25.8 Ų | 25.8 | 0% | 0 | 13% | 0.13 | C | C | . | . | H | α-helix | trans | -66.1 | -37.4 | 173.3 | -76.6 | 167.3 | 0 | 0 | 0 | 111.4 | L661 R665 L668 L698 C702 T716 A717 L718 R722 V723 M724 | L661-L720 HydrophobicContact CD2-CD1 4.04Å; R665-L720 VanDerWaalsContact CA-CD2 3.48Å; R665-L720 HydrophobicContact CB-CD2 3.73Å; R665-L720 HydrophobicContact CB-CG 4.28Å; R665-L720 HydrophobicContact CG-CD2 4.24Å; L668-L720 HydrophobicContact CD1-CD2 3.64Å; L698-L720 HydrophobicContact CD1-CD1 4.42Å; L698-L720 HydrophobicContact CD1-CD2 4.48Å; C702-L720 WeakPolarHBondContact SG-CB 3.38Å; T716-L720 WeakPolarHBondContact O-CG 3.4Å; T716-L720 PolarHBondContact O-N 3.05Å; A717-L720 WeakPolarHBondContact O-CB 3.35Å; A717-L720 PolarHBondContact O-N 3.03Å; L718-L720 VanDerWaalsContact C-N 3.32Å; L718-L720 PolarHBondContact O-N 3Å; L720-R722 VanDerWaalsContact C-N 3.28Å; L720-R722 PolarHBondContact O-N 2.81Å; L720-V723 PolarHBondContact O-N 3.12Å; L720-M724 WeakPolarHBondContact O-CG 3.25Å; L720-M724 PolarHBondContact O-N 2.89Å |
| 721 | F | 94.8 | Very high | 92.2 | Very high | 0 Ų | 0 | 28.4 Ų | 28.4 | 0% | 0 | 14% | 0.138 | C | C | . | . | H | α-helix | trans | -57.8 | -40.3 | 170.6 | -75.3 | -65 | 0 | 0 | 0 | 112.1 | E699 C702 F703 L706 A717 L718 S719 M724 C725 H744 L747 A748 | E699-F721 HydrophobicContact CG-CE1 4.27Å; C702-F721 HydrophobicContact CB-CD1 4.46Å; C702-F721 HydrophobicContact CB-CD2 4.09Å; C702-F721 HydrophobicContact CB-CE1 3.97Å; C702-F721 HydrophobicContact CB-CE2 3.53Å; C702-F721 VanDerWaalsContact CB-CE2 3.47Å; C702-F721 HydrophobicContact CB-CG 4.45Å; C702-F721 HydrophobicContact CB-CZ 3.46Å; C702-F721 VanDerWaalsContact CB-CZ 3.46Å; F703-F721 HydrophobicContact CD1-CE2 4.41Å; F703-F721 AromaticContact CD1-CZ 3.81Å; F703-F721 HydrophobicContact CD1-CZ 3.88Å; F703-F721 HydrophobicContact CD2-CE1 4.41Å; F703-F721 AromaticContact CD2-CZ 3.96Å; F703-F721 HydrophobicContact CD2-CZ 3.98Å; F703-F721 HydrophobicContact CE1-CE1 4.4Å; F703-F721 HydrophobicContact CE1-CE2 4.49Å; F703-F721 AromaticContact CE1-CZ 3.81Å; F703-F721 HydrophobicContact CE1-CZ 3.81Å; F703-F721 AromaticContact CE2-CE1 3.97Å; F703-F721 HydrophobicContact CE2-CE1 4.04Å; F703-F721 AromaticContact CE2-CZ 3.9Å; F703-F721 HydrophobicContact CE2-CZ 3.9Å; F703-F721 AromaticContact CG-CZ 3.92Å; F703-F721 HydrophobicContact CG-CZ 3.97Å; F703-F721 AromaticContact CZ-CE1 3.96Å; F703-F721 HydrophobicContact CZ-CE1 4.07Å; F703-F721 AromaticContact CZ-CZ 3.82Å; F703-F721 HydrophobicContact CZ-CZ 3.82Å; L706-F721 HydrophobicContact CD1-CE2 4.26Å; L706-F721 HydrophobicContact CD2-CE2 4.48Å; A717-F721 WeakPolarHBondContact O-CD2 3.38Å; A717-F721 PolarHBondContact O-N 3.2Å; L718-F721 WeakPolarHBondContact O-CB 3.28Å; L718-F721 PolarHBondContact O-N 3.38Å; S719-F721 VanDerWaalsContact C-N 3.33Å; F721-M724 HydrophobicContact CB-CE 4.39Å; F721-M724 HydrophobicContact CD1-CE 3.51Å; F721-M724 HydrophobicContact CD1-SD 4.45Å; F721-M724 HydrophobicContact CE1-CE 3.96Å; F721-M724 HydrophobicContact CG-CE 4.03Å; F721-M724 PolarHBondContact O-N 3.04Å; F721-C725 PolarHBondContact O-N 3.35Å; F721-C725 VanDerWaalsContact O-N 3.08Å; F721-C725 PolarHBondContact O-SG 3.29Å; F721-H744 HydrophobicContact CB-CB 4.31Å; F721-H744 HydrophobicContact CD1-CB 3.93Å; F721-H744 AromaticContact CD1-CD2 3.48Å; F721-H744 WeakPolarHBondContact CD1-CD2 3.38Å; F721-H744 AromaticContact CD1-CG 3.72Å; F721-H744 AromaticContact CD1-ND1 3.58Å; F721-H744 AromaticContact CE1-CD2 3.53Å; F721-H744 WeakPolarHBondContact CE1-CD2 3.47Å; F721-H744 AromaticContact CE1-CE1 3.86Å; F721-H744 AromaticContact CE1-ND1 3.51Å; F721-H744 AromaticContact CE1-NE2 3.64Å; F721-H744 HydrophobicContact CG-CB 4.41Å; F721-L747 HydrophobicContact CD2-CB 4.02Å; F721-L747 HydrophobicContact CD2-CD1 4.21Å; F721-L747 HydrophobicContact CD2-CD2 3.77Å; F721-L747 HydrophobicContact CD2-CG 4.34Å; F721-L747 HydrophobicContact CE1-CD1 4.27Å; F721-L747 HydrophobicContact CE1-CD2 4.47Å; F721-L747 HydrophobicContact CE2-CB 4.47Å; F721-L747 HydrophobicContact CE2-CD1 3.91Å; F721-L747 HydrophobicContact CE2-CD2 3.52Å; F721-L747 VanDerWaalsContact CE2-CD2 3.41Å; F721-L747 HydrophobicContact CE2-CG 4.41Å; F721-L747 HydrophobicContact CG-CB 4.33Å; F721-L747 HydrophobicContact CG-CD2 4.38Å; F721-L747 HydrophobicContact CZ-CD1 3.94Å; F721-L747 HydrophobicContact CZ-CD2 3.94Å; F721-A748 HydrophobicContact CB-CB 4.31Å |
| 722 | R | 93.6 | Very high | 92 | Very high | 71 Ų | 71 | 27.1 Ų | 27.1 | 27% | 0.268 | 13% | 0.134 | S | C | . | . | H | α-helix | trans | -59.7 | -49.2 | 174.4 | 177.2 | 61.8 | 65.3 | -163.4 | -2.2 | 111.5 | L718 S719 L720 M724 C725 E726 A745 A748 N749 | L718-R722 PolarHBondContact O-N 2.95Å; S719-R722 VanDerWaalsContact O-CB 3.32Å; S719-R722 WeakPolarHBondContact O-CB 3.37Å; S719-R722 PolarHBondContact O-N 3.34Å; L720-R722 VanDerWaalsContact C-N 3.28Å; L720-R722 PolarHBondContact O-N 2.81Å; R722-M724 VanDerWaalsContact C-N 3.28Å; R722-M724 PolarHBondContact O-N 3.24Å; R722-C725 WeakPolarHBondContact O-CB 3.19Å; R722-C725 PolarHBondContact O-N 2.94Å; R722-C725 VanDerWaalsContact O-N 3.08Å; R722-E726 HydrophobicContact CG-CG 4.47Å; R722-E726 VanDerWaalsContact CG-OE1 3.31Å; R722-E726 WeakPolarHBondContact CG-OE1 3.25Å; R722-E726 WeakPolarHBondContact O-CG 3.35Å; R722-E726 PolarHBondContact O-N 3.11Å; R722-A745 PolarHBondContact NH2-O 2.96Å; R722-A748 HydrophobicContact CB-CB 3.85Å; R722-A748 PolarHBondContact NH2-O 3.12Å; R722-N749 PolarHBondContact NH2-OD1 3.34Å |
| 723 | V | 94.9 | Very high | 91.4 | Very high | 6.33333 Ų | 6.33333 | 30 Ų | 30 | 4% | 0.038 | 14% | 0.142 | C | C | . | . | H | α-helix | trans | -64.2 | -34.7 | -178.4 | -179 | 0 | 0 | 0 | 0 | 111.5 | R665 L668 I669 N672 S719 L720 E726 E727 | R665-V723 HydrophobicContact CG-CG2 4.11Å; L668-V723 HydrophobicContact CB-CG1 3.49Å; L668-V723 VanDerWaalsContact CB-CG1 3.48Å; I669-V723 HydrophobicContact CG1-CG1 4.34Å; I669-V723 HydrophobicContact CG1-CG2 4.01Å; N672-V723 WeakPolarHBondContact ND2-CG1 3.27Å; N672-V723 PolarHBondContact ND2-O 2.82Å; S719-V723 WeakPolarHBondContact O-CG2 3.38Å; S719-V723 PolarHBondContact O-N 3.06Å; S719-V723 VanDerWaalsContact O-N 3.14Å; L720-V723 PolarHBondContact O-N 3.12Å; V723-E726 PolarHBondContact O-N 3.24Å; V723-E727 PolarHBondContact O-N 3.43Å |
| 724 | M | 94 | Very high | 90.5 | Very high | 21.3333 Ų | 21.3333 | 33.7 Ų | 33.7 | 11% | 0.105 | 17% | 0.169 | C | C | . | . | H | α-helix | trans | -65.6 | -38.2 | 172 | -70 | 176.4 | 8.9 | 0 | 0 | 112.5 | L698 E699 C702 L720 F721 R722 E727 A728 Y741 | L698-M724 HydrophobicContact CD2-CG 3.97Å; L698-M724 HydrophobicContact CD2-SD 3.87Å; L698-M724 HydrophobicContact CG-SD 4.04Å; E699-M724 HydrophobicContact CB-CE 4.29Å; E699-M724 HydrophobicContact CG-CE 4.32Å; C702-M724 HydrophobicContact CB-CE 4.47Å; L720-M724 WeakPolarHBondContact O-CG 3.25Å; L720-M724 PolarHBondContact O-N 2.89Å; F721-M724 HydrophobicContact CB-CE 4.39Å; F721-M724 HydrophobicContact CD1-CE 3.51Å; F721-M724 HydrophobicContact CD1-SD 4.45Å; F721-M724 HydrophobicContact CE1-CE 3.96Å; F721-M724 HydrophobicContact CG-CE 4.03Å; F721-M724 PolarHBondContact O-N 3.04Å; R722-M724 VanDerWaalsContact C-N 3.28Å; R722-M724 PolarHBondContact O-N 3.24Å; M724-E727 PolarHBondContact O-N 2.99Å; M724-A728 PolarHBondContact O-N 3.22Å; M724-A728 VanDerWaalsContact O-N 3.1Å; M724-Y741 HydrophobicContact CB-CE1 4.22Å |
| 725 | C | 92.9 | Very high | 89.4 | Confident | 0.333333 Ų | 0.333333 | 41.5 Ų | 41.5 | 0% | 0.002 | 21% | 0.21 | C | C | . | . | H | α-helix | trans | -65.7 | -43.7 | 175.1 | -62.6 | 0 | 0 | 0 | 0 | 111.4 | F721 R722 E727 A728 E729 L737 Y741 H744 A745 | F721-C725 PolarHBondContact O-N 3.35Å; F721-C725 VanDerWaalsContact O-N 3.08Å; F721-C725 PolarHBondContact O-SG 3.29Å; R722-C725 WeakPolarHBondContact O-CB 3.19Å; R722-C725 PolarHBondContact O-N 2.94Å; R722-C725 VanDerWaalsContact O-N 3.08Å; C725-E727 VanDerWaalsContact C-N 3.3Å; C725-E727 PolarHBondContact O-N 3.33Å; C725-A728 WeakPolarHBondContact O-CB 3.37Å; C725-A728 PolarHBondContact O-N 3.03Å; C725-A728 VanDerWaalsContact O-N 3.11Å; C725-E729 WeakPolarHBondContact O-CG 3.4Å; C725-E729 PolarHBondContact O-N 3.14Å; C725-L737 HydrophobicContact CB-CD2 4.05Å; C725-Y741 HydrophobicContact CB-CD2 4.03Å; C725-Y741 HydrophobicContact CB-CE2 3.68Å; C725-Y741 PolarHBondContact SG-O 2.9Å; C725-H744 VanDerWaalsContact SG-C 3.52Å; C725-H744 VanDerWaalsContact SG-CB 3.55Å; C725-H744 WeakPolarHBondContact SG-CB 3.29Å; C725-A745 HydrophobicContact CB-CB 4.32Å; C725-A745 PolarHBondContact SG-N 3.36Å; C725-A745 VanDerWaalsContact SG-N 3.4Å |
| 726 | E | 92.7 | Very high | 88.7 | Confident | 75.6667 Ų | 75.6667 | 45.6 Ų | 45.6 | 35% | 0.354 | 23% | 0.228 | S | C | . | . | H | α-helix | trans | -59.6 | -40.6 | 174.7 | -69.3 | 167.7 | -173.7 | 0 | 0 | 111.3 | R722 V723 A728 E729 I730 | R722-E726 HydrophobicContact CG-CG 4.47Å; R722-E726 VanDerWaalsContact CG-OE1 3.31Å; R722-E726 WeakPolarHBondContact CG-OE1 3.25Å; R722-E726 WeakPolarHBondContact O-CG 3.35Å; R722-E726 PolarHBondContact O-N 3.11Å; V723-E726 PolarHBondContact O-N 3.24Å; E726-A728 VanDerWaalsContact C-N 3.33Å; E726-A728 PolarHBondContact O-N 2.91Å; E726-E729 PolarHBondContact O-N 3.09Å; E726-I730 WeakPolarHBondContact O-CD1 3.42Å; E726-I730 VanDerWaalsContact O-CG1 3.24Å; E726-I730 WeakPolarHBondContact O-CG1 3.38Å; E726-I730 PolarHBondContact O-N 3.06Å; E726-I730 VanDerWaalsContact O-N 3.07Å |
| 727 | E | 93.2 | Very high | 88 | Confident | 16.6667 Ų | 16.6667 | 47.4 Ų | 47.4 | 8% | 0.078 | 24% | 0.237 | C | C | . | . | H | α-helix | trans | -60.7 | -43.1 | 174.2 | -168 | -172.4 | 109.6 | 0 | 0 | 111.3 | W635 R671 N672 L675 V723 M724 C725 I730 R731 | W635-E727 HydrophobicContact CH2-CG 4.2Å; W635-E727 WeakPolarHBondContact CH2-OE1 3.46Å; W635-E727 WeakPolarHBondContact CZ3-OE1 2.98Å; R671-E727 WeakPolarHBondContact CD-OE2 3.47Å; R671-E727 IonicContact CZ-OE2 3.39Å; R671-E727 IonicContact NE-OE2 3.08Å; R671-E727 IonicContact NH1-OE1 2.95Å; R671-E727 IonicContact NH1-OE2 3.49Å; R671-E727 PolarHBondContact NH1-OE2 3Å; R671-E727 IonicContact NH2-OE1 2.78Å; R671-E727 PolarHBondContact NH2-OE1 3.35Å; R671-E727 IonicContact NH2-OE2 2.8Å; R671-E727 PolarHBondContact NH2-OE2 3.39Å; N672-E727 PolarHBondContact ND2-N 3.22Å; N672-E727 VanDerWaalsContact OD1-CB 3.27Å; N672-E727 WeakPolarHBondContact OD1-CB 3.37Å; N672-E727 VanDerWaalsContact OD1-CG 3.31Å; N672-E727 WeakPolarHBondContact OD1-CG 3.38Å; L675-E727 HydrophobicContact CD1-CG 4.37Å; V723-E727 PolarHBondContact O-N 3.43Å; M724-E727 PolarHBondContact O-N 2.99Å; C725-E727 VanDerWaalsContact C-N 3.3Å; C725-E727 PolarHBondContact O-N 3.33Å; E727-I730 PolarHBondContact O-N 3.15Å; E727-R731 WeakPolarHBondContact O-CB 3.2Å; E727-R731 WeakPolarHBondContact O-CD 3.25Å; E727-R731 VanDerWaalsContact O-CG 3.26Å; E727-R731 WeakPolarHBondContact O-CG 3.4Å; E727-R731 PolarHBondContact O-N 3.25Å; E727-R731 VanDerWaalsContact O-N 3.09Å; E727-R731 IonicContact OE1-NH1 3.37Å; E727-R731 PolarHBondContact OE1-NH1 3.49Å |
| 728 | A | 91.4 | Very high | 87.3 | Confident | 10 Ų | 10 | 49.7 Ų | 49.7 | 8% | 0.083 | 25% | 0.252 | C | S | . | . | H | α-helix | trans | -64.9 | -40.8 | 177.7 | 0 | 0 | 0 | 0 | 0 | 112.3 | M724 C725 E726 I730 R731 C732 L737 Y741 | M724-A728 PolarHBondContact O-N 3.22Å; M724-A728 VanDerWaalsContact O-N 3.1Å; C725-A728 WeakPolarHBondContact O-CB 3.37Å; C725-A728 PolarHBondContact O-N 3.03Å; C725-A728 VanDerWaalsContact O-N 3.11Å; E726-A728 VanDerWaalsContact C-N 3.33Å; E726-A728 PolarHBondContact O-N 2.91Å; A728-I730 VanDerWaalsContact C-N 3.32Å; A728-I730 PolarHBondContact O-N 3.41Å; A728-R731 PolarHBondContact O-N 3.16Å; A728-C732 VanDerWaalsContact O-CB 3.29Å; A728-C732 WeakPolarHBondContact O-CB 3.22Å; A728-C732 PolarHBondContact O-N 3.15Å; A728-C732 PolarHBondContact O-SG 3.32Å; A728-L737 HydrophobicContact CB-CD2 4.12Å; A728-Y741 HydrophobicContact CB-CD1 4.01Å; A728-Y741 HydrophobicContact CB-CD2 3.83Å; A728-Y741 HydrophobicContact CB-CE1 4.1Å; A728-Y741 HydrophobicContact CB-CE2 3.79Å; A728-Y741 HydrophobicContact CB-CG 3.81Å |
| 729 | E | 91.2 | Very high | 86.5 | Confident | 80.3333 Ų | 80.3333 | 52.7 Ų | 52.7 | 38% | 0.375 | 28% | 0.277 | S | S | . | . | H | α-helix | trans | -63.9 | -37.5 | 175.6 | -71.9 | 169.5 | -159.3 | 0 | 0 | 112.6 | R679 C725 E726 R731 C732 L737 Y741 | R679-E729 PolarHBondContact NH2-O 3.19Å; R679-E729 VanDerWaalsContact NH2-O 3.07Å; C725-E729 WeakPolarHBondContact O-CG 3.4Å; C725-E729 PolarHBondContact O-N 3.14Å; E726-E729 PolarHBondContact O-N 3.09Å; E729-R731 VanDerWaalsContact C-N 3.3Å; E729-R731 PolarHBondContact O-N 3.02Å; E729-C732 PolarHBondContact O-N 3.42Å; E729-L737 HydrophobicContact CG-CD1 3.96Å; E729-L737 HydrophobicContact CG-CD2 3.9Å; E729-L737 HydrophobicContact CG-CG 3.8Å; E729-L737 WeakPolarHBondContact OE1-CD1 3.36Å; E729-Y741 HydrophobicContact CG-CE2 3.74Å; E729-Y741 WeakPolarHBondContact OE1-CE2 3.47Å; E729-Y741 PolarHBondContact OE1-OH 3.07Å |
| 730 | I | 91.6 | Very high | 85.8 | Confident | 17 Ų | 17 | 55.2 Ų | 55.2 | 9% | 0.087 | 29% | 0.286 | C | S | . | . | H | α-helix | trans | -64.4 | -42.7 | 175.8 | -67.9 | 160.6 | 0 | 0 | 0 | 110 | N672 L675 M676 R679 A682 E726 E727 A728 | N672-I730 HydrophobicContact CB-CD1 3.84Å; N672-I730 WeakPolarHBondContact O-CD1 3.45Å; L675-I730 HydrophobicContact CB-CG2 3.93Å; M676-I730 HydrophobicContact CB-CD1 4Å; M676-I730 HydrophobicContact CB-CG1 4.26Å; R679-I730 HydrophobicContact CG-CG2 4.31Å; R679-I730 WeakPolarHBondContact CG-O 3.33Å; R679-I730 PolarHBondContact NE-O 3.28Å; R679-I730 VanDerWaalsContact NE-O 3.11Å; A682-I730 HydrophobicContact CB-CG2 4.21Å; E726-I730 WeakPolarHBondContact O-CD1 3.42Å; E726-I730 VanDerWaalsContact O-CG1 3.24Å; E726-I730 WeakPolarHBondContact O-CG1 3.38Å; E726-I730 PolarHBondContact O-N 3.06Å; E726-I730 VanDerWaalsContact O-N 3.07Å; E727-I730 PolarHBondContact O-N 3.15Å; A728-I730 VanDerWaalsContact C-N 3.32Å; A728-I730 PolarHBondContact O-N 3.41Å |
| 731 | R | 88.4 | Confident | 85.3 | Confident | 66 Ų | 66 | 57.2 Ų | 57.2 | 25% | 0.249 | 29% | 0.294 | C | S | . | . | H | α-helix | trans | -77.6 | -32 | -175.5 | -71.3 | 173 | 68.2 | -172.8 | -0.9 | 114.1 | W635 N683 S686 E727 A728 E729 | W635-R731 HydrophobicContact CZ2-CG 4.4Å; N683-R731 PolarHBondContact ND2-O 3.14Å; N683-R731 VanDerWaalsContact OD1-CB 3.26Å; N683-R731 WeakPolarHBondContact OD1-CB 3.42Å; N683-R731 WeakPolarHBondContact OD1-CG 3.41Å; N683-R731 PolarHBondContact OD1-NE 2.81Å; N683-R731 VanDerWaalsContact OD1-NE 3.17Å; N683-R731 PolarHBondContact OD1-O 3.46Å; S686-R731 PolarHBondContact OG-NH2 3.05Å; S686-R731 VanDerWaalsContact OG-NH2 3.13Å; E727-R731 WeakPolarHBondContact O-CB 3.2Å; E727-R731 WeakPolarHBondContact O-CD 3.25Å; E727-R731 VanDerWaalsContact O-CG 3.26Å; E727-R731 WeakPolarHBondContact O-CG 3.4Å; E727-R731 PolarHBondContact O-N 3.25Å; E727-R731 VanDerWaalsContact O-N 3.09Å; E727-R731 IonicContact OE1-NH1 3.37Å; E727-R731 PolarHBondContact OE1-NH1 3.49Å; A728-R731 PolarHBondContact O-N 3.16Å; E729-R731 VanDerWaalsContact C-N 3.3Å; E729-R731 PolarHBondContact O-N 3.02Å |
| 732 | C | 82.5 | Confident | 84.8 | Confident | 33.3333 Ų | 33.3333 | 60.7 Ų | 60.7 | 23% | 0.225 | 32% | 0.315 | C | S | . | . | trans | -94.5 | 132.3 | -178.7 | -64.5 | 0 | 0 | 0 | 0 | 110.3 | R679 A728 E729 S734 E736 L737 | R679-C732 PolarHBondContact NH2-O 3.11Å; R679-C732 VanDerWaalsContact NH2-O 3.11Å; A728-C732 VanDerWaalsContact O-CB 3.29Å; A728-C732 WeakPolarHBondContact O-CB 3.22Å; A728-C732 PolarHBondContact O-N 3.15Å; A728-C732 PolarHBondContact O-SG 3.32Å; E729-C732 PolarHBondContact O-N 3.42Å; C732-S734 VanDerWaalsContact C-N 3.32Å; C732-S734 PolarHBondContact O-N 2.99Å; C732-E736 HydrophobicContact CB-CB 4.25Å; C732-L737 HydrophobicContact CB-CD2 4.06Å; C732-L737 HydrophobicContact CB-CG 4.48Å | ||
| 733 | F | 73.7 | Confident | 84.4 | Confident | 149.667 Ų | 149.667 | 58.5 Ų | 58.5 | 66% | 0.656 | 31% | 0.308 | S | S | * | . | S | Bend | trans | -74.2 | 8.3 | 167.6 | -63.6 | -79.8 | 0 | 0 | 0 | 111.9 | R679 D735 E736 L737 | R679-F733 HydrophobicContact CG-CE1 4.26Å; F733-D735 PolarHBondContact O-N 3.17Å; F733-E736 PolarHBondContact O-N 3.29Å; F733-L737 PolarHBondContact O-N 3.41Å |
| 734 | S | 71.5 | Confident | 84.1 | Confident | 79 Ų | 79 | 58.7 Ų | 58.7 | 55% | 0.552 | 31% | 0.308 | S | S | * | . | S | Bend | trans | -77.9 | 138.7 | 178.9 | -174.5 | 0 | 0 | 0 | 0 | 111.2 | C732 E736 | C732-S734 VanDerWaalsContact C-N 3.32Å; C732-S734 PolarHBondContact O-N 2.99Å; S734-E736 PolarHBondContact O-N 3.23Å; S734-E736 PolarHBondContact OG-N 3.12Å |
| 735 | D | 70.5 | Confident | 83.7 | Confident | 163.667 Ų | 163.667 | 58.3 Ų | 58.3 | 88% | 0.875 | 31% | 0.309 | S | S | * | . | S | Bend | trans | -74.7 | -11.2 | 175 | -65.3 | -28.2 | 0 | 0 | 0 | 112.6 | F733 | F733-D735 PolarHBondContact O-N 3.17Š|
| 736 | E | 74.3 | Confident | 83.4 | Confident | 137.667 Ų | 137.667 | 61.4 Ų | 61.4 | 64% | 0.643 | 32% | 0.323 | S | S | * | . | S | Bend | trans | -102.3 | 94.5 | 179.4 | -64.9 | -177.7 | 174.8 | 0 | 0 | 111.9 | C732 F733 S734 | C732-E736 HydrophobicContact CB-CB 4.25Å; F733-E736 PolarHBondContact O-N 3.29Å; S734-E736 PolarHBondContact O-N 3.23Å; S734-E736 PolarHBondContact OG-N 3.12Å |
| 737 | L | 79 | Confident | 83.1 | Confident | 43.3333 Ų | 43.3333 | 57.9 Ų | 57.9 | 23% | 0.227 | 31% | 0.307 | C | S | . | . | P | Polyproline II helix | trans | -65.4 | 141.6 | 173.3 | -79.9 | 133.8 | 0 | 0 | 0 | 110.9 | C725 A728 E729 C732 F733 Y741 V742 | C725-L737 HydrophobicContact CB-CD2 4.05Å; A728-L737 HydrophobicContact CB-CD2 4.12Å; E729-L737 HydrophobicContact CG-CD1 3.96Å; E729-L737 HydrophobicContact CG-CD2 3.9Å; E729-L737 HydrophobicContact CG-CG 3.8Å; E729-L737 WeakPolarHBondContact OE1-CD1 3.36Å; C732-L737 HydrophobicContact CB-CD2 4.06Å; C732-L737 HydrophobicContact CB-CG 4.48Å; F733-L737 PolarHBondContact O-N 3.41Å; L737-Y741 HydrophobicContact CB-CD1 4.38Å; L737-Y741 HydrophobicContact CB-CG 4.3Å; L737-Y741 HydrophobicContact CD1-CD1 3.93Å; L737-Y741 HydrophobicContact CD1-CE1 3.85Å; L737-Y741 HydrophobicContact CD1-CE2 4.45Å; L737-Y741 HydrophobicContact CD1-CG 4.29Å; L737-Y741 VanDerWaalsContact CD2-CB 3.41Å; L737-Y741 HydrophobicContact CD2-CD2 3.91Å; L737-Y741 HydrophobicContact CD2-CE2 4.19Å; L737-Y741 HydrophobicContact CD2-CG 4.2Å; L737-Y741 HydrophobicContact CG-CG 4.48Å; L737-V742 HydrophobicContact CB-CG2 3.91Å |
| 738 | P | 79.7 | Confident | 82.8 | Confident | 48.6667 Ų | 48.6667 | 57.2 Ų | 57.2 | 32% | 0.316 | 30% | 0.304 | S | S | . | . | P | Polyproline II helix | trans | -56.7 | 145.5 | 170.9 | -20.1 | 30.6 | 0 | 0 | 0 | 111.2 | E740 Y741 V742 | P738-E740 HydrophobicContact CB-CG 4.32Å; P738-E740 WeakPolarHBondContact CB-OE2 3.36Å; P738-E740 PolarHBondContact O-N 3.05Å; P738-E740 VanDerWaalsContact O-N 3.09Å; P738-Y741 HydrophobicContact CB-CD2 4.06Å; P738-Y741 HydrophobicContact CG-CD2 4.04Å; P738-Y741 HydrophobicContact CG-CE2 4.41Å; P738-Y741 WeakPolarHBondContact O-CB 3.34Å; P738-Y741 PolarHBondContact O-N 3.06Å; P738-V742 PolarHBondContact O-N 2.98Å |
| 739 | A | 77.2 | Confident | 82.3 | Confident | 62.6667 Ų | 62.6667 | 59.8 Ų | 59.8 | 52% | 0.518 | 32% | 0.317 | S | S | . | . | H | α-helix | trans | -55.7 | -31.8 | -174.1 | 0 | 0 | 0 | 0 | 0 | 113.6 | Y741 V742 H743 V774 | A739-Y741 VanDerWaalsContact C-N 3.3Å; A739-Y741 PolarHBondContact O-N 3.14Å; A739-V742 PolarHBondContact O-N 3.29Å; A739-H743 PolarHBondContact O-CD2 3.18Å; A739-H743 PolarHBondContact O-N 3.34Å; A739-V774 HydrophobicContact CB-CG2 4.08Å |
| 740 | E | 79 | Confident | 81.6 | Confident | 76.3333 Ų | 76.3333 | 56 Ų | 56 | 36% | 0.357 | 30% | 0.299 | S | S | . | . | H | α-helix | trans | -63.9 | -34.1 | 175.8 | 34.4 | 164.3 | 178.8 | 0 | 0 | 112.9 | P738 V742 H743 H744 V774 T776 | P738-E740 HydrophobicContact CB-CG 4.32Å; P738-E740 WeakPolarHBondContact CB-OE2 3.36Å; P738-E740 PolarHBondContact O-N 3.05Å; P738-E740 VanDerWaalsContact O-N 3.09Å; E740-V742 VanDerWaalsContact C-N 3.35Å; E740-V742 PolarHBondContact O-N 3.18Å; E740-H743 WeakPolarHBondContact O-CB 3.37Å; E740-H743 PolarHBondContact O-N 3.07Å; E740-H743 VanDerWaalsContact O-N 3.13Å; E740-H744 PolarHBondContact O-CD2 3.28Å; E740-H744 PolarHBondContact O-CE1 3.48Å; E740-H744 PolarHBondContact O-N 3Å; E740-H744 VanDerWaalsContact O-N 3.12Å; E740-H744 PolarHBondContact O-ND1 3.43Å; E740-H744 VanDerWaalsContact O-ND1 3.13Å; E740-V774 HydrophobicContact CB-CG1 4.14Å; E740-T776 HydrophobicContact CB-CG2 3.92Å; E740-T776 HydrophobicContact CG-CG2 3.32Å |
| 741 | Y | 85.2 | Confident | 80.7 | Confident | 42.6667 Ų | 42.6667 | 57.2 Ų | 57.2 | 17% | 0.167 | 31% | 0.307 | C | S | . | . | H | α-helix | trans | -72.9 | -31.9 | -178.6 | -98.1 | -83.1 | 0 | 0 | 0 | 112.9 | M724 C725 A728 E729 L737 P738 A739 H743 H744 A745 | M724-Y741 HydrophobicContact CB-CE1 4.22Å; C725-Y741 HydrophobicContact CB-CD2 4.03Å; C725-Y741 HydrophobicContact CB-CE2 3.68Å; C725-Y741 PolarHBondContact SG-O 2.9Å; A728-Y741 HydrophobicContact CB-CD1 4.01Å; A728-Y741 HydrophobicContact CB-CD2 3.83Å; A728-Y741 HydrophobicContact CB-CE1 4.1Å; A728-Y741 HydrophobicContact CB-CE2 3.79Å; A728-Y741 HydrophobicContact CB-CG 3.81Å; E729-Y741 HydrophobicContact CG-CE2 3.74Å; E729-Y741 WeakPolarHBondContact OE1-CE2 3.47Å; E729-Y741 PolarHBondContact OE1-OH 3.07Å; L737-Y741 HydrophobicContact CB-CD1 4.38Å; L737-Y741 HydrophobicContact CB-CG 4.3Å; L737-Y741 HydrophobicContact CD1-CD1 3.93Å; L737-Y741 HydrophobicContact CD1-CE1 3.85Å; L737-Y741 HydrophobicContact CD1-CE2 4.45Å; L737-Y741 HydrophobicContact CD1-CG 4.29Å; L737-Y741 VanDerWaalsContact CD2-CB 3.41Å; L737-Y741 HydrophobicContact CD2-CD2 3.91Å; L737-Y741 HydrophobicContact CD2-CE2 4.19Å; L737-Y741 HydrophobicContact CD2-CG 4.2Å; L737-Y741 HydrophobicContact CG-CG 4.48Å; P738-Y741 HydrophobicContact CB-CD2 4.06Å; P738-Y741 HydrophobicContact CG-CD2 4.04Å; P738-Y741 HydrophobicContact CG-CE2 4.41Å; P738-Y741 WeakPolarHBondContact O-CB 3.34Å; P738-Y741 PolarHBondContact O-N 3.06Å; A739-Y741 VanDerWaalsContact C-N 3.3Å; A739-Y741 PolarHBondContact O-N 3.14Å; Y741-H743 VanDerWaalsContact C-N 3.26Å; Y741-H743 PolarHBondContact O-N 3.38Å; Y741-H744 AromaticContact CD1-ND1 3.72Å; Y741-H744 WeakPolarHBondContact O-CB 3.42Å; Y741-H744 PolarHBondContact O-N 3.02Å; Y741-H744 VanDerWaalsContact O-N 3.09Å; Y741-A745 HydrophobicContact CE1-CB 4.41Å; Y741-A745 VanDerWaalsContact O-CB 3.26Å; Y741-A745 WeakPolarHBondContact O-CB 3.3Å; Y741-A745 PolarHBondContact O-N 3.08Å |
| 742 | V | 84.7 | Confident | 79.7 | Confident | 73 Ų | 73 | 60 Ų | 60 | 44% | 0.442 | 33% | 0.327 | S | S | . | . | H | α-helix | trans | -57.4 | -43.2 | 176.3 | 177.4 | 0 | 0 | 0 | 0 | 110.4 | L737 P738 A739 E740 A745 E746 | L737-V742 HydrophobicContact CB-CG2 3.91Å; P738-V742 PolarHBondContact O-N 2.98Å; A739-V742 PolarHBondContact O-N 3.29Å; E740-V742 VanDerWaalsContact C-N 3.35Å; E740-V742 PolarHBondContact O-N 3.18Å; V742-A745 PolarHBondContact O-N 3.21Å; V742-E746 PolarHBondContact O-N 3.06Å; V742-E746 VanDerWaalsContact O-N 3.15Å |
| 743 | H | 84.2 | Confident | 78.8 | Confident | 25.3333 Ų | 25.3333 | 61.9 Ų | 61.9 | 12% | 0.117 | 33% | 0.334 | C | S | . | . | H | α-helix | trans | -71.6 | -37.7 | 178.5 | -66.9 | -50.4 | 0 | 0 | 0 | 113.3 | A739 E740 Y741 A745 E746 L747 K771 L772 T773 V774 | A739-H743 PolarHBondContact O-CD2 3.18Å; A739-H743 PolarHBondContact O-N 3.34Å; E740-H743 WeakPolarHBondContact O-CB 3.37Å; E740-H743 PolarHBondContact O-N 3.07Å; E740-H743 VanDerWaalsContact O-N 3.13Å; Y741-H743 VanDerWaalsContact C-N 3.26Å; Y741-H743 PolarHBondContact O-N 3.38Å; H743-A745 VanDerWaalsContact C-N 3.33Å; H743-A745 PolarHBondContact O-N 3.36Å; H743-E746 PolarHBondContact O-N 3.2Å; H743-L747 WeakPolarHBondContact O-CB 3.43Å; H743-L747 PolarHBondContact O-N 3.25Å; H743-K771 PolarHBondContact CE1-O 3.16Å; H743-L772 HydrophobicContact CB-CD2 3.57Å; H743-L772 VanDerWaalsContact CB-CD2 3.49Å; H743-T773 PolarHBondContact CE1-N 3.48Å; H743-T773 PolarHBondContact CE1-OG1 3.07Å; H743-T773 PolarHBondContact NE2-N 2.94Å; H743-T773 PolarHBondContact NE2-OG1 3.28Å; H743-V774 WeakPolarHBondContact NE2-CG2 3.41Å; H743-V774 PolarHBondContact NE2-N 3.48Å |
| 744 | H | 88.5 | Confident | 77.9 | Confident | 9.33333 Ų | 9.33333 | 59.8 Ų | 59.8 | 4% | 0.043 | 34% | 0.336 | C | S | . | . | H | α-helix | trans | -63.9 | -39.3 | 173 | -64.4 | 168.1 | 0 | 0 | 0 | 111.7 | E699 F703 F721 C725 E740 Y741 E746 L747 A748 | E699-H744 IonicContact OE1-CD2 2.71Å; E699-H744 IonicContact OE1-CE1 3.1Å; E699-H744 PolarHBondContact OE1-CE1 3.4Å; E699-H744 IonicContact OE1-NE2 3.46Å; E699-H744 PolarHBondContact OE1-NE2 3.26Å; E699-H744 VanDerWaalsContact OE1-NE2 3.1Å; F703-H744 AromaticContact CE2-NE2 3.96Å; F703-H744 AromaticContact CZ-CE1 3.88Å; F703-H744 AromaticContact CZ-NE2 3.73Å; F721-H744 HydrophobicContact CB-CB 4.31Å; F721-H744 HydrophobicContact CD1-CB 3.93Å; F721-H744 AromaticContact CD1-CD2 3.48Å; F721-H744 WeakPolarHBondContact CD1-CD2 3.38Å; F721-H744 AromaticContact CD1-CG 3.72Å; F721-H744 AromaticContact CD1-ND1 3.58Å; F721-H744 AromaticContact CE1-CD2 3.53Å; F721-H744 WeakPolarHBondContact CE1-CD2 3.47Å; F721-H744 AromaticContact CE1-CE1 3.86Å; F721-H744 AromaticContact CE1-ND1 3.51Å; F721-H744 AromaticContact CE1-NE2 3.64Å; F721-H744 HydrophobicContact CG-CB 4.41Å; C725-H744 VanDerWaalsContact SG-C 3.52Å; C725-H744 VanDerWaalsContact SG-CB 3.55Å; C725-H744 WeakPolarHBondContact SG-CB 3.29Å; E740-H744 PolarHBondContact O-CD2 3.28Å; E740-H744 PolarHBondContact O-CE1 3.48Å; E740-H744 PolarHBondContact O-N 3Å; E740-H744 VanDerWaalsContact O-N 3.12Å; E740-H744 PolarHBondContact O-ND1 3.43Å; E740-H744 VanDerWaalsContact O-ND1 3.13Å; Y741-H744 AromaticContact CD1-ND1 3.72Å; Y741-H744 WeakPolarHBondContact O-CB 3.42Å; Y741-H744 PolarHBondContact O-N 3.02Å; Y741-H744 VanDerWaalsContact O-N 3.09Å; H744-E746 VanDerWaalsContact C-N 3.33Å; H744-E746 PolarHBondContact O-N 2.9Å; H744-L747 PolarHBondContact O-N 2.95Å; H744-A748 WeakPolarHBondContact O-CB 3.4Å; H744-A748 PolarHBondContact O-N 3.16Å |
| 745 | A | 87 | Confident | 77.2 | Confident | 14.3333 Ų | 14.3333 | 61.2 Ų | 61.2 | 12% | 0.118 | 34% | 0.341 | C | S | . | . | H | α-helix | trans | -64.6 | -38.5 | 176.1 | 0 | 0 | 0 | 0 | 0 | 111.7 | R722 C725 Y741 V742 H743 A748 N749 | R722-A745 PolarHBondContact NH2-O 2.96Å; C725-A745 HydrophobicContact CB-CB 4.32Å; C725-A745 PolarHBondContact SG-N 3.36Å; C725-A745 VanDerWaalsContact SG-N 3.4Å; Y741-A745 HydrophobicContact CE1-CB 4.41Å; Y741-A745 VanDerWaalsContact O-CB 3.26Å; Y741-A745 WeakPolarHBondContact O-CB 3.3Å; Y741-A745 PolarHBondContact O-N 3.08Å; V742-A745 PolarHBondContact O-N 3.21Å; H743-A745 VanDerWaalsContact C-N 3.33Å; H743-A745 PolarHBondContact O-N 3.36Å; A745-A748 PolarHBondContact O-N 2.87Å; A745-N749 VanDerWaalsContact O-CG 3.26Å; A745-N749 PolarHBondContact O-N 3.01Å; A745-N749 PolarHBondContact O-ND2 3.44Å; A745-N749 PolarHBondContact O-OD1 3.22Å |
| 746 | E | 85.5 | Confident | 76.8 | Confident | 65.3333 Ų | 65.3333 | 57.3 Ų | 57.3 | 31% | 0.305 | 32% | 0.323 | S | S | . | . | H | α-helix | trans | -65.2 | -45.8 | 172.9 | -95.8 | -170.7 | 173.9 | 0 | 0 | 112 | V742 H743 H744 A748 N749 Y768 K771 | V742-E746 PolarHBondContact O-N 3.06Å; V742-E746 VanDerWaalsContact O-N 3.15Å; H743-E746 PolarHBondContact O-N 3.2Å; H744-E746 VanDerWaalsContact C-N 3.33Å; H744-E746 PolarHBondContact O-N 2.9Å; E746-A748 VanDerWaalsContact C-N 3.3Å; E746-A748 PolarHBondContact O-N 3.07Å; E746-N749 VanDerWaalsContact O-CB 3.3Å; E746-N749 WeakPolarHBondContact O-CB 3.42Å; E746-N749 PolarHBondContact O-N 3.16Å; E746-N749 VanDerWaalsContact O-N 3.11Å; E746-Y768 HydrophobicContact CB-CD1 4.24Å; E746-Y768 HydrophobicContact CB-CE1 4.44Å; E746-Y768 HydrophobicContact CG-CD1 3.86Å; E746-Y768 HydrophobicContact CG-CE1 4.11Å; E746-Y768 VanDerWaalsContact O-CD1 3.25Å; E746-Y768 WeakPolarHBondContact O-CD1 3.36Å; E746-Y768 WeakPolarHBondContact O-CE1 3.32Å; E746-K771 WeakPolarHBondContact OE1-CD 3.32Å; E746-K771 WeakPolarHBondContact OE1-CE 3.35Å; E746-K771 IonicContact OE1-NZ 3.93Å; E746-K771 PolarHBondContact OE1-NZ 3.39Å |
| 747 | L | 86.9 | Confident | 77 | Confident | 1.66667 Ų | 1.66667 | 52.7 Ų | 52.7 | 1% | 0.009 | 31% | 0.313 | C | S | . | . | H | α-helix | trans | -60.2 | -41.7 | 176.9 | -147.6 | 90.3 | 0 | 0 | 0 | 111.2 | F703 L706 L718 F721 H743 H744 N749 A750 L769 L772 | F703-L747 HydrophobicContact CE1-CD1 3.79Å; F703-L747 HydrophobicContact CE1-CD2 4.06Å; F703-L747 HydrophobicContact CZ-CD1 4.05Å; L706-L747 HydrophobicContact CD1-CD2 4.08Å; L718-L747 HydrophobicContact CD2-CD1 4.04Å; L718-L747 HydrophobicContact CD2-CD2 4.48Å; L718-L747 HydrophobicContact CD2-CG 3.83Å; L718-L747 WeakPolarHBondContact CD2-O 3.49Å; F721-L747 HydrophobicContact CD2-CB 4.02Å; F721-L747 HydrophobicContact CD2-CD1 4.21Å; F721-L747 HydrophobicContact CD2-CD2 3.77Å; F721-L747 HydrophobicContact CD2-CG 4.34Å; F721-L747 HydrophobicContact CE1-CD1 4.27Å; F721-L747 HydrophobicContact CE1-CD2 4.47Å; F721-L747 HydrophobicContact CE2-CB 4.47Å; F721-L747 HydrophobicContact CE2-CD1 3.91Å; F721-L747 HydrophobicContact CE2-CD2 3.52Å; F721-L747 VanDerWaalsContact CE2-CD2 3.41Å; F721-L747 HydrophobicContact CE2-CG 4.41Å; F721-L747 HydrophobicContact CG-CB 4.33Å; F721-L747 HydrophobicContact CG-CD2 4.38Å; F721-L747 HydrophobicContact CZ-CD1 3.94Å; F721-L747 HydrophobicContact CZ-CD2 3.94Å; H743-L747 WeakPolarHBondContact O-CB 3.43Å; H743-L747 PolarHBondContact O-N 3.25Å; H744-L747 PolarHBondContact O-N 2.95Å; L747-N749 PolarHBondContact O-N 3.11Å; L747-N749 VanDerWaalsContact O-N 3.16Å; L747-A750 WeakPolarHBondContact O-CB 3.38Å; L747-A750 PolarHBondContact O-N 3.11Å; L747-L769 HydrophobicContact CD1-CD2 4.1Å; L747-L769 HydrophobicContact CD1-CG 4.27Å; L747-L769 HydrophobicContact CD2-CD2 3.98Å; L747-L769 HydrophobicContact CD2-CG 4.32Å; L747-L772 HydrophobicContact CD1-CD2 4.07Å; L747-L772 HydrophobicContact CG-CD2 4.37Å |
| 748 | A | 87 | Confident | 77.3 | Confident | 2 Ų | 2 | 52.3 Ų | 52.3 | 2% | 0.017 | 31% | 0.309 | C | S | . | . | H | α-helix | trans | -60.4 | -24.6 | 176.4 | 0 | 0 | 0 | 0 | 0 | 113.5 | L718 F721 R722 H744 A745 E746 A750 T751 | L718-A748 VanDerWaalsContact O-CB 3.3Å; L718-A748 WeakPolarHBondContact O-CB 3.47Å; F721-A748 HydrophobicContact CB-CB 4.31Å; R722-A748 HydrophobicContact CB-CB 3.85Å; R722-A748 PolarHBondContact NH2-O 3.12Å; H744-A748 WeakPolarHBondContact O-CB 3.4Å; H744-A748 PolarHBondContact O-N 3.16Å; A745-A748 PolarHBondContact O-N 2.87Å; E746-A748 VanDerWaalsContact C-N 3.3Å; E746-A748 PolarHBondContact O-N 3.07Å; A748-A750 VanDerWaalsContact C-N 3.28Å; A748-A750 PolarHBondContact O-N 3.43Å; A748-A750 VanDerWaalsContact O-N 3.16Å; A748-T751 WeakPolarHBondContact O-CG2 3.34Å; A748-T751 PolarHBondContact O-N 3.37Å; A748-T751 PolarHBondContact O-OG1 3.03Å |
| 749 | N | 81.8 | Confident | 77.6 | Confident | 64.6667 Ų | 64.6667 | 53.4 Ų | 53.4 | 35% | 0.346 | 32% | 0.322 | S | S | . | . | G | 310 helix | trans | -71.1 | -13.3 | 175.2 | -66.8 | -32.2 | 0 | 0 | 0 | 113.2 | R722 A745 E746 L747 T751 N752 | R722-N749 PolarHBondContact NH2-OD1 3.34Å; A745-N749 VanDerWaalsContact O-CG 3.26Å; A745-N749 PolarHBondContact O-N 3.01Å; A745-N749 PolarHBondContact O-ND2 3.44Å; A745-N749 PolarHBondContact O-OD1 3.22Å; E746-N749 VanDerWaalsContact O-CB 3.3Å; E746-N749 WeakPolarHBondContact O-CB 3.42Å; E746-N749 PolarHBondContact O-N 3.16Å; E746-N749 VanDerWaalsContact O-N 3.11Å; L747-N749 PolarHBondContact O-N 3.11Å; L747-N749 VanDerWaalsContact O-N 3.16Å; N749-T751 PolarHBondContact O-N 3.02Å; N749-T751 VanDerWaalsContact O-N 3.08Å; N749-N752 WeakPolarHBondContact O-CB 3.41Å; N749-N752 PolarHBondContact O-N 3.29Å; N749-N752 VanDerWaalsContact O-N 3.13Å |
| 750 | A | 76.5 | Confident | 78 | Confident | 1 Ų | 1 | 54 Ų | 54 | 1% | 0.008 | 32% | 0.319 | C | S | . | . | G | 310 helix | trans | -64.4 | -17 | 174.7 | 0 | 0 | 0 | 0 | 0 | 113.2 | L718 L747 A748 N752 L753 S764 I765 Y768 | L718-A750 HydrophobicContact CD1-CB 3.93Å; L718-A750 HydrophobicContact CD2-CB 4.2Å; L747-A750 WeakPolarHBondContact O-CB 3.38Å; L747-A750 PolarHBondContact O-N 3.11Å; A748-A750 VanDerWaalsContact C-N 3.28Å; A748-A750 PolarHBondContact O-N 3.43Å; A748-A750 VanDerWaalsContact O-N 3.16Å; A750-N752 PolarHBondContact O-N 2.96Å; A750-L753 HydrophobicContact CB-CD1 4.43Å; A750-L753 PolarHBondContact O-N 2.98Å; A750-S764 PolarHBondContact O-OG 2.98Å; A750-I765 HydrophobicContact CB-CG1 4.3Å; A750-Y768 HydrophobicContact CB-CD2 3.66Å; A750-Y768 HydrophobicContact CB-CE2 3.73Å; A750-Y768 VanDerWaalsContact CB-CE2 3.46Å; A750-Y768 HydrophobicContact CB-CG 4.4Å |
| 751 | T | 71.6 | Confident | 78.4 | Confident | 42 Ų | 42 | 50.8 Ų | 50.8 | 26% | 0.258 | 30% | 0.304 | S | S | . | . | G | 310 helix | trans | -69.9 | -17.7 | 176.9 | 56.5 | 0 | 0 | 0 | 0 | 114.1 | I715 L718 A748 N749 L753 P754 | I715-T751 HydrophobicContact CG2-CG2 4.21Å; L718-T751 HydrophobicContact CB-CG2 3.48Å; L718-T751 VanDerWaalsContact CB-CG2 3.44Å; L718-T751 HydrophobicContact CD1-CG2 3.87Å; L718-T751 VanDerWaalsContact CD1-CG2 3.48Å; L718-T751 HydrophobicContact CG-CG2 4.33Å; A748-T751 WeakPolarHBondContact O-CG2 3.34Å; A748-T751 PolarHBondContact O-N 3.37Å; A748-T751 PolarHBondContact O-OG1 3.03Å; N749-T751 PolarHBondContact O-N 3.02Å; N749-T751 VanDerWaalsContact O-N 3.08Å; T751-L753 VanDerWaalsContact C-N 3.33Å; T751-L753 PolarHBondContact O-N 3.17Å; T751-L753 VanDerWaalsContact O-N 3.13Å; T751-P754 WeakPolarHBondContact O-CD 3.46Å |
| 752 | N | 66.8 | Low | 78.8 | Confident | 125.333 Ų | 125.333 | 49.2 Ų | 49.2 | 67% | 0.67 | 30% | 0.298 | S | S | * | . | G | 310 helix | trans | -77.8 | 10.2 | -175.6 | -67.7 | -19.1 | 0 | 0 | 0 | 114.1 | N749 A750 P754 | N749-N752 WeakPolarHBondContact O-CB 3.41Å; N749-N752 PolarHBondContact O-N 3.29Å; N749-N752 VanDerWaalsContact O-N 3.13Å; A750-N752 PolarHBondContact O-N 2.96Å; N752-P754 WeakPolarHBondContact O-CD 3.16Å |
| 753 | L | 63.4 | Low | 79 | Confident | 71.6667 Ų | 71.6667 | 51.7 Ų | 51.7 | 38% | 0.375 | 30% | 0.303 | S | S | . | . | trans | -100.3 | 85.3 | 178.5 | -72.1 | 154.4 | 0 | 0 | 0 | 111.2 | A750 T751 T755 V756 S764 Y768 | A750-L753 HydrophobicContact CB-CD1 4.43Å; A750-L753 PolarHBondContact O-N 2.98Å; T751-L753 VanDerWaalsContact C-N 3.33Å; T751-L753 PolarHBondContact O-N 3.17Å; T751-L753 VanDerWaalsContact O-N 3.13Å; L753-T755 PolarHBondContact O-N 3.34Å; L753-V756 HydrophobicContact CB-CG2 3.97Å; L753-V756 HydrophobicContact CD2-CG2 4.08Å; L753-V756 HydrophobicContact CG-CG2 4.48Å; L753-V756 PolarHBondContact O-N 3.21Å; L753-S764 VanDerWaalsContact CD1-CB 3.45Å; L753-S764 WeakPolarHBondContact CD1-OG 3.33Å; L753-Y768 HydrophobicContact CD1-CE2 4.16Å | ||
| 754 | P | 55.5 | Low | 79.2 | Confident | 105.333 Ų | 105.333 | 51.5 Ų | 51.5 | 68% | 0.684 | 30% | 0.304 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -64.4 | 21.5 | -171.1 | 2.9 | 0.2 | 0 | 0 | 0 | 113.7 | T751 N752 V756 | T751-P754 WeakPolarHBondContact O-CD 3.46Å; N752-P754 WeakPolarHBondContact O-CD 3.16Å; P754-V756 PolarHBondContact O-N 2.76Å |
| 755 | T | 56.4 | Low | 79.4 | Confident | 109.667 Ų | 109.667 | 51.1 Ų | 51.1 | 67% | 0.673 | 30% | 0.302 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -107.4 | 50 | -172.6 | 17.4 | 0 | 0 | 0 | 0 | 113 | I715 L753 G757 L761 | I715-T755 HydrophobicContact CD1-CG2 4.2Å; L753-T755 PolarHBondContact O-N 3.34Å; T755-G757 VanDerWaalsContact C-N 3.3Å; T755-L761 HydrophobicContact CG2-CB 4.11Å; T755-L761 HydrophobicContact CG2-CD1 4.36Å; T755-L761 HydrophobicContact CG2-CD2 4.01Å; T755-L761 HydrophobicContact CG2-CG 4.39Å |
| 756 | V | 62.9 | Low | 79.6 | Confident | 81.3333 Ų | 81.3333 | 50.6 Ų | 50.6 | 49% | 0.493 | 30% | 0.298 | S | S | . | . | S | Bend | trans | -104.3 | 113.6 | 178.5 | -148.3 | 0 | 0 | 0 | 0 | 112.6 | L753 P754 V760 | L753-V756 HydrophobicContact CB-CG2 3.97Å; L753-V756 HydrophobicContact CD2-CG2 4.08Å; L753-V756 HydrophobicContact CG-CG2 4.48Å; L753-V756 PolarHBondContact O-N 3.21Å; P754-V756 PolarHBondContact O-N 2.76Å; V756-V760 HydrophobicContact CB-CB 3.91Å; V756-V760 HydrophobicContact CB-CG1 4.07Å; V756-V760 HydrophobicContact CG1-CB 3.34Å; V756-V760 HydrophobicContact CG1-CG1 3.53Å; V756-V760 VanDerWaalsContact CG1-CG1 3.49Å; V756-V760 HydrophobicContact CG1-CG2 3.55Å; V756-V760 HydrophobicContact CG2-CG1 4.45Å |
| 757 | G | 77.8 | Confident | 79.7 | Confident | 42 Ų | 42 | 50.2 Ų | 50.2 | 43% | 0.433 | 30% | 0.303 | S | S | . | . | trans | -85.5 | 157.7 | 176.4 | 0 | 0 | 0 | 0 | 0 | 113.2 | T755 A759 V760 L761 | T755-G757 VanDerWaalsContact C-N 3.3Å; G757-A759 VanDerWaalsContact C-N 3.32Å; G757-A759 PolarHBondContact O-N 3.08Å; G757-V760 PolarHBondContact O-N 3.05Å; G757-V760 VanDerWaalsContact O-N 3.14Å; G757-L761 PolarHBondContact O-N 3.27Å; G757-L761 VanDerWaalsContact O-N 3.07Å | ||
| 758 | R | 85.5 | Confident | 79.9 | Confident | 34.6667 Ų | 34.6667 | 52.8 Ų | 52.8 | 13% | 0.131 | 31% | 0.312 | C | S | . | . | H | α-helix | trans | -48.8 | -38 | -171.9 | -176.6 | 65.7 | -171 | 94.3 | -8.9 | 114.9 | L706 S708 N711 L761 Q762 N841 | L706-R758 PolarHBondContact O-NH2 3.17Å; S708-R758 VanDerWaalsContact O-CZ 3.23Å; S708-R758 PolarHBondContact O-NE 3.31Å; S708-R758 PolarHBondContact O-NH2 3.07Å; N711-R758 VanDerWaalsContact OD1-CA 3.3Å; N711-R758 WeakPolarHBondContact OD1-CA 3.27Å; N711-R758 VanDerWaalsContact OD1-CB 3.28Å; N711-R758 WeakPolarHBondContact OD1-CB 3.35Å; N711-R758 WeakPolarHBondContact OD1-CD 3.39Å; R758-L761 PolarHBondContact O-N 3.05Å; R758-Q762 VanDerWaalsContact NH1-CB 3.3Å; R758-Q762 WeakPolarHBondContact O-CB 3.38Å; R758-Q762 PolarHBondContact O-N 2.99Å; R758-N841 PolarHBondContact NH2-ND2 3.09Å |
| 759 | A | 85.5 | Confident | 80.1 | Confident | 71.6667 Ų | 71.6667 | 52.7 Ų | 52.7 | 59% | 0.592 | 31% | 0.312 | S | S | * | . | H | α-helix | trans | -66.5 | -37.5 | -179.6 | 0 | 0 | 0 | 0 | 0 | 112.9 | G757 Q762 K763 | G757-A759 VanDerWaalsContact C-N 3.32Å; G757-A759 PolarHBondContact O-N 3.08Å; A759-Q762 PolarHBondContact O-N 3.33Å; A759-K763 WeakPolarHBondContact O-CG 3.4Å; A759-K763 PolarHBondContact O-N 3.19Å; A759-K763 VanDerWaalsContact O-N 3.13Å |
| 760 | V | 86.1 | Confident | 80.4 | Confident | 75 Ų | 75 | 52.4 Ų | 52.4 | 46% | 0.455 | 31% | 0.308 | S | S | . | . | H | α-helix | trans | -73.3 | -41 | 176.4 | -178.8 | 0 | 0 | 0 | 0 | 110.3 | V756 G757 Q762 K763 S764 | V756-V760 HydrophobicContact CB-CB 3.91Å; V756-V760 HydrophobicContact CB-CG1 4.07Å; V756-V760 HydrophobicContact CG1-CB 3.34Å; V756-V760 HydrophobicContact CG1-CG1 3.53Å; V756-V760 VanDerWaalsContact CG1-CG1 3.49Å; V756-V760 HydrophobicContact CG1-CG2 3.55Å; V756-V760 HydrophobicContact CG2-CG1 4.45Å; G757-V760 PolarHBondContact O-N 3.05Å; G757-V760 VanDerWaalsContact O-N 3.14Å; V760-Q762 VanDerWaalsContact C-N 3.29Å; V760-Q762 PolarHBondContact O-N 3.1Å; V760-K763 PolarHBondContact O-N 3.28Å; V760-S764 PolarHBondContact O-N 3.14Å; V760-S764 VanDerWaalsContact O-N 3.09Å; V760-S764 PolarHBondContact O-OG 3.19Å |
| 761 | L | 88.5 | Confident | 80.9 | Confident | 8.66667 Ų | 8.66667 | 57.3 Ų | 57.3 | 5% | 0.045 | 33% | 0.329 | C | S | . | . | H | α-helix | trans | -57.5 | -44.6 | 172.2 | 179.4 | 61.9 | 0 | 0 | 0 | 111.1 | A714 I715 L718 T755 G757 R758 K763 S764 I765 | A714-L761 HydrophobicContact CB-CD2 4.46Å; I715-L761 HydrophobicContact CD1-CD2 4.39Å; I715-L761 HydrophobicContact CG1-CD2 3.98Å; L718-L761 HydrophobicContact CD1-CD1 4.43Å; T755-L761 HydrophobicContact CG2-CB 4.11Å; T755-L761 HydrophobicContact CG2-CD1 4.36Å; T755-L761 HydrophobicContact CG2-CD2 4.01Å; T755-L761 HydrophobicContact CG2-CG 4.39Å; G757-L761 PolarHBondContact O-N 3.27Å; G757-L761 VanDerWaalsContact O-N 3.07Å; R758-L761 PolarHBondContact O-N 3.05Å; L761-K763 PolarHBondContact O-N 3.16Å; L761-S764 WeakPolarHBondContact O-CB 3.33Å; L761-S764 PolarHBondContact O-N 3.31Å; L761-I765 HydrophobicContact CD1-CD1 4.22Å; L761-I765 HydrophobicContact CD1-CG1 4.36Å; L761-I765 HydrophobicContact CG-CD1 3.93Å; L761-I765 HydrophobicContact CG-CG1 4.49Å; L761-I765 WeakPolarHBondContact O-CG1 3.33Å; L761-I765 PolarHBondContact O-N 3.08Å |
| 762 | Q | 92.2 | Very high | 81.5 | Confident | 9 Ų | 9 | 55.6 Ų | 55.6 | 4% | 0.042 | 32% | 0.318 | C | S | . | . | H | α-helix | trans | -62 | -43.3 | 178.4 | -169.1 | 60.3 | 42.2 | 0 | 0 | 112.5 | L706 R758 A759 V760 S764 I765 N766 N841 | L706-Q762 PolarHBondContact O-OE1 3.03Å; R758-Q762 VanDerWaalsContact NH1-CB 3.3Å; R758-Q762 WeakPolarHBondContact O-CB 3.38Å; R758-Q762 PolarHBondContact O-N 2.99Å; A759-Q762 PolarHBondContact O-N 3.33Å; V760-Q762 VanDerWaalsContact C-N 3.29Å; V760-Q762 PolarHBondContact O-N 3.1Å; Q762-S764 VanDerWaalsContact C-N 3.31Å; Q762-S764 PolarHBondContact O-N 3.27Å; Q762-I765 PolarHBondContact O-N 3.18Å; Q762-N766 PolarHBondContact NE2-OD1 3.16Å; Q762-N766 VanDerWaalsContact O-CG 3.26Å; Q762-N766 PolarHBondContact O-N 3.16Å; Q762-N766 PolarHBondContact O-OD1 3.04Å; Q762-N841 WeakPolarHBondContact CG-OD1 3.27Å |
| 763 | K | 89.3 | Confident | 82.2 | Confident | 125.333 Ų | 125.333 | 53.5 Ų | 53.5 | 55% | 0.545 | 31% | 0.309 | S | S | . | . | H | α-helix | trans | -62.1 | -39.4 | 176.5 | -73.8 | -177.6 | 178.1 | -172.3 | 0 | 111.6 | A759 V760 L761 S767 | A759-K763 WeakPolarHBondContact O-CG 3.4Å; A759-K763 PolarHBondContact O-N 3.19Å; A759-K763 VanDerWaalsContact O-N 3.13Å; V760-K763 PolarHBondContact O-N 3.28Å; L761-K763 PolarHBondContact O-N 3.16Å; K763-S767 WeakPolarHBondContact O-CB 3.45Å; K763-S767 PolarHBondContact O-N 3.29Å |
| 764 | S | 88.3 | Confident | 82.9 | Confident | 21.6667 Ų | 21.6667 | 52.3 Ų | 52.3 | 15% | 0.152 | 31% | 0.305 | C | S | . | . | H | α-helix | trans | -61.7 | -50.5 | 174.2 | -143.1 | 0 | 0 | 0 | 0 | 110.8 | A750 L753 V760 L761 Q762 N766 S767 Y768 | A750-S764 PolarHBondContact O-OG 2.98Å; L753-S764 VanDerWaalsContact CD1-CB 3.45Å; L753-S764 WeakPolarHBondContact CD1-OG 3.33Å; V760-S764 PolarHBondContact O-N 3.14Å; V760-S764 VanDerWaalsContact O-N 3.09Å; V760-S764 PolarHBondContact O-OG 3.19Å; L761-S764 WeakPolarHBondContact O-CB 3.33Å; L761-S764 PolarHBondContact O-N 3.31Å; Q762-S764 VanDerWaalsContact C-N 3.31Å; Q762-S764 PolarHBondContact O-N 3.27Å; S764-N766 PolarHBondContact O-N 3.11Å; S764-S767 VanDerWaalsContact O-CB 3.28Å; S764-S767 WeakPolarHBondContact O-CB 3.39Å; S764-S767 PolarHBondContact O-N 3.26Å; S764-S767 VanDerWaalsContact O-N 3.11Å; S764-Y768 VanDerWaalsContact O-CD2 3.26Å; S764-Y768 WeakPolarHBondContact O-CD2 3.39Å; S764-Y768 PolarHBondContact O-N 3.16Å; S764-Y768 VanDerWaalsContact O-N 3.12Å |
| 765 | I | 91.9 | Very high | 84.1 | Confident | 0 Ų | 0 | 49 Ų | 49 | 0% | 0 | 28% | 0.284 | C | S | . | . | H | α-helix | trans | -54.8 | -51.7 | 176.6 | -70.1 | 168.6 | 0 | 0 | 0 | 111 | L706 A714 L718 A750 L761 Q762 S767 Y768 L769 | L706-I765 HydrophobicContact CB-CG2 4.11Å; L706-I765 HydrophobicContact CD1-CG2 4.01Å; L706-I765 HydrophobicContact CD2-CD1 4.47Å; L706-I765 HydrophobicContact CG-CG2 4.44Å; A714-I765 HydrophobicContact CB-CD1 4.43Å; L718-I765 HydrophobicContact CD1-CD1 4.16Å; L718-I765 HydrophobicContact CD1-CG1 4.05Å; L718-I765 HydrophobicContact CD2-CG1 4.46Å; A750-I765 HydrophobicContact CB-CG1 4.3Å; L761-I765 HydrophobicContact CD1-CD1 4.22Å; L761-I765 HydrophobicContact CD1-CG1 4.36Å; L761-I765 HydrophobicContact CG-CD1 3.93Å; L761-I765 HydrophobicContact CG-CG1 4.49Å; L761-I765 WeakPolarHBondContact O-CG1 3.33Å; L761-I765 PolarHBondContact O-N 3.08Å; Q762-I765 PolarHBondContact O-N 3.18Å; I765-S767 VanDerWaalsContact C-N 3.28Å; I765-S767 PolarHBondContact O-N 3.32Å; I765-Y768 PolarHBondContact O-N 3.2Å; I765-Y768 VanDerWaalsContact O-N 3.11Å; I765-L769 HydrophobicContact CG2-CD1 3.79Å; I765-L769 HydrophobicContact CG2-CG 4.15Å; I765-L769 WeakPolarHBondContact O-CG 3.37Å; I765-L769 PolarHBondContact O-N 3.45Å |
| 766 | N | 92.2 | Very high | 85.6 | Confident | 3.66667 Ų | 3.66667 | 44.3 Ų | 44.3 | 2% | 0.02 | 26% | 0.255 | C | S | . | . | H | α-helix | trans | -60.3 | -38.9 | 180 | -65.2 | -13.6 | 0 | 0 | 0 | 111.9 | Q762 S764 Y768 L769 K770 A848 E930 | Q762-N766 PolarHBondContact NE2-OD1 3.16Å; Q762-N766 VanDerWaalsContact O-CG 3.26Å; Q762-N766 PolarHBondContact O-N 3.16Å; Q762-N766 PolarHBondContact O-OD1 3.04Å; S764-N766 PolarHBondContact O-N 3.11Å; N766-Y768 VanDerWaalsContact C-N 3.3Å; N766-Y768 PolarHBondContact O-N 3.01Å; N766-L769 PolarHBondContact O-N 3.23Å; N766-L769 VanDerWaalsContact O-N 3.16Å; N766-K770 VanDerWaalsContact O-CG 3.31Å; N766-K770 WeakPolarHBondContact O-CG 3.33Å; N766-K770 PolarHBondContact O-N 3.16Å; N766-A848 HydrophobicContact CB-CB 4.49Å; N766-E930 HydrophobicContact CB-CG 4.35Å; N766-E930 VanDerWaalsContact CB-OE2 3.29Å; N766-E930 WeakPolarHBondContact CB-OE2 3.46Å |
| 767 | S | 88.6 | Confident | 86.8 | Confident | 58.3333 Ų | 58.3333 | 44.3 Ų | 44.3 | 41% | 0.408 | 26% | 0.255 | S | S | . | . | H | α-helix | trans | -59.6 | -39.7 | 175.6 | -172.4 | 0 | 0 | 0 | 0 | 112.7 | K763 S764 I765 K771 | K763-S767 WeakPolarHBondContact O-CB 3.45Å; K763-S767 PolarHBondContact O-N 3.29Å; S764-S767 VanDerWaalsContact O-CB 3.28Å; S764-S767 WeakPolarHBondContact O-CB 3.39Å; S764-S767 PolarHBondContact O-N 3.26Å; S764-S767 VanDerWaalsContact O-N 3.11Å; I765-S767 VanDerWaalsContact C-N 3.28Å; I765-S767 PolarHBondContact O-N 3.32Å; S767-K771 WeakPolarHBondContact O-CG 3.43Å |
| 768 | Y | 89.3 | Confident | 87.4 | Confident | 55.3333 Ų | 55.3333 | 42.3 Ų | 42.3 | 22% | 0.217 | 24% | 0.235 | C | C | . | . | H | α-helix | trans | -73.1 | -41.5 | 173.7 | -75.8 | -77.3 | 0 | 0 | 0 | 112.4 | E746 A750 L753 S764 I765 N766 K770 K771 | E746-Y768 HydrophobicContact CB-CD1 4.24Å; E746-Y768 HydrophobicContact CB-CE1 4.44Å; E746-Y768 HydrophobicContact CG-CD1 3.86Å; E746-Y768 HydrophobicContact CG-CE1 4.11Å; E746-Y768 VanDerWaalsContact O-CD1 3.25Å; E746-Y768 WeakPolarHBondContact O-CD1 3.36Å; E746-Y768 WeakPolarHBondContact O-CE1 3.32Å; A750-Y768 HydrophobicContact CB-CD2 3.66Å; A750-Y768 HydrophobicContact CB-CE2 3.73Å; A750-Y768 VanDerWaalsContact CB-CE2 3.46Å; A750-Y768 HydrophobicContact CB-CG 4.4Å; L753-Y768 HydrophobicContact CD1-CE2 4.16Å; S764-Y768 VanDerWaalsContact O-CD2 3.26Å; S764-Y768 WeakPolarHBondContact O-CD2 3.39Å; S764-Y768 PolarHBondContact O-N 3.16Å; S764-Y768 VanDerWaalsContact O-N 3.12Å; I765-Y768 PolarHBondContact O-N 3.2Å; I765-Y768 VanDerWaalsContact O-N 3.11Å; N766-Y768 VanDerWaalsContact C-N 3.3Å; N766-Y768 PolarHBondContact O-N 3.01Å; Y768-K770 PolarHBondContact O-N 3.19Å; Y768-K771 WeakPolarHBondContact O-CB 3.44Å; Y768-K771 PolarHBondContact O-N 3.11Å |
| 769 | L | 92.3 | Very high | 87.7 | Confident | 0 Ų | 0 | 40.8 Ų | 40.8 | 0% | 0 | 23% | 0.229 | C | C | . | . | H | α-helix | trans | -58.3 | -35.8 | 176.7 | -71.1 | 175.2 | 0 | 0 | 0 | 112.4 | F703 L706 L747 I765 N766 K771 L772 F845 A848 T849 | F703-L769 HydrophobicContact CD1-CD2 4.04Å; F703-L769 HydrophobicContact CE1-CD2 3.78Å; L706-L769 HydrophobicContact CD1-CD1 4.38Å; L706-L769 HydrophobicContact CD1-CD2 3.97Å; L706-L769 HydrophobicContact CD1-CG 4.49Å; L747-L769 HydrophobicContact CD1-CD2 4.1Å; L747-L769 HydrophobicContact CD1-CG 4.27Å; L747-L769 HydrophobicContact CD2-CD2 3.98Å; L747-L769 HydrophobicContact CD2-CG 4.32Å; I765-L769 HydrophobicContact CG2-CD1 3.79Å; I765-L769 HydrophobicContact CG2-CG 4.15Å; I765-L769 WeakPolarHBondContact O-CG 3.37Å; I765-L769 PolarHBondContact O-N 3.45Å; N766-L769 PolarHBondContact O-N 3.23Å; N766-L769 VanDerWaalsContact O-N 3.16Å; L769-K771 PolarHBondContact O-N 3.1Å; L769-L772 HydrophobicContact CB-CD1 4.48Å; L769-L772 HydrophobicContact CD2-CD1 3.81Å; L769-L772 WeakPolarHBondContact O-CB 3.3Å; L769-L772 WeakPolarHBondContact O-CD1 3.39Å; L769-L772 VanDerWaalsContact O-CG 3.27Å; L769-L772 WeakPolarHBondContact O-CG 3.37Å; L769-L772 PolarHBondContact O-N 3.02Å; L769-F845 HydrophobicContact CD1-CD2 3.59Å; L769-F845 HydrophobicContact CD1-CE2 4.16Å; L769-F845 HydrophobicContact CD2-CE2 4.42Å; L769-A848 HydrophobicContact CB-CB 3.7Å; L769-T849 HydrophobicContact CB-CG2 3.95Å; L769-T849 HydrophobicContact CD1-CG2 4.28Å; L769-T849 HydrophobicContact CD2-CG2 3.92Å; L769-T849 HydrophobicContact CG-CG2 4.27Å |
| 770 | K | 88.6 | Confident | 88 | Confident | 59.3333 Ų | 59.3333 | 40.5 Ų | 40.5 | 26% | 0.258 | 21% | 0.213 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -65.3 | -15.7 | 176.1 | -76.7 | -177.2 | 53 | -167 | 0 | 115 | N766 Y768 A848 Y929 E930 L931 H932 | N766-K770 VanDerWaalsContact O-CG 3.31Å; N766-K770 WeakPolarHBondContact O-CG 3.33Å; N766-K770 PolarHBondContact O-N 3.16Å; Y768-K770 PolarHBondContact O-N 3.19Å; K770-A848 HydrophobicContact CG-CB 3.73Å; K770-Y929 PolarHBondContact NZ-O 3.07Å; K770-E930 WeakPolarHBondContact CD-O 3.49Å; K770-E930 WeakPolarHBondContact CE-O 3.45Å; K770-E930 IonicContact NZ-OE2 2.79Å; K770-E930 PolarHBondContact NZ-OE2 2.94Å; K770-L931 WeakPolarHBondContact CE-O 3.42Å; K770-L931 PolarHBondContact NZ-O 3.39Å; K770-H932 PolarHBondContact O-CD2 3.18Å; K770-H932 VanDerWaalsContact O-CD2 3.25Å; K770-H932 PolarHBondContact O-NE2 3.22Å |
| 771 | K | 85.1 | Confident | 88.3 | Confident | 103.667 Ų | 103.667 | 39.7 Ų | 39.7 | 45% | 0.451 | 20% | 0.204 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -95 | -7.5 | -179.2 | -62.8 | 176.2 | 179.3 | -179.5 | 0 | 113 | H743 E746 S767 Y768 L769 T773 | H743-K771 PolarHBondContact CE1-O 3.16Å; E746-K771 WeakPolarHBondContact OE1-CD 3.32Å; E746-K771 WeakPolarHBondContact OE1-CE 3.35Å; E746-K771 IonicContact OE1-NZ 3.93Å; E746-K771 PolarHBondContact OE1-NZ 3.39Å; S767-K771 WeakPolarHBondContact O-CG 3.43Å; Y768-K771 WeakPolarHBondContact O-CB 3.44Å; Y768-K771 PolarHBondContact O-N 3.11Å; L769-K771 PolarHBondContact O-N 3.1Å; K771-T773 WeakPolarHBondContact O-CG2 3.49Å; K771-T773 PolarHBondContact O-N 2.96Å |
| 772 | L | 86.1 | Confident | 88.6 | Confident | 6.66667 Ų | 6.66667 | 39.3 Ų | 39.3 | 4% | 0.035 | 20% | 0.202 | C | C | . | . | trans | -59.4 | 133 | 174.6 | -64.7 | 174.5 | 0 | 0 | 0 | 109 | F703 H743 L747 L769 T849 V852 H932 | F703-L772 HydrophobicContact CE1-CD1 4.01Å; F703-L772 HydrophobicContact CZ-CD1 4.26Å; H743-L772 HydrophobicContact CB-CD2 3.57Å; H743-L772 VanDerWaalsContact CB-CD2 3.49Å; L747-L772 HydrophobicContact CD1-CD2 4.07Å; L747-L772 HydrophobicContact CG-CD2 4.37Å; L769-L772 HydrophobicContact CB-CD1 4.48Å; L769-L772 HydrophobicContact CD2-CD1 3.81Å; L769-L772 WeakPolarHBondContact O-CB 3.3Å; L769-L772 WeakPolarHBondContact O-CD1 3.39Å; L769-L772 VanDerWaalsContact O-CG 3.27Å; L769-L772 WeakPolarHBondContact O-CG 3.37Å; L769-L772 PolarHBondContact O-N 3.02Å; L772-T849 HydrophobicContact CD1-CG2 4.21Å; L772-V852 HydrophobicContact CB-CG1 4.22Å; L772-V852 HydrophobicContact CB-CG2 3.78Å; L772-V852 VanDerWaalsContact O-CG2 3.25Å; L772-V852 WeakPolarHBondContact O-CG2 3.29Å; L772-H932 PolarHBondContact O-NE2 3.07Å | ||
| 773 | T | 79.7 | Confident | 88.7 | Confident | 79.6667 Ų | 79.6667 | 39 Ų | 39 | 49% | 0.489 | 20% | 0.2 | S | C | . | . | trans | -121.2 | -17.1 | 177.3 | 66.2 | 0 | 0 | 0 | 0 | 113.1 | H743 K771 Q855 | H743-T773 PolarHBondContact CE1-N 3.48Å; H743-T773 PolarHBondContact CE1-OG1 3.07Å; H743-T773 PolarHBondContact NE2-N 2.94Å; H743-T773 PolarHBondContact NE2-OG1 3.28Å; K771-T773 WeakPolarHBondContact O-CG2 3.49Å; K771-T773 PolarHBondContact O-N 2.96Å; T773-Q855 PolarHBondContact O-OE1 3.12Å | ||
| 774 | V | 79 | Confident | 88.9 | Confident | 46.3333 Ų | 46.3333 | 35.2 Ų | 35.2 | 28% | 0.281 | 19% | 0.185 | S | C | . | . | S | Bend | trans | -104.4 | 121.3 | -179.6 | -177.9 | 0 | 0 | 0 | 0 | 109.7 | A739 E740 H743 T776 | A739-V774 HydrophobicContact CB-CG2 4.08Å; E740-V774 HydrophobicContact CB-CG1 4.14Å; H743-V774 WeakPolarHBondContact NE2-CG2 3.41Å; H743-V774 PolarHBondContact NE2-N 3.48Å; V774-T776 PolarHBondContact O-N 3.32Å; V774-T776 VanDerWaalsContact O-N 3.14Å |
| 775 | P | 80.4 | Confident | 89.2 | Confident | 36.6667 Ų | 36.6667 | 35.2 Ų | 35.2 | 24% | 0.238 | 18% | 0.183 | C | C | . | . | trans | -80.9 | 104.8 | 175.4 | 29.8 | -32.4 | 0 | 0 | 0 | 111.9 | R780 V852 Q855 T856 | P775-R780 HydrophobicContact CB-CG 4.34Å; P775-R780 PolarHBondContact O-NE 3.13Å; P775-V852 HydrophobicContact CB-CG1 4.12Å; P775-V852 WeakPolarHBondContact CB-O 3.39Å; P775-Q855 WeakPolarHBondContact CG-O 3.47Å; P775-T856 HydrophobicContact CB-CG2 3.28Å; P775-T856 VanDerWaalsContact CB-CG2 3.45Å; P775-T856 HydrophobicContact CG-CG2 3.18Å | ||
| 776 | T | 87.7 | Confident | 89.4 | Confident | 11.3333 Ų | 11.3333 | 35.2 Ų | 35.2 | 7% | 0.07 | 18% | 0.183 | C | C | . | . | trans | -84.7 | 154.8 | 173.9 | 65.8 | 0 | 0 | 0 | 0 | 111.5 | E699 E740 V774 G778 C779 R780 | E699-T776 VanDerWaalsContact CD-OG1 3.25Å; E699-T776 WeakPolarHBondContact OE1-CB 3.38Å; E699-T776 WeakPolarHBondContact OE1-CG2 3.35Å; E699-T776 PolarHBondContact OE1-OG1 3.36Å; E699-T776 WeakPolarHBondContact OE2-CB 3.4Å; E699-T776 PolarHBondContact OE2-OG1 3.11Å; E699-T776 VanDerWaalsContact OE2-OG1 3.11Å; E740-T776 HydrophobicContact CB-CG2 3.92Å; E740-T776 HydrophobicContact CG-CG2 3.32Å; V774-T776 PolarHBondContact O-N 3.32Å; V774-T776 VanDerWaalsContact O-N 3.14Å; T776-G778 VanDerWaalsContact C-N 3.28Å; T776-G778 PolarHBondContact O-N 3.1Å; T776-C779 PolarHBondContact O-N 2.9Å; T776-C779 WeakPolarHBondContact OG1-CB 3.41Å; T776-C779 PolarHBondContact OG1-N 3.21Å; T776-C779 VanDerWaalsContact OG1-N 3.13Å; T776-R780 WeakPolarHBondContact O-CG 3.46Å; T776-R780 PolarHBondContact O-N 3.18Å | ||
| 777 | T | 88.3 | Confident | 89.5 | Confident | 81.3333 Ų | 81.3333 | 36.2 Ų | 36.2 | 50% | 0.499 | 19% | 0.187 | S | C | . | . | H | α-helix | trans | -57.4 | -42.4 | 177.3 | -48.7 | 0 | 0 | 0 | 0 | 111.2 | E696 R780 Q781 | E696-T777 HydrophobicContact CG-CG2 4.38Å; E696-T777 WeakPolarHBondContact OE1-CB 3.48Å; E696-T777 PolarHBondContact OE1-OG1 3.21Å; T777-R780 PolarHBondContact O-N 3.17Å; T777-Q781 PolarHBondContact O-N 3.22Å |
| 778 | G | 90.6 | Very high | 89.8 | Confident | 0.333333 Ų | 0.333333 | 40.1 Ų | 40.1 | 0% | 0.003 | 19% | 0.192 | C | C | . | . | H | α-helix | trans | -68.6 | -37.6 | 179.8 | 0 | 0 | 0 | 0 | 0 | 113.1 | E699 T700 T776 A782 | E699-G778 WeakPolarHBondContact OE2-CA 3.38Å; E699-G778 PolarHBondContact OE2-N 3.22Å; E699-G778 VanDerWaalsContact OE2-N 3.08Å; T700-G778 VanDerWaalsContact OG1-CA 3.31Å; T700-G778 WeakPolarHBondContact OG1-CA 3.28Å; T700-G778 PolarHBondContact OG1-O 2.83Å; T776-G778 VanDerWaalsContact C-N 3.28Å; T776-G778 PolarHBondContact O-N 3.1Å; G778-A782 VanDerWaalsContact O-CB 3.28Å; G778-A782 WeakPolarHBondContact O-CB 3.42Å; G778-A782 PolarHBondContact O-N 3.16Å |
| 779 | C | 92.1 | Very high | 90 | Very high | 2 Ų | 2 | 39.7 Ų | 39.7 | 1% | 0.014 | 19% | 0.191 | C | C | . | . | H | α-helix | trans | -63.7 | -44.2 | 174.2 | -171.9 | 0 | 0 | 0 | 0 | 111.7 | F703 T776 A782 W783 | F703-C779 HydrophobicContact CD2-CB 4.06Å; F703-C779 HydrophobicContact CE2-CB 3.56Å; F703-C779 HydrophobicContact CZ-CB 3.93Å; T776-C779 PolarHBondContact O-N 2.9Å; T776-C779 WeakPolarHBondContact OG1-CB 3.41Å; T776-C779 PolarHBondContact OG1-N 3.21Å; T776-C779 VanDerWaalsContact OG1-N 3.13Å; C779-A782 PolarHBondContact O-N 3.25Å; C779-W783 WeakPolarHBondContact O-CB 3.39Å; C779-W783 PolarHBondContact O-N 3.07Å |
| 780 | R | 90.9 | Very high | 90.2 | Very high | 67 Ų | 67 | 39.7 Ų | 39.7 | 25% | 0.253 | 19% | 0.191 | S | C | . | . | H | α-helix | trans | -61 | -50.2 | 177 | -154 | -179.9 | -148.8 | -150 | -0.1 | 111.8 | P775 T776 T777 A782 W783 E784 V853 T856 I893 | P775-R780 HydrophobicContact CB-CG 4.34Å; P775-R780 PolarHBondContact O-NE 3.13Å; T776-R780 WeakPolarHBondContact O-CG 3.46Å; T776-R780 PolarHBondContact O-N 3.18Å; T777-R780 PolarHBondContact O-N 3.17Å; R780-A782 VanDerWaalsContact C-N 3.3Å; R780-A782 PolarHBondContact O-N 2.91Å; R780-W783 WeakPolarHBondContact O-CB 3.4Å; R780-W783 PolarHBondContact O-N 3.15Å; R780-W783 VanDerWaalsContact O-N 3.14Å; R780-E784 IonicContact CZ-OE1 3.98Å; R780-E784 IonicContact NE-OE1 3.5Å; R780-E784 PolarHBondContact NE-OE1 2.72Å; R780-E784 IonicContact NH2-OE1 2.91Å; R780-E784 PolarHBondContact NH2-OE1 3.12Å; R780-E784 PolarHBondContact O-N 3.21Å; R780-V853 HydrophobicContact CB-CG1 4.37Å; R780-V853 HydrophobicContact CG-CB 4.35Å; R780-V853 HydrophobicContact CG-CG1 3.96Å; R780-T856 PolarHBondContact NH2-OG1 3.37Å; R780-I893 HydrophobicContact CG-CD1 4.02Å |
| 781 | Q | 92.7 | Very high | 90.5 | Very high | 58.3333 Ų | 58.3333 | 39.3 Ų | 39.3 | 27% | 0.273 | 19% | 0.193 | S | C | . | . | H | α-helix | trans | -59.5 | -44.1 | 178.4 | -177.5 | 63.7 | 37.2 | 0 | 0 | 111.1 | T700 T777 W783 E784 D785 | T700-Q781 HydrophobicContact CG2-CB 4.07Å; T700-Q781 HydrophobicContact CG2-CG 3.82Å; T777-Q781 PolarHBondContact O-N 3.22Å; Q781-W783 VanDerWaalsContact C-N 3.29Å; Q781-W783 PolarHBondContact O-N 3.18Å; Q781-E784 PolarHBondContact O-N 3.23Å; Q781-D785 VanDerWaalsContact NE2-CG 3.3Å; Q781-D785 PolarHBondContact NE2-OD1 3.27Å; Q781-D785 VanDerWaalsContact NE2-OD1 3.14Å; Q781-D785 PolarHBondContact NE2-OD2 3.21Å; Q781-D785 WeakPolarHBondContact O-CB 3.42Å; Q781-D785 PolarHBondContact O-N 3.26Å |
| 782 | A | 95.3 | Very high | 90.8 | Very high | 0 Ų | 0 | 35.2 Ų | 35.2 | 0% | 0 | 18% | 0.179 | C | C | . | . | H | α-helix | trans | -62.1 | -37.5 | 177.3 | 0 | 0 | 0 | 0 | 0 | 112 | T700 F703 V704 G778 C779 R780 T786 F845 | T700-A782 HydrophobicContact CG2-CB 3.99Å; F703-A782 HydrophobicContact CB-CB 3.51Å; F703-A782 VanDerWaalsContact CB-CB 3.48Å; F703-A782 HydrophobicContact CG-CB 4.35Å; V704-A782 HydrophobicContact CG2-CB 4.04Å; G778-A782 VanDerWaalsContact O-CB 3.28Å; G778-A782 WeakPolarHBondContact O-CB 3.42Å; G778-A782 PolarHBondContact O-N 3.16Å; C779-A782 PolarHBondContact O-N 3.25Å; R780-A782 VanDerWaalsContact C-N 3.3Å; R780-A782 PolarHBondContact O-N 2.91Å; A782-T786 WeakPolarHBondContact O-CB 3.35Å; A782-T786 PolarHBondContact O-N 3.11Å; A782-T786 PolarHBondContact O-OG1 3.09Å; A782-F845 HydrophobicContact CB-CZ 4.14Å |
| 783 | W | 95.1 | Very high | 91.2 | Very high | 1.33333 Ų | 1.33333 | 34.9 Ų | 34.9 | 1% | 0.005 | 18% | 0.177 | C | C | . | . | H | α-helix | trans | -64 | -49.4 | 175 | -167.5 | 95.1 | 0 | 0 | 0 | 112.1 | C779 R780 Q781 T786 Y787 L846 T849 G850 V853 V897 F900 | C779-W783 WeakPolarHBondContact O-CB 3.39Å; C779-W783 PolarHBondContact O-N 3.07Å; R780-W783 WeakPolarHBondContact O-CB 3.4Å; R780-W783 PolarHBondContact O-N 3.15Å; R780-W783 VanDerWaalsContact O-N 3.14Å; Q781-W783 VanDerWaalsContact C-N 3.29Å; Q781-W783 PolarHBondContact O-N 3.18Å; W783-T786 PolarHBondContact O-N 3.23Å; W783-Y787 HydrophobicContact CH2-CD1 4.38Å; W783-Y787 HydrophobicContact CH2-CD2 4.42Å; W783-Y787 HydrophobicContact CH2-CG 4.11Å; W783-Y787 HydrophobicContact CZ3-CD1 4.21Å; W783-Y787 HydrophobicContact CZ3-CG 4.1Å; W783-Y787 VanDerWaalsContact O-CB 3.31Å; W783-Y787 WeakPolarHBondContact O-CB 3.37Å; W783-Y787 PolarHBondContact O-N 3.42Å; W783-L846 HydrophobicContact CD2-CD2 3.91Å; W783-L846 HydrophobicContact CG-CD2 3.97Å; W783-L846 HydrophobicContact CZ2-CD2 4.11Å; W783-L846 PolarHBondContact NE1-O 3.13Å; W783-L846 WeakPolarHBondContact O-CD2 3.47Å; W783-T849 VanDerWaalsContact CD1-OG1 3.25Å; W783-G850 VanDerWaalsContact NE1-CA 3.28Å; W783-V853 HydrophobicContact CB-CG1 3.96Å; W783-V853 HydrophobicContact CB-CG2 3.89Å; W783-V853 HydrophobicContact CD2-CG2 4.06Å; W783-V853 HydrophobicContact CG-CG1 4.14Å; W783-V853 HydrophobicContact CG-CG2 4.02Å; W783-V897 HydrophobicContact CH2-CB 4.29Å; W783-V897 HydrophobicContact CH2-CG2 3.68Å; W783-V897 HydrophobicContact CZ2-CB 4.41Å; W783-V897 HydrophobicContact CZ2-CG2 3.77Å; W783-V897 HydrophobicContact CZ3-CG2 4.21Å; W783-F900 HydrophobicContact CH2-CB 4.2Å; W783-F900 HydrophobicContact CZ2-CB 4.26Å; W783-F900 HydrophobicContact CZ2-CD1 4.35Å; W783-F900 HydrophobicContact CZ2-CG 4.38Å |
| 784 | E | 93 | Very high | 91.9 | Very high | 45.6667 Ų | 45.6667 | 31.2 Ų | 31.2 | 21% | 0.213 | 16% | 0.155 | C | C | . | . | H | α-helix | trans | -62.2 | -45.9 | 179.8 | -70.7 | -179.1 | -166 | 0 | 0 | 112.1 | R780 Q781 Y787 R788 I893 | R780-E784 IonicContact CZ-OE1 3.98Å; R780-E784 IonicContact NE-OE1 3.5Å; R780-E784 PolarHBondContact NE-OE1 2.72Å; R780-E784 IonicContact NH2-OE1 2.91Å; R780-E784 PolarHBondContact NH2-OE1 3.12Å; R780-E784 PolarHBondContact O-N 3.21Å; Q781-E784 PolarHBondContact O-N 3.23Å; E784-Y787 PolarHBondContact O-N 3.27Å; E784-R788 WeakPolarHBondContact O-CG 3.45Å; E784-R788 PolarHBondContact O-N 3.06Å; E784-R788 IonicContact OE2-CZ 3.05Å; E784-R788 IonicContact OE2-NH1 2.97Å; E784-R788 IonicContact OE2-NH2 3.38Å; E784-R788 PolarHBondContact OE2-NH2 3.29Å; E784-I893 WeakPolarHBondContact OE1-CG1 3.5Å |
| 785 | D | 93.2 | Very high | 92.4 | Very high | 22.3333 Ų | 22.3333 | 34.2 Ų | 34.2 | 12% | 0.119 | 16% | 0.164 | C | C | . | . | H | α-helix | trans | -64.8 | -45.5 | 178.2 | -70.1 | -22.9 | 0 | 0 | 0 | 111 | Q781 Y787 R788 Y789 | Q781-D785 VanDerWaalsContact NE2-CG 3.3Å; Q781-D785 PolarHBondContact NE2-OD1 3.27Å; Q781-D785 VanDerWaalsContact NE2-OD1 3.14Å; Q781-D785 PolarHBondContact NE2-OD2 3.21Å; Q781-D785 WeakPolarHBondContact O-CB 3.42Å; Q781-D785 PolarHBondContact O-N 3.26Å; D785-Y787 VanDerWaalsContact C-N 3.28Å; D785-Y787 PolarHBondContact O-N 3.24Å; D785-R788 PolarHBondContact O-N 3.17Å; D785-R788 IonicContact OD1-CZ 3.46Å; D785-R788 IonicContact OD1-NH1 3.01Å; D785-R788 PolarHBondContact OD1-NH1 3.14Å; D785-Y789 HydrophobicContact CB-CE2 4.13Å; D785-Y789 WeakPolarHBondContact O-CD2 3.45Å; D785-Y789 WeakPolarHBondContact O-CE2 3.45Å; D785-Y789 VanDerWaalsContact O-CG 3.3Å; D785-Y789 PolarHBondContact O-N 3.14Å; D785-Y789 VanDerWaalsContact O-N 3.15Å |
| 786 | T | 96.3 | Very high | 92.8 | Very high | 0 Ų | 0 | 32.6 Ų | 32.6 | 0% | 0 | 15% | 0.153 | C | C | . | . | H | α-helix | trans | -61.2 | -38.3 | 176 | -56.9 | 0 | 0 | 0 | 0 | 111.4 | W707 A782 W783 Y789 W790 M842 F845 L846 | W707-T786 HydrophobicContact CZ2-CG2 4.36Å; W707-T786 PolarHBondContact NE1-OG1 3.32Å; W707-T786 VanDerWaalsContact NE1-OG1 3.08Å; A782-T786 WeakPolarHBondContact O-CB 3.35Å; A782-T786 PolarHBondContact O-N 3.11Å; A782-T786 PolarHBondContact O-OG1 3.09Å; W783-T786 PolarHBondContact O-N 3.23Å; T786-Y789 PolarHBondContact O-N 3.1Å; T786-W790 VanDerWaalsContact O-CB 3.23Å; T786-W790 WeakPolarHBondContact O-CB 3.32Å; T786-W790 PolarHBondContact O-N 3.16Å; T786-M842 HydrophobicContact CG2-CB 3.84Å; T786-M842 HydrophobicContact CG2-CG 3.87Å; T786-M842 HydrophobicContact CG2-SD 4.37Å; T786-F845 HydrophobicContact CG2-CD1 3.88Å; T786-F845 HydrophobicContact CG2-CE1 4.45Å; T786-L846 HydrophobicContact CG2-CD1 4.4Å; T786-L846 HydrophobicContact CG2-CD2 4.11Å; T786-L846 HydrophobicContact CG2-CG 4.06Å |
| 787 | Y | 95.7 | Very high | 92.9 | Very high | 25 Ų | 25 | 32.6 Ų | 32.6 | 10% | 0.098 | 15% | 0.152 | C | C | . | . | H | α-helix | trans | -64.2 | -43.4 | 176.6 | 176.5 | -120.4 | 0 | 0 | 0 | 111.7 | W783 E784 D785 Y789 W790 V791 L846 S899 F900 Q903 | W783-Y787 HydrophobicContact CH2-CD1 4.38Å; W783-Y787 HydrophobicContact CH2-CD2 4.42Å; W783-Y787 HydrophobicContact CH2-CG 4.11Å; W783-Y787 HydrophobicContact CZ3-CD1 4.21Å; W783-Y787 HydrophobicContact CZ3-CG 4.1Å; W783-Y787 VanDerWaalsContact O-CB 3.31Å; W783-Y787 WeakPolarHBondContact O-CB 3.37Å; W783-Y787 PolarHBondContact O-N 3.42Å; E784-Y787 PolarHBondContact O-N 3.27Å; D785-Y787 VanDerWaalsContact C-N 3.28Å; D785-Y787 PolarHBondContact O-N 3.24Å; Y787-Y789 VanDerWaalsContact C-N 3.35Å; Y787-Y789 PolarHBondContact O-N 3.08Å; Y787-W790 HydrophobicContact CD2-CE3 4.12Å; Y787-W790 AromaticContact CE2-CE3 3.94Å; Y787-W790 HydrophobicContact CE2-CE3 4.01Å; Y787-W790 HydrophobicContact CE2-CZ3 4.19Å; Y787-W790 PolarHBondContact O-N 3.09Å; Y787-V791 HydrophobicContact CD2-CG2 4.14Å; Y787-V791 HydrophobicContact CE1-CG2 4.29Å; Y787-V791 HydrophobicContact CE2-CG2 3.66Å; Y787-V791 WeakPolarHBondContact O-CG2 3.34Å; Y787-V791 PolarHBondContact O-N 2.95Å; Y787-L846 HydrophobicContact CD2-CD1 4.4Å; Y787-S899 WeakPolarHBondContact OH-CB 3.17Å; Y787-S899 PolarHBondContact OH-OG 3.17Å; Y787-F900 HydrophobicContact CD2-CB 3.93Å; Y787-F900 HydrophobicContact CD2-CD2 4.07Å; Y787-F900 HydrophobicContact CD2-CG 4.36Å; Y787-F900 HydrophobicContact CE2-CB 3.57Å; Y787-F900 HydrophobicContact CE2-CD2 4.1Å; Y787-F900 HydrophobicContact CE2-CG 4.3Å; Y787-Q903 PolarHBondContact OH-NE2 3.14Å; Y787-Q903 VanDerWaalsContact OH-NE2 3.08Å |
| 788 | R | 93.5 | Very high | 92.9 | Very high | 139.667 Ų | 139.667 | 32.7 Ų | 32.7 | 53% | 0.527 | 15% | 0.146 | S | C | . | . | H | α-helix | trans | -58.3 | -46.2 | 174.8 | -69.1 | 176.3 | -167.8 | 124.1 | 7.7 | 111.6 | E784 D785 V791 A792 | E784-R788 WeakPolarHBondContact O-CG 3.45Å; E784-R788 PolarHBondContact O-N 3.06Å; E784-R788 IonicContact OE2-CZ 3.05Å; E784-R788 IonicContact OE2-NH1 2.97Å; E784-R788 IonicContact OE2-NH2 3.38Å; E784-R788 PolarHBondContact OE2-NH2 3.29Å; D785-R788 PolarHBondContact O-N 3.17Å; D785-R788 IonicContact OD1-CZ 3.46Å; D785-R788 IonicContact OD1-NH1 3.01Å; D785-R788 PolarHBondContact OD1-NH1 3.14Å; R788-V791 PolarHBondContact O-N 3.1Å; R788-A792 PolarHBondContact O-N 3.15Å |
| 789 | Y | 94.5 | Very high | 92.6 | Very high | 47 Ų | 47 | 34.8 Ų | 34.8 | 18% | 0.184 | 16% | 0.161 | C | C | . | . | H | α-helix | trans | -64.8 | -42.8 | 176 | -58.4 | -45.1 | 0 | 0 | 0 | 112 | F652 W707 D785 T786 Y787 V791 A792 F793 V811 L815 | F652-Y789 HydrophobicContact CE2-CD2 4.45Å; F652-Y789 HydrophobicContact CE2-CE1 4.36Å; F652-Y789 AromaticContact CE2-CE2 3.65Å; F652-Y789 HydrophobicContact CE2-CE2 3.65Å; F652-Y789 AromaticContact CE2-CZ 3.63Å; F652-Y789 WeakPolarHBondContact CE2-OH 3.32Å; F652-Y789 AromaticContact CZ-CE2 3.86Å; F652-Y789 HydrophobicContact CZ-CE2 4.1Å; W707-Y789 HydrophobicContact CH2-CD2 4.23Å; W707-Y789 HydrophobicContact CZ2-CD2 4.31Å; D785-Y789 HydrophobicContact CB-CE2 4.13Å; D785-Y789 WeakPolarHBondContact O-CD2 3.45Å; D785-Y789 WeakPolarHBondContact O-CE2 3.45Å; D785-Y789 VanDerWaalsContact O-CG 3.3Å; D785-Y789 PolarHBondContact O-N 3.14Å; D785-Y789 VanDerWaalsContact O-N 3.15Å; T786-Y789 PolarHBondContact O-N 3.1Å; Y787-Y789 VanDerWaalsContact C-N 3.35Å; Y787-Y789 PolarHBondContact O-N 3.08Å; Y789-V791 VanDerWaalsContact C-N 3.31Å; Y789-V791 PolarHBondContact O-N 3.05Å; Y789-A792 PolarHBondContact O-N 3.22Å; Y789-A792 VanDerWaalsContact O-N 3.17Å; Y789-F793 VanDerWaalsContact O-CD2 3.29Å; Y789-F793 WeakPolarHBondContact O-CD2 3.45Å; Y789-F793 PolarHBondContact O-N 3.28Å; Y789-V811 HydrophobicContact CD1-CG1 4.26Å; Y789-L815 HydrophobicContact CD1-CD1 3.67Å; Y789-L815 VanDerWaalsContact CD1-CD1 3.46Å; Y789-L815 HydrophobicContact CD2-CD1 4.28Å; Y789-L815 HydrophobicContact CE1-CD1 4.08Å; Y789-L815 HydrophobicContact CG-CD1 3.84Å |
| 790 | W | 96.2 | Very high | 91.9 | Very high | 0 Ų | 0 | 38.9 Ų | 38.9 | 0% | 0 | 18% | 0.178 | C | C | . | . | H | α-helix | trans | -59.9 | -39.4 | 177.9 | 180 | 91.2 | 0 | 0 | 0 | 112.4 | T786 Y787 F793 T794 W839 T843 L846 F900 Q903 L904 L907 | T786-W790 VanDerWaalsContact O-CB 3.23Å; T786-W790 WeakPolarHBondContact O-CB 3.32Å; T786-W790 PolarHBondContact O-N 3.16Å; Y787-W790 HydrophobicContact CD2-CE3 4.12Å; Y787-W790 AromaticContact CE2-CE3 3.94Å; Y787-W790 HydrophobicContact CE2-CE3 4.01Å; Y787-W790 HydrophobicContact CE2-CZ3 4.19Å; Y787-W790 PolarHBondContact O-N 3.09Å; W790-F793 PolarHBondContact O-N 3.36Å; W790-T794 VanDerWaalsContact CE2-OG1 3.31Å; W790-T794 HydrophobicContact CH2-CG2 4.25Å; W790-T794 HydrophobicContact CZ2-CG2 4.48Å; W790-T794 WeakPolarHBondContact CZ2-OG1 3.31Å; W790-T794 VanDerWaalsContact O-CB 3.26Å; W790-T794 WeakPolarHBondContact O-CB 3.25Å; W790-T794 PolarHBondContact O-N 2.87Å; W790-T794 PolarHBondContact O-OG1 3.17Å; W790-W839 AromaticContact CD1-CD1 3.73Å; W790-W839 AromaticContact CD1-NE1 3.54Å; W790-W839 AromaticContact CE2-NE1 3.63Å; W790-W839 HydrophobicContact CZ2-CZ2 4.1Å; W790-W839 AromaticContact NE1-CD1 3.77Å; W790-W839 AromaticContact NE1-CE2 3.5Å; W790-W839 AromaticContact NE1-CZ2 3.78Å; W790-W839 AromaticContact NE1-NE1 3.11Å; W790-W839 VanDerWaalsContact NE1-NE1 3.11Å; W790-T843 PolarHBondContact NE1-OG1 3.02Å; W790-L846 HydrophobicContact CB-CD1 3.68Å; W790-L846 HydrophobicContact CD2-CD1 4.18Å; W790-L846 HydrophobicContact CG-CD1 3.66Å; W790-F900 HydrophobicContact CD2-CD2 4.26Å; W790-F900 HydrophobicContact CD2-CE2 4.15Å; W790-F900 AromaticContact CE2-CE2 3.89Å; W790-F900 AromaticContact CE3-CD2 4Å; W790-F900 HydrophobicContact CE3-CD2 4.07Å; W790-F900 HydrophobicContact CE3-CE2 4.4Å; W790-F900 AromaticContact CH2-CD2 3.9Å; W790-F900 HydrophobicContact CH2-CD2 4.09Å; W790-F900 HydrophobicContact CH2-CE2 4.21Å; W790-F900 HydrophobicContact CZ2-CD2 4.27Å; W790-F900 AromaticContact CZ2-CE2 3.93Å; W790-F900 HydrophobicContact CZ2-CE2 3.93Å; W790-F900 AromaticContact CZ3-CD2 3.85Å; W790-F900 HydrophobicContact CZ3-CD2 3.99Å; W790-F900 HydrophobicContact CZ3-CE2 4.44Å; W790-Q903 HydrophobicContact CH2-CB 3.8Å; W790-Q903 HydrophobicContact CZ3-CB 3.85Å; W790-L904 HydrophobicContact CH2-CB 4.47Å; W790-L904 HydrophobicContact CZ2-CB 4.49Å; W790-L904 HydrophobicContact CZ2-CD1 4.12Å; W790-L907 HydrophobicContact CZ2-CD1 4.22Å |
| 791 | V | 94.7 | Very high | 90.9 | Very high | 50 Ų | 50 | 40.4 Ų | 40.4 | 30% | 0.303 | 20% | 0.197 | S | C | . | . | H | α-helix | trans | -61.9 | -45.4 | 175.3 | 170.5 | 0 | 0 | 0 | 0 | 110.9 | Y787 R788 Y789 T794 K795 | Y787-V791 HydrophobicContact CD2-CG2 4.14Å; Y787-V791 HydrophobicContact CE1-CG2 4.29Å; Y787-V791 HydrophobicContact CE2-CG2 3.66Å; Y787-V791 WeakPolarHBondContact O-CG2 3.34Å; Y787-V791 PolarHBondContact O-N 2.95Å; R788-V791 PolarHBondContact O-N 3.1Å; Y789-V791 VanDerWaalsContact C-N 3.31Å; Y789-V791 PolarHBondContact O-N 3.05Å; V791-T794 PolarHBondContact O-N 3.32Å; V791-K795 WeakPolarHBondContact O-CB 3.25Å; V791-K795 PolarHBondContact O-N 3.11Å |
| 792 | A | 92.6 | Very high | 89.7 | Confident | 18 Ų | 18 | 46.6 Ų | 46.6 | 15% | 0.149 | 22% | 0.223 | C | C | . | . | H | α-helix | trans | -61.4 | -46 | 177.1 | 0 | 0 | 0 | 0 | 0 | 112 | R788 Y789 T794 K795 F796 V811 | R788-A792 PolarHBondContact O-N 3.15Å; Y789-A792 PolarHBondContact O-N 3.22Å; Y789-A792 VanDerWaalsContact O-N 3.17Å; A792-T794 VanDerWaalsContact C-N 3.34Å; A792-T794 PolarHBondContact O-N 3.15Å; A792-K795 PolarHBondContact O-N 3.26Å; A792-F796 PolarHBondContact O-N 3.16Å; A792-F796 VanDerWaalsContact O-N 3.09Å; A792-V811 HydrophobicContact CB-CB 4.41Å; A792-V811 HydrophobicContact CB-CG1 4.19Å |
| 793 | F | 93.9 | Very high | 88 | Confident | 0 Ų | 0 | 47.9 Ų | 47.9 | 0% | 0 | 23% | 0.232 | C | C | . | . | H | α-helix | trans | -62.2 | -41.9 | 175.3 | -86.3 | -114 | 0 | 0 | 0 | 111.9 | Y789 W790 K795 F796 L797 V812 L815 V835 L838 W839 M842 | Y789-F793 VanDerWaalsContact O-CD2 3.29Å; Y789-F793 WeakPolarHBondContact O-CD2 3.45Å; Y789-F793 PolarHBondContact O-N 3.28Å; W790-F793 PolarHBondContact O-N 3.36Å; F793-K795 PolarHBondContact O-N 3.07Å; F793-F796 PolarHBondContact O-N 3.13Å; F793-L797 WeakPolarHBondContact O-CB 3.29Å; F793-L797 VanDerWaalsContact O-CG 3.29Å; F793-L797 WeakPolarHBondContact O-CG 3.31Å; F793-L797 PolarHBondContact O-N 3.07Å; F793-V812 HydrophobicContact CB-CG2 4.38Å; F793-V812 HydrophobicContact CD1-CG1 4.34Å; F793-V812 HydrophobicContact CD1-CG2 4.22Å; F793-V812 HydrophobicContact CD2-CB 4.47Å; F793-V812 HydrophobicContact CD2-CG2 3.62Å; F793-V812 HydrophobicContact CE1-CG1 4.03Å; F793-V812 HydrophobicContact CE1-CG2 4.44Å; F793-V812 HydrophobicContact CE2-CB 4.24Å; F793-V812 HydrophobicContact CE2-CG1 4.49Å; F793-V812 HydrophobicContact CE2-CG2 3.86Å; F793-V812 HydrophobicContact CG-CG2 3.82Å; F793-V812 HydrophobicContact CZ-CB 4.3Å; F793-V812 HydrophobicContact CZ-CG1 4.13Å; F793-V812 HydrophobicContact CZ-CG2 4.26Å; F793-L815 HydrophobicContact CE2-CB 3.96Å; F793-L815 HydrophobicContact CE2-CD1 4.03Å; F793-L815 HydrophobicContact CE2-CD2 3.53Å; F793-L815 HydrophobicContact CE2-CG 4.41Å; F793-L815 HydrophobicContact CZ-CB 3.99Å; F793-L815 HydrophobicContact CZ-CD2 3.67Å; F793-V835 HydrophobicContact CD1-CG1 3.74Å; F793-V835 HydrophobicContact CE1-CG1 3.85Å; F793-L838 HydrophobicContact CE1-CB 4.41Å; F793-L838 HydrophobicContact CE1-CD2 3.97Å; F793-L838 HydrophobicContact CE1-CG 4.32Å; F793-L838 HydrophobicContact CZ-CD2 3.83Å; F793-L838 HydrophobicContact CZ-CG 4.46Å; F793-W839 HydrophobicContact CB-CB 4.42Å; F793-W839 HydrophobicContact CB-CG 4.42Å; F793-W839 HydrophobicContact CD1-CB 4.11Å; F793-M842 HydrophobicContact CB-CE 4.17Å; F793-M842 HydrophobicContact CD1-CE 3.8Å; F793-M842 HydrophobicContact CD2-CE 3.81Å; F793-M842 HydrophobicContact CE1-CE 4.1Å; F793-M842 HydrophobicContact CE2-CE 4.1Å; F793-M842 HydrophobicContact CG-CE 3.65Å; F793-M842 HydrophobicContact CZ-CE 4.24Å |
| 794 | T | 93.2 | Very high | 86.3 | Confident | 3 Ų | 3 | 56.4 Ų | 56.4 | 2% | 0.018 | 27% | 0.269 | C | S | . | . | H | α-helix | trans | -64.5 | -41.5 | 179.1 | -59.1 | 0 | 0 | 0 | 0 | 111.2 | W790 V791 A792 L797 K798 W839 L907 | W790-T794 VanDerWaalsContact CE2-OG1 3.31Å; W790-T794 HydrophobicContact CH2-CG2 4.25Å; W790-T794 HydrophobicContact CZ2-CG2 4.48Å; W790-T794 WeakPolarHBondContact CZ2-OG1 3.31Å; W790-T794 VanDerWaalsContact O-CB 3.26Å; W790-T794 WeakPolarHBondContact O-CB 3.25Å; W790-T794 PolarHBondContact O-N 2.87Å; W790-T794 PolarHBondContact O-OG1 3.17Å; V791-T794 PolarHBondContact O-N 3.32Å; A792-T794 VanDerWaalsContact C-N 3.34Å; A792-T794 PolarHBondContact O-N 3.15Å; T794-L797 PolarHBondContact O-N 3.41Å; T794-K798 HydrophobicContact CG2-CD 4.28Å; T794-K798 WeakPolarHBondContact O-CB 3.3Å; T794-K798 VanDerWaalsContact O-CG 3.26Å; T794-K798 WeakPolarHBondContact O-CG 3.46Å; T794-K798 PolarHBondContact O-N 3.13Å; T794-W839 PolarHBondContact OG1-NE1 3.09Å; T794-L907 HydrophobicContact CG2-CD1 4.22Å; T794-L907 HydrophobicContact CG2-CD2 4.03Å; T794-L907 HydrophobicContact CG2-CG 4.38Å |
| 795 | K | 90.7 | Very high | 84.6 | Confident | 108.333 Ų | 108.333 | 63.9 Ų | 63.9 | 47% | 0.471 | 30% | 0.301 | S | S | . | . | H | α-helix | trans | -60.6 | -46.8 | 174.7 | -169.5 | -170.8 | -177.2 | -161.5 | 0 | 111.2 | V791 A792 F793 K798 S799 D806 | V791-K795 WeakPolarHBondContact O-CB 3.25Å; V791-K795 PolarHBondContact O-N 3.11Å; A792-K795 PolarHBondContact O-N 3.26Å; F793-K795 PolarHBondContact O-N 3.07Å; K795-K798 PolarHBondContact O-N 3.32Å; K795-S799 PolarHBondContact O-N 3.44Å; K795-S799 PolarHBondContact O-OG 3.1Å; K795-D806 WeakPolarHBondContact CE-OD2 3.27Å; K795-D806 VanDerWaalsContact NZ-CG 3.29Å; K795-D806 IonicContact NZ-OD1 3.05Å; K795-D806 PolarHBondContact NZ-OD1 3.21Å; K795-D806 VanDerWaalsContact NZ-OD1 3.15Å; K795-D806 IonicContact NZ-OD2 3.25Å; K795-D806 PolarHBondContact NZ-OD2 3.2Å |
| 796 | F | 89.3 | Confident | 83.3 | Confident | 3.66667 Ų | 3.66667 | 65.2 Ų | 65.2 | 2% | 0.016 | 31% | 0.308 | C | S | . | . | H | α-helix | trans | -59.8 | -51 | 176.4 | 170.9 | -103.7 | 0 | 0 | 0 | 112 | A792 F793 K798 S799 F800 S803 L809 V812 L830 V835 | A792-F796 PolarHBondContact O-N 3.16Å; A792-F796 VanDerWaalsContact O-N 3.09Å; F793-F796 PolarHBondContact O-N 3.13Å; F796-K798 VanDerWaalsContact C-N 3.3Å; F796-K798 PolarHBondContact O-N 2.96Å; F796-S799 PolarHBondContact O-N 3.37Å; F796-S799 VanDerWaalsContact O-N 3.13Å; F796-S799 PolarHBondContact O-OG 3.09Å; F796-F800 HydrophobicContact CE1-CD2 4.3Å; F796-F800 HydrophobicContact CE2-CD2 4.24Å; F796-F800 AromaticContact CZ-CD2 3.7Å; F796-F800 HydrophobicContact CZ-CD2 3.7Å; F796-F800 HydrophobicContact CZ-CE2 4.34Å; F796-F800 PolarHBondContact O-N 3.27Å; F796-F800 VanDerWaalsContact O-N 3.08Å; F796-S803 WeakPolarHBondContact CE2-OG 3.31Å; F796-L809 HydrophobicContact CD2-CB 4.48Å; F796-L809 HydrophobicContact CD2-CD1 3.92Å; F796-L809 HydrophobicContact CE2-CD1 3.49Å; F796-L809 VanDerWaalsContact CE2-CD1 3.48Å; F796-L809 HydrophobicContact CZ-CD1 4.21Å; F796-V812 HydrophobicContact CB-CG2 3.88Å; F796-V812 HydrophobicContact CD1-CB 4.46Å; F796-V812 HydrophobicContact CD1-CG1 3.94Å; F796-V812 HydrophobicContact CD1-CG2 4.3Å; F796-V812 HydrophobicContact CE1-CG1 4.17Å; F796-V812 HydrophobicContact CG-CG1 4.38Å; F796-V812 HydrophobicContact CG-CG2 4.14Å; F796-L830 HydrophobicContact CE1-CD2 4.12Å; F796-L830 HydrophobicContact CE2-CD2 4.46Å; F796-L830 HydrophobicContact CZ-CD2 3.8Å; F796-V835 HydrophobicContact CD1-CG1 4.13Å; F796-V835 HydrophobicContact CE1-CG1 4.06Å |
| 797 | L | 89.7 | Confident | 82.2 | Confident | 10.6667 Ų | 10.6667 | 72.7 Ų | 72.7 | 6% | 0.056 | 34% | 0.343 | C | S | . | . | H | α-helix | trans | -63.4 | -32.9 | -178.4 | -70.4 | 174.8 | 0 | 0 | 0 | 112.9 | F793 T794 S799 L832 V835 I836 W839 I919 | F793-L797 WeakPolarHBondContact O-CB 3.29Å; F793-L797 VanDerWaalsContact O-CG 3.29Å; F793-L797 WeakPolarHBondContact O-CG 3.31Å; F793-L797 PolarHBondContact O-N 3.07Å; T794-L797 PolarHBondContact O-N 3.41Å; L797-S799 VanDerWaalsContact C-N 3.3Å; L797-S799 PolarHBondContact O-N 3.28Å; L797-L832 HydrophobicContact CD2-CD1 3.99Å; L797-V835 HydrophobicContact CD2-CG1 4Å; L797-V835 HydrophobicContact CG-CG1 4.45Å; L797-I836 HydrophobicContact CD1-CG1 4.42Å; L797-I836 HydrophobicContact CD2-CD1 4.41Å; L797-I836 HydrophobicContact CD2-CG1 3.86Å; L797-W839 HydrophobicContact CD1-CB 3.96Å; L797-W839 HydrophobicContact CD1-CD2 3.86Å; L797-W839 HydrophobicContact CD1-CE3 4.43Å; L797-W839 HydrophobicContact CD1-CG 3.61Å; L797-I919 HydrophobicContact CB-CD1 4.02Å; L797-I919 HydrophobicContact CD1-CD1 4.12Å; L797-I919 HydrophobicContact CD2-CD1 4.19Å; L797-I919 HydrophobicContact CG-CD1 4.34Å |
| 798 | K | 87.5 | Confident | 81.5 | Confident | 85.3333 Ų | 85.3333 | 71.9 Ų | 71.9 | 37% | 0.371 | 34% | 0.341 | S | S | . | . | H | α-helix | trans | -67.4 | -27.3 | 173.4 | -75.4 | 178 | 178.6 | -176.8 | 0 | 113.2 | T794 K795 F796 S906 L907 I910 | T794-K798 HydrophobicContact CG2-CD 4.28Å; T794-K798 WeakPolarHBondContact O-CB 3.3Å; T794-K798 VanDerWaalsContact O-CG 3.26Å; T794-K798 WeakPolarHBondContact O-CG 3.46Å; T794-K798 PolarHBondContact O-N 3.13Å; K795-K798 PolarHBondContact O-N 3.32Å; F796-K798 VanDerWaalsContact C-N 3.3Å; F796-K798 PolarHBondContact O-N 2.96Å; K798-S906 PolarHBondContact NZ-OG 3.24Å; K798-L907 HydrophobicContact CD-CD2 4.3Å; K798-L907 HydrophobicContact CG-CD2 4.09Å; K798-I910 HydrophobicContact CD-CD1 4.15Å; K798-I910 HydrophobicContact CG-CD1 3.8Å |
| 799 | S | 83.9 | Confident | 81 | Confident | 43.3333 Ų | 43.3333 | 66.5 Ų | 66.5 | 30% | 0.303 | 32% | 0.323 | S | S | . | . | H | α-helix | trans | -99.5 | -11.9 | -176.1 | 64.1 | 0 | 0 | 0 | 0 | 114.4 | K795 F796 L797 K802 S803 | K795-S799 PolarHBondContact O-N 3.44Å; K795-S799 PolarHBondContact O-OG 3.1Å; F796-S799 PolarHBondContact O-N 3.37Å; F796-S799 VanDerWaalsContact O-N 3.13Å; F796-S799 PolarHBondContact O-OG 3.09Å; L797-S799 VanDerWaalsContact C-N 3.3Å; L797-S799 PolarHBondContact O-N 3.28Å; S799-K802 CarbonylContact O-C 3.36Å; S799-K802 WeakPolarHBondContact O-CA 3.36Å; S799-K802 WeakPolarHBondContact O-CB 3.38Å; S799-K802 PolarHBondContact O-N 3.21Å; S799-S803 PolarHBondContact O-N 3.22Å; S799-S803 WeakPolarHBondContact OG-CB 3.28Å; S799-S803 PolarHBondContact OG-OG 3.34Å |
| 800 | F | 78.1 | Confident | 80.4 | Confident | 88.3333 Ų | 88.3333 | 70.9 Ų | 70.9 | 39% | 0.387 | 35% | 0.345 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -64.6 | 140.8 | -178.6 | -172.8 | -90.1 | 0 | 0 | 0 | 112.5 | F796 L832 | F796-F800 HydrophobicContact CE1-CD2 4.3Å; F796-F800 HydrophobicContact CE2-CD2 4.24Å; F796-F800 AromaticContact CZ-CD2 3.7Å; F796-F800 HydrophobicContact CZ-CD2 3.7Å; F796-F800 HydrophobicContact CZ-CE2 4.34Å; F796-F800 PolarHBondContact O-N 3.27Å; F796-F800 VanDerWaalsContact O-N 3.08Å; F800-L832 HydrophobicContact CD1-CD1 4.13Å; F800-L832 HydrophobicContact CD1-CD2 3.92Å; F800-L832 HydrophobicContact CD2-CD1 4.25Å; F800-L832 HydrophobicContact CE1-CD1 4.2Å; F800-L832 HydrophobicContact CE1-CD2 3.48Å; F800-L832 VanDerWaalsContact CE1-CD2 3.46Å; F800-L832 HydrophobicContact CE1-CG 4.39Å; F800-L832 HydrophobicContact CE2-CD1 4.31Å; F800-L832 HydrophobicContact CG-CD1 4.16Å; F800-L832 HydrophobicContact CZ-CD1 4.29Å; F800-L832 HydrophobicContact CZ-CD2 3.95Å; F800-L832 HydrophobicContact CZ-CG 4.47Å |
| 801 | P | 70 | Confident | 80 | Confident | 98 Ų | 98 | 73.2 Ų | 73.2 | 64% | 0.636 | 36% | 0.359 | S | S | * | . | T | Hydrogen-bonded Turn | cis | -87.5 | 6.6 | -0.4 | 35 | -35.3 | 0 | 0 | 0 | 114.3 | S803 | P801-S803 PolarHBondContact O-N 3.14Š|
| 802 | K | 67.4 | Low | 79.7 | Confident | 189.75 Ų | 189.75 | 70.8 Ų | 70.8 | 83% | 0.825 | 34% | 0.344 | S | S | * | . | S | Bend | trans | -82.3 | 3.6 | -170.3 | -62.2 | -175.6 | -179.7 | -179.4 | 0 | 114.3 | S799 K804 | S799-K802 CarbonylContact O-C 3.36Å; S799-K802 WeakPolarHBondContact O-CA 3.36Å; S799-K802 WeakPolarHBondContact O-CB 3.38Å; S799-K802 PolarHBondContact O-N 3.21Å; K802-K804 PolarHBondContact O-N 3.01Å |
| 803 | S | 60 | Low | 79.4 | Confident | 26.5 Ų | 26.5 | 73.2 Ų | 73.2 | 19% | 0.185 | 35% | 0.352 | C | S | . | . | trans | -81.2 | 97.8 | -178 | 59.2 | 0 | 0 | 0 | 0 | 111.3 | F796 S799 P801 | F796-S803 WeakPolarHBondContact CE2-OG 3.31Å; S799-S803 PolarHBondContact O-N 3.22Å; S799-S803 WeakPolarHBondContact OG-CB 3.28Å; S799-S803 PolarHBondContact OG-OG 3.34Å; P801-S803 PolarHBondContact O-N 3.14Å | ||
| 804 | K | 57.7 | Low | 79 | Confident | 179.75 Ų | 179.75 | 76.8 Ų | 76.8 | 78% | 0.782 | 37% | 0.37 | S | S | * | . | trans | -76.4 | 71.9 | 167.1 | -70 | -172.3 | 176.9 | -175.7 | 0 | 111.3 | K802 D806 | K802-K804 PolarHBondContact O-N 3.01Å; K804-D806 WeakPolarHBondContact O-CB 3.31Å; K804-D806 PolarHBondContact O-N 2.83Å | ||
| 805 | F | 58.1 | Low | 78.8 | Confident | 204.25 Ų | 204.25 | 76.7 Ų | 76.7 | 90% | 0.896 | 37% | 0.369 | S | S | * | . | S | Bend | trans | -95.3 | 87.8 | 178.7 | -76.9 | -85.9 | 0 | 0 | 0 | 111.3 | ||
| 806 | D | 66.8 | Low | 78.7 | Confident | 48.75 Ų | 48.75 | 71.7 Ų | 71.7 | 26% | 0.261 | 35% | 0.348 | S | S | . | . | trans | -128.7 | 147.3 | 176.5 | -170.1 | 3.5 | 0 | 0 | 0 | 107.9 | K795 K804 S808 L809 | K795-D806 WeakPolarHBondContact CE-OD2 3.27Å; K795-D806 VanDerWaalsContact NZ-CG 3.29Å; K795-D806 IonicContact NZ-OD1 3.05Å; K795-D806 PolarHBondContact NZ-OD1 3.21Å; K795-D806 VanDerWaalsContact NZ-OD1 3.15Å; K795-D806 IonicContact NZ-OD2 3.25Å; K795-D806 PolarHBondContact NZ-OD2 3.2Å; K804-D806 WeakPolarHBondContact O-CB 3.31Å; K804-D806 PolarHBondContact O-N 2.83Å; D806-S808 WeakPolarHBondContact CB-OG 3.36Å; D806-S808 VanDerWaalsContact CG-OG 3.3Å; D806-S808 PolarHBondContact O-N 3.13Å; D806-S808 VanDerWaalsContact O-N 3.12Å; D806-S808 PolarHBondContact OD2-OG 2.99Å; D806-L809 WeakPolarHBondContact O-CB 3.19Å; D806-L809 PolarHBondContact O-N 3.14Å | ||
| 807 | E | 73.5 | Confident | 78.4 | Confident | 156.5 Ų | 156.5 | 77.4 Ų | 77.4 | 73% | 0.731 | 37% | 0.373 | S | S | * | . | H | α-helix | trans | -55.3 | -31.1 | 178.8 | -69.4 | 179.2 | 164.9 | 0 | 0 | 111.6 | L809 Q810 V811 | E807-L809 VanDerWaalsContact C-N 3.3Å; E807-L809 PolarHBondContact O-N 3.2Å; E807-Q810 PolarHBondContact O-N 3.1Å; E807-V811 PolarHBondContact O-N 3.35Å |
| 808 | S | 79.5 | Confident | 78.1 | Confident | 8.75 Ų | 8.75 | 79.1 Ų | 79.1 | 6% | 0.061 | 38% | 0.381 | C | S | . | . | H | α-helix | trans | -61.1 | -34.4 | 175.4 | 60.2 | 0 | 0 | 0 | 0 | 113.4 | D806 Q810 V811 V812 | D806-S808 WeakPolarHBondContact CB-OG 3.36Å; D806-S808 VanDerWaalsContact CG-OG 3.3Å; D806-S808 PolarHBondContact O-N 3.13Å; D806-S808 VanDerWaalsContact O-N 3.12Å; D806-S808 PolarHBondContact OD2-OG 2.99Å; S808-Q810 VanDerWaalsContact C-N 3.34Å; S808-Q810 PolarHBondContact O-N 3.4Å; S808-V811 PolarHBondContact O-N 3.25Å; S808-V812 WeakPolarHBondContact O-CB 3.45Å; S808-V812 WeakPolarHBondContact O-CG2 3.35Å; S808-V812 PolarHBondContact O-N 3.24Å |
| 809 | L | 82.9 | Confident | 77.9 | Confident | 26.25 Ų | 26.25 | 75.1 Ų | 75.1 | 14% | 0.137 | 36% | 0.363 | C | S | . | . | H | α-helix | trans | -64.7 | -42.1 | 179.6 | 177 | 61.9 | 0 | 0 | 0 | 110.8 | F796 D806 E807 V811 V812 E813 L830 | F796-L809 HydrophobicContact CD2-CB 4.48Å; F796-L809 HydrophobicContact CD2-CD1 3.92Å; F796-L809 HydrophobicContact CE2-CD1 3.49Å; F796-L809 VanDerWaalsContact CE2-CD1 3.48Å; F796-L809 HydrophobicContact CZ-CD1 4.21Å; D806-L809 WeakPolarHBondContact O-CB 3.19Å; D806-L809 PolarHBondContact O-N 3.14Å; E807-L809 VanDerWaalsContact C-N 3.3Å; E807-L809 PolarHBondContact O-N 3.2Å; L809-V811 VanDerWaalsContact C-N 3.34Å; L809-V811 PolarHBondContact O-N 3.21Å; L809-V812 PolarHBondContact O-N 3.2Å; L809-E813 HydrophobicContact CD1-CG 3.99Å; L809-E813 HydrophobicContact CG-CG 4.25Å; L809-E813 WeakPolarHBondContact O-CB 3.21Å; L809-E813 VanDerWaalsContact O-CG 3.29Å; L809-E813 WeakPolarHBondContact O-CG 3.27Å; L809-E813 PolarHBondContact O-N 3.13Å; L809-L830 HydrophobicContact CD1-CD2 4.32Å |
| 810 | Q | 83.6 | Confident | 77.7 | Confident | 140.75 Ų | 140.75 | 74.6 Ų | 74.6 | 66% | 0.658 | 36% | 0.356 | S | S | * | . | H | α-helix | trans | -61.9 | -45.2 | 179.8 | -64.6 | -178.3 | 4.9 | 0 | 0 | 111.3 | E807 S808 V812 E813 M814 | E807-Q810 PolarHBondContact O-N 3.1Å; S808-Q810 VanDerWaalsContact C-N 3.34Å; S808-Q810 PolarHBondContact O-N 3.4Å; Q810-V812 PolarHBondContact O-N 3.34Å; Q810-E813 PolarHBondContact O-N 3.36Å; Q810-M814 VanDerWaalsContact O-CB 3.26Å; Q810-M814 WeakPolarHBondContact O-CB 3.23Å; Q810-M814 PolarHBondContact O-N 3.13Å |
| 811 | V | 86.8 | Confident | 77.1 | Confident | 47.25 Ų | 47.25 | 73.3 Ų | 73.3 | 29% | 0.286 | 35% | 0.354 | S | S | . | . | H | α-helix | trans | -62 | -44.8 | 176.5 | 176.5 | 0 | 0 | 0 | 0 | 110.9 | Y789 A792 E807 S808 L809 M814 L815 | Y789-V811 HydrophobicContact CD1-CG1 4.26Å; A792-V811 HydrophobicContact CB-CB 4.41Å; A792-V811 HydrophobicContact CB-CG1 4.19Å; E807-V811 PolarHBondContact O-N 3.35Å; S808-V811 PolarHBondContact O-N 3.25Å; L809-V811 VanDerWaalsContact C-N 3.34Å; L809-V811 PolarHBondContact O-N 3.21Å; V811-M814 PolarHBondContact O-N 3.32Å; V811-L815 HydrophobicContact CG1-CD1 3.74Å; V811-L815 VanDerWaalsContact O-CB 3.26Å; V811-L815 WeakPolarHBondContact O-CB 3.45Å; V811-L815 PolarHBondContact O-N 3.12Å |
| 812 | V | 88.6 | Confident | 76.7 | Confident | 0 Ų | 0 | 78.1 Ų | 78.1 | 0% | 0 | 36% | 0.359 | C | S | . | . | H | α-helix | trans | -62.7 | -47.4 | 178.7 | 170.6 | 0 | 0 | 0 | 0 | 111.5 | F793 F796 S808 L809 Q810 T816 L830 V835 | F793-V812 HydrophobicContact CB-CG2 4.38Å; F793-V812 HydrophobicContact CD1-CG1 4.34Å; F793-V812 HydrophobicContact CD1-CG2 4.22Å; F793-V812 HydrophobicContact CD2-CB 4.47Å; F793-V812 HydrophobicContact CD2-CG2 3.62Å; F793-V812 HydrophobicContact CE1-CG1 4.03Å; F793-V812 HydrophobicContact CE1-CG2 4.44Å; F793-V812 HydrophobicContact CE2-CB 4.24Å; F793-V812 HydrophobicContact CE2-CG1 4.49Å; F793-V812 HydrophobicContact CE2-CG2 3.86Å; F793-V812 HydrophobicContact CG-CG2 3.82Å; F793-V812 HydrophobicContact CZ-CB 4.3Å; F793-V812 HydrophobicContact CZ-CG1 4.13Å; F793-V812 HydrophobicContact CZ-CG2 4.26Å; F796-V812 HydrophobicContact CB-CG2 3.88Å; F796-V812 HydrophobicContact CD1-CB 4.46Å; F796-V812 HydrophobicContact CD1-CG1 3.94Å; F796-V812 HydrophobicContact CD1-CG2 4.3Å; F796-V812 HydrophobicContact CE1-CG1 4.17Å; F796-V812 HydrophobicContact CG-CG1 4.38Å; F796-V812 HydrophobicContact CG-CG2 4.14Å; S808-V812 WeakPolarHBondContact O-CB 3.45Å; S808-V812 WeakPolarHBondContact O-CG2 3.35Å; S808-V812 PolarHBondContact O-N 3.24Å; L809-V812 PolarHBondContact O-N 3.2Å; Q810-V812 PolarHBondContact O-N 3.34Å; V812-T816 WeakPolarHBondContact O-CB 3.31Å; V812-T816 PolarHBondContact O-N 3.18Å; V812-T816 PolarHBondContact O-OG1 3.18Å; V812-L830 HydrophobicContact CG1-CD2 4.34Å; V812-V835 HydrophobicContact CG1-CG1 3.82Å; V812-V835 HydrophobicContact CG1-CG2 4.17Å |
| 813 | E | 85.7 | Confident | 76.2 | Confident | 67.25 Ų | 67.25 | 75.4 Ų | 75.4 | 31% | 0.314 | 35% | 0.354 | S | S | . | . | H | α-helix | trans | -62.8 | -44.9 | 178.2 | -71.7 | -163.9 | 179.5 | 0 | 0 | 111.9 | L809 Q810 K817 L830 | L809-E813 HydrophobicContact CD1-CG 3.99Å; L809-E813 HydrophobicContact CG-CG 4.25Å; L809-E813 WeakPolarHBondContact O-CB 3.21Å; L809-E813 VanDerWaalsContact O-CG 3.29Å; L809-E813 WeakPolarHBondContact O-CG 3.27Å; L809-E813 PolarHBondContact O-N 3.13Å; Q810-E813 PolarHBondContact O-N 3.36Å; E813-K817 VanDerWaalsContact O-CB 3.32Å; E813-K817 WeakPolarHBondContact O-CB 3.3Å; E813-K817 WeakPolarHBondContact O-CD 3.05Å; E813-K817 VanDerWaalsContact O-CG 3.25Å; E813-K817 WeakPolarHBondContact O-CG 3.21Å; E813-K817 PolarHBondContact O-N 3.31Å; E813-K817 IonicContact OE2-NZ 3.35Å; E813-K817 PolarHBondContact OE2-NZ 3.13Å; E813-K817 VanDerWaalsContact OE2-NZ 3.09Å; E813-L830 HydrophobicContact CB-CD1 4.32Å; E813-L830 HydrophobicContact CG-CD1 3.84Å; E813-L830 HydrophobicContact CG-CD2 4.23Å; E813-L830 HydrophobicContact CG-CG 4.49Å |
| 814 | M | 86.9 | Confident | 75.8 | Confident | 77.25 Ų | 77.25 | 77.9 Ų | 77.9 | 38% | 0.381 | 37% | 0.371 | S | S | . | . | H | α-helix | trans | -59.8 | -56.4 | 179.7 | -177.4 | -166.2 | 78.1 | 0 | 0 | 110.7 | F652 Q810 V811 T816 K817 Q818 | F652-M814 HydrophobicContact CB-CE 4.43Å; F652-M814 HydrophobicContact CD2-CE 4.37Å; Q810-M814 VanDerWaalsContact O-CB 3.26Å; Q810-M814 WeakPolarHBondContact O-CB 3.23Å; Q810-M814 PolarHBondContact O-N 3.13Å; V811-M814 PolarHBondContact O-N 3.32Å; M814-T816 PolarHBondContact O-N 3.2Å; M814-K817 PolarHBondContact O-N 3.1Å; M814-Q818 VanDerWaalsContact CG-OE1 3.29Å; M814-Q818 WeakPolarHBondContact O-CB 3.33Å; M814-Q818 VanDerWaalsContact O-CG 3.3Å; M814-Q818 WeakPolarHBondContact O-CG 3.33Å; M814-Q818 PolarHBondContact O-N 3.09Å; M814-Q818 PolarHBondContact O-OE1 3.13Å |
| 815 | L | 88.8 | Confident | 75.4 | Confident | 0.25 Ų | 0.25 | 73.7 Ų | 73.7 | 0% | 0.001 | 36% | 0.361 | C | S | . | . | H | α-helix | trans | -64.1 | -40.7 | -178.7 | -108.2 | 140.8 | 0 | 0 | 0 | 112.2 | F652 W707 Y789 F793 V811 K817 Q818 M819 L838 M842 | F652-L815 HydrophobicContact CD1-CD1 4.4Å; F652-L815 HydrophobicContact CD1-CD2 4.38Å; F652-L815 HydrophobicContact CD2-CD1 3.61Å; F652-L815 HydrophobicContact CD2-CD2 3.87Å; F652-L815 HydrophobicContact CD2-CG 4.32Å; F652-L815 HydrophobicContact CE1-CD1 4.22Å; F652-L815 HydrophobicContact CE1-CD2 4.08Å; F652-L815 HydrophobicContact CE2-CD1 3.4Å; F652-L815 VanDerWaalsContact CE2-CD1 3.4Å; F652-L815 HydrophobicContact CE2-CD2 3.49Å; F652-L815 VanDerWaalsContact CE2-CD2 3.41Å; F652-L815 HydrophobicContact CE2-CG 4.26Å; F652-L815 HydrophobicContact CG-CD1 4.12Å; F652-L815 HydrophobicContact CG-CD2 4.3Å; F652-L815 HydrophobicContact CZ-CD1 3.73Å; F652-L815 HydrophobicContact CZ-CD2 3.6Å; W707-L815 HydrophobicContact CH2-CD1 4.46Å; W707-L815 HydrophobicContact CH2-CD2 3.98Å; W707-L815 HydrophobicContact CZ3-CD2 4.18Å; Y789-L815 HydrophobicContact CD1-CD1 3.67Å; Y789-L815 VanDerWaalsContact CD1-CD1 3.46Å; Y789-L815 HydrophobicContact CD2-CD1 4.28Å; Y789-L815 HydrophobicContact CE1-CD1 4.08Å; Y789-L815 HydrophobicContact CG-CD1 3.84Å; F793-L815 HydrophobicContact CE2-CB 3.96Å; F793-L815 HydrophobicContact CE2-CD1 4.03Å; F793-L815 HydrophobicContact CE2-CD2 3.53Å; F793-L815 HydrophobicContact CE2-CG 4.41Å; F793-L815 HydrophobicContact CZ-CB 3.99Å; F793-L815 HydrophobicContact CZ-CD2 3.67Å; V811-L815 HydrophobicContact CG1-CD1 3.74Å; V811-L815 VanDerWaalsContact O-CB 3.26Å; V811-L815 WeakPolarHBondContact O-CB 3.45Å; V811-L815 PolarHBondContact O-N 3.12Å; L815-K817 VanDerWaalsContact C-N 3.32Å; L815-K817 PolarHBondContact O-N 3.41Å; L815-Q818 PolarHBondContact O-N 3.18Å; L815-M819 HydrophobicContact CD2-CE 4.48Å; L815-M819 HydrophobicContact CD2-CG 4.19Å; L815-M819 HydrophobicContact CG-CG 4.15Å; L815-M819 VanDerWaalsContact O-CB 3.28Å; L815-M819 WeakPolarHBondContact O-CB 3.43Å; L815-M819 WeakPolarHBondContact O-CG 3.29Å; L815-M819 PolarHBondContact O-N 3.28Å; L815-L838 HydrophobicContact CD2-CD2 4.01Å; L815-M842 HydrophobicContact CD2-SD 4.36Å |
| 816 | T | 88.1 | Confident | 75 | Confident | 3.75 Ų | 3.75 | 76.2 Ų | 76.2 | 2% | 0.023 | 36% | 0.364 | C | S | . | . | H | α-helix | trans | -63 | -44.6 | 178.3 | -55.3 | 0 | 0 | 0 | 0 | 110.2 | V812 M814 Q818 M819 M820 L830 M834 V835 | V812-T816 WeakPolarHBondContact O-CB 3.31Å; V812-T816 PolarHBondContact O-N 3.18Å; V812-T816 PolarHBondContact O-OG1 3.18Å; M814-T816 PolarHBondContact O-N 3.2Å; T816-Q818 VanDerWaalsContact C-N 3.32Å; T816-Q818 PolarHBondContact O-N 3.31Å; T816-M819 PolarHBondContact O-N 2.91Å; T816-M820 HydrophobicContact CG2-CE 3.81Å; T816-M820 HydrophobicContact CG2-SD 3.89Å; T816-M820 WeakPolarHBondContact O-CB 3.33Å; T816-M820 WeakPolarHBondContact O-CE 3.41Å; T816-M820 WeakPolarHBondContact O-CG 3.34Å; T816-M820 VanDerWaalsContact O-SD 3.36Å; T816-L830 HydrophobicContact CG2-CD1 4.37Å; T816-M834 HydrophobicContact CG2-CB 4.39Å; T816-V835 HydrophobicContact CG2-CG2 4.17Å |
| 817 | K | 82.8 | Confident | 74.3 | Confident | 123.75 Ų | 123.75 | 76.6 Ų | 76.6 | 54% | 0.538 | 38% | 0.38 | S | S | . | . | H | α-helix | trans | -63.9 | -34.3 | 176.5 | -73.6 | 169.3 | -176.5 | 163 | 0 | 112.6 | E813 M814 L815 | E813-K817 VanDerWaalsContact O-CB 3.32Å; E813-K817 WeakPolarHBondContact O-CB 3.3Å; E813-K817 WeakPolarHBondContact O-CD 3.05Å; E813-K817 VanDerWaalsContact O-CG 3.25Å; E813-K817 WeakPolarHBondContact O-CG 3.21Å; E813-K817 PolarHBondContact O-N 3.31Å; E813-K817 IonicContact OE2-NZ 3.35Å; E813-K817 PolarHBondContact OE2-NZ 3.13Å; E813-K817 VanDerWaalsContact OE2-NZ 3.09Å; M814-K817 PolarHBondContact O-N 3.1Å; L815-K817 VanDerWaalsContact C-N 3.32Å; L815-K817 PolarHBondContact O-N 3.41Å |
| 818 | Q | 83.2 | Confident | 73.4 | Confident | 45.75 Ų | 45.75 | 75.1 Ų | 75.1 | 21% | 0.214 | 39% | 0.387 | C | S | . | . | H | α-helix | trans | -86.9 | -22.1 | -176.3 | -72.8 | 173.3 | -3.2 | 0 | 0 | 114.5 | F652 F657 M814 L815 T816 M820 | F652-Q818 HydrophobicContact CB-CB 4.28Å; F652-Q818 HydrophobicContact CB-CG 4.39Å; F652-Q818 PolarHBondContact O-NE2 3.07Å; F652-Q818 PolarHBondContact O-OE1 3.14Å; F657-Q818 VanDerWaalsContact CD1-O 3.27Å; F657-Q818 WeakPolarHBondContact CD1-O 3.43Å; F657-Q818 WeakPolarHBondContact CE1-O 3.32Å; F657-Q818 WeakPolarHBondContact CZ-O 3.32Å; M814-Q818 VanDerWaalsContact CG-OE1 3.29Å; M814-Q818 WeakPolarHBondContact O-CB 3.33Å; M814-Q818 VanDerWaalsContact O-CG 3.3Å; M814-Q818 WeakPolarHBondContact O-CG 3.33Å; M814-Q818 PolarHBondContact O-N 3.09Å; M814-Q818 PolarHBondContact O-OE1 3.13Å; L815-Q818 PolarHBondContact O-N 3.18Å; T816-Q818 VanDerWaalsContact C-N 3.32Å; T816-Q818 PolarHBondContact O-N 3.31Å; Q818-M820 VanDerWaalsContact C-N 3.3Å; Q818-M820 PolarHBondContact O-N 3.28Å |
| 819 | M | 84.3 | Confident | 72.4 | Confident | 0 Ų | 0 | 82.9 Ų | 82.9 | 0% | 0 | 42% | 0.422 | C | S | . | . | S | Bend | trans | -98.2 | 17 | 179.2 | -68.9 | -64.5 | -126 | 0 | 0 | 113 | F652 V704 Y705 W707 S708 L709 L815 T816 L838 | F652-M819 HydrophobicContact CD1-CE 4.17Å; F652-M819 HydrophobicContact CD1-CG 4.41Å; F652-M819 HydrophobicContact CD1-SD 3.84Å; F652-M819 HydrophobicContact CE1-CE 3.47Å; F652-M819 HydrophobicContact CE1-CG 4.22Å; F652-M819 HydrophobicContact CE1-SD 3.82Å; F652-M819 VanDerWaalsContact CE1-SD 3.52Å; F652-M819 HydrophobicContact CZ-CE 3.78Å; V704-M819 HydrophobicContact CG1-CE 3.87Å; Y705-M819 HydrophobicContact CD1-CE 4.33Å; Y705-M819 HydrophobicContact CD1-SD 4.16Å; Y705-M819 HydrophobicContact CE1-CE 4.37Å; Y705-M819 HydrophobicContact CE1-SD 3.97Å; W707-M819 HydrophobicContact CD2-CE 4.29Å; W707-M819 HydrophobicContact CE3-CE 3.77Å; W707-M819 VanDerWaalsContact CE3-CE 3.42Å; W707-M819 HydrophobicContact CH2-CE 3.46Å; W707-M819 VanDerWaalsContact CH2-CE 3.43Å; W707-M819 HydrophobicContact CZ2-CE 4.15Å; W707-M819 HydrophobicContact CZ3-CE 3.26Å; W707-M819 HydrophobicContact CZ3-CG 3.95Å; W707-M819 HydrophobicContact CZ3-SD 4.25Å; S708-M819 PolarHBondContact OG-O 3.24Å; L709-M819 VanDerWaalsContact CB-O 3.31Å; L709-M819 WeakPolarHBondContact CB-O 3.34Å; L709-M819 PolarHBondContact N-O 3.09Å; L815-M819 HydrophobicContact CD2-CE 4.48Å; L815-M819 HydrophobicContact CD2-CG 4.19Å; L815-M819 HydrophobicContact CG-CG 4.15Å; L815-M819 VanDerWaalsContact O-CB 3.28Å; L815-M819 WeakPolarHBondContact O-CB 3.43Å; L815-M819 WeakPolarHBondContact O-CG 3.29Å; L815-M819 PolarHBondContact O-N 3.28Å; T816-M819 PolarHBondContact O-N 2.91Å; M819-L838 HydrophobicContact CB-CD1 4Å; M819-L838 HydrophobicContact CB-CD2 3.99Å; M819-L838 HydrophobicContact CG-CD1 4.38Å; M819-L838 HydrophobicContact CG-CD2 4.45Å |
| 820 | M | 78.3 | Confident | 71.6 | Confident | 33 Ų | 33 | 83.9 Ų | 83.9 | 16% | 0.163 | 43% | 0.427 | C | S | . | . | S | Bend | trans | -118.8 | 149.7 | -179.9 | -76.9 | -175 | 5 | 0 | 0 | 111.5 | L709 T816 Q818 R822 M834 | L709-M820 HydrophobicContact CB-CG 4.33Å; L709-M820 HydrophobicContact CD1-CG 3.97Å; L709-M820 HydrophobicContact CD1-SD 4.38Å; T816-M820 HydrophobicContact CG2-CE 3.81Å; T816-M820 HydrophobicContact CG2-SD 3.89Å; T816-M820 WeakPolarHBondContact O-CB 3.33Å; T816-M820 WeakPolarHBondContact O-CE 3.41Å; T816-M820 WeakPolarHBondContact O-CG 3.34Å; T816-M820 VanDerWaalsContact O-SD 3.36Å; Q818-M820 VanDerWaalsContact C-N 3.3Å; Q818-M820 PolarHBondContact O-N 3.28Å; M820-R822 PolarHBondContact O-N 3.22Å; M820-M834 HydrophobicContact CE-CB 4.45Å; M820-M834 HydrophobicContact CE-CE 3.42Å; M820-M834 VanDerWaalsContact CE-CE 3.48Å; M820-M834 HydrophobicContact CE-CG 3.99Å; M820-M834 HydrophobicContact CE-SD 3.07Å; M820-M834 WeakPolarHBondContact CE-SD 3.38Å; M820-M834 HydrophobicContact SD-CB 4.04Å; M820-M834 HydrophobicContact SD-CE 4.5Å; M820-M834 HydrophobicContact SD-CG 4.19Å; M820-M834 HydrophobicContact SD-SD 3.51Å; M820-M834 VanDerWaalsContact SD-SD 3.63Å |
| 821 | D | 65.9 | Low | 71.4 | Confident | 62.25 Ų | 62.25 | 80.6 Ų | 80.6 | 33% | 0.333 | 41% | 0.414 | S | S | . | . | trans | -67.9 | 119.1 | 168.7 | 176.3 | 11.7 | 0 | 0 | 0 | 110.1 | N823 S824 | D821-N823 PolarHBondContact O-N 3.22Å; D821-N823 VanDerWaalsContact O-N 3.12Å; D821-N823 WeakPolarHBondContact OD1-CB 3.36Å; D821-N823 PolarHBondContact OD1-N 3.05Å; D821-N823 PolarHBondContact OD1-ND2 3.38Å; D821-S824 WeakPolarHBondContact O-CB 3.48Å; D821-S824 PolarHBondContact O-N 3.2Å; D821-S824 VanDerWaalsContact O-N 3.15Å; D821-S824 PolarHBondContact OD2-OG 3.34Å | ||
| 822 | R | 62.3 | Low | 71.4 | Confident | 197.5 Ų | 197.5 | 80.1 Ų | 80.1 | 75% | 0.745 | 41% | 0.41 | S | S | * | . | G | 310 helix | trans | -59.7 | -22.3 | 179.5 | -69.2 | -177.2 | 108.8 | -172.2 | 4 | 112.7 | M820 S824 | M820-R822 PolarHBondContact O-N 3.22Å; R822-S824 PolarHBondContact O-N 3.21Å |
| 823 | N | 56.5 | Low | 71.3 | Confident | 134 Ų | 134 | 84.3 Ų | 84.3 | 72% | 0.717 | 43% | 0.43 | S | S | * | . | G | 310 helix | trans | -73 | -15.5 | 179.6 | -63.4 | -35.6 | 0 | 0 | 0 | 113.2 | H488 D821 | H488-N823 PolarHBondContact NE2-ND2 3.04Å; H488-N823 PolarHBondContact NE2-OD1 3.45Å; D821-N823 PolarHBondContact O-N 3.22Å; D821-N823 VanDerWaalsContact O-N 3.12Å; D821-N823 WeakPolarHBondContact OD1-CB 3.36Å; D821-N823 PolarHBondContact OD1-N 3.05Å; D821-N823 PolarHBondContact OD1-ND2 3.38Å |
| 824 | S | 51.1 | Low | 71.5 | Confident | 78.75 Ų | 78.75 | 83.1 Ų | 83.1 | 55% | 0.551 | 42% | 0.424 | S | S | * | . | G | 310 helix | trans | -91.5 | -8.8 | -164.3 | -92.8 | 0 | 0 | 0 | 0 | 116.9 | D821 R822 | D821-S824 WeakPolarHBondContact O-CB 3.48Å; D821-S824 PolarHBondContact O-N 3.2Å; D821-S824 VanDerWaalsContact O-N 3.15Å; D821-S824 PolarHBondContact OD2-OG 3.34Å; R822-S824 PolarHBondContact O-N 3.21Å |
| 825 | T | 50.1 | Low | 71.7 | Confident | 91.75 Ų | 91.75 | 79.4 Ų | 79.4 | 56% | 0.563 | 41% | 0.406 | S | S | * | . | trans | -165.4 | 133.6 | 172.3 | 16.7 | 0 | 0 | 0 | 0 | 114.7 | G827 | T825-G827 VanDerWaalsContact C-N 3.32Å; T825-G827 PolarHBondContact O-N 3.3Å | ||
| 826 | R | 49.9 | Very low | 71.9 | Confident | 256.25 Ų | 256.25 | 79.4 Ų | 79.4 | 97% | 0.967 | 41% | 0.406 | S | S | * | . | trans | -91.5 | 20.5 | 174.9 | -97.8 | -176.6 | 173.5 | 179.4 | -1.2 | 114.6 | ||||
| 827 | G | 51.4 | Low | 72.1 | Confident | 58.25 Ų | 58.25 | 84.8 Ų | 84.8 | 60% | 0.601 | 43% | 0.429 | S | S | * | . | trans | -102 | 136.4 | -177.5 | 0 | 0 | 0 | 0 | 0 | 113 | T825 E829 | T825-G827 VanDerWaalsContact C-N 3.32Å; T825-G827 PolarHBondContact O-N 3.3Å; G827-E829 VanDerWaalsContact C-N 3.3Å; G827-E829 PolarHBondContact O-N 2.9Å | ||
| 828 | S | 54.2 | Low | 72.7 | Confident | 123.75 Ų | 123.75 | 78.9 Ų | 78.9 | 87% | 0.865 | 40% | 0.403 | S | S | * | . | trans | -78.4 | -7.7 | 177.6 | 54.2 | 0 | 0 | 0 | 0 | 114.4 | ||||
| 829 | E | 58.8 | Low | 73.3 | Confident | 173 Ų | 173 | 76.7 Ų | 76.7 | 81% | 0.808 | 39% | 0.393 | S | S | * | . | S | Bend | trans | -89.2 | 129.9 | -174.9 | -154.4 | 122 | -159.6 | 0 | 0 | 111.3 | G827 N831 | G827-E829 VanDerWaalsContact C-N 3.3Å; G827-E829 PolarHBondContact O-N 2.9Å; E829-N831 PolarHBondContact O-N 3.29Å; E829-N831 VanDerWaalsContact O-N 3.11Å |
| 830 | L | 66.7 | Low | 73.8 | Confident | 47.5 Ų | 47.5 | 77 Ų | 77 | 25% | 0.249 | 40% | 0.396 | C | S | . | . | trans | -60.5 | 111.3 | 177.9 | -167.2 | 83.4 | 0 | 0 | 0 | 109.9 | F796 L809 V812 E813 T816 L832 V835 | F796-L830 HydrophobicContact CE1-CD2 4.12Å; F796-L830 HydrophobicContact CE2-CD2 4.46Å; F796-L830 HydrophobicContact CZ-CD2 3.8Å; L809-L830 HydrophobicContact CD1-CD2 4.32Å; V812-L830 HydrophobicContact CG1-CD2 4.34Å; E813-L830 HydrophobicContact CB-CD1 4.32Å; E813-L830 HydrophobicContact CG-CD1 3.84Å; E813-L830 HydrophobicContact CG-CD2 4.23Å; E813-L830 HydrophobicContact CG-CG 4.49Å; T816-L830 HydrophobicContact CG2-CD1 4.37Å; L830-L832 PolarHBondContact O-N 3.25Å; L830-L832 VanDerWaalsContact O-N 3.14Å; L830-V835 HydrophobicContact CD1-CG2 4.07Å; L830-V835 HydrophobicContact CD2-CG2 3.77Å; L830-V835 HydrophobicContact CG-CG2 3.86Å | ||
| 831 | N | 79.8 | Confident | 74.7 | Confident | 71.25 Ų | 71.25 | 76.3 Ų | 76.3 | 38% | 0.381 | 39% | 0.393 | S | S | . | . | trans | -76.7 | 103.5 | 179.3 | -174 | -24.1 | 0 | 0 | 0 | 110.3 | E829 Q833 M834 V835 | E829-N831 PolarHBondContact O-N 3.29Å; E829-N831 VanDerWaalsContact O-N 3.11Å; N831-Q833 PolarHBondContact O-N 3.21Å; N831-Q833 VanDerWaalsContact O-N 3.13Å; N831-Q833 WeakPolarHBondContact OD1-CB 3.42Å; N831-Q833 PolarHBondContact OD1-N 3Å; N831-Q833 VanDerWaalsContact OD1-N 3.12Å; N831-M834 HydrophobicContact CB-CB 4.24Å; N831-M834 HydrophobicContact CB-CG 4Å; N831-M834 HydrophobicContact CB-SD 3.52Å; N831-M834 WeakPolarHBondContact CB-SD 3.43Å; N831-M834 VanDerWaalsContact CG-SD 3.57Å; N831-M834 PolarHBondContact ND2-SD 3.28Å; N831-M834 VanDerWaalsContact ND2-SD 3.41Å; N831-M834 WeakPolarHBondContact O-CA 3.38Å; N831-M834 WeakPolarHBondContact O-CB 3.29Å; N831-M834 PolarHBondContact O-N 3.34Å; N831-V835 PolarHBondContact O-N 3.09Å; N831-V835 VanDerWaalsContact O-N 3.16Å | ||
| 832 | L | 85.4 | Confident | 76.1 | Confident | 36.75 Ų | 36.75 | 73.3 Ų | 73.3 | 19% | 0.192 | 38% | 0.377 | C | S | . | . | H | α-helix | trans | -51.2 | -37.4 | -179.8 | -177.9 | 65.8 | 0 | 0 | 0 | 113.1 | L797 F800 L830 M834 V835 I836 E916 | L797-L832 HydrophobicContact CD2-CD1 3.99Å; F800-L832 HydrophobicContact CD1-CD1 4.13Å; F800-L832 HydrophobicContact CD1-CD2 3.92Å; F800-L832 HydrophobicContact CD2-CD1 4.25Å; F800-L832 HydrophobicContact CE1-CD1 4.2Å; F800-L832 HydrophobicContact CE1-CD2 3.48Å; F800-L832 VanDerWaalsContact CE1-CD2 3.46Å; F800-L832 HydrophobicContact CE1-CG 4.39Å; F800-L832 HydrophobicContact CE2-CD1 4.31Å; F800-L832 HydrophobicContact CG-CD1 4.16Å; F800-L832 HydrophobicContact CZ-CD1 4.29Å; F800-L832 HydrophobicContact CZ-CD2 3.95Å; F800-L832 HydrophobicContact CZ-CG 4.47Å; L830-L832 PolarHBondContact O-N 3.25Å; L830-L832 VanDerWaalsContact O-N 3.14Å; L832-M834 VanDerWaalsContact C-N 3.28Å; L832-M834 PolarHBondContact O-N 3.25Å; L832-V835 WeakPolarHBondContact O-CB 3.42Å; L832-V835 PolarHBondContact O-N 3.26Å; L832-I836 HydrophobicContact CD1-CD1 4.26Å; L832-I836 HydrophobicContact CD1-CG1 4.48Å; L832-I836 HydrophobicContact CD2-CD1 4.39Å; L832-I836 HydrophobicContact CG-CD1 3.94Å; L832-I836 HydrophobicContact CG-CG1 4.47Å; L832-I836 WeakPolarHBondContact O-CD1 3.47Å; L832-I836 WeakPolarHBondContact O-CG1 3.32Å; L832-I836 PolarHBondContact O-N 3.28Å; L832-E916 WeakPolarHBondContact CD2-OE2 3.42Å; L832-E916 WeakPolarHBondContact CG-OE2 3.45Å |
| 833 | Q | 87.9 | Confident | 77.8 | Confident | 89 Ų | 89 | 63.9 Ų | 63.9 | 42% | 0.416 | 34% | 0.341 | S | S | . | . | H | α-helix | trans | -64.6 | -33.2 | 178.1 | -68.9 | -62.2 | -43.9 | 0 | 0 | 112.4 | N831 K837 E916 | N831-Q833 PolarHBondContact O-N 3.21Å; N831-Q833 VanDerWaalsContact O-N 3.13Å; N831-Q833 WeakPolarHBondContact OD1-CB 3.42Å; N831-Q833 PolarHBondContact OD1-N 3Å; N831-Q833 VanDerWaalsContact OD1-N 3.12Å; Q833-K837 WeakPolarHBondContact O-CB 3.18Å; Q833-K837 VanDerWaalsContact O-CG 3.27Å; Q833-K837 WeakPolarHBondContact O-CG 3.44Å; Q833-K837 PolarHBondContact O-N 3.21Å; Q833-K837 VanDerWaalsContact O-N 3.09Å; Q833-E916 PolarHBondContact NE2-OE1 3.03Å |
| 834 | M | 88.2 | Confident | 79.7 | Confident | 41.25 Ų | 41.25 | 57.6 Ų | 57.6 | 20% | 0.203 | 31% | 0.307 | C | S | . | . | H | α-helix | trans | -72.5 | -41.5 | 175.8 | -67.2 | 165.4 | 168.5 | 0 | 0 | 110.9 | L709 T816 M820 N831 L832 I836 K837 L838 | L709-M834 HydrophobicContact CD1-CB 4.2Å; T816-M834 HydrophobicContact CG2-CB 4.39Å; M820-M834 HydrophobicContact CE-CB 4.45Å; M820-M834 HydrophobicContact CE-CE 3.42Å; M820-M834 VanDerWaalsContact CE-CE 3.48Å; M820-M834 HydrophobicContact CE-CG 3.99Å; M820-M834 HydrophobicContact CE-SD 3.07Å; M820-M834 WeakPolarHBondContact CE-SD 3.38Å; M820-M834 HydrophobicContact SD-CB 4.04Å; M820-M834 HydrophobicContact SD-CE 4.5Å; M820-M834 HydrophobicContact SD-CG 4.19Å; M820-M834 HydrophobicContact SD-SD 3.51Å; M820-M834 VanDerWaalsContact SD-SD 3.63Å; N831-M834 HydrophobicContact CB-CB 4.24Å; N831-M834 HydrophobicContact CB-CG 4Å; N831-M834 HydrophobicContact CB-SD 3.52Å; N831-M834 WeakPolarHBondContact CB-SD 3.43Å; N831-M834 VanDerWaalsContact CG-SD 3.57Å; N831-M834 PolarHBondContact ND2-SD 3.28Å; N831-M834 VanDerWaalsContact ND2-SD 3.41Å; N831-M834 WeakPolarHBondContact O-CA 3.38Å; N831-M834 WeakPolarHBondContact O-CB 3.29Å; N831-M834 PolarHBondContact O-N 3.34Å; L832-M834 VanDerWaalsContact C-N 3.28Å; L832-M834 PolarHBondContact O-N 3.25Å; M834-I836 VanDerWaalsContact C-N 3.29Å; M834-I836 PolarHBondContact O-N 3.16Å; M834-K837 PolarHBondContact O-N 3.12Å; M834-L838 WeakPolarHBondContact O-CB 3.4Å; M834-L838 PolarHBondContact O-N 3.19Å |
| 835 | V | 91.6 | Very high | 81.9 | Confident | 0 Ų | 0 | 53.8 Ų | 53.8 | 0% | 0 | 28% | 0.281 | C | S | . | . | H | α-helix | trans | -56.3 | -45.6 | 173.9 | 179.7 | 0 | 0 | 0 | 0 | 110.7 | F793 F796 L797 V812 T816 L830 N831 L832 L838 W839 | F793-V835 HydrophobicContact CD1-CG1 3.74Å; F793-V835 HydrophobicContact CE1-CG1 3.85Å; F796-V835 HydrophobicContact CD1-CG1 4.13Å; F796-V835 HydrophobicContact CE1-CG1 4.06Å; L797-V835 HydrophobicContact CD2-CG1 4Å; L797-V835 HydrophobicContact CG-CG1 4.45Å; V812-V835 HydrophobicContact CG1-CG1 3.82Å; V812-V835 HydrophobicContact CG1-CG2 4.17Å; T816-V835 HydrophobicContact CG2-CG2 4.17Å; L830-V835 HydrophobicContact CD1-CG2 4.07Å; L830-V835 HydrophobicContact CD2-CG2 3.77Å; L830-V835 HydrophobicContact CG-CG2 3.86Å; N831-V835 PolarHBondContact O-N 3.09Å; N831-V835 VanDerWaalsContact O-N 3.16Å; L832-V835 WeakPolarHBondContact O-CB 3.42Å; L832-V835 PolarHBondContact O-N 3.26Å; V835-L838 PolarHBondContact O-N 3.33Å; V835-W839 VanDerWaalsContact O-CB 3.3Å; V835-W839 WeakPolarHBondContact O-CB 3.29Å; V835-W839 PolarHBondContact O-N 3.06Å |
| 836 | I | 93.1 | Very high | 84.1 | Confident | 0.75 Ų | 0.75 | 49.5 Ų | 49.5 | 0% | 0.004 | 25% | 0.254 | C | S | . | . | H | α-helix | trans | -67.7 | -39.8 | 179.9 | -67.6 | 166.7 | 0 | 0 | 0 | 111.9 | L797 L832 M834 W839 A840 E916 S918 I919 | L797-I836 HydrophobicContact CD1-CG1 4.42Å; L797-I836 HydrophobicContact CD2-CD1 4.41Å; L797-I836 HydrophobicContact CD2-CG1 3.86Å; L832-I836 HydrophobicContact CD1-CD1 4.26Å; L832-I836 HydrophobicContact CD1-CG1 4.48Å; L832-I836 HydrophobicContact CD2-CD1 4.39Å; L832-I836 HydrophobicContact CG-CD1 3.94Å; L832-I836 HydrophobicContact CG-CG1 4.47Å; L832-I836 WeakPolarHBondContact O-CD1 3.47Å; L832-I836 WeakPolarHBondContact O-CG1 3.32Å; L832-I836 PolarHBondContact O-N 3.28Å; M834-I836 VanDerWaalsContact C-N 3.29Å; M834-I836 PolarHBondContact O-N 3.16Å; I836-W839 PolarHBondContact O-N 3.14Å; I836-A840 VanDerWaalsContact O-CB 3.29Å; I836-A840 WeakPolarHBondContact O-CB 3.39Å; I836-A840 PolarHBondContact O-N 3.04Å; I836-E916 HydrophobicContact CD1-CB 4.2Å; I836-E916 HydrophobicContact CD1-CG 4.31Å; I836-E916 WeakPolarHBondContact CD1-OE1 3.33Å; I836-E916 WeakPolarHBondContact CD1-OE2 3.27Å; I836-S918 WeakPolarHBondContact CD1-OG 3.35Å; I836-S918 WeakPolarHBondContact CG2-OG 3.47Å; I836-I919 HydrophobicContact CD1-CD1 4.17Å; I836-I919 HydrophobicContact CD1-CG1 3.94Å; I836-I919 HydrophobicContact CG1-CD1 4.35Å; I836-I919 HydrophobicContact CG1-CG1 4.11Å; I836-I919 HydrophobicContact CG2-CG1 4.19Å |
| 837 | K | 92.9 | Very high | 86.3 | Confident | 115.25 Ų | 115.25 | 37.3 Ų | 37.3 | 50% | 0.501 | 21% | 0.208 | S | C | . | . | H | α-helix | trans | -62.9 | -44.4 | 175.5 | -76.3 | 173.5 | -179 | -179.6 | 0 | 111.8 | L709 Q833 M834 A840 N841 | L709-K837 HydrophobicContact CD2-CB 3.87Å; Q833-K837 WeakPolarHBondContact O-CB 3.18Å; Q833-K837 VanDerWaalsContact O-CG 3.27Å; Q833-K837 WeakPolarHBondContact O-CG 3.44Å; Q833-K837 PolarHBondContact O-N 3.21Å; Q833-K837 VanDerWaalsContact O-N 3.09Å; M834-K837 PolarHBondContact O-N 3.12Å; K837-A840 PolarHBondContact O-N 3.12Å; K837-N841 PolarHBondContact O-N 3.2Å; K837-N841 PolarHBondContact O-OD1 3.08Å |
| 838 | L | 94.4 | Very high | 88.3 | Confident | 0 Ų | 0 | 34.5 Ų | 34.5 | 0% | 0 | 18% | 0.18 | C | C | . | . | H | α-helix | trans | -64.6 | -44.8 | 177.9 | -173.8 | 59.2 | 0 | 0 | 0 | 110.8 | W707 L709 F793 L815 M819 M834 V835 A840 N841 M842 | W707-L838 HydrophobicContact CE3-CD1 3.62Å; W707-L838 HydrophobicContact CZ3-CD1 3.85Å; W707-L838 HydrophobicContact CZ3-CG 4.47Å; W707-L838 WeakPolarHBondContact O-CD1 3.16Å; L709-L838 HydrophobicContact CD1-CB 4.19Å; L709-L838 HydrophobicContact CD2-CB 4.42Å; L709-L838 HydrophobicContact CG-CB 4.29Å; L709-L838 HydrophobicContact CG-CD1 4.21Å; F793-L838 HydrophobicContact CE1-CB 4.41Å; F793-L838 HydrophobicContact CE1-CD2 3.97Å; F793-L838 HydrophobicContact CE1-CG 4.32Å; F793-L838 HydrophobicContact CZ-CD2 3.83Å; F793-L838 HydrophobicContact CZ-CG 4.46Å; L815-L838 HydrophobicContact CD2-CD2 4.01Å; M819-L838 HydrophobicContact CB-CD1 4Å; M819-L838 HydrophobicContact CB-CD2 3.99Å; M819-L838 HydrophobicContact CG-CD1 4.38Å; M819-L838 HydrophobicContact CG-CD2 4.45Å; M834-L838 WeakPolarHBondContact O-CB 3.4Å; M834-L838 PolarHBondContact O-N 3.19Å; V835-L838 PolarHBondContact O-N 3.33Å; L838-A840 VanDerWaalsContact C-N 3.32Å; L838-A840 PolarHBondContact O-N 3.24Å; L838-N841 PolarHBondContact O-N 3.07Å; L838-M842 HydrophobicContact CG-CE 4.36Å; L838-M842 WeakPolarHBondContact O-CG 3.25Å; L838-M842 PolarHBondContact O-N 3.18Å |
| 839 | W | 95.9 | Very high | 90.2 | Very high | 1 Ų | 1 | 28.6 Ų | 28.6 | 0% | 0.004 | 14% | 0.138 | C | C | . | . | H | α-helix | trans | -58.7 | -41.4 | 173.3 | 176.2 | 83.1 | 0 | 0 | 0 | 112.7 | W790 F793 T794 L797 V835 I836 M842 T843 L907 I919 H922 V923 | W790-W839 AromaticContact CD1-CD1 3.73Å; W790-W839 AromaticContact CD1-NE1 3.54Å; W790-W839 AromaticContact CE2-NE1 3.63Å; W790-W839 HydrophobicContact CZ2-CZ2 4.1Å; W790-W839 AromaticContact NE1-CD1 3.77Å; W790-W839 AromaticContact NE1-CE2 3.5Å; W790-W839 AromaticContact NE1-CZ2 3.78Å; W790-W839 AromaticContact NE1-NE1 3.11Å; W790-W839 VanDerWaalsContact NE1-NE1 3.11Å; F793-W839 HydrophobicContact CB-CB 4.42Å; F793-W839 HydrophobicContact CB-CG 4.42Å; F793-W839 HydrophobicContact CD1-CB 4.11Å; T794-W839 PolarHBondContact OG1-NE1 3.09Å; L797-W839 HydrophobicContact CD1-CB 3.96Å; L797-W839 HydrophobicContact CD1-CD2 3.86Å; L797-W839 HydrophobicContact CD1-CE3 4.43Å; L797-W839 HydrophobicContact CD1-CG 3.61Å; V835-W839 VanDerWaalsContact O-CB 3.3Å; V835-W839 WeakPolarHBondContact O-CB 3.29Å; V835-W839 PolarHBondContact O-N 3.06Å; I836-W839 PolarHBondContact O-N 3.14Å; W839-M842 HydrophobicContact CB-CE 4.45Å; W839-M842 PolarHBondContact O-N 3.11Å; W839-T843 WeakPolarHBondContact O-CB 3.43Å; W839-T843 PolarHBondContact O-N 3.27Å; W839-T843 PolarHBondContact O-OG1 3Å; W839-L907 HydrophobicContact CH2-CD1 4.01Å; W839-L907 HydrophobicContact CZ2-CD1 3.55Å; W839-I919 HydrophobicContact CE3-CG2 4.45Å; W839-I919 HydrophobicContact CH2-CG2 3.72Å; W839-I919 HydrophobicContact CZ2-CG2 4.37Å; W839-I919 HydrophobicContact CZ3-CB 4.47Å; W839-I919 HydrophobicContact CZ3-CG2 3.76Å; W839-H922 HydrophobicContact CZ3-CB 4.16Å; W839-V923 HydrophobicContact CH2-CG2 3.64Å; W839-V923 HydrophobicContact CZ3-CG2 4.45Å |
| 840 | A | 95.9 | Very high | 91.7 | Very high | 6.25 Ų | 6.25 | 20.4 Ų | 20.4 | 5% | 0.052 | 10% | 0.1 | C | C | . | . | H | α-helix | trans | -66 | -40.3 | 176.8 | 0 | 0 | 0 | 0 | 0 | 112.1 | I836 K837 L838 T843 G844 H922 L926 | I836-A840 VanDerWaalsContact O-CB 3.29Å; I836-A840 WeakPolarHBondContact O-CB 3.39Å; I836-A840 PolarHBondContact O-N 3.04Å; K837-A840 PolarHBondContact O-N 3.12Å; L838-A840 VanDerWaalsContact C-N 3.32Å; L838-A840 PolarHBondContact O-N 3.24Å; A840-T843 PolarHBondContact O-N 3.29Å; A840-G844 PolarHBondContact O-N 3.28Å; A840-H922 HydrophobicContact CB-CB 4.17Å; A840-H922 VanDerWaalsContact CB-CD2 3.45Å; A840-H922 WeakPolarHBondContact CB-CD2 3.38Å; A840-L926 HydrophobicContact CB-CD1 4.46Å; A840-L926 WeakPolarHBondContact O-CD1 3.4Å |
| 841 | N | 96 | Very high | 92.7 | Very high | 18 Ų | 18 | 18.1 Ų | 18.1 | 10% | 0.096 | 9% | 0.088 | C | C | . | . | H | α-helix | trans | -62.5 | -46 | 174.4 | -71.5 | -2.5 | 0 | 0 | 0 | 111.5 | W707 R758 Q762 K837 L838 T843 G844 F845 | W707-N841 HydrophobicContact CB-CB 3.72Å; W707-N841 WeakPolarHBondContact O-CB 3.39Å; W707-N841 PolarHBondContact O-ND2 3.31Å; W707-N841 VanDerWaalsContact O-ND2 3.08Å; R758-N841 PolarHBondContact NH2-ND2 3.09Å; Q762-N841 WeakPolarHBondContact CG-OD1 3.27Å; K837-N841 PolarHBondContact O-N 3.2Å; K837-N841 PolarHBondContact O-OD1 3.08Å; L838-N841 PolarHBondContact O-N 3.07Å; N841-T843 VanDerWaalsContact C-N 3.33Å; N841-T843 PolarHBondContact O-N 2.94Å; N841-G844 PolarHBondContact O-N 3.18Å; N841-F845 PolarHBondContact O-N 3.11Å |
| 842 | M | 97.1 | Very high | 92.9 | Very high | 0 Ų | 0 | 14.7 Ų | 14.7 | 0% | 0 | 7% | 0.07 | C | C | . | . | H | α-helix | trans | -59.9 | -43.6 | 174.7 | -70.7 | -173.1 | -69.8 | 0 | 0 | 111.4 | W707 T786 F793 L815 L838 W839 G844 F845 L846 | W707-M842 HydrophobicContact CD2-CG 3.72Å; W707-M842 HydrophobicContact CE3-CG 3.68Å; W707-M842 HydrophobicContact CE3-SD 4.3Å; W707-M842 HydrophobicContact CG-CG 4.17Å; W707-M842 HydrophobicContact CH2-CG 4.42Å; W707-M842 HydrophobicContact CH2-SD 4.14Å; W707-M842 HydrophobicContact CZ2-CG 4.44Å; W707-M842 HydrophobicContact CZ2-SD 4.47Å; W707-M842 HydrophobicContact CZ3-CG 4.03Å; W707-M842 HydrophobicContact CZ3-SD 4.02Å; T786-M842 HydrophobicContact CG2-CB 3.84Å; T786-M842 HydrophobicContact CG2-CG 3.87Å; T786-M842 HydrophobicContact CG2-SD 4.37Å; F793-M842 HydrophobicContact CB-CE 4.17Å; F793-M842 HydrophobicContact CD1-CE 3.8Å; F793-M842 HydrophobicContact CD2-CE 3.81Å; F793-M842 HydrophobicContact CE1-CE 4.1Å; F793-M842 HydrophobicContact CE2-CE 4.1Å; F793-M842 HydrophobicContact CG-CE 3.65Å; F793-M842 HydrophobicContact CZ-CE 4.24Å; L815-M842 HydrophobicContact CD2-SD 4.36Å; L838-M842 HydrophobicContact CG-CE 4.36Å; L838-M842 WeakPolarHBondContact O-CG 3.25Å; L838-M842 PolarHBondContact O-N 3.18Å; W839-M842 HydrophobicContact CB-CE 4.45Å; W839-M842 PolarHBondContact O-N 3.11Å; M842-G844 VanDerWaalsContact C-N 3.34Å; M842-G844 PolarHBondContact O-N 3.22Å; M842-F845 WeakPolarHBondContact O-CB 3.31Å; M842-F845 PolarHBondContact O-N 3.14Å; M842-L846 VanDerWaalsContact O-CG 3.3Å; M842-L846 WeakPolarHBondContact O-CG 3.3Å; M842-L846 PolarHBondContact O-N 3.14Å |
| 843 | T | 97.1 | Very high | 92.9 | Very high | 0 Ų | 0 | 13.1 Ų | 13.1 | 0% | 0 | 6% | 0.062 | C | C | . | . | H | α-helix | trans | -60.8 | -43.8 | 177.2 | -53 | 0 | 0 | 0 | 0 | 111.2 | W790 W839 A840 N841 F845 L846 C847 F900 L904 L926 | W790-T843 PolarHBondContact NE1-OG1 3.02Å; W839-T843 WeakPolarHBondContact O-CB 3.43Å; W839-T843 PolarHBondContact O-N 3.27Å; W839-T843 PolarHBondContact O-OG1 3Å; A840-T843 PolarHBondContact O-N 3.29Å; N841-T843 VanDerWaalsContact C-N 3.33Å; N841-T843 PolarHBondContact O-N 2.94Å; T843-F845 PolarHBondContact O-N 2.79Å; T843-L846 PolarHBondContact O-N 3.08Å; T843-C847 WeakPolarHBondContact O-CB 3.4Å; T843-C847 PolarHBondContact O-N 2.93Å; T843-C847 PolarHBondContact O-SG 3.15Å; T843-C847 VanDerWaalsContact O-SG 3.32Å; T843-F900 HydrophobicContact CG2-CZ 4.45Å; T843-L904 HydrophobicContact CG2-CD1 3.76Å; T843-L904 HydrophobicContact CG2-CD2 4.45Å; T843-L926 HydrophobicContact CG2-CB 4.48Å; T843-L926 HydrophobicContact CG2-CD1 3.59Å |
| 844 | G | 96.5 | Very high | 92.5 | Very high | 0 Ų | 0 | 9.7 Ų | 9.7 | 0% | 0 | 5% | 0.046 | C | C | . | . | H | α-helix | trans | -62.9 | -42.4 | 176.8 | 0 | 0 | 0 | 0 | 0 | 112.7 | A840 N841 M842 C847 A848 | A840-G844 PolarHBondContact O-N 3.28Å; N841-G844 PolarHBondContact O-N 3.18Å; M842-G844 VanDerWaalsContact C-N 3.34Å; M842-G844 PolarHBondContact O-N 3.22Å; G844-C847 PolarHBondContact O-N 3.21Å; G844-A848 VanDerWaalsContact O-CB 3.29Å; G844-A848 WeakPolarHBondContact O-CB 3.38Å; G844-A848 PolarHBondContact O-N 3.03Å |
| 845 | F | 96.8 | Very high | 91.5 | Very high | 0.5 Ų | 0.5 | 11 Ų | 11 | 0% | 0.002 | 5% | 0.052 | C | C | . | . | H | α-helix | trans | -58.5 | -51.2 | 173.6 | 176.3 | -95.5 | 0 | 0 | 0 | 111.6 | F703 W707 L769 A782 T786 N841 M842 T843 C847 A848 T849 | F703-F845 HydrophobicContact CB-CE2 4.04Å; F703-F845 HydrophobicContact CB-CZ 4.02Å; F703-F845 AromaticContact CD1-CE2 3.9Å; F703-F845 HydrophobicContact CD1-CE2 3.9Å; F703-F845 HydrophobicContact CD1-CZ 4.35Å; F703-F845 HydrophobicContact CG-CE2 4.35Å; F703-F845 HydrophobicContact CG-CZ 4.44Å; W707-F845 AromaticContact CD1-CG 3.91Å; L769-F845 HydrophobicContact CD1-CD2 3.59Å; L769-F845 HydrophobicContact CD1-CE2 4.16Å; L769-F845 HydrophobicContact CD2-CE2 4.42Å; A782-F845 HydrophobicContact CB-CZ 4.14Å; T786-F845 HydrophobicContact CG2-CD1 3.88Å; T786-F845 HydrophobicContact CG2-CE1 4.45Å; N841-F845 PolarHBondContact O-N 3.11Å; M842-F845 WeakPolarHBondContact O-CB 3.31Å; M842-F845 PolarHBondContact O-N 3.14Å; T843-F845 PolarHBondContact O-N 2.79Å; F845-C847 VanDerWaalsContact C-N 3.34Å; F845-C847 PolarHBondContact O-N 3.05Å; F845-A848 PolarHBondContact O-N 3.13Å; F845-A848 VanDerWaalsContact O-N 3.13Å; F845-T849 HydrophobicContact CD2-CG2 4.33Å; F845-T849 HydrophobicContact CE2-CG2 4.01Å; F845-T849 HydrophobicContact CZ-CG2 4.28Å; F845-T849 PolarHBondContact O-N 3.28Å; F845-T849 PolarHBondContact O-OG1 3.13Å |
| 846 | L | 96.5 | Very high | 89.6 | Confident | 0 Ų | 0 | 12.9 Ų | 12.9 | 0% | 0 | 6% | 0.064 | C | C | . | . | H | α-helix | trans | -62.2 | -40.2 | -179.6 | -67.5 | 171.4 | 0 | 0 | 0 | 112.4 | W783 T786 Y787 W790 M842 T843 G850 F900 | W783-L846 HydrophobicContact CD2-CD2 3.91Å; W783-L846 HydrophobicContact CG-CD2 3.97Å; W783-L846 HydrophobicContact CZ2-CD2 4.11Å; W783-L846 PolarHBondContact NE1-O 3.13Å; W783-L846 WeakPolarHBondContact O-CD2 3.47Å; T786-L846 HydrophobicContact CG2-CD1 4.4Å; T786-L846 HydrophobicContact CG2-CD2 4.11Å; T786-L846 HydrophobicContact CG2-CG 4.06Å; Y787-L846 HydrophobicContact CD2-CD1 4.4Å; W790-L846 HydrophobicContact CB-CD1 3.68Å; W790-L846 HydrophobicContact CD2-CD1 4.18Å; W790-L846 HydrophobicContact CG-CD1 3.66Å; M842-L846 VanDerWaalsContact O-CG 3.3Å; M842-L846 WeakPolarHBondContact O-CG 3.3Å; M842-L846 PolarHBondContact O-N 3.14Å; T843-L846 PolarHBondContact O-N 3.08Å; L846-G850 WeakPolarHBondContact O-CA 3.43Å; L846-G850 PolarHBondContact O-N 3.1Å; L846-F900 HydrophobicContact CB-CD1 4.47Å; L846-F900 HydrophobicContact CB-CD2 4.41Å; L846-F900 HydrophobicContact CB-CE1 3.92Å; L846-F900 HydrophobicContact CB-CE2 3.83Å; L846-F900 HydrophobicContact CB-CZ 3.53Å; L846-F900 VanDerWaalsContact CB-CZ 3.48Å; L846-F900 HydrophobicContact CD1-CD2 3.97Å; L846-F900 HydrophobicContact CD1-CE2 3.65Å; L846-F900 HydrophobicContact CD1-CZ 4.25Å; L846-F900 HydrophobicContact CG-CE2 4.4Å |
| 847 | C | 95.6 | Very high | 87.2 | Confident | 0 Ų | 0 | 15 Ų | 15 | 0% | 0 | 8% | 0.078 | C | C | . | . | H | α-helix | trans | -63.4 | -42.6 | 174.7 | -74.2 | 0 | 0 | 0 | 0 | 112.4 | T843 G844 F845 E930 L931 H932 | T843-C847 WeakPolarHBondContact O-CB 3.4Å; T843-C847 PolarHBondContact O-N 2.93Å; T843-C847 PolarHBondContact O-SG 3.15Å; T843-C847 VanDerWaalsContact O-SG 3.32Å; G844-C847 PolarHBondContact O-N 3.21Å; F845-C847 VanDerWaalsContact C-N 3.34Å; F845-C847 PolarHBondContact O-N 3.05Å; C847-E930 CarbonylContact C-O 3.51Å; C847-E930 VanDerWaalsContact C-O 3.27Å; C847-E930 HydrophobicContact CB-CB 4.27Å; C847-E930 WeakPolarHBondContact CB-O 3.44Å; C847-L931 HydrophobicContact CB-CD1 4.49Å; C847-H932 WeakPolarHBondContact O-CB 3.31Å; C847-H932 PolarHBondContact O-N 3.25Å |
| 848 | A | 94.1 | Very high | 84.5 | Confident | 0 Ų | 0 | 14.2 Ų | 14.2 | 0% | 0 | 8% | 0.083 | C | C | . | . | H | α-helix | trans | -74.6 | -32.9 | -175.4 | 0 | 0 | 0 | 0 | 0 | 113.1 | N766 L769 K770 G844 F845 E930 H932 | N766-A848 HydrophobicContact CB-CB 4.49Å; L769-A848 HydrophobicContact CB-CB 3.7Å; K770-A848 HydrophobicContact CG-CB 3.73Å; G844-A848 VanDerWaalsContact O-CB 3.29Å; G844-A848 WeakPolarHBondContact O-CB 3.38Å; G844-A848 PolarHBondContact O-N 3.03Å; F845-A848 PolarHBondContact O-N 3.13Å; F845-A848 VanDerWaalsContact O-N 3.13Å; A848-E930 WeakPolarHBondContact CA-O 3.37Å; A848-E930 PolarHBondContact N-O 3.28Å; A848-H932 PolarHBondContact O-CD2 3.37Å; A848-H932 VanDerWaalsContact O-CD2 3.29Å |
| 849 | T | 93.2 | Very high | 81.5 | Confident | 0 Ų | 0 | 19.4 Ų | 19.4 | 0% | 0 | 12% | 0.119 | C | C | . | . | H | α-helix | trans | -107.1 | -15.8 | -173.4 | 56 | 0 | 0 | 0 | 0 | 114.3 | L769 L772 W783 F845 G851 V852 V853 | L769-T849 HydrophobicContact CB-CG2 3.95Å; L769-T849 HydrophobicContact CD1-CG2 4.28Å; L769-T849 HydrophobicContact CD2-CG2 3.92Å; L769-T849 HydrophobicContact CG-CG2 4.27Å; L772-T849 HydrophobicContact CD1-CG2 4.21Å; W783-T849 VanDerWaalsContact CD1-OG1 3.25Å; F845-T849 HydrophobicContact CD2-CG2 4.33Å; F845-T849 HydrophobicContact CE2-CG2 4.01Å; F845-T849 HydrophobicContact CZ-CG2 4.28Å; F845-T849 PolarHBondContact O-N 3.28Å; F845-T849 PolarHBondContact O-OG1 3.13Å; T849-G851 PolarHBondContact O-N 3.1Å; T849-G851 VanDerWaalsContact O-N 3.11Å; T849-V852 VanDerWaalsContact O-CB 3.3Å; T849-V852 WeakPolarHBondContact O-CB 3.46Å; T849-V852 PolarHBondContact O-N 3.16Å; T849-V853 PolarHBondContact O-N 3.28Å |
| 850 | G | 91.1 | Very high | 78.4 | Confident | 0 Ų | 0 | 23.1 Ų | 23.1 | 0% | 0 | 15% | 0.145 | C | C | . | . | H | α-helix | trans | -60.2 | -27.6 | -176.5 | 0 | 0 | 0 | 0 | 0 | 114.1 | W783 L846 V853 L854 | W783-G850 VanDerWaalsContact NE1-CA 3.28Å; L846-G850 WeakPolarHBondContact O-CA 3.43Å; L846-G850 PolarHBondContact O-N 3.1Å; G850-V853 VanDerWaalsContact O-CG2 3.24Å; G850-V853 WeakPolarHBondContact O-CG2 3.46Å; G850-L854 WeakPolarHBondContact O-CB 3.44Å; G850-L854 WeakPolarHBondContact O-CG 3.28Å; G850-L854 PolarHBondContact O-N 3.12Å; G850-L854 VanDerWaalsContact O-N 3.12Å |
| 851 | G | 87.2 | Confident | 75.2 | Confident | 0 Ų | 0 | 29.4 Ų | 29.4 | 0% | 0 | 18% | 0.177 | C | C | . | . | H | α-helix | trans | -73.2 | -28.3 | 176.2 | 0 | 0 | 0 | 0 | 0 | 114.2 | T849 L854 Q855 H932 S934 | T849-G851 PolarHBondContact O-N 3.1Å; T849-G851 VanDerWaalsContact O-N 3.11Å; G851-L854 PolarHBondContact O-N 2.96Å; G851-Q855 WeakPolarHBondContact O-CG 3.41Å; G851-Q855 PolarHBondContact O-N 3.36Å; G851-H932 WeakPolarHBondContact CA-ND1 3.26Å; G851-S934 WeakPolarHBondContact CA-OG 3.34Å; G851-S934 PolarHBondContact O-OG 3.1Å; G851-S934 VanDerWaalsContact O-OG 3.11Å |
| 852 | V | 85.7 | Confident | 71.9 | Confident | 0.5 Ų | 0.5 | 33.5 Ų | 33.5 | 0% | 0.003 | 21% | 0.207 | C | C | . | . | H | α-helix | trans | -72.3 | -47.5 | 176.8 | -172.2 | 0 | 0 | 0 | 0 | 109.4 | L772 P775 T849 L854 Q855 | L772-V852 HydrophobicContact CB-CG1 4.22Å; L772-V852 HydrophobicContact CB-CG2 3.78Å; L772-V852 VanDerWaalsContact O-CG2 3.25Å; L772-V852 WeakPolarHBondContact O-CG2 3.29Å; P775-V852 HydrophobicContact CB-CG1 4.12Å; P775-V852 WeakPolarHBondContact CB-O 3.39Å; T849-V852 VanDerWaalsContact O-CB 3.3Å; T849-V852 WeakPolarHBondContact O-CB 3.46Å; T849-V852 PolarHBondContact O-N 3.16Å; V852-L854 VanDerWaalsContact C-N 3.26Å; V852-L854 PolarHBondContact O-N 3.19Å; V852-L854 VanDerWaalsContact O-N 3.15Å; V852-Q855 PolarHBondContact O-N 3.3Å; V852-Q855 VanDerWaalsContact O-N 3.1Å |
| 853 | V | 84.8 | Confident | 68.5 | Low | 2 Ų | 2 | 40.4 Ų | 40.4 | 1% | 0.012 | 24% | 0.244 | C | C | . | . | H | α-helix | trans | -63.1 | -27.9 | 178.8 | -158.9 | 0 | 0 | 0 | 0 | 112 | R780 W783 T849 G850 Q855 T856 I893 V897 | R780-V853 HydrophobicContact CB-CG1 4.37Å; R780-V853 HydrophobicContact CG-CB 4.35Å; R780-V853 HydrophobicContact CG-CG1 3.96Å; W783-V853 HydrophobicContact CB-CG1 3.96Å; W783-V853 HydrophobicContact CB-CG2 3.89Å; W783-V853 HydrophobicContact CD2-CG2 4.06Å; W783-V853 HydrophobicContact CG-CG1 4.14Å; W783-V853 HydrophobicContact CG-CG2 4.02Å; T849-V853 PolarHBondContact O-N 3.28Å; G850-V853 VanDerWaalsContact O-CG2 3.24Å; G850-V853 WeakPolarHBondContact O-CG2 3.46Å; V853-Q855 PolarHBondContact O-N 2.94Å; V853-T856 PolarHBondContact O-OG1 3.32Å; V853-I893 HydrophobicContact CG1-CG2 3.73Å; V853-I893 HydrophobicContact CG2-CG2 4.42Å; V853-V897 HydrophobicContact CG2-CG2 4.02Å |
| 854 | L | 78.6 | Confident | 65.2 | Low | 18.5 Ų | 18.5 | 47.7 Ų | 47.7 | 10% | 0.097 | 28% | 0.282 | C | S | . | . | H | α-helix | trans | -71.6 | -33.7 | 176 | -147.6 | 112 | 0 | 0 | 0 | 113.8 | G850 G851 V852 T856 S857 L894 V897 L935 H938 | G850-L854 WeakPolarHBondContact O-CB 3.44Å; G850-L854 WeakPolarHBondContact O-CG 3.28Å; G850-L854 PolarHBondContact O-N 3.12Å; G850-L854 VanDerWaalsContact O-N 3.12Å; G851-L854 PolarHBondContact O-N 2.96Å; V852-L854 VanDerWaalsContact C-N 3.26Å; V852-L854 PolarHBondContact O-N 3.19Å; V852-L854 VanDerWaalsContact O-N 3.15Å; L854-T856 VanDerWaalsContact C-N 3.25Å; L854-T856 PolarHBondContact O-N 3.09Å; L854-T856 VanDerWaalsContact O-N 3.16Å; L854-T856 PolarHBondContact O-OG1 2.97Å; L854-S857 WeakPolarHBondContact O-CB 3.48Å; L854-S857 PolarHBondContact O-N 3.3Å; L854-S857 VanDerWaalsContact O-N 3.11Å; L854-S857 PolarHBondContact O-OG 3.15Å; L854-S857 VanDerWaalsContact O-OG 3.12Å; L854-L894 HydrophobicContact CD1-CD1 3.86Å; L854-L894 HydrophobicContact CD1-CG 4.28Å; L854-L894 HydrophobicContact CD2-CB 4.38Å; L854-L894 HydrophobicContact CD2-CD1 3.52Å; L854-L894 HydrophobicContact CG-CD1 4.41Å; L854-V897 HydrophobicContact CD1-CB 4.29Å; L854-V897 HydrophobicContact CD1-CG1 4.13Å; L854-V897 HydrophobicContact CD1-CG2 4.43Å; L854-V897 HydrophobicContact CD2-CB 4.03Å; L854-V897 HydrophobicContact CD2-CG1 4.4Å; L854-V897 HydrophobicContact CD2-CG2 4.02Å; L854-V897 HydrophobicContact CG-CB 4.2Å; L854-V897 HydrophobicContact CG-CG1 4.1Å; L854-V897 HydrophobicContact CG-CG2 4.04Å; L854-L935 HydrophobicContact CD1-CD2 3.31Å; L854-L935 HydrophobicContact CD2-CD2 4.22Å; L854-L935 HydrophobicContact CG-CD2 4.42Å; L854-H938 VanDerWaalsContact CD2-CE1 3.45Å; L854-H938 WeakPolarHBondContact CD2-CE1 3.28Å; L854-H938 WeakPolarHBondContact CD2-NE2 3.49Å |
| 855 | Q | 67.6 | Low | 61.8 | Low | 68.25 Ų | 68.25 | 58.9 Ų | 58.9 | 32% | 0.319 | 33% | 0.326 | S | S | . | . | H | α-helix | trans | -65.6 | -5 | -175 | -75.9 | 173.4 | -17 | 0 | 0 | 112.8 | T773 P775 G851 V852 V853 S857 T858 C859 S934 | T773-Q855 PolarHBondContact O-OE1 3.12Å; P775-Q855 WeakPolarHBondContact CG-O 3.47Å; G851-Q855 WeakPolarHBondContact O-CG 3.41Å; G851-Q855 PolarHBondContact O-N 3.36Å; V852-Q855 PolarHBondContact O-N 3.3Å; V852-Q855 VanDerWaalsContact O-N 3.1Å; V853-Q855 PolarHBondContact O-N 2.94Å; Q855-S857 PolarHBondContact O-N 3.3Å; Q855-S857 VanDerWaalsContact O-N 3.1Å; Q855-T858 PolarHBondContact O-N 3.07Å; Q855-T858 VanDerWaalsContact O-N 3.11Å; Q855-T858 PolarHBondContact O-OG1 3.15Å; Q855-T858 VanDerWaalsContact O-OG1 3.08Å; Q855-C859 PolarHBondContact O-N 3.28Å; Q855-S934 PolarHBondContact NE2-OG 2.94Å |
| 856 | T | 51.1 | Low | 58.4 | Low | 39.75 Ų | 39.75 | 62.3 Ų | 62.3 | 24% | 0.244 | 35% | 0.354 | C | S | . | . | H | α-helix | trans | -73.1 | -15 | 173.8 | 49.4 | 0 | 0 | 0 | 0 | 112.7 | P775 R780 V853 L854 T858 | P775-T856 HydrophobicContact CB-CG2 3.28Å; P775-T856 VanDerWaalsContact CB-CG2 3.45Å; P775-T856 HydrophobicContact CG-CG2 3.18Å; R780-T856 PolarHBondContact NH2-OG1 3.37Å; V853-T856 PolarHBondContact O-OG1 3.32Å; L854-T856 VanDerWaalsContact C-N 3.25Å; L854-T856 PolarHBondContact O-N 3.09Å; L854-T856 VanDerWaalsContact O-N 3.16Å; L854-T856 PolarHBondContact O-OG1 2.97Å; T856-T858 VanDerWaalsContact C-N 3.26Å; T856-T858 PolarHBondContact O-N 3.35Å |
| 857 | S | 42.6 | Very low | 55.1 | Low | 45.25 Ų | 45.25 | 68.4 Ų | 68.4 | 32% | 0.316 | 39% | 0.394 | S | S | . | . | H | α-helix | trans | -74.5 | -13.8 | 179.3 | 43.3 | 0 | 0 | 0 | 0 | 115.1 | L854 Q855 S860 | L854-S857 WeakPolarHBondContact O-CB 3.48Å; L854-S857 PolarHBondContact O-N 3.3Å; L854-S857 VanDerWaalsContact O-N 3.11Å; L854-S857 PolarHBondContact O-OG 3.15Å; L854-S857 VanDerWaalsContact O-OG 3.12Å; Q855-S857 PolarHBondContact O-N 3.3Å; Q855-S857 VanDerWaalsContact O-N 3.1Å; S857-S860 PolarHBondContact O-OG 3.2Å |
| 858 | T | 36.1 | Very low | 51.8 | Low | 98 Ų | 98 | 75.3 Ų | 75.3 | 60% | 0.601 | 44% | 0.435 | S | S | * | . | H | α-helix | trans | -95.6 | -23.5 | -179 | 51 | 0 | 0 | 0 | 0 | 114.6 | Q855 T856 S860 N861 | Q855-T858 PolarHBondContact O-N 3.07Å; Q855-T858 VanDerWaalsContact O-N 3.11Å; Q855-T858 PolarHBondContact O-OG1 3.15Å; Q855-T858 VanDerWaalsContact O-OG1 3.08Å; T856-T858 VanDerWaalsContact C-N 3.26Å; T856-T858 PolarHBondContact O-N 3.35Å; T858-S860 VanDerWaalsContact C-N 3.29Å; T858-S860 PolarHBondContact O-N 3.13Å; T858-N861 PolarHBondContact O-N 3.36Å |
| 859 | C | 31.4 | Very low | 48.7 | Very low | 110 Ų | 110 | 79.4 Ų | 79.4 | 74% | 0.743 | 47% | 0.47 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -76.8 | -7.9 | -178.5 | -78.6 | 0 | 0 | 0 | 0 | 115 | Q855 N861 S862 | Q855-C859 PolarHBondContact O-N 3.28Å; C859-N861 PolarHBondContact O-N 2.95Å; C859-N861 VanDerWaalsContact O-N 3.08Å; C859-S862 PolarHBondContact O-N 2.93Å |
| 860 | S | 31.3 | Very low | 45.4 | Very low | 79 Ų | 79 | 88.9 Ų | 88.9 | 55% | 0.552 | 51% | 0.511 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -84.6 | -4.2 | 176.9 | 52 | 0 | 0 | 0 | 0 | 115 | S857 T858 N890 | S857-S860 PolarHBondContact O-OG 3.2Å; T858-S860 VanDerWaalsContact C-N 3.29Å; T858-S860 PolarHBondContact O-N 3.13Å; S860-N890 PolarHBondContact OG-ND2 3.19Å |
| 861 | N | 28.3 | Very low | 42.3 | Very low | 138.25 Ų | 138.25 | 97 Ų | 97 | 74% | 0.739 | 55% | 0.554 | S | S | * | * | trans | -112.6 | 22.5 | -177.3 | -79.7 | -6.4 | 0 | 0 | 0 | 114.8 | T858 C859 D863 | T858-N861 PolarHBondContact O-N 3.36Å; C859-N861 PolarHBondContact O-N 2.95Å; C859-N861 VanDerWaalsContact O-N 3.08Å; N861-D863 VanDerWaalsContact C-N 3.27Å; N861-D863 PolarHBondContact O-N 2.84Å | ||
| 862 | S | 28.3 | Very low | 39.4 | Very low | 103.5 Ų | 103.5 | 103.9 Ų | 103.9 | 72% | 0.724 | 59% | 0.591 | S | S | * | * | trans | -102.7 | 11.8 | 176 | -161 | 0 | 0 | 0 | 0 | 114.6 | C859 L864 | C859-S862 PolarHBondContact O-N 2.93Å; S862-L864 PolarHBondContact O-N 3.35Å | ||
| 863 | D | 25.6 | Very low | 36.8 | Very low | 145.25 Ų | 145.25 | 109.7 Ų | 109.7 | 78% | 0.777 | 63% | 0.628 | S | S | * | * | trans | -100.7 | 61.1 | 174 | -74.4 | -27.4 | 0 | 0 | 0 | 112.3 | N861 Y865 | N861-D863 VanDerWaalsContact C-N 3.27Å; N861-D863 PolarHBondContact O-N 2.84Å; D863-Y865 VanDerWaalsContact C-N 3.25Å; D863-Y865 PolarHBondContact O-N 2.97Å | ||
| 864 | L | 27.3 | Very low | 34.1 | Very low | 152.75 Ų | 152.75 | 117.6 Ų | 117.6 | 80% | 0.8 | 67% | 0.669 | S | S | * | * | trans | -107.1 | 55.9 | 166.4 | -79.4 | 161 | 0 | 0 | 0 | 113.5 | S862 A866 | S862-L864 PolarHBondContact O-N 3.35Å; L864-A866 VanDerWaalsContact C-N 3.33Å; L864-A866 HydrophobicContact CB-CB 4.28Å; L864-A866 HydrophobicContact CD2-CB 4.33Å; L864-A866 PolarHBondContact O-N 3.1Å | ||
| 865 | Y | 24.9 | Very low | 31.7 | Very low | 236.25 Ų | 236.25 | 124 Ų | 124 | 93% | 0.926 | 70% | 0.7 | S | S | * | * | trans | -112.8 | 76.3 | 148.9 | -83.5 | -85.4 | 0 | 0 | 0 | 110 | D863 | D863-Y865 VanDerWaalsContact C-N 3.25Å; D863-Y865 PolarHBondContact O-N 2.97Å | ||
| 866 | A | 24.6 | Very low | 29.8 | Very low | 70.25 Ų | 70.25 | 127.1 Ų | 127.1 | 58% | 0.581 | 72% | 0.718 | S | S | * | * | trans | -134 | 125 | 156.5 | 0 | 0 | 0 | 0 | 0 | 108.5 | L864 V868 | L864-A866 VanDerWaalsContact C-N 3.33Å; L864-A866 HydrophobicContact CB-CB 4.28Å; L864-A866 HydrophobicContact CD2-CB 4.33Å; L864-A866 PolarHBondContact O-N 3.1Å; A866-V868 PolarHBondContact O-N 3.31Å | ||
| 867 | P | 27.8 | Very low | 28.7 | Very low | 129.5 Ų | 129.5 | 132.4 Ų | 132.4 | 84% | 0.841 | 75% | 0.745 | S | S | * | * | trans | -71.1 | 119.6 | -178.3 | 18.7 | -15.3 | 0 | 0 | 0 | 109.5 | A869 | P867-A869 PolarHBondContact O-N 3.11Š| ||
| 868 | V | 26.2 | Very low | 28 | Very low | 143.5 Ų | 143.5 | 138 Ų | 138 | 87% | 0.87 | 77% | 0.766 | S | S | * | * | trans | -59.4 | 102.2 | 175 | 178.8 | 0 | 0 | 0 | 0 | 109.4 | A866 K870 | A866-V868 PolarHBondContact O-N 3.31Å; V868-K870 PolarHBondContact O-N 2.78Å | ||
| 869 | A | 28.2 | Very low | 27.5 | Very low | 87 Ų | 87 | 141.8 Ų | 141.8 | 72% | 0.719 | 78% | 0.775 | S | S | * | * | trans | -74.4 | 119.9 | 164.5 | 0 | 0 | 0 | 0 | 0 | 108.9 | P867 L871 | P867-A869 PolarHBondContact O-N 3.11Å; A869-L871 PolarHBondContact O-N 3.25Å | ||
| 870 | K | 25.5 | Very low | 27.4 | Very low | 198.5 Ų | 198.5 | 143.7 Ų | 143.7 | 86% | 0.863 | 78% | 0.777 | S | S | * | * | trans | -41.4 | 122 | 171.1 | -67.5 | 171.6 | 175.2 | 176.7 | 0 | 112 | V868 | V868-K870 PolarHBondContact O-N 2.78Š| ||
| 871 | L | 25.6 | Very low | 27.2 | Very low | 172 Ų | 172 | 146.4 Ų | 146.4 | 90% | 0.901 | 79% | 0.79 | S | S | * | * | trans | -130.8 | 130.4 | 154.3 | -87.2 | 159.4 | 0 | 0 | 0 | 109.5 | A869 | A869-L871 PolarHBondContact O-N 3.25Š| ||
| 872 | N | 26.6 | Very low | 27.2 | Very low | 144.5 Ų | 144.5 | 148 Ų | 148 | 77% | 0.773 | 79% | 0.793 | S | S | * | * | trans | -64.7 | 155 | -170.4 | -72 | -32.5 | 0 | 0 | 0 | 113.7 | I874 | N872-I874 PolarHBondContact O-N 3.25Š| ||
| 873 | P | 29.7 | Very low | 27.1 | Very low | 122.25 Ų | 122.25 | 148.5 Ų | 148.5 | 79% | 0.794 | 80% | 0.797 | S | S | * | * | trans | -82.5 | 126.9 | 177.9 | 33 | -29.9 | 0 | 0 | 0 | 110.7 | ||||
| 874 | I | 29.4 | Very low | 27.1 | Very low | 168 Ų | 168 | 147.4 Ų | 147.4 | 86% | 0.862 | 80% | 0.795 | S | S | * | * | trans | -110.6 | 125.8 | 163 | -63.6 | 177.4 | 0 | 0 | 0 | 107.5 | N872 | N872-I874 PolarHBondContact O-N 3.25Š| ||
| 875 | M | 27.6 | Very low | 26.9 | Very low | 153 Ų | 153 | 149 Ų | 149 | 75% | 0.754 | 80% | 0.798 | S | S | * | * | trans | -68.2 | 148.1 | 175.3 | -64.2 | 171.1 | 28 | 0 | 0 | 112.1 | ||||
| 876 | D | 26.7 | Very low | 27 | Very low | 132 Ų | 132 | 146.7 Ų | 146.7 | 71% | 0.706 | 79% | 0.793 | S | S | * | * | trans | 122.7 | 121.5 | 134.6 | -74.1 | -22.8 | 0 | 0 | 0 | 117 | ||||
| 877 | N | 29.7 | Very low | 27 | Very low | 151.5 Ų | 151.5 | 148.5 Ų | 148.5 | 81% | 0.81 | 80% | 0.802 | S | S | * | * | 121.3 | 119.6 | 121.8 | -91.9 | -27.8 | 0 | 0 | 0 | 118.2 | K879 | N877-K879 PolarHBondContact O-N 3.01Š| |||
| 878 | E | 26.3 | Very low | 27.1 | Very low | 162 Ų | 162 | 148.5 Ų | 148.5 | 76% | 0.757 | 79% | 0.794 | S | S | * | * | trans | -30.8 | 131.6 | 152.2 | -68 | -174.9 | 153.3 | 0 | 0 | 116.7 | ||||
| 879 | K | 27.4 | Very low | 27.6 | Very low | 178.5 Ų | 178.5 | 146.2 Ų | 146.2 | 78% | 0.776 | 78% | 0.782 | S | S | * | * | trans | 136.7 | 122.4 | 135.9 | -84.6 | 158.2 | -173.4 | 166.4 | 0 | 114.7 | N877 | N877-K879 PolarHBondContact O-N 3.01Š| ||
| 880 | N | 28.1 | Very low | 28.3 | Very low | 150.25 Ų | 150.25 | 145.2 Ų | 145.2 | 80% | 0.803 | 77% | 0.765 | S | S | * | * | trans | 109.6 | 97.2 | 145.1 | -71.5 | -18 | 0 | 0 | 0 | 115.8 | H882 | N880-H882 VanDerWaalsContact C-N 3.28Å; N880-H882 PolarHBondContact O-N 3.36Å; N880-H882 VanDerWaalsContact O-N 3.08Å | ||
| 881 | V | 28.4 | Very low | 29.2 | Very low | 136.25 Ų | 136.25 | 143.6 Ų | 143.6 | 83% | 0.826 | 76% | 0.76 | S | S | * | * | trans | -92.1 | 112.9 | 158.6 | -178.5 | 0 | 0 | 0 | 0 | 108.6 | S883 | V881-S883 PolarHBondContact O-N 3.11Š| ||
| 882 | H | 26.6 | Very low | 30.7 | Very low | 171.25 Ų | 171.25 | 141 Ų | 141 | 79% | 0.793 | 75% | 0.747 | S | S | * | * | trans | -89.2 | 107.7 | 164.3 | -71.5 | -69.2 | 0 | 0 | 0 | 110.8 | N880 V884 | N880-H882 VanDerWaalsContact C-N 3.28Å; N880-H882 PolarHBondContact O-N 3.36Å; N880-H882 VanDerWaalsContact O-N 3.08Å; H882-V884 VanDerWaalsContact C-N 3.3Å; H882-V884 PolarHBondContact O-N 3.2Å | ||
| 883 | S | 26.2 | Very low | 32.3 | Very low | 115 Ų | 115 | 134.7 Ų | 134.7 | 80% | 0.804 | 71% | 0.713 | S | S | * | * | trans | -98.2 | 107.2 | 163.3 | 45.9 | 0 | 0 | 0 | 0 | 110.6 | V881 E885 | V881-S883 PolarHBondContact O-N 3.11Å; S883-E885 PolarHBondContact O-N 2.75Å | ||
| 884 | V | 26.4 | Very low | 33.8 | Very low | 122 Ų | 122 | 133 Ų | 133 | 74% | 0.739 | 70% | 0.697 | S | S | * | * | trans | -62.5 | 114.5 | 166.8 | -179.7 | 0 | 0 | 0 | 0 | 109.5 | H882 F886 | H882-V884 VanDerWaalsContact C-N 3.3Å; H882-V884 PolarHBondContact O-N 3.2Å; V884-F886 HydrophobicContact CG1-CD2 4.32Å; V884-F886 PolarHBondContact O-N 3.15Å; V884-F886 VanDerWaalsContact O-N 3.08Å | ||
| 885 | E | 23.2 | Very low | 35.7 | Very low | 184.5 Ų | 184.5 | 129.1 Ų | 129.1 | 86% | 0.862 | 68% | 0.684 | S | S | * | * | trans | -61.4 | 106.5 | 170.7 | -76.7 | 177.2 | 148.8 | 0 | 0 | 109.8 | S883 S887 | S883-E885 PolarHBondContact O-N 2.75Å; E885-S887 VanDerWaalsContact C-N 3.29Å; E885-S887 PolarHBondContact O-N 3.08Å | ||
| 886 | F | 26.3 | Very low | 38.2 | Very low | 189 Ų | 189 | 123.5 Ų | 123.5 | 83% | 0.829 | 66% | 0.66 | S | S | * | * | trans | -83.5 | 93.6 | 160.9 | -102.5 | -92 | 0 | 0 | 0 | 107.8 | V884 L888 | V884-F886 HydrophobicContact CG1-CD2 4.32Å; V884-F886 PolarHBondContact O-N 3.15Å; V884-F886 VanDerWaalsContact O-N 3.08Å; F886-L888 VanDerWaalsContact C-N 3.26Å; F886-L888 PolarHBondContact O-N 3.14Å | ||
| 887 | S | 26.2 | Very low | 41.1 | Very low | 107.75 Ų | 107.75 | 117.3 Ų | 117.3 | 75% | 0.753 | 63% | 0.627 | S | S | * | * | trans | -72.2 | 107.5 | 165.3 | 41.3 | 0 | 0 | 0 | 0 | 108.9 | E885 P889 | E885-S887 VanDerWaalsContact C-N 3.29Å; E885-S887 PolarHBondContact O-N 3.08Å; S887-P889 WeakPolarHBondContact O-CD 3.4Å | ||
| 888 | L | 29 | Very low | 43.8 | Very low | 130.75 Ų | 130.75 | 111.7 Ų | 111.7 | 69% | 0.685 | 60% | 0.601 | S | S | * | * | trans | -65.6 | 124.4 | 173.8 | -79.3 | 104.2 | 0 | 0 | 0 | 109.6 | F886 N890 | F886-L888 VanDerWaalsContact C-N 3.26Å; F886-L888 PolarHBondContact O-N 3.14Å; L888-N890 HydrophobicContact CB-CB 4.44Å; L888-N890 PolarHBondContact O-N 3.06Å | ||
| 889 | P | 37.1 | Very low | 46.8 | Very low | 94 Ų | 94 | 106 Ų | 106 | 61% | 0.61 | 58% | 0.579 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -69.8 | 3.8 | -176 | 16 | -19.4 | 0 | 0 | 0 | 115.4 | S887 Q891 | S887-P889 WeakPolarHBondContact O-CD 3.4Å; P889-Q891 PolarHBondContact O-N 3.38Å |
| 890 | N | 42.3 | Very low | 49.9 | Very low | 67 Ų | 67 | 97.5 Ų | 97.5 | 36% | 0.358 | 54% | 0.542 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -88.6 | -15.2 | -167.7 | -71.1 | -14.9 | 0 | 0 | 0 | 115.1 | S860 L888 | S860-N890 PolarHBondContact OG-ND2 3.19Å; L888-N890 HydrophobicContact CB-CB 4.44Å; L888-N890 PolarHBondContact O-N 3.06Å |
| 891 | Q | 45 | Very low | 53 | Low | 165 Ų | 165 | 90.4 Ų | 90.4 | 77% | 0.771 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -78.6 | -28.6 | 178.2 | -85.4 | -176.7 | -7.2 | 0 | 0 | 113.7 | P889 I893 L894 C895 | P889-Q891 PolarHBondContact O-N 3.38Å; Q891-I893 VanDerWaalsContact C-N 3.31Å; Q891-I893 PolarHBondContact O-N 3.11Å; Q891-L894 PolarHBondContact O-N 2.84Å; Q891-C895 VanDerWaalsContact O-CB 3.3Å; Q891-C895 WeakPolarHBondContact O-CB 3.45Å; Q891-C895 PolarHBondContact O-N 2.91Å |
| 892 | D | 57.3 | Low | 56 | Low | 117.25 Ų | 117.25 | 86.9 Ų | 86.9 | 63% | 0.627 | 48% | 0.481 | S | S | * | . | H | α-helix | trans | -68.7 | -31.5 | -173.1 | -70.8 | -24.9 | 0 | 0 | 0 | 113.5 | C895 S896 | D892-C895 WeakPolarHBondContact O-CB 3.39Å; D892-C895 PolarHBondContact O-N 3.09Å; D892-S896 WeakPolarHBondContact O-CB 3.42Å; D892-S896 PolarHBondContact O-N 3.36Å; D892-S896 PolarHBondContact O-OG 3.13Å |
| 893 | I | 59.3 | Low | 59.2 | Low | 12.25 Ų | 12.25 | 81.1 Ų | 81.1 | 6% | 0.063 | 45% | 0.454 | C | S | . | . | H | α-helix | trans | -73.9 | -42.6 | -176.8 | -63.2 | 170 | 0 | 0 | 0 | 111.3 | R780 E784 V853 Q891 C895 S896 V897 | R780-I893 HydrophobicContact CG-CD1 4.02Å; E784-I893 WeakPolarHBondContact OE1-CG1 3.5Å; V853-I893 HydrophobicContact CG1-CG2 3.73Å; V853-I893 HydrophobicContact CG2-CG2 4.42Å; Q891-I893 VanDerWaalsContact C-N 3.31Å; Q891-I893 PolarHBondContact O-N 3.11Å; I893-C895 VanDerWaalsContact C-N 3.29Å; I893-C895 PolarHBondContact O-N 3.25Å; I893-S896 WeakPolarHBondContact O-CA 3.47Å; I893-S896 WeakPolarHBondContact O-CB 3.38Å; I893-S896 PolarHBondContact O-N 3.22Å; I893-S896 VanDerWaalsContact O-N 3.1Å; I893-V897 HydrophobicContact CG2-CG2 4.45Å; I893-V897 WeakPolarHBondContact O-CG2 3.49Å; I893-V897 PolarHBondContact O-N 3.1Å; I893-V897 VanDerWaalsContact O-N 3.15Å |
| 894 | L | 61.1 | Low | 62.4 | Low | 86.5 Ų | 86.5 | 75.6 Ų | 75.6 | 45% | 0.453 | 42% | 0.416 | S | S | . | . | H | α-helix | trans | -60 | -41.8 | 176.2 | -166.6 | 100.5 | 0 | 0 | 0 | 110.3 | L854 Q891 S896 V897 A898 | L854-L894 HydrophobicContact CD1-CD1 3.86Å; L854-L894 HydrophobicContact CD1-CG 4.28Å; L854-L894 HydrophobicContact CD2-CB 4.38Å; L854-L894 HydrophobicContact CD2-CD1 3.52Å; L854-L894 HydrophobicContact CG-CD1 4.41Å; Q891-L894 PolarHBondContact O-N 2.84Å; L894-S896 VanDerWaalsContact C-N 3.32Å; L894-S896 PolarHBondContact O-N 3.16Å; L894-V897 PolarHBondContact O-N 3.25Å; L894-A898 VanDerWaalsContact O-CB 3.29Å; L894-A898 WeakPolarHBondContact O-CB 3.42Å; L894-A898 PolarHBondContact O-N 3.21Å; L894-A898 VanDerWaalsContact O-N 3.09Å |
| 895 | C | 69.8 | Low | 65.5 | Low | 85 Ų | 85 | 69.9 Ų | 69.9 | 57% | 0.574 | 38% | 0.381 | S | S | * | . | H | α-helix | trans | -62.4 | -38.5 | 174.2 | -149.6 | 0 | 0 | 0 | 0 | 112 | Q891 D892 I893 S899 | Q891-C895 VanDerWaalsContact O-CB 3.3Å; Q891-C895 WeakPolarHBondContact O-CB 3.45Å; Q891-C895 PolarHBondContact O-N 2.91Å; D892-C895 WeakPolarHBondContact O-CB 3.39Å; D892-C895 PolarHBondContact O-N 3.09Å; I893-C895 VanDerWaalsContact C-N 3.29Å; I893-C895 PolarHBondContact O-N 3.25Å; C895-S899 WeakPolarHBondContact O-CB 3.39Å; C895-S899 PolarHBondContact O-N 3Å |
| 896 | S | 80.6 | Confident | 68.8 | Low | 36 Ų | 36 | 62.7 Ų | 62.7 | 25% | 0.252 | 35% | 0.351 | S | S | . | . | H | α-helix | trans | -68.7 | -44.5 | -179.5 | -61.9 | 0 | 0 | 0 | 0 | 112.9 | D892 I893 L894 S899 F900 | D892-S896 WeakPolarHBondContact O-CB 3.42Å; D892-S896 PolarHBondContact O-N 3.36Å; D892-S896 PolarHBondContact O-OG 3.13Å; I893-S896 WeakPolarHBondContact O-CA 3.47Å; I893-S896 WeakPolarHBondContact O-CB 3.38Å; I893-S896 PolarHBondContact O-N 3.22Å; I893-S896 VanDerWaalsContact O-N 3.1Å; L894-S896 VanDerWaalsContact C-N 3.32Å; L894-S896 PolarHBondContact O-N 3.16Å; S896-S899 WeakPolarHBondContact O-CB 3.33Å; S896-S899 PolarHBondContact O-N 3.18Å; S896-F900 WeakPolarHBondContact O-CB 3.21Å; S896-F900 PolarHBondContact O-N 3.2Å |
| 897 | V | 87.1 | Confident | 71.9 | Confident | 2.25 Ų | 2.25 | 53.9 Ų | 53.9 | 1% | 0.014 | 31% | 0.313 | C | S | . | . | H | α-helix | trans | -66.5 | -44.1 | 177 | 177.9 | 0 | 0 | 0 | 0 | 111.1 | W783 V853 L854 I893 L894 S899 F900 L901 L935 | W783-V897 HydrophobicContact CH2-CB 4.29Å; W783-V897 HydrophobicContact CH2-CG2 3.68Å; W783-V897 HydrophobicContact CZ2-CB 4.41Å; W783-V897 HydrophobicContact CZ2-CG2 3.77Å; W783-V897 HydrophobicContact CZ3-CG2 4.21Å; V853-V897 HydrophobicContact CG2-CG2 4.02Å; L854-V897 HydrophobicContact CD1-CB 4.29Å; L854-V897 HydrophobicContact CD1-CG1 4.13Å; L854-V897 HydrophobicContact CD1-CG2 4.43Å; L854-V897 HydrophobicContact CD2-CB 4.03Å; L854-V897 HydrophobicContact CD2-CG1 4.4Å; L854-V897 HydrophobicContact CD2-CG2 4.02Å; L854-V897 HydrophobicContact CG-CB 4.2Å; L854-V897 HydrophobicContact CG-CG1 4.1Å; L854-V897 HydrophobicContact CG-CG2 4.04Å; I893-V897 HydrophobicContact CG2-CG2 4.45Å; I893-V897 WeakPolarHBondContact O-CG2 3.49Å; I893-V897 PolarHBondContact O-N 3.1Å; I893-V897 VanDerWaalsContact O-N 3.15Å; L894-V897 PolarHBondContact O-N 3.25Å; V897-S899 VanDerWaalsContact C-N 3.32Å; V897-S899 PolarHBondContact O-N 3.1Å; V897-F900 WeakPolarHBondContact O-CB 3.31Å; V897-F900 PolarHBondContact O-N 3.14Å; V897-L901 HydrophobicContact CG1-CD1 4.49Å; V897-L901 WeakPolarHBondContact O-CG 3.43Å; V897-L901 PolarHBondContact O-N 3.12Å; V897-L935 HydrophobicContact CG1-CD2 3.57Å |
| 898 | A | 85.4 | Confident | 75 | Confident | 32.75 Ų | 32.75 | 48.8 Ų | 48.8 | 27% | 0.271 | 28% | 0.277 | S | S | . | . | H | α-helix | trans | -61.8 | -41.3 | 175.2 | 0 | 0 | 0 | 0 | 0 | 111.7 | L894 L901 N902 | L894-A898 VanDerWaalsContact O-CB 3.29Å; L894-A898 WeakPolarHBondContact O-CB 3.42Å; L894-A898 PolarHBondContact O-N 3.21Å; L894-A898 VanDerWaalsContact O-N 3.09Å; A898-L901 PolarHBondContact O-N 3.12Å; A898-N902 WeakPolarHBondContact O-CB 3.31Å; A898-N902 PolarHBondContact O-N 3.26Å; A898-N902 PolarHBondContact O-ND2 3.07Å |
| 899 | S | 89.1 | Confident | 77.9 | Confident | 42.75 Ų | 42.75 | 44.2 Ų | 44.2 | 30% | 0.299 | 25% | 0.253 | S | S | . | . | H | α-helix | trans | -62.6 | -42.2 | 174.7 | -177.1 | 0 | 0 | 0 | 0 | 112 | Y787 C895 S896 V897 N902 Q903 | Y787-S899 WeakPolarHBondContact OH-CB 3.17Å; Y787-S899 PolarHBondContact OH-OG 3.17Å; C895-S899 WeakPolarHBondContact O-CB 3.39Å; C895-S899 PolarHBondContact O-N 3Å; S896-S899 WeakPolarHBondContact O-CB 3.33Å; S896-S899 PolarHBondContact O-N 3.18Å; V897-S899 VanDerWaalsContact C-N 3.32Å; V897-S899 PolarHBondContact O-N 3.1Å; S899-N902 PolarHBondContact O-N 3Å; S899-Q903 WeakPolarHBondContact O-CB 3.34Å; S899-Q903 VanDerWaalsContact O-CG 3.31Å; S899-Q903 WeakPolarHBondContact O-CG 3.45Å; S899-Q903 PolarHBondContact O-N 3.39Å; S899-Q903 PolarHBondContact OG-NE2 3.25Å; S899-Q903 VanDerWaalsContact OG-NE2 3.15Å |
| 900 | F | 94.3 | Very high | 80.2 | Confident | 0 Ų | 0 | 41.4 Ų | 41.4 | 0% | 0 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -57.6 | -52.3 | 173.3 | 166.6 | -111.1 | 0 | 0 | 0 | 111.7 | W783 Y787 W790 T843 L846 S896 V897 N902 Q903 L904 | W783-F900 HydrophobicContact CH2-CB 4.2Å; W783-F900 HydrophobicContact CZ2-CB 4.26Å; W783-F900 HydrophobicContact CZ2-CD1 4.35Å; W783-F900 HydrophobicContact CZ2-CG 4.38Å; Y787-F900 HydrophobicContact CD2-CB 3.93Å; Y787-F900 HydrophobicContact CD2-CD2 4.07Å; Y787-F900 HydrophobicContact CD2-CG 4.36Å; Y787-F900 HydrophobicContact CE2-CB 3.57Å; Y787-F900 HydrophobicContact CE2-CD2 4.1Å; Y787-F900 HydrophobicContact CE2-CG 4.3Å; W790-F900 HydrophobicContact CD2-CD2 4.26Å; W790-F900 HydrophobicContact CD2-CE2 4.15Å; W790-F900 AromaticContact CE2-CE2 3.89Å; W790-F900 AromaticContact CE3-CD2 4Å; W790-F900 HydrophobicContact CE3-CD2 4.07Å; W790-F900 HydrophobicContact CE3-CE2 4.4Å; W790-F900 AromaticContact CH2-CD2 3.9Å; W790-F900 HydrophobicContact CH2-CD2 4.09Å; W790-F900 HydrophobicContact CH2-CE2 4.21Å; W790-F900 HydrophobicContact CZ2-CD2 4.27Å; W790-F900 AromaticContact CZ2-CE2 3.93Å; W790-F900 HydrophobicContact CZ2-CE2 3.93Å; W790-F900 AromaticContact CZ3-CD2 3.85Å; W790-F900 HydrophobicContact CZ3-CD2 3.99Å; W790-F900 HydrophobicContact CZ3-CE2 4.44Å; T843-F900 HydrophobicContact CG2-CZ 4.45Å; L846-F900 HydrophobicContact CB-CD1 4.47Å; L846-F900 HydrophobicContact CB-CD2 4.41Å; L846-F900 HydrophobicContact CB-CE1 3.92Å; L846-F900 HydrophobicContact CB-CE2 3.83Å; L846-F900 HydrophobicContact CB-CZ 3.53Å; L846-F900 VanDerWaalsContact CB-CZ 3.48Å; L846-F900 HydrophobicContact CD1-CD2 3.97Å; L846-F900 HydrophobicContact CD1-CE2 3.65Å; L846-F900 HydrophobicContact CD1-CZ 4.25Å; L846-F900 HydrophobicContact CG-CE2 4.4Å; S896-F900 WeakPolarHBondContact O-CB 3.21Å; S896-F900 PolarHBondContact O-N 3.2Å; V897-F900 WeakPolarHBondContact O-CB 3.31Å; V897-F900 PolarHBondContact O-N 3.14Å; F900-N902 VanDerWaalsContact C-N 3.31Å; F900-N902 PolarHBondContact O-N 3.03Å; F900-Q903 PolarHBondContact O-N 3.44Å; F900-L904 HydrophobicContact CE1-CD2 4.26Å; F900-L904 HydrophobicContact CE2-CD2 4.46Å; F900-L904 HydrophobicContact CZ-CD2 3.9Å; F900-L904 VanDerWaalsContact O-CB 3.32Å; F900-L904 WeakPolarHBondContact O-CB 3.36Å; F900-L904 PolarHBondContact O-N 3.32Å |
| 901 | L | 92.9 | Very high | 81.9 | Confident | 0.5 Ų | 0.5 | 39.9 Ų | 39.9 | 0% | 0.003 | 23% | 0.226 | C | C | . | . | H | α-helix | trans | -60.7 | -41.3 | 179.9 | -66.6 | 178.5 | 0 | 0 | 0 | 111.8 | V897 A898 L904 L905 L931 L935 H938 F939 Q942 | V897-L901 HydrophobicContact CG1-CD1 4.49Å; V897-L901 WeakPolarHBondContact O-CG 3.43Å; V897-L901 PolarHBondContact O-N 3.12Å; A898-L901 PolarHBondContact O-N 3.12Å; L901-L904 PolarHBondContact O-N 3.27Å; L901-L905 VanDerWaalsContact O-CB 3.29Å; L901-L905 WeakPolarHBondContact O-CB 3.18Å; L901-L905 WeakPolarHBondContact O-CG 3.48Å; L901-L905 PolarHBondContact O-N 3.17Å; L901-L931 HydrophobicContact CD2-CD1 3.95Å; L901-L935 HydrophobicContact CD1-CB 4.46Å; L901-L935 HydrophobicContact CD1-CD2 4.37Å; L901-H938 HydrophobicContact CD1-CB 3.99Å; L901-F939 HydrophobicContact CD1-CB 4.4Å; L901-F939 HydrophobicContact CD2-CD2 4.22Å; L901-Q942 HydrophobicContact CB-CG 4.39Å |
| 902 | N | 91.3 | Very high | 83.2 | Confident | 63.25 Ų | 63.25 | 34.9 Ų | 34.9 | 34% | 0.338 | 21% | 0.21 | S | C | . | . | H | α-helix | trans | -63.7 | -45.6 | 176.1 | -128.2 | -20.4 | 0 | 0 | 0 | 112.3 | A898 S899 F900 L904 L905 S906 Q942 | A898-N902 WeakPolarHBondContact O-CB 3.31Å; A898-N902 PolarHBondContact O-N 3.26Å; A898-N902 PolarHBondContact O-ND2 3.07Å; S899-N902 PolarHBondContact O-N 3Å; F900-N902 VanDerWaalsContact C-N 3.31Å; F900-N902 PolarHBondContact O-N 3.03Å; N902-L904 VanDerWaalsContact C-N 3.33Å; N902-L904 PolarHBondContact O-N 3.13Å; N902-L905 PolarHBondContact O-N 3.37Å; N902-S906 WeakPolarHBondContact O-CB 3.33Å; N902-S906 PolarHBondContact O-N 3.01Å; N902-Q942 PolarHBondContact ND2-NE2 3.42Å; N902-Q942 WeakPolarHBondContact OD1-CG 3.25Å; N902-Q942 PolarHBondContact OD1-OE1 3.17Å |
| 903 | Q | 92.8 | Very high | 84 | Confident | 49.75 Ų | 49.75 | 38.3 Ų | 38.3 | 23% | 0.232 | 22% | 0.222 | C | C | . | . | H | α-helix | trans | -64.7 | -38.4 | 176.6 | -73.2 | -176 | 52.4 | 0 | 0 | 111.9 | Y787 W790 S899 F900 S906 L907 | Y787-Q903 PolarHBondContact OH-NE2 3.14Å; Y787-Q903 VanDerWaalsContact OH-NE2 3.08Å; W790-Q903 HydrophobicContact CH2-CB 3.8Å; W790-Q903 HydrophobicContact CZ3-CB 3.85Å; S899-Q903 WeakPolarHBondContact O-CB 3.34Å; S899-Q903 VanDerWaalsContact O-CG 3.31Å; S899-Q903 WeakPolarHBondContact O-CG 3.45Å; S899-Q903 PolarHBondContact O-N 3.39Å; S899-Q903 PolarHBondContact OG-NE2 3.25Å; S899-Q903 VanDerWaalsContact OG-NE2 3.15Å; F900-Q903 PolarHBondContact O-N 3.44Å; Q903-S906 WeakPolarHBondContact O-CB 3.32Å; Q903-S906 PolarHBondContact O-N 3.35Å; Q903-S906 PolarHBondContact O-OG 3.31Å; Q903-L907 PolarHBondContact O-N 2.95Å |
| 904 | L | 93.5 | Very high | 84.9 | Confident | 0.25 Ų | 0.25 | 45.2 Ų | 45.2 | 0% | 0.001 | 25% | 0.251 | C | S | . | . | H | α-helix | trans | -64.1 | -43.9 | 176.1 | -172.1 | 62.6 | 0 | 0 | 0 | 111.3 | W790 T843 F900 L901 N902 S906 L907 V923 C927 | W790-L904 HydrophobicContact CH2-CB 4.47Å; W790-L904 HydrophobicContact CZ2-CB 4.49Å; W790-L904 HydrophobicContact CZ2-CD1 4.12Å; T843-L904 HydrophobicContact CG2-CD1 3.76Å; T843-L904 HydrophobicContact CG2-CD2 4.45Å; F900-L904 HydrophobicContact CE1-CD2 4.26Å; F900-L904 HydrophobicContact CE2-CD2 4.46Å; F900-L904 HydrophobicContact CZ-CD2 3.9Å; F900-L904 VanDerWaalsContact O-CB 3.32Å; F900-L904 WeakPolarHBondContact O-CB 3.36Å; F900-L904 PolarHBondContact O-N 3.32Å; L901-L904 PolarHBondContact O-N 3.27Å; N902-L904 VanDerWaalsContact C-N 3.33Å; N902-L904 PolarHBondContact O-N 3.13Å; L904-S906 VanDerWaalsContact C-N 3.33Å; L904-S906 PolarHBondContact O-N 3.12Å; L904-L907 HydrophobicContact CD1-CD1 4.37Å; L904-L907 WeakPolarHBondContact O-CB 3.37Å; L904-L907 PolarHBondContact O-N 3.19Å; L904-V923 HydrophobicContact CD1-CB 4.47Å; L904-V923 HydrophobicContact CD1-CG1 3.95Å; L904-V923 HydrophobicContact CD1-CG2 4.08Å; L904-V923 HydrophobicContact CG-CG1 4.16Å; L904-C927 VanDerWaalsContact CD2-SG 3.51Å; L904-C927 WeakPolarHBondContact CD2-SG 3.37Å |
| 905 | L | 92.6 | Very high | 85.9 | Confident | 1.25 Ų | 1.25 | 41.6 Ų | 41.6 | 1% | 0.007 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -65 | -36.6 | 173.9 | -122.2 | 117.9 | 0 | 0 | 0 | 112 | L901 N902 L907 L908 L909 F939 Q942 I943 V946 F966 V970 | L901-L905 VanDerWaalsContact O-CB 3.29Å; L901-L905 WeakPolarHBondContact O-CB 3.18Å; L901-L905 WeakPolarHBondContact O-CG 3.48Å; L901-L905 PolarHBondContact O-N 3.17Å; N902-L905 PolarHBondContact O-N 3.37Å; L905-L907 PolarHBondContact O-N 3.1Å; L905-L907 VanDerWaalsContact O-N 3.16Å; L905-L908 HydrophobicContact CD1-CD1 4.16Å; L905-L908 HydrophobicContact CD2-CD1 4.33Å; L905-L908 WeakPolarHBondContact O-CB 3.37Å; L905-L908 PolarHBondContact O-N 3.03Å; L905-L909 PolarHBondContact O-N 3.07Å; L905-F939 HydrophobicContact CD1-CD2 4.36Å; L905-F939 HydrophobicContact CD1-CE2 4.12Å; L905-F939 HydrophobicContact CD1-CZ 4.18Å; L905-F939 HydrophobicContact CD2-CD2 4.49Å; L905-F939 HydrophobicContact CD2-CE2 3.53Å; L905-F939 HydrophobicContact CD2-CZ 3.69Å; L905-F939 HydrophobicContact CG-CD2 4.41Å; L905-F939 HydrophobicContact CG-CE2 3.75Å; L905-F939 HydrophobicContact CG-CZ 4.41Å; L905-Q942 HydrophobicContact CD1-CB 3.44Å; L905-Q942 VanDerWaalsContact CD1-CB 3.44Å; L905-Q942 VanDerWaalsContact CD2-C 3.46Å; L905-Q942 HydrophobicContact CD2-CB 3.73Å; L905-Q942 WeakPolarHBondContact CD2-O 3.44Å; L905-I943 HydrophobicContact CD1-CG1 3.93Å; L905-I943 HydrophobicContact CD2-CD1 4.42Å; L905-I943 HydrophobicContact CD2-CG1 3.96Å; L905-V946 HydrophobicContact CD2-CB 4.49Å; L905-V946 HydrophobicContact CD2-CG2 3.8Å; L905-V946 HydrophobicContact CG-CG2 4.49Å; L905-F966 HydrophobicContact CD1-CE2 3.66Å; L905-F966 HydrophobicContact CD1-CZ 3.76Å; L905-F966 HydrophobicContact CD2-CE2 4.39Å; L905-F966 HydrophobicContact CD2-CZ 4.35Å; L905-F966 HydrophobicContact CG-CE2 3.85Å; L905-F966 HydrophobicContact CG-CZ 3.95Å; L905-V970 HydrophobicContact CD1-CG2 4.31Å |
| 906 | S | 91.4 | Very high | 86.4 | Confident | 34.25 Ų | 34.25 | 40.2 Ų | 40.2 | 24% | 0.24 | 22% | 0.218 | C | C | . | . | H | α-helix | trans | -60.7 | -24.9 | 177 | 83 | 0 | 0 | 0 | 0 | 113.3 | K798 N902 Q903 L904 L908 L909 | K798-S906 PolarHBondContact NZ-OG 3.24Å; N902-S906 WeakPolarHBondContact O-CB 3.33Å; N902-S906 PolarHBondContact O-N 3.01Å; Q903-S906 WeakPolarHBondContact O-CB 3.32Å; Q903-S906 PolarHBondContact O-N 3.35Å; Q903-S906 PolarHBondContact O-OG 3.31Å; L904-S906 VanDerWaalsContact C-N 3.33Å; L904-S906 PolarHBondContact O-N 3.12Å; S906-L908 VanDerWaalsContact C-N 3.3Å; S906-L908 PolarHBondContact O-N 3.03Å; S906-L909 WeakPolarHBondContact O-CB 3.32Å; S906-L909 PolarHBondContact O-N 3.23Å |
| 907 | L | 92 | Very high | 86.7 | Confident | 3 Ų | 3 | 41.8 Ų | 41.8 | 2% | 0.016 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -68.9 | -29.7 | 175 | -67.5 | 171.2 | 0 | 0 | 0 | 112.2 | W790 T794 K798 W839 Q903 L904 L905 L909 I910 L915 L920 V923 | W790-L907 HydrophobicContact CZ2-CD1 4.22Å; T794-L907 HydrophobicContact CG2-CD1 4.22Å; T794-L907 HydrophobicContact CG2-CD2 4.03Å; T794-L907 HydrophobicContact CG2-CG 4.38Å; K798-L907 HydrophobicContact CD-CD2 4.3Å; K798-L907 HydrophobicContact CG-CD2 4.09Å; W839-L907 HydrophobicContact CH2-CD1 4.01Å; W839-L907 HydrophobicContact CZ2-CD1 3.55Å; Q903-L907 PolarHBondContact O-N 2.95Å; L904-L907 HydrophobicContact CD1-CD1 4.37Å; L904-L907 WeakPolarHBondContact O-CB 3.37Å; L904-L907 PolarHBondContact O-N 3.19Å; L905-L907 PolarHBondContact O-N 3.1Å; L905-L907 VanDerWaalsContact O-N 3.16Å; L907-L909 VanDerWaalsContact C-N 3.26Å; L907-L909 PolarHBondContact O-N 3.2Å; L907-I910 HydrophobicContact CD2-CD1 3.95Å; L907-I910 PolarHBondContact O-N 2.96Å; L907-L915 HydrophobicContact CD2-CD2 4.44Å; L907-L920 WeakPolarHBondContact O-CD2 3.43Å; L907-V923 HydrophobicContact CB-CG2 4.19Å; L907-V923 HydrophobicContact CD1-CG2 4.02Å |
| 908 | L | 91.4 | Very high | 86.7 | Confident | 1 Ų | 1 | 42.3 Ų | 42.3 | 1% | 0.005 | 24% | 0.237 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -73.9 | -16.2 | 174.9 | -60.3 | -177.4 | 0 | 0 | 0 | 112.8 | L905 S906 I910 L920 V923 K924 F966 H969 V970 | L905-L908 HydrophobicContact CD1-CD1 4.16Å; L905-L908 HydrophobicContact CD2-CD1 4.33Å; L905-L908 WeakPolarHBondContact O-CB 3.37Å; L905-L908 PolarHBondContact O-N 3.03Å; S906-L908 VanDerWaalsContact C-N 3.3Å; S906-L908 PolarHBondContact O-N 3.03Å; L908-I910 VanDerWaalsContact C-N 3.31Å; L908-L920 HydrophobicContact CD2-CD1 3.52Å; L908-L920 HydrophobicContact CD2-CD2 4.01Å; L908-V923 HydrophobicContact CD1-CG1 4.27Å; L908-V923 HydrophobicContact CD2-CB 4Å; L908-V923 HydrophobicContact CD2-CG1 3.56Å; L908-V923 VanDerWaalsContact CD2-CG1 3.49Å; L908-V923 HydrophobicContact CG-CG1 3.81Å; L908-K924 HydrophobicContact CD2-CG 4.16Å; L908-F966 HydrophobicContact CB-CD2 3.78Å; L908-F966 HydrophobicContact CB-CE2 4.09Å; L908-H969 HydrophobicContact CB-CB 4.42Å; L908-H969 HydrophobicContact CD1-CB 4.2Å; L908-H969 HydrophobicContact CD2-CB 4.18Å; L908-H969 HydrophobicContact CG-CB 4.48Å; L908-V970 HydrophobicContact CD1-CG2 4.43Å |
| 909 | L | 88.7 | Confident | 87 | Confident | 33.5 Ų | 33.5 | 40.9 Ų | 40.9 | 18% | 0.175 | 23% | 0.225 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -86.4 | -6.4 | 173 | -73.6 | 168.1 | 0 | 0 | 0 | 112.4 | L905 S906 L907 V946 F950 Q962 F966 | L905-L909 PolarHBondContact O-N 3.07Å; S906-L909 WeakPolarHBondContact O-CB 3.32Å; S906-L909 PolarHBondContact O-N 3.23Å; L907-L909 VanDerWaalsContact C-N 3.26Å; L907-L909 PolarHBondContact O-N 3.2Å; L909-V946 HydrophobicContact CD1-CG1 3.96Å; L909-V946 HydrophobicContact CD2-CG1 4.23Å; L909-V946 HydrophobicContact CG-CG1 4.43Å; L909-F950 HydrophobicContact CD2-CE1 4.37Å; L909-F950 HydrophobicContact CD2-CZ 4.31Å; L909-Q962 HydrophobicContact CB-CG 4.46Å; L909-Q962 HydrophobicContact CD2-CG 4.2Å; L909-Q962 VanDerWaalsContact O-CD 3.25Å; L909-Q962 WeakPolarHBondContact O-CG 3.43Å; L909-Q962 PolarHBondContact O-NE2 3.19Å; L909-F966 HydrophobicContact CD2-CB 3.73Å; L909-F966 HydrophobicContact CD2-CD1 4.38Å; L909-F966 HydrophobicContact CD2-CD2 3.6Å; L909-F966 HydrophobicContact CD2-CE2 4.27Å; L909-F966 HydrophobicContact CD2-CG 3.64Å; L909-F966 HydrophobicContact CG-CB 4.47Å; L909-F966 HydrophobicContact CG-CD2 3.57Å; L909-F966 HydrophobicContact CG-CE2 3.98Å; L909-F966 HydrophobicContact CG-CG 4.17Å |
| 910 | I | 85.7 | Confident | 87.1 | Confident | 36 Ų | 36 | 39.6 Ų | 39.6 | 19% | 0.185 | 21% | 0.214 | C | C | . | . | S | Bend | trans | -80.1 | 128.9 | 178.1 | -62.3 | 175.9 | 0 | 0 | 0 | 108.5 | K798 L907 L908 S912 K914 L915 | K798-I910 HydrophobicContact CD-CD1 4.15Å; K798-I910 HydrophobicContact CG-CD1 3.8Å; L907-I910 HydrophobicContact CD2-CD1 3.95Å; L907-I910 PolarHBondContact O-N 2.96Å; L908-I910 VanDerWaalsContact C-N 3.31Å; I910-S912 PolarHBondContact O-N 3.19Å; I910-K914 HydrophobicContact CG2-CB 3.94Å; I910-L915 HydrophobicContact CB-CB 4.44Å; I910-L915 HydrophobicContact CB-CD2 4.47Å; I910-L915 HydrophobicContact CG2-CB 3.98Å |
| 911 | P | 79 | Confident | 87 | Confident | 34.5 Ų | 34.5 | 45.5 Ų | 45.5 | 22% | 0.224 | 24% | 0.236 | C | C | . | . | trans | -53 | 133.3 | 177.4 | -26.3 | 33.7 | 0 | 0 | 0 | 111.3 | Q913 K914 | P911-Q913 PolarHBondContact O-N 3.28Å; P911-K914 HydrophobicContact CB-CD 4.45Å; P911-K914 HydrophobicContact CG-CD 4.39Å; P911-K914 WeakPolarHBondContact O-CB 3.02Å; P911-K914 PolarHBondContact O-N 2.95Å | ||
| 912 | S | 72.5 | Confident | 87 | Confident | 61.75 Ų | 61.75 | 47.6 Ų | 47.6 | 43% | 0.432 | 25% | 0.246 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -54 | -24.8 | -173.1 | 54.5 | 0 | 0 | 0 | 0 | 115 | I910 K914 L915 D965 | I910-S912 PolarHBondContact O-N 3.19Å; S912-K914 VanDerWaalsContact C-N 3.32Å; S912-K914 PolarHBondContact O-N 3.24Å; S912-L915 VanDerWaalsContact O-O 3.14Å; S912-D965 PolarHBondContact N-OD2 2.92Å; S912-D965 PolarHBondContact OG-OD2 3.46Å |
| 913 | Q | 74.4 | Confident | 87.2 | Confident | 188.75 Ų | 188.75 | 44.6 Ų | 44.6 | 88% | 0.882 | 23% | 0.23 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -75.4 | -19.9 | 177 | -61 | 171.4 | 6.8 | 0 | 0 | 113.8 | P911 | P911-Q913 PolarHBondContact O-N 3.28Š|
| 914 | K | 77.4 | Confident | 87.2 | Confident | 155.25 Ų | 155.25 | 44.6 Ų | 44.6 | 68% | 0.675 | 23% | 0.229 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -98.4 | -10.7 | -176.5 | -66.6 | -175.3 | 179.2 | 177.8 | 0 | 113.4 | I910 P911 S912 | I910-K914 HydrophobicContact CG2-CB 3.94Å; P911-K914 HydrophobicContact CB-CD 4.45Å; P911-K914 HydrophobicContact CG-CD 4.39Å; P911-K914 WeakPolarHBondContact O-CB 3.02Å; P911-K914 PolarHBondContact O-N 2.95Å; S912-K914 VanDerWaalsContact C-N 3.32Å; S912-K914 PolarHBondContact O-N 3.24Å |
| 915 | L | 81.2 | Confident | 87.2 | Confident | 11.25 Ų | 11.25 | 47.6 Ų | 47.6 | 6% | 0.059 | 24% | 0.244 | C | C | . | . | S | Bend | trans | -125.5 | 141.7 | -178.6 | -167.4 | 67.6 | 0 | 0 | 0 | 109.4 | L907 I910 S912 A917 I919 L920 | L907-L915 HydrophobicContact CD2-CD2 4.44Å; I910-L915 HydrophobicContact CB-CB 4.44Å; I910-L915 HydrophobicContact CB-CD2 4.47Å; I910-L915 HydrophobicContact CG2-CB 3.98Å; S912-L915 VanDerWaalsContact O-O 3.14Å; L915-A917 PolarHBondContact O-N 3.08Å; L915-I919 HydrophobicContact CD1-CB 4.34Å; L915-I919 HydrophobicContact CD1-CD1 3.66Å; L915-I919 HydrophobicContact CD1-CG2 4.29Å; L915-I919 HydrophobicContact CD2-CB 4.13Å; L915-I919 HydrophobicContact CD2-CG2 3.83Å; L915-I919 HydrophobicContact CG-CB 4.08Å; L915-I919 HydrophobicContact CG-CD1 4.04Å; L915-I919 HydrophobicContact CG-CG2 4.17Å; L915-L920 HydrophobicContact CD2-CD2 4.05Å; L915-L920 HydrophobicContact CD2-CG 4.1Å |
| 916 | E | 81.6 | Confident | 87.3 | Confident | 57 Ų | 57 | 48.4 Ų | 48.4 | 27% | 0.266 | 25% | 0.248 | S | C | . | . | trans | -62 | 131.2 | 177.1 | -164.8 | -159 | 146.5 | 0 | 0 | 110.4 | L832 Q833 I836 S918 I919 | L832-E916 WeakPolarHBondContact CD2-OE2 3.42Å; L832-E916 WeakPolarHBondContact CG-OE2 3.45Å; Q833-E916 PolarHBondContact NE2-OE1 3.03Å; I836-E916 HydrophobicContact CD1-CB 4.2Å; I836-E916 HydrophobicContact CD1-CG 4.31Å; I836-E916 WeakPolarHBondContact CD1-OE1 3.33Å; I836-E916 WeakPolarHBondContact CD1-OE2 3.27Å; E916-S918 WeakPolarHBondContact CG-OG 3.29Å; E916-S918 PolarHBondContact O-N 3.18Å; E916-S918 VanDerWaalsContact O-N 3.09Å; E916-S918 WeakPolarHBondContact OE1-CB 3.42Å; E916-S918 PolarHBondContact OE1-OG 3.04Å; E916-S918 VanDerWaalsContact OE2-CB 3.24Å; E916-S918 WeakPolarHBondContact OE2-CB 3.24Å; E916-S918 PolarHBondContact OE2-N 3.01Å; E916-S918 PolarHBondContact OE2-OG 3.38Å; E916-I919 HydrophobicContact CB-CD1 4.04Å; E916-I919 HydrophobicContact CB-CG1 4.29Å; E916-I919 WeakPolarHBondContact O-CB 3.28Å; E916-I919 PolarHBondContact O-N 3.05Å | ||
| 917 | A | 86 | Confident | 87.5 | Confident | 69.25 Ų | 69.25 | 46.8 Ų | 46.8 | 57% | 0.572 | 24% | 0.236 | S | C | * | . | H | α-helix | trans | -57.2 | -26.1 | -174.9 | 0 | 0 | 0 | 0 | 0 | 113.5 | L915 I919 L920 R921 | L915-A917 PolarHBondContact O-N 3.08Å; A917-I919 VanDerWaalsContact C-N 3.33Å; A917-I919 PolarHBondContact O-N 3.08Å; A917-L920 PolarHBondContact O-N 3.36Å; A917-R921 PolarHBondContact O-N 2.96Å |
| 918 | S | 87.9 | Confident | 87.5 | Confident | 12.25 Ų | 12.25 | 46.9 Ų | 46.9 | 9% | 0.086 | 24% | 0.237 | C | C | . | . | H | α-helix | trans | -66.6 | -36.8 | 175.7 | 71.4 | 0 | 0 | 0 | 0 | 112.4 | I836 E916 R921 H922 | I836-S918 WeakPolarHBondContact CD1-OG 3.35Å; I836-S918 WeakPolarHBondContact CG2-OG 3.47Å; E916-S918 WeakPolarHBondContact CG-OG 3.29Å; E916-S918 PolarHBondContact O-N 3.18Å; E916-S918 VanDerWaalsContact O-N 3.09Å; E916-S918 WeakPolarHBondContact OE1-CB 3.42Å; E916-S918 PolarHBondContact OE1-OG 3.04Å; E916-S918 VanDerWaalsContact OE2-CB 3.24Å; E916-S918 WeakPolarHBondContact OE2-CB 3.24Å; E916-S918 PolarHBondContact OE2-N 3.01Å; E916-S918 PolarHBondContact OE2-OG 3.38Å; S918-R921 WeakPolarHBondContact O-CB 3.43Å; S918-R921 PolarHBondContact O-N 3.09Å; S918-H922 PolarHBondContact O-N 3.11Å; S918-H922 PolarHBondContact O-ND1 3.04Å |
| 919 | I | 91.1 | Very high | 87.5 | Confident | 3.5 Ų | 3.5 | 51.3 Ų | 51.3 | 2% | 0.018 | 25% | 0.254 | C | S | . | . | H | α-helix | trans | -63.6 | -50 | 178.6 | -60.4 | 169.3 | 0 | 0 | 0 | 109.4 | L797 I836 W839 L915 E916 A917 R921 H922 V923 | L797-I919 HydrophobicContact CB-CD1 4.02Å; L797-I919 HydrophobicContact CD1-CD1 4.12Å; L797-I919 HydrophobicContact CD2-CD1 4.19Å; L797-I919 HydrophobicContact CG-CD1 4.34Å; I836-I919 HydrophobicContact CD1-CD1 4.17Å; I836-I919 HydrophobicContact CD1-CG1 3.94Å; I836-I919 HydrophobicContact CG1-CD1 4.35Å; I836-I919 HydrophobicContact CG1-CG1 4.11Å; I836-I919 HydrophobicContact CG2-CG1 4.19Å; W839-I919 HydrophobicContact CE3-CG2 4.45Å; W839-I919 HydrophobicContact CH2-CG2 3.72Å; W839-I919 HydrophobicContact CZ2-CG2 4.37Å; W839-I919 HydrophobicContact CZ3-CB 4.47Å; W839-I919 HydrophobicContact CZ3-CG2 3.76Å; L915-I919 HydrophobicContact CD1-CB 4.34Å; L915-I919 HydrophobicContact CD1-CD1 3.66Å; L915-I919 HydrophobicContact CD1-CG2 4.29Å; L915-I919 HydrophobicContact CD2-CB 4.13Å; L915-I919 HydrophobicContact CD2-CG2 3.83Å; L915-I919 HydrophobicContact CG-CB 4.08Å; L915-I919 HydrophobicContact CG-CD1 4.04Å; L915-I919 HydrophobicContact CG-CG2 4.17Å; E916-I919 HydrophobicContact CB-CD1 4.04Å; E916-I919 HydrophobicContact CB-CG1 4.29Å; E916-I919 WeakPolarHBondContact O-CB 3.28Å; E916-I919 PolarHBondContact O-N 3.05Å; A917-I919 VanDerWaalsContact C-N 3.33Å; A917-I919 PolarHBondContact O-N 3.08Å; I919-R921 VanDerWaalsContact C-N 3.26Å; I919-R921 PolarHBondContact O-N 3.07Å; I919-H922 PolarHBondContact O-N 3.1Å; I919-H922 VanDerWaalsContact O-N 3.1Å; I919-V923 HydrophobicContact CG2-CG2 4.43Å; I919-V923 WeakPolarHBondContact O-CG2 3.32Å; I919-V923 PolarHBondContact O-N 3.29Å |
| 920 | L | 90.7 | Very high | 87.7 | Confident | 16.25 Ų | 16.25 | 50.5 Ų | 50.5 | 9% | 0.085 | 25% | 0.25 | C | C | . | . | H | α-helix | trans | -58.6 | -38.1 | 177.7 | -125.1 | 118.9 | 0 | 0 | 0 | 112.3 | L907 L908 L915 A917 K924 | L907-L920 WeakPolarHBondContact O-CD2 3.43Å; L908-L920 HydrophobicContact CD2-CD1 3.52Å; L908-L920 HydrophobicContact CD2-CD2 4.01Å; L915-L920 HydrophobicContact CD2-CD2 4.05Å; L915-L920 HydrophobicContact CD2-CG 4.1Å; A917-L920 PolarHBondContact O-N 3.36Å; L920-K924 WeakPolarHBondContact O-CB 3.48Å; L920-K924 WeakPolarHBondContact O-CE 3.17Å; L920-K924 WeakPolarHBondContact O-CG 3.35Å; L920-K924 PolarHBondContact O-N 3.17Å; L920-K924 VanDerWaalsContact O-N 3.12Å |
| 921 | R | 92 | Very high | 87.9 | Confident | 122.75 Ų | 122.75 | 49.3 Ų | 49.3 | 46% | 0.463 | 24% | 0.243 | S | C | . | . | H | α-helix | trans | -62.2 | -49 | 174.2 | -170.7 | -174.5 | -32.5 | 100.8 | 5.9 | 111.4 | A917 S918 I919 K924 E925 | A917-R921 PolarHBondContact O-N 2.96Å; S918-R921 WeakPolarHBondContact O-CB 3.43Å; S918-R921 PolarHBondContact O-N 3.09Å; I919-R921 VanDerWaalsContact C-N 3.26Å; I919-R921 PolarHBondContact O-N 3.07Å; R921-K924 PolarHBondContact O-N 3.04Å; R921-E925 HydrophobicContact CG-CG 4.46Å; R921-E925 VanDerWaalsContact CG-OE1 3.23Å; R921-E925 WeakPolarHBondContact CG-OE1 3.41Å; R921-E925 IonicContact CZ-OE1 3.92Å; R921-E925 IonicContact CZ-OE2 3.06Å; R921-E925 IonicContact NH1-OE1 3.82Å; R921-E925 PolarHBondContact NH1-OE1 2.88Å; R921-E925 IonicContact NH1-OE2 2.7Å; R921-E925 PolarHBondContact NH1-OE2 2.78Å; R921-E925 WeakPolarHBondContact O-CB 3.12Å; R921-E925 WeakPolarHBondContact O-CG 3.33Å; R921-E925 PolarHBondContact O-N 3.13Å |
| 922 | H | 93.9 | Very high | 88.4 | Confident | 44.25 Ų | 44.25 | 48 Ų | 48 | 21% | 0.205 | 24% | 0.235 | C | C | . | . | H | α-helix | trans | -62.7 | -44.4 | 178.5 | -70 | 105.2 | 0 | 0 | 0 | 112 | W839 A840 S918 I919 K924 E925 L926 | W839-H922 HydrophobicContact CZ3-CB 4.16Å; A840-H922 HydrophobicContact CB-CB 4.17Å; A840-H922 VanDerWaalsContact CB-CD2 3.45Å; A840-H922 WeakPolarHBondContact CB-CD2 3.38Å; S918-H922 PolarHBondContact O-N 3.11Å; S918-H922 PolarHBondContact O-ND1 3.04Å; I919-H922 PolarHBondContact O-N 3.1Å; I919-H922 VanDerWaalsContact O-N 3.1Å; H922-K924 VanDerWaalsContact C-N 3.32Å; H922-K924 PolarHBondContact O-N 2.86Å; H922-E925 PolarHBondContact O-N 3.3Å; H922-L926 HydrophobicContact CB-CD1 4.32Å; H922-L926 VanDerWaalsContact O-CB 3.27Å; H922-L926 WeakPolarHBondContact O-CB 3.47Å; H922-L926 WeakPolarHBondContact O-CG 3.26Å; H922-L926 PolarHBondContact O-N 3.1Å |
| 923 | V | 95 | Very high | 89 | Confident | 0 Ų | 0 | 46.8 Ų | 46.8 | 0% | 0 | 23% | 0.225 | C | C | . | . | H | α-helix | trans | -55.6 | -49.3 | 176.2 | 178.2 | 0 | 0 | 0 | 0 | 110.4 | W839 L904 L907 L908 I919 E925 C927 | W839-V923 HydrophobicContact CH2-CG2 3.64Å; W839-V923 HydrophobicContact CZ3-CG2 4.45Å; L904-V923 HydrophobicContact CD1-CB 4.47Å; L904-V923 HydrophobicContact CD1-CG1 3.95Å; L904-V923 HydrophobicContact CD1-CG2 4.08Å; L904-V923 HydrophobicContact CG-CG1 4.16Å; L907-V923 HydrophobicContact CB-CG2 4.19Å; L907-V923 HydrophobicContact CD1-CG2 4.02Å; L908-V923 HydrophobicContact CD1-CG1 4.27Å; L908-V923 HydrophobicContact CD2-CB 4Å; L908-V923 HydrophobicContact CD2-CG1 3.56Å; L908-V923 VanDerWaalsContact CD2-CG1 3.49Å; L908-V923 HydrophobicContact CG-CG1 3.81Å; I919-V923 HydrophobicContact CG2-CG2 4.43Å; I919-V923 WeakPolarHBondContact O-CG2 3.32Å; I919-V923 PolarHBondContact O-N 3.29Å; V923-E925 PolarHBondContact O-N 3.07Å; V923-C927 WeakPolarHBondContact O-CB 3.37Å; V923-C927 PolarHBondContact O-N 3.21Å; V923-C927 PolarHBondContact O-SG 3.24Å |
| 924 | K | 94.1 | Very high | 89.4 | Confident | 51.25 Ų | 51.25 | 39.2 Ų | 39.2 | 22% | 0.223 | 19% | 0.192 | C | C | . | . | H | α-helix | trans | -61.4 | -47.6 | 179.7 | -73.5 | -179.7 | -43.2 | -168.6 | 0 | 112.4 | L908 L920 R921 H922 S928 H969 Y972 V973 | L908-K924 HydrophobicContact CD2-CG 4.16Å; L920-K924 WeakPolarHBondContact O-CB 3.48Å; L920-K924 WeakPolarHBondContact O-CE 3.17Å; L920-K924 WeakPolarHBondContact O-CG 3.35Å; L920-K924 PolarHBondContact O-N 3.17Å; L920-K924 VanDerWaalsContact O-N 3.12Å; R921-K924 PolarHBondContact O-N 3.04Å; H922-K924 VanDerWaalsContact C-N 3.32Å; H922-K924 PolarHBondContact O-N 2.86Å; K924-S928 WeakPolarHBondContact O-CB 3.34Å; K924-S928 PolarHBondContact O-N 3.19Å; K924-S928 VanDerWaalsContact O-N 3.11Å; K924-S928 PolarHBondContact O-OG 3.18Å; K924-H969 HydrophobicContact CD-CB 4.33Å; K924-H969 HydrophobicContact CG-CB 4.47Å; K924-Y972 HydrophobicContact CB-CD1 4.1Å; K924-Y972 HydrophobicContact CB-CE1 4.02Å; K924-Y972 HydrophobicContact CD-CD1 4.19Å; K924-Y972 HydrophobicContact CG-CD1 4.41Å; K924-V973 HydrophobicContact CB-CG2 4.24Å; K924-V973 HydrophobicContact CG-CG2 4.13Å |
| 925 | E | 93.7 | Very high | 89.9 | Confident | 63.5 Ų | 63.5 | 31.8 Ų | 31.8 | 30% | 0.297 | 16% | 0.16 | S | C | . | . | H | α-helix | trans | -64.9 | -47.7 | -179.6 | -73.2 | 178.1 | -165.4 | 0 | 0 | 111.5 | R921 H922 V923 S928 Y929 | R921-E925 HydrophobicContact CG-CG 4.46Å; R921-E925 VanDerWaalsContact CG-OE1 3.23Å; R921-E925 WeakPolarHBondContact CG-OE1 3.41Å; R921-E925 IonicContact CZ-OE1 3.92Å; R921-E925 IonicContact CZ-OE2 3.06Å; R921-E925 IonicContact NH1-OE1 3.82Å; R921-E925 PolarHBondContact NH1-OE1 2.88Å; R921-E925 IonicContact NH1-OE2 2.7Å; R921-E925 PolarHBondContact NH1-OE2 2.78Å; R921-E925 WeakPolarHBondContact O-CB 3.12Å; R921-E925 WeakPolarHBondContact O-CG 3.33Å; R921-E925 PolarHBondContact O-N 3.13Å; H922-E925 PolarHBondContact O-N 3.3Å; V923-E925 PolarHBondContact O-N 3.07Å; E925-S928 WeakPolarHBondContact O-CB 3.47Å; E925-S928 PolarHBondContact O-N 3.09Å; E925-S928 VanDerWaalsContact O-N 3.13Å; E925-Y929 HydrophobicContact CB-CD2 4.36Å; E925-Y929 WeakPolarHBondContact O-CB 3.44Å; E925-Y929 WeakPolarHBondContact O-CD2 3.4Å; E925-Y929 PolarHBondContact O-N 3.17Å |
| 926 | L | 94.7 | Very high | 90.2 | Very high | 17.25 Ų | 17.25 | 31.8 Ų | 31.8 | 9% | 0.09 | 16% | 0.16 | C | C | . | . | H | α-helix | trans | -66.7 | -43.4 | -177.5 | -64.2 | 172.7 | 0 | 0 | 0 | 111.9 | A840 T843 H922 S928 Y929 E930 L931 | A840-L926 HydrophobicContact CB-CD1 4.46Å; A840-L926 WeakPolarHBondContact O-CD1 3.4Å; T843-L926 HydrophobicContact CG2-CB 4.48Å; T843-L926 HydrophobicContact CG2-CD1 3.59Å; H922-L926 HydrophobicContact CB-CD1 4.32Å; H922-L926 VanDerWaalsContact O-CB 3.27Å; H922-L926 WeakPolarHBondContact O-CB 3.47Å; H922-L926 WeakPolarHBondContact O-CG 3.26Å; H922-L926 PolarHBondContact O-N 3.1Å; L926-S928 PolarHBondContact O-N 3.11Å; L926-Y929 PolarHBondContact O-N 3.14Å; L926-E930 HydrophobicContact CB-CB 4.48Å; L926-E930 HydrophobicContact CD2-CB 4.19Å; L926-E930 HydrophobicContact CD2-CG 3.58Å; L926-E930 CarbonylContact O-C 3.28Å; L926-E930 WeakPolarHBondContact O-CA 3.31Å; L926-E930 WeakPolarHBondContact O-CB 3.39Å; L926-E930 PolarHBondContact O-N 3.09Å; L926-L931 PolarHBondContact O-N 3.03Å |
| 927 | C | 93.7 | Very high | 90.2 | Very high | 0.5 Ų | 0.5 | 29.4 Ų | 29.4 | 0% | 0.003 | 15% | 0.151 | C | C | . | . | H | α-helix | trans | -64.3 | -30.1 | 173.9 | -64.4 | 0 | 0 | 0 | 0 | 112.5 | L904 V923 F939 V973 V977 | L904-C927 VanDerWaalsContact CD2-SG 3.51Å; L904-C927 WeakPolarHBondContact CD2-SG 3.37Å; V923-C927 WeakPolarHBondContact O-CB 3.37Å; V923-C927 PolarHBondContact O-N 3.21Å; V923-C927 PolarHBondContact O-SG 3.24Å; C927-F939 HydrophobicContact CB-CE1 4.39Å; C927-F939 HydrophobicContact CB-CE2 4.48Å; C927-F939 HydrophobicContact CB-CZ 3.91Å; C927-V973 HydrophobicContact CB-CG1 3.65Å; C927-V973 HydrophobicContact CB-CG2 4.42Å; C927-V977 VanDerWaalsContact O-CG2 3.26Å; C927-V977 WeakPolarHBondContact O-CG2 3.36Å |
| 928 | S | 93 | Very high | 90.1 | Very high | 4.25 Ų | 4.25 | 29.1 Ų | 29.1 | 3% | 0.03 | 14% | 0.137 | C | C | . | . | H | α-helix | trans | -77.7 | -38.2 | -178.8 | -63.7 | 0 | 0 | 0 | 0 | 113.4 | K924 E925 L926 N980 | K924-S928 WeakPolarHBondContact O-CB 3.34Å; K924-S928 PolarHBondContact O-N 3.19Å; K924-S928 VanDerWaalsContact O-N 3.11Å; K924-S928 PolarHBondContact O-OG 3.18Å; E925-S928 WeakPolarHBondContact O-CB 3.47Å; E925-S928 PolarHBondContact O-N 3.09Å; E925-S928 VanDerWaalsContact O-N 3.13Å; L926-S928 PolarHBondContact O-N 3.11Å; S928-N980 PolarHBondContact O-ND2 3.38Å; S928-N980 VanDerWaalsContact O-ND2 3.08Å |
| 929 | Y | 91.8 | Very high | 90.2 | Very high | 93.75 Ų | 93.75 | 28.6 Ų | 28.6 | 37% | 0.368 | 13% | 0.133 | S | C | . | . | H | α-helix | trans | -119.3 | -27.5 | -166.6 | -57.9 | -67.2 | 0 | 0 | 0 | 113.8 | K770 E925 L926 N976 N980 | K770-Y929 PolarHBondContact NZ-O 3.07Å; E925-Y929 HydrophobicContact CB-CD2 4.36Å; E925-Y929 WeakPolarHBondContact O-CB 3.44Å; E925-Y929 WeakPolarHBondContact O-CD2 3.4Å; E925-Y929 PolarHBondContact O-N 3.17Å; L926-Y929 PolarHBondContact O-N 3.14Å; Y929-N976 HydrophobicContact CE1-CB 4.39Å; Y929-N976 PolarHBondContact OH-OD1 3.29Å; Y929-N980 WeakPolarHBondContact CD1-ND2 3.33Å |
| 930 | E | 92.2 | Very high | 90.2 | Very high | 17.5 Ų | 17.5 | 28.5 Ų | 28.5 | 8% | 0.082 | 13% | 0.133 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -106.6 | -5.9 | -171.7 | -53 | -57.7 | 174.2 | 0 | 0 | 114.5 | N766 K770 C847 A848 L926 H932 | N766-E930 HydrophobicContact CB-CG 4.35Å; N766-E930 VanDerWaalsContact CB-OE2 3.29Å; N766-E930 WeakPolarHBondContact CB-OE2 3.46Å; K770-E930 WeakPolarHBondContact CD-O 3.49Å; K770-E930 WeakPolarHBondContact CE-O 3.45Å; K770-E930 IonicContact NZ-OE2 2.79Å; K770-E930 PolarHBondContact NZ-OE2 2.94Å; C847-E930 CarbonylContact C-O 3.51Å; C847-E930 VanDerWaalsContact C-O 3.27Å; C847-E930 HydrophobicContact CB-CB 4.27Å; C847-E930 WeakPolarHBondContact CB-O 3.44Å; A848-E930 WeakPolarHBondContact CA-O 3.37Å; A848-E930 PolarHBondContact N-O 3.28Å; L926-E930 HydrophobicContact CB-CB 4.48Å; L926-E930 HydrophobicContact CD2-CB 4.19Å; L926-E930 HydrophobicContact CD2-CG 3.58Å; L926-E930 CarbonylContact O-C 3.28Å; L926-E930 WeakPolarHBondContact O-CA 3.31Å; L926-E930 WeakPolarHBondContact O-CB 3.39Å; L926-E930 PolarHBondContact O-N 3.09Å; E930-H932 PolarHBondContact O-N 3.08Å |
| 931 | L | 91 | Very high | 90 | Very high | 10.25 Ų | 10.25 | 32.2 Ų | 32.2 | 5% | 0.054 | 15% | 0.15 | C | C | . | . | trans | -67 | 127.2 | 178.1 | -165.6 | 67.7 | 0 | 0 | 0 | 111.1 | K770 C847 L901 L926 L935 I936 F939 | K770-L931 WeakPolarHBondContact CE-O 3.42Å; K770-L931 PolarHBondContact NZ-O 3.39Å; C847-L931 HydrophobicContact CB-CD1 4.49Å; L901-L931 HydrophobicContact CD2-CD1 3.95Å; L926-L931 PolarHBondContact O-N 3.03Å; L931-L935 HydrophobicContact CD1-CB 3.81Å; L931-L935 HydrophobicContact CD1-CD1 3.86Å; L931-L935 HydrophobicContact CD1-CG 4.48Å; L931-L935 HydrophobicContact CD2-CB 4.42Å; L931-L935 HydrophobicContact CG-CB 3.96Å; L931-I936 HydrophobicContact CD2-CG1 4.06Å; L931-I936 HydrophobicContact CG-CG1 4.48Å; L931-F939 HydrophobicContact CD2-CB 3.72Å; L931-F939 HydrophobicContact CD2-CD1 3.93Å; L931-F939 HydrophobicContact CD2-CD2 4.46Å; L931-F939 HydrophobicContact CD2-CG 3.8Å | ||
| 932 | H | 89.5 | Confident | 89.9 | Confident | 8 Ų | 8 | 28.1 Ų | 28.1 | 4% | 0.037 | 14% | 0.136 | C | C | . | . | trans | -62.3 | 144.6 | 174.7 | -169.7 | -88.2 | 0 | 0 | 0 | 111.5 | K770 L772 C847 A848 G851 E930 S934 L935 | K770-H932 PolarHBondContact O-CD2 3.18Å; K770-H932 VanDerWaalsContact O-CD2 3.25Å; K770-H932 PolarHBondContact O-NE2 3.22Å; L772-H932 PolarHBondContact O-NE2 3.07Å; C847-H932 WeakPolarHBondContact O-CB 3.31Å; C847-H932 PolarHBondContact O-N 3.25Å; A848-H932 PolarHBondContact O-CD2 3.37Å; A848-H932 VanDerWaalsContact O-CD2 3.29Å; G851-H932 WeakPolarHBondContact CA-ND1 3.26Å; E930-H932 PolarHBondContact O-N 3.08Å; H932-S934 VanDerWaalsContact C-N 3.3Å; H932-S934 PolarHBondContact CE1-OG 3.17Å; H932-S934 PolarHBondContact ND1-N 3.08Å; H932-S934 PolarHBondContact ND1-OG 3.26Å; H932-S934 PolarHBondContact O-N 3.07Å; H932-L935 HydrophobicContact CB-CD1 4.27Å; H932-L935 HydrophobicContact CB-CG 4.27Å; H932-L935 WeakPolarHBondContact O-CB 3.35Å; H932-L935 PolarHBondContact O-N 3.31Å | ||
| 933 | V | 84.6 | Confident | 89.9 | Confident | 37 Ų | 37 | 26 Ų | 26 | 22% | 0.224 | 13% | 0.126 | C | C | . | . | G | 310 helix | trans | -57.8 | -39 | -171.9 | 68.6 | 0 | 0 | 0 | 0 | 113.3 | L935 I936 L984 T989 | V933-L935 VanDerWaalsContact C-N 3.25Å; V933-L935 PolarHBondContact O-N 3.2Å; V933-L935 VanDerWaalsContact O-N 3.13Å; V933-I936 HydrophobicContact CG2-CD1 4.42Å; V933-I936 WeakPolarHBondContact O-CG1 3.41Å; V933-I936 PolarHBondContact O-N 3.08Å; V933-I936 VanDerWaalsContact O-N 3.15Å; V933-L984 HydrophobicContact CG2-CD1 4.21Å; V933-T989 HydrophobicContact CG2-CG2 3.61Å; V933-T989 WeakPolarHBondContact CG2-OG1 3.17Å |
| 934 | S | 82.3 | Confident | 89.7 | Confident | 28.5 Ų | 28.5 | 29 Ų | 29 | 20% | 0.199 | 14% | 0.14 | C | C | . | . | G | 310 helix | trans | -68.8 | -16.1 | 177.8 | 39.5 | 0 | 0 | 0 | 0 | 114.2 | G851 Q855 H932 H938 | G851-S934 WeakPolarHBondContact CA-OG 3.34Å; G851-S934 PolarHBondContact O-OG 3.1Å; G851-S934 VanDerWaalsContact O-OG 3.11Å; Q855-S934 PolarHBondContact NE2-OG 2.94Å; H932-S934 VanDerWaalsContact C-N 3.3Å; H932-S934 PolarHBondContact CE1-OG 3.17Å; H932-S934 PolarHBondContact ND1-N 3.08Å; H932-S934 PolarHBondContact ND1-OG 3.26Å; H932-S934 PolarHBondContact O-N 3.07Å; S934-H938 PolarHBondContact O-ND1 3.11Å |
| 935 | L | 87.5 | Confident | 89.6 | Confident | 0 Ų | 0 | 29 Ų | 29 | 0% | 0 | 15% | 0.146 | C | C | . | . | G | 310 helix | trans | -89.7 | -14.4 | 178 | -62.2 | -178.1 | 0 | 0 | 0 | 113.3 | L854 V897 L901 L931 H932 V933 G937 H938 F939 | L854-L935 HydrophobicContact CD1-CD2 3.31Å; L854-L935 HydrophobicContact CD2-CD2 4.22Å; L854-L935 HydrophobicContact CG-CD2 4.42Å; V897-L935 HydrophobicContact CG1-CD2 3.57Å; L901-L935 HydrophobicContact CD1-CB 4.46Å; L901-L935 HydrophobicContact CD1-CD2 4.37Å; L931-L935 HydrophobicContact CD1-CB 3.81Å; L931-L935 HydrophobicContact CD1-CD1 3.86Å; L931-L935 HydrophobicContact CD1-CG 4.48Å; L931-L935 HydrophobicContact CD2-CB 4.42Å; L931-L935 HydrophobicContact CG-CB 3.96Å; H932-L935 HydrophobicContact CB-CD1 4.27Å; H932-L935 HydrophobicContact CB-CG 4.27Å; H932-L935 WeakPolarHBondContact O-CB 3.35Å; H932-L935 PolarHBondContact O-N 3.31Å; V933-L935 VanDerWaalsContact C-N 3.25Å; V933-L935 PolarHBondContact O-N 3.2Å; V933-L935 VanDerWaalsContact O-N 3.13Å; L935-G937 VanDerWaalsContact C-N 3.34Å; L935-G937 PolarHBondContact O-N 2.99Å; L935-H938 PolarHBondContact O-N 3.02Å; L935-F939 VanDerWaalsContact O-CB 3.29Å; L935-F939 WeakPolarHBondContact O-CB 3.37Å; L935-F939 PolarHBondContact O-N 3.27Å |
| 936 | I | 87.1 | Confident | 89.5 | Confident | 10.75 Ų | 10.75 | 26.8 Ų | 26.8 | 6% | 0.055 | 14% | 0.137 | C | C | . | . | H | α-helix | trans | -62.3 | -42.6 | -173.2 | -63.1 | 175.3 | 0 | 0 | 0 | 111.3 | L931 V933 F939 F940 V977 C981 L991 | L931-I936 HydrophobicContact CD2-CG1 4.06Å; L931-I936 HydrophobicContact CG-CG1 4.48Å; V933-I936 HydrophobicContact CG2-CD1 4.42Å; V933-I936 WeakPolarHBondContact O-CG1 3.41Å; V933-I936 PolarHBondContact O-N 3.08Å; V933-I936 VanDerWaalsContact O-N 3.15Å; I936-F939 PolarHBondContact O-N 3.27Å; I936-F940 HydrophobicContact CG2-CD2 4.23Å; I936-F940 HydrophobicContact CG2-CE1 4.32Å; I936-F940 HydrophobicContact CG2-CE2 4.04Å; I936-F940 HydrophobicContact CG2-CZ 4.1Å; I936-F940 PolarHBondContact O-N 2.94Å; I936-V977 HydrophobicContact CD1-CG1 3.99Å; I936-V977 HydrophobicContact CG1-CG1 4.18Å; I936-V977 HydrophobicContact CG2-CG1 3.71Å; I936-C981 VanDerWaalsContact CD1-SG 3.54Å; I936-C981 WeakPolarHBondContact CD1-SG 3.4Å; I936-L991 HydrophobicContact CB-CD2 4.09Å; I936-L991 HydrophobicContact CG2-CD2 3.65Å |
| 937 | G | 82.8 | Confident | 89.4 | Confident | 7 Ų | 7 | 26 Ų | 26 | 7% | 0.072 | 13% | 0.133 | C | C | . | . | H | α-helix | trans | -57.5 | -55.5 | 175.7 | 0 | 0 | 0 | 0 | 0 | 111.8 | L935 F939 F940 E941 Q990 V992 | L935-G937 VanDerWaalsContact C-N 3.34Å; L935-G937 PolarHBondContact O-N 2.99Å; G937-F939 VanDerWaalsContact C-N 3.28Å; G937-F939 PolarHBondContact O-N 2.9Å; G937-F940 PolarHBondContact O-N 3.24Å; G937-F940 VanDerWaalsContact O-N 3.11Å; G937-E941 PolarHBondContact O-N 3.16Å; G937-Q990 WeakPolarHBondContact CA-O 3.41Å; G937-V992 VanDerWaalsContact CA-CG2 3.45Å; G937-V992 WeakPolarHBondContact O-CG2 3.42Å |
| 938 | H | 84 | Confident | 89.2 | Confident | 63.5 Ų | 63.5 | 30.2 Ų | 30.2 | 29% | 0.294 | 16% | 0.156 | S | C | . | . | H | α-helix | trans | -57.5 | -39.3 | 176.6 | -63.3 | 18.5 | 0 | 0 | 0 | 112.7 | L854 L901 S934 L935 F940 E941 Q942 Q990 | L854-H938 VanDerWaalsContact CD2-CE1 3.45Å; L854-H938 WeakPolarHBondContact CD2-CE1 3.28Å; L854-H938 WeakPolarHBondContact CD2-NE2 3.49Å; L901-H938 HydrophobicContact CD1-CB 3.99Å; S934-H938 PolarHBondContact O-ND1 3.11Å; L935-H938 PolarHBondContact O-N 3.02Å; H938-F940 VanDerWaalsContact C-N 3.34Å; H938-F940 PolarHBondContact O-N 3.16Å; H938-E941 IonicContact ND1-OE2 3.28Å; H938-E941 PolarHBondContact ND1-OE2 3.33Å; H938-E941 WeakPolarHBondContact O-CB 3.4Å; H938-E941 PolarHBondContact O-N 3.22Å; H938-Q942 WeakPolarHBondContact O-CG 3.42Å; H938-Q942 PolarHBondContact O-N 3.12Å; H938-Q990 PolarHBondContact CE1-OE1 3.14Å |
| 939 | F | 90.5 | Very high | 89.1 | Confident | 0.5 Ų | 0.5 | 39.2 Ų | 39.2 | 0% | 0.002 | 19% | 0.189 | C | C | . | . | H | α-helix | trans | -64.5 | -40.4 | 177.6 | -176.5 | -111.5 | 0 | 0 | 0 | 112.1 | L901 L905 C927 L931 L935 I936 G937 Q942 I943 V973 | L901-F939 HydrophobicContact CD1-CB 4.4Å; L901-F939 HydrophobicContact CD2-CD2 4.22Å; L905-F939 HydrophobicContact CD1-CD2 4.36Å; L905-F939 HydrophobicContact CD1-CE2 4.12Å; L905-F939 HydrophobicContact CD1-CZ 4.18Å; L905-F939 HydrophobicContact CD2-CD2 4.49Å; L905-F939 HydrophobicContact CD2-CE2 3.53Å; L905-F939 HydrophobicContact CD2-CZ 3.69Å; L905-F939 HydrophobicContact CG-CD2 4.41Å; L905-F939 HydrophobicContact CG-CE2 3.75Å; L905-F939 HydrophobicContact CG-CZ 4.41Å; C927-F939 HydrophobicContact CB-CE1 4.39Å; C927-F939 HydrophobicContact CB-CE2 4.48Å; C927-F939 HydrophobicContact CB-CZ 3.91Å; L931-F939 HydrophobicContact CD2-CB 3.72Å; L931-F939 HydrophobicContact CD2-CD1 3.93Å; L931-F939 HydrophobicContact CD2-CD2 4.46Å; L931-F939 HydrophobicContact CD2-CG 3.8Å; L935-F939 VanDerWaalsContact O-CB 3.29Å; L935-F939 WeakPolarHBondContact O-CB 3.37Å; L935-F939 PolarHBondContact O-N 3.27Å; I936-F939 PolarHBondContact O-N 3.27Å; G937-F939 VanDerWaalsContact C-N 3.28Å; G937-F939 PolarHBondContact O-N 2.9Å; F939-Q942 PolarHBondContact O-N 3.04Å; F939-I943 HydrophobicContact CD1-CD1 3.81Å; F939-I943 HydrophobicContact CE1-CD1 3.49Å; F939-I943 VanDerWaalsContact CE1-CD1 3.48Å; F939-I943 HydrophobicContact CE1-CG1 4.41Å; F939-I943 HydrophobicContact CG-CD1 4.5Å; F939-I943 HydrophobicContact CZ-CD1 3.98Å; F939-I943 WeakPolarHBondContact O-CG1 3.33Å; F939-I943 PolarHBondContact O-N 3.38Å; F939-V973 HydrophobicContact CE1-CG1 3.67Å; F939-V973 HydrophobicContact CZ-CG1 4Å |
| 940 | F | 90.7 | Very high | 89.1 | Confident | 2.25 Ų | 2.25 | 35.3 Ų | 35.3 | 1% | 0.01 | 17% | 0.174 | C | C | . | . | H | α-helix | trans | -68.3 | -36.9 | 174.8 | -75.3 | 3 | 0 | 0 | 0 | 112.3 | I936 G937 H938 Q942 I943 H944 M974 V977 L978 L991 V992 I994 I997 | I936-F940 HydrophobicContact CG2-CD2 4.23Å; I936-F940 HydrophobicContact CG2-CE1 4.32Å; I936-F940 HydrophobicContact CG2-CE2 4.04Å; I936-F940 HydrophobicContact CG2-CZ 4.1Å; I936-F940 PolarHBondContact O-N 2.94Å; G937-F940 PolarHBondContact O-N 3.24Å; G937-F940 VanDerWaalsContact O-N 3.11Å; H938-F940 VanDerWaalsContact C-N 3.34Å; H938-F940 PolarHBondContact O-N 3.16Å; F940-Q942 VanDerWaalsContact C-N 3.32Å; F940-Q942 PolarHBondContact O-N 3.17Å; F940-I943 HydrophobicContact CD1-CD1 4.03Å; F940-I943 HydrophobicContact CE1-CD1 4.46Å; F940-I943 WeakPolarHBondContact O-CB 3.35Å; F940-I943 PolarHBondContact O-N 3.09Å; F940-H944 PolarHBondContact O-N 3.02Å; F940-M974 HydrophobicContact CD1-CG 4.48Å; F940-M974 HydrophobicContact CE1-CB 4.47Å; F940-M974 HydrophobicContact CE1-CG 3.95Å; F940-M974 HydrophobicContact CE2-CE 4.43Å; F940-M974 HydrophobicContact CZ-CB 4.39Å; F940-M974 HydrophobicContact CZ-CE 4.43Å; F940-M974 HydrophobicContact CZ-CG 4.19Å; F940-V977 HydrophobicContact CE1-CG1 4.21Å; F940-V977 HydrophobicContact CZ-CB 4.45Å; F940-V977 HydrophobicContact CZ-CG1 3.99Å; F940-L978 HydrophobicContact CE2-CD2 4.1Å; F940-L978 HydrophobicContact CE2-CG 4.45Å; F940-L978 HydrophobicContact CZ-CD2 4.25Å; F940-L978 HydrophobicContact CZ-CG 4.26Å; F940-L991 HydrophobicContact CD2-CD2 3.98Å; F940-L991 HydrophobicContact CE2-CD2 3.68Å; F940-L991 HydrophobicContact CZ-CD2 4.48Å; F940-V992 HydrophobicContact CB-CG1 4.38Å; F940-I994 HydrophobicContact CD2-CD1 4.15Å; F940-I994 HydrophobicContact CD2-CG1 4.05Å; F940-I994 HydrophobicContact CE2-CD1 3.99Å; F940-I994 HydrophobicContact CE2-CG1 4.18Å; F940-I997 HydrophobicContact CB-CD1 3.84Å; F940-I997 HydrophobicContact CG-CD1 4.34Å; F940-I997 WeakPolarHBondContact O-CD1 3.39Å |
| 941 | E | 86.9 | Confident | 88.9 | Confident | 92.75 Ų | 92.75 | 36.1 Ų | 36.1 | 43% | 0.433 | 18% | 0.181 | S | C | . | . | H | α-helix | trans | -60.1 | -41.2 | 171.6 | -75.2 | 173.2 | 175.9 | 0 | 0 | 112.3 | G937 H938 H944 S945 V992 | G937-E941 PolarHBondContact O-N 3.16Å; H938-E941 IonicContact ND1-OE2 3.28Å; H938-E941 PolarHBondContact ND1-OE2 3.33Å; H938-E941 WeakPolarHBondContact O-CB 3.4Å; H938-E941 PolarHBondContact O-N 3.22Å; E941-H944 WeakPolarHBondContact O-CB 3.38Å; E941-H944 PolarHBondContact O-N 3.29Å; E941-S945 WeakPolarHBondContact O-CB 3.36Å; E941-S945 PolarHBondContact O-N 3.31Å; E941-V992 HydrophobicContact CG-CB 4.32Å; E941-V992 HydrophobicContact CG-CG1 3.91Å; E941-V992 HydrophobicContact CG-CG2 3.83Å; E941-V992 WeakPolarHBondContact OE1-CG2 3.33Å |
| 942 | Q | 89.4 | Confident | 88.6 | Confident | 38.25 Ų | 38.25 | 39.2 Ų | 39.2 | 18% | 0.179 | 20% | 0.198 | C | C | . | . | H | α-helix | trans | -67.3 | -38.8 | 176 | -62.7 | -54.6 | -29.8 | 0 | 0 | 111.8 | L901 N902 L905 H938 F939 F940 H944 S945 V946 | L901-Q942 HydrophobicContact CB-CG 4.39Å; N902-Q942 PolarHBondContact ND2-NE2 3.42Å; N902-Q942 WeakPolarHBondContact OD1-CG 3.25Å; N902-Q942 PolarHBondContact OD1-OE1 3.17Å; L905-Q942 HydrophobicContact CD1-CB 3.44Å; L905-Q942 VanDerWaalsContact CD1-CB 3.44Å; L905-Q942 VanDerWaalsContact CD2-C 3.46Å; L905-Q942 HydrophobicContact CD2-CB 3.73Å; L905-Q942 WeakPolarHBondContact CD2-O 3.44Å; H938-Q942 WeakPolarHBondContact O-CG 3.42Å; H938-Q942 PolarHBondContact O-N 3.12Å; F939-Q942 PolarHBondContact O-N 3.04Å; F940-Q942 VanDerWaalsContact C-N 3.32Å; F940-Q942 PolarHBondContact O-N 3.17Å; Q942-H944 VanDerWaalsContact C-N 3.32Å; Q942-H944 PolarHBondContact O-N 3.24Å; Q942-S945 PolarHBondContact O-N 3.27Å; Q942-V946 WeakPolarHBondContact O-CG2 3.29Å; Q942-V946 PolarHBondContact O-N 3.28Å |
| 943 | I | 93.7 | Very high | 88.3 | Confident | 0 Ų | 0 | 47.4 Ų | 47.4 | 0% | 0 | 24% | 0.242 | C | C | . | . | H | α-helix | trans | -59.8 | -44.4 | 171.6 | -72.1 | 164.4 | 0 | 0 | 0 | 110.8 | L905 F939 F940 V946 T947 V970 M974 I997 | L905-I943 HydrophobicContact CD1-CG1 3.93Å; L905-I943 HydrophobicContact CD2-CD1 4.42Å; L905-I943 HydrophobicContact CD2-CG1 3.96Å; F939-I943 HydrophobicContact CD1-CD1 3.81Å; F939-I943 HydrophobicContact CE1-CD1 3.49Å; F939-I943 VanDerWaalsContact CE1-CD1 3.48Å; F939-I943 HydrophobicContact CE1-CG1 4.41Å; F939-I943 HydrophobicContact CG-CD1 4.5Å; F939-I943 HydrophobicContact CZ-CD1 3.98Å; F939-I943 WeakPolarHBondContact O-CG1 3.33Å; F939-I943 PolarHBondContact O-N 3.38Å; F940-I943 HydrophobicContact CD1-CD1 4.03Å; F940-I943 HydrophobicContact CE1-CD1 4.46Å; F940-I943 WeakPolarHBondContact O-CB 3.35Å; F940-I943 PolarHBondContact O-N 3.09Å; I943-V946 PolarHBondContact O-N 2.9Å; I943-T947 HydrophobicContact CG2-CG2 4.24Å; I943-T947 WeakPolarHBondContact O-CB 3.27Å; I943-T947 WeakPolarHBondContact O-CG2 3.42Å; I943-T947 PolarHBondContact O-N 3.31Å; I943-T947 PolarHBondContact O-OG1 3Å; I943-V970 HydrophobicContact CB-CG1 4.4Å; I943-V970 HydrophobicContact CB-CG2 4.33Å; I943-V970 HydrophobicContact CD1-CG1 3.89Å; I943-V970 HydrophobicContact CD1-CG2 3.46Å; I943-V970 VanDerWaalsContact CD1-CG2 3.46Å; I943-V970 HydrophobicContact CG1-CG1 4.06Å; I943-V970 HydrophobicContact CG1-CG2 4.11Å; I943-V970 HydrophobicContact CG2-CG1 3.51Å; I943-V970 VanDerWaalsContact CG2-CG1 3.48Å; I943-V970 HydrophobicContact CG2-CG2 3.71Å; I943-M974 HydrophobicContact CD1-CG 4.06Å; I943-M974 HydrophobicContact CD1-SD 4.42Å; I943-M974 HydrophobicContact CG2-SD 4.25Å; I943-I997 HydrophobicContact CG2-CD1 4.42Å; I943-I997 HydrophobicContact CG2-CG1 4.48Å; I943-I997 HydrophobicContact CG2-CG2 3.64Å |
| 944 | H | 91.7 | Very high | 88.2 | Confident | 61.75 Ų | 61.75 | 51.2 Ų | 51.2 | 29% | 0.286 | 27% | 0.265 | S | S | . | . | H | α-helix | trans | -59.1 | -49.7 | 176.1 | -180 | -127.8 | 0 | 0 | 0 | 111 | F940 E941 Q942 V946 T947 N948 P996 I997 | F940-H944 PolarHBondContact O-N 3.02Å; E941-H944 WeakPolarHBondContact O-CB 3.38Å; E941-H944 PolarHBondContact O-N 3.29Å; Q942-H944 VanDerWaalsContact C-N 3.32Å; Q942-H944 PolarHBondContact O-N 3.24Å; H944-V946 VanDerWaalsContact C-N 3.31Å; H944-V946 PolarHBondContact O-N 3.12Å; H944-T947 WeakPolarHBondContact CA-OG1 3.26Å; H944-T947 PolarHBondContact O-N 3.1Å; H944-T947 PolarHBondContact O-OG1 3.15Å; H944-T947 VanDerWaalsContact O-OG1 3.11Å; H944-N948 VanDerWaalsContact O-CB 3.24Å; H944-N948 WeakPolarHBondContact O-CB 3.21Å; H944-N948 PolarHBondContact O-N 3.17Å; H944-P996 VanDerWaalsContact NE2-CB 3.28Å; H944-P996 WeakPolarHBondContact NE2-CB 3.45Å; H944-I997 HydrophobicContact CB-CD1 4.15Å; H944-I997 HydrophobicContact CB-CG1 3.61Å |
| 945 | S | 90.2 | Very high | 88.1 | Confident | 51.25 Ų | 51.25 | 52.3 Ų | 52.3 | 36% | 0.358 | 28% | 0.282 | S | S | . | . | H | α-helix | trans | -56.3 | -42.5 | 178.2 | -175.5 | 0 | 0 | 0 | 0 | 112.6 | E941 Q942 R949 | E941-S945 WeakPolarHBondContact O-CB 3.36Å; E941-S945 PolarHBondContact O-N 3.31Å; Q942-S945 PolarHBondContact O-N 3.27Å; S945-R949 WeakPolarHBondContact O-CG 3.35Å; S945-R949 PolarHBondContact O-NE 3.38Å |
| 946 | V | 91.5 | Very high | 88.1 | Confident | 17.25 Ų | 17.25 | 58.7 Ų | 58.7 | 11% | 0.105 | 31% | 0.312 | C | S | . | . | H | α-helix | trans | -69.4 | -49.4 | 177.4 | 174.9 | 0 | 0 | 0 | 0 | 111.5 | L905 L909 Q942 I943 H944 N948 R949 F950 F966 | L905-V946 HydrophobicContact CD2-CB 4.49Å; L905-V946 HydrophobicContact CD2-CG2 3.8Å; L905-V946 HydrophobicContact CG-CG2 4.49Å; L909-V946 HydrophobicContact CD1-CG1 3.96Å; L909-V946 HydrophobicContact CD2-CG1 4.23Å; L909-V946 HydrophobicContact CG-CG1 4.43Å; Q942-V946 WeakPolarHBondContact O-CG2 3.29Å; Q942-V946 PolarHBondContact O-N 3.28Å; I943-V946 PolarHBondContact O-N 2.9Å; H944-V946 VanDerWaalsContact C-N 3.31Å; H944-V946 PolarHBondContact O-N 3.12Å; V946-N948 VanDerWaalsContact C-N 3.31Å; V946-N948 PolarHBondContact O-N 3.28Å; V946-R949 WeakPolarHBondContact O-CB 3.45Å; V946-R949 PolarHBondContact O-N 3.17Å; V946-F950 HydrophobicContact CG1-CE1 4.12Å; V946-F950 HydrophobicContact CG1-CZ 4.14Å; V946-F966 HydrophobicContact CB-CE1 4.22Å; V946-F966 HydrophobicContact CB-CZ 3.96Å; V946-F966 HydrophobicContact CG1-CD1 4.25Å; V946-F966 HydrophobicContact CG1-CE1 3.6Å; V946-F966 HydrophobicContact CG1-CE2 4.09Å; V946-F966 HydrophobicContact CG1-CZ 3.5Å; V946-F966 VanDerWaalsContact CG1-CZ 3.45Å; V946-F966 HydrophobicContact CG2-CZ 4.44Å |
| 947 | T | 92.7 | Very high | 88.2 | Confident | 1.75 Ų | 1.75 | 59.3 Ų | 59.3 | 1% | 0.011 | 32% | 0.316 | C | S | . | . | H | α-helix | trans | -67.3 | -30.9 | -177.5 | 53.5 | 0 | 0 | 0 | 0 | 113 | I943 H944 R949 F950 F966 L1001 | I943-T947 HydrophobicContact CG2-CG2 4.24Å; I943-T947 WeakPolarHBondContact O-CB 3.27Å; I943-T947 WeakPolarHBondContact O-CG2 3.42Å; I943-T947 PolarHBondContact O-N 3.31Å; I943-T947 PolarHBondContact O-OG1 3Å; H944-T947 WeakPolarHBondContact CA-OG1 3.26Å; H944-T947 PolarHBondContact O-N 3.1Å; H944-T947 PolarHBondContact O-OG1 3.15Å; H944-T947 VanDerWaalsContact O-OG1 3.11Å; T947-R949 PolarHBondContact O-N 2.92Å; T947-F950 HydrophobicContact CG2-CE2 4.22Å; T947-F950 VanDerWaalsContact O-CB 3.31Å; T947-F950 WeakPolarHBondContact O-CB 3.41Å; T947-F950 WeakPolarHBondContact O-CG 3.19Å; T947-F950 PolarHBondContact O-N 3.06Å; T947-F950 VanDerWaalsContact O-N 3.1Å; T947-F966 HydrophobicContact CG2-CE1 3.97Å; T947-L1001 HydrophobicContact CG2-CD2 4.08Å |
| 948 | N | 90.9 | Very high | 88.5 | Confident | 88.5 Ų | 88.5 | 63.9 Ų | 63.9 | 47% | 0.473 | 34% | 0.338 | S | S | . | . | H | α-helix | trans | -63.9 | -29.4 | 176.4 | -164 | 54.8 | 0 | 0 | 0 | 112 | H944 V946 F950 S951 | H944-N948 VanDerWaalsContact O-CB 3.24Å; H944-N948 WeakPolarHBondContact O-CB 3.21Å; H944-N948 PolarHBondContact O-N 3.17Å; V946-N948 VanDerWaalsContact C-N 3.31Å; V946-N948 PolarHBondContact O-N 3.28Å; N948-F950 PolarHBondContact O-N 2.99Å; N948-S951 PolarHBondContact O-N 3.29Å |
| 949 | R | 90.4 | Very high | 88.8 | Confident | 191.75 Ų | 191.75 | 64.1 Ų | 64.1 | 72% | 0.724 | 34% | 0.341 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -75.8 | -4.5 | 176.2 | -63.3 | 171.3 | 127 | -177.5 | 1.3 | 113.9 | S945 V946 T947 S951 | S945-R949 WeakPolarHBondContact O-CG 3.35Å; S945-R949 PolarHBondContact O-NE 3.38Å; V946-R949 WeakPolarHBondContact O-CB 3.45Å; V946-R949 PolarHBondContact O-N 3.17Å; T947-R949 PolarHBondContact O-N 2.92Å; R949-S951 VanDerWaalsContact C-N 3.26Å |
| 950 | F | 91.7 | Very high | 88.8 | Confident | 12.25 Ų | 12.25 | 66.1 Ų | 66.1 | 5% | 0.054 | 36% | 0.355 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -77.7 | -16.6 | 174.6 | -62.8 | -11.1 | 0 | 0 | 0 | 112.2 | L909 V946 T947 N948 V957 N958 N963 F966 V967 Y1004 | L909-F950 HydrophobicContact CD2-CE1 4.37Å; L909-F950 HydrophobicContact CD2-CZ 4.31Å; V946-F950 HydrophobicContact CG1-CE1 4.12Å; V946-F950 HydrophobicContact CG1-CZ 4.14Å; T947-F950 HydrophobicContact CG2-CE2 4.22Å; T947-F950 VanDerWaalsContact O-CB 3.31Å; T947-F950 WeakPolarHBondContact O-CB 3.41Å; T947-F950 WeakPolarHBondContact O-CG 3.19Å; T947-F950 PolarHBondContact O-N 3.06Å; T947-F950 VanDerWaalsContact O-N 3.1Å; N948-F950 PolarHBondContact O-N 2.99Å; F950-V957 WeakPolarHBondContact O-CA 3.46Å; F950-N958 PolarHBondContact O-N 3.14Å; F950-N963 HydrophobicContact CD1-CB 4.28Å; F950-N963 WeakPolarHBondContact CD1-ND2 3.42Å; F950-N963 HydrophobicContact CD2-CB 4.32Å; F950-N963 HydrophobicContact CE1-CB 4.05Å; F950-N963 VanDerWaalsContact CE1-CG 3.45Å; F950-N963 VanDerWaalsContact CE1-OD1 3.29Å; F950-N963 WeakPolarHBondContact CE1-OD1 3.27Å; F950-N963 HydrophobicContact CE2-CB 4.1Å; F950-N963 HydrophobicContact CG-CB 4.41Å; F950-N963 HydrophobicContact CZ-CB 3.95Å; F950-F966 AromaticContact CE2-CD1 3.87Å; F950-F966 HydrophobicContact CE2-CD1 3.87Å; F950-F966 HydrophobicContact CE2-CE1 4.43Å; F950-F966 HydrophobicContact CZ-CB 4.36Å; F950-F966 AromaticContact CZ-CD1 3.53Å; F950-F966 HydrophobicContact CZ-CD1 3.53Å; F950-F966 VanDerWaalsContact CZ-CD1 3.5Å; F950-F966 HydrophobicContact CZ-CE1 4.12Å; F950-F966 HydrophobicContact CZ-CG 4.18Å; F950-V967 HydrophobicContact CD2-CG2 4.41Å; F950-V967 HydrophobicContact CE2-CG2 3.89Å; F950-Y1004 HydrophobicContact CB-CD2 4.19Å; F950-Y1004 HydrophobicContact CB-CE2 4.44Å; F950-Y1004 AromaticContact CD2-CD2 3.85Å; F950-Y1004 HydrophobicContact CD2-CD2 3.85Å; F950-Y1004 HydrophobicContact CD2-CE2 4.12Å; F950-Y1004 HydrophobicContact CG-CD2 4.39Å; F950-Y1004 HydrophobicContact CG-CE2 4.44Å |
| 951 | S | 88.4 | Confident | 88.6 | Confident | 34.5 Ų | 34.5 | 70.2 Ų | 70.2 | 24% | 0.241 | 38% | 0.384 | C | S | . | . | B | Isolated β-bridge | trans | -102.8 | 140.2 | 171.2 | -63.2 | 0 | 0 | 0 | 0 | 109.5 | N948 R949 Q956 | N948-S951 PolarHBondContact O-N 3.29Å; R949-S951 VanDerWaalsContact C-N 3.26Å; S951-Q956 WeakPolarHBondContact CA-O 3.36Å |
| 952 | D | 84.7 | Confident | 88.8 | Confident | 74.75 Ų | 74.75 | 69.6 Ų | 69.6 | 40% | 0.4 | 38% | 0.381 | S | S | . | . | trans | -80.6 | 177.3 | 169.3 | 66 | 20.2 | 0 | 0 | 0 | 111.7 | T954 G955 Q956 | D952-T954 VanDerWaalsContact CG-OG1 3.31Å; D952-T954 PolarHBondContact O-N 3.21Å; D952-T954 VanDerWaalsContact O-N 3.09Å; D952-T954 WeakPolarHBondContact OD1-CA 3.41Å; D952-T954 WeakPolarHBondContact OD1-CB 3.44Å; D952-T954 PolarHBondContact OD1-N 3.25Å; D952-T954 PolarHBondContact OD1-OG1 3.07Å; D952-T954 PolarHBondContact OD2-OG1 3.2Å; D952-G955 PolarHBondContact O-N 3.37Å; D952-G955 PolarHBondContact OD1-N 3.33Å; D952-G955 VanDerWaalsContact OD1-N 3.09Å; D952-Q956 PolarHBondContact N-O 3.21Å; D952-Q956 PolarHBondContact OD1-N 3.14Å | ||
| 953 | D | 82 | Confident | 88.9 | Confident | 181 Ų | 181 | 68.5 Ų | 68.5 | 97% | 0.968 | 38% | 0.376 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -63 | -14.9 | 179.7 | -61.2 | -34.1 | 0 | 0 | 0 | 113.2 | ||
| 954 | T | 83.2 | Confident | 88.8 | Confident | 116 Ų | 116 | 69 Ų | 69 | 71% | 0.712 | 38% | 0.379 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -89.6 | -6.7 | 174.6 | 76.1 | 0 | 0 | 0 | 0 | 113 | D952 Q956 | D952-T954 VanDerWaalsContact CG-OG1 3.31Å; D952-T954 PolarHBondContact O-N 3.21Å; D952-T954 VanDerWaalsContact O-N 3.09Å; D952-T954 WeakPolarHBondContact OD1-CA 3.41Å; D952-T954 WeakPolarHBondContact OD1-CB 3.44Å; D952-T954 PolarHBondContact OD1-N 3.25Å; D952-T954 PolarHBondContact OD1-OG1 3.07Å; D952-T954 PolarHBondContact OD2-OG1 3.2Å; T954-Q956 VanDerWaalsContact C-N 3.33Å |
| 955 | G | 80.2 | Confident | 88.8 | Confident | 52 Ų | 52 | 67.3 Ų | 67.3 | 54% | 0.536 | 37% | 0.372 | S | S | . | . | trans | 83.8 | 5.2 | -175.4 | 0 | 0 | 0 | 0 | 0 | 114.1 | D952 | D952-G955 PolarHBondContact O-N 3.37Å; D952-G955 PolarHBondContact OD1-N 3.33Å; D952-G955 VanDerWaalsContact OD1-N 3.09Å | ||
| 956 | Q | 86.5 | Confident | 88.9 | Confident | 135.5 Ų | 135.5 | 64.9 Ų | 64.9 | 63% | 0.633 | 36% | 0.355 | S | S | * | . | trans | -75.3 | 130.9 | 176.8 | -170.2 | 175.4 | 3.8 | 0 | 0 | 110 | S951 D952 T954 | S951-Q956 WeakPolarHBondContact CA-O 3.36Å; D952-Q956 PolarHBondContact N-O 3.21Å; D952-Q956 PolarHBondContact OD1-N 3.14Å; T954-Q956 VanDerWaalsContact C-N 3.33Å | ||
| 957 | V | 89.9 | Confident | 89.1 | Confident | 23.5 Ų | 23.5 | 64.1 Ų | 64.1 | 14% | 0.142 | 35% | 0.35 | C | S | . | . | B | Isolated β-bridge | trans | -84.1 | 126 | -178.5 | -179.3 | 0 | 0 | 0 | 0 | 110.5 | F950 I959 Y1004 V1007 | F950-V957 WeakPolarHBondContact O-CA 3.46Å; V957-I959 HydrophobicContact CG1-CG1 4.41Å; V957-I959 PolarHBondContact O-N 3.33Å; V957-Y1004 HydrophobicContact CG1-CD2 3.43Å; V957-Y1004 VanDerWaalsContact CG1-CD2 3.45Å; V957-Y1004 HydrophobicContact CG1-CE2 3.94Å; V957-Y1004 HydrophobicContact CG1-CG 4.22Å; V957-V1007 HydrophobicContact CB-CG2 4.42Å; V957-V1007 HydrophobicContact CG2-CG2 4.32Å |
| 958 | N | 89.4 | Confident | 89.1 | Confident | 102 Ų | 102 | 66.1 Ų | 66.1 | 55% | 0.545 | 36% | 0.36 | S | S | . | . | trans | -84.6 | 101.4 | 175.1 | -176.9 | 4.6 | 0 | 0 | 0 | 111.5 | F950 N963 | F950-N958 PolarHBondContact O-N 3.14Å; N958-N963 PolarHBondContact O-ND2 3.29Å | ||
| 959 | I | 90.2 | Very high | 89.2 | Confident | 69.5 Ų | 69.5 | 62.9 Ų | 62.9 | 36% | 0.356 | 34% | 0.342 | S | S | . | . | trans | -86 | 118.8 | 177.3 | -59.3 | 173.5 | 0 | 0 | 0 | 110 | V957 V1007 L1008 | V957-I959 HydrophobicContact CG1-CG1 4.41Å; V957-I959 PolarHBondContact O-N 3.33Å; I959-V1007 HydrophobicContact CD1-CB 3.89Å; I959-V1007 HydrophobicContact CD1-CG1 3.65Å; I959-V1007 VanDerWaalsContact CD1-O 3.26Å; I959-V1007 WeakPolarHBondContact CD1-O 3.24Å; I959-L1008 HydrophobicContact CD1-CD2 4.44Å; I959-L1008 HydrophobicContact CG2-CD2 3.9Å | ||
| 960 | C | 89.9 | Confident | 89.4 | Confident | 42.5 Ų | 42.5 | 53.8 Ų | 53.8 | 29% | 0.287 | 31% | 0.307 | S | S | . | . | trans | -145.5 | 162.3 | 169.5 | 71.6 | 0 | 0 | 0 | 0 | 110.1 | Q962 N963 T964 Y1004 | C960-Q962 PolarHBondContact O-N 3.05Å; C960-N963 PolarHBondContact O-N 3.34Å; C960-N963 PolarHBondContact SG-N 3.17Å; C960-N963 VanDerWaalsContact SG-N 3.44Å; C960-T964 WeakPolarHBondContact O-CB 3.35Å; C960-T964 PolarHBondContact O-N 3.26Å; C960-T964 PolarHBondContact O-OG1 3.23Å; C960-T964 VanDerWaalsContact O-OG1 3.05Å; C960-Y1004 PolarHBondContact N-OH 2.9Å; C960-Y1004 PolarHBondContact O-OH 3.21Å | ||
| 961 | S | 87.6 | Confident | 89.6 | Confident | 87.5 Ų | 87.5 | 53.3 Ų | 53.3 | 61% | 0.612 | 31% | 0.306 | S | S | * | . | H | α-helix | trans | -57.3 | -38.5 | -179.1 | 54.5 | 0 | 0 | 0 | 0 | 112.3 | T964 D965 | S961-T964 PolarHBondContact O-N 3.1Å; S961-D965 WeakPolarHBondContact O-CB 3.36Å; S961-D965 VanDerWaalsContact O-CG 3.28Å; S961-D965 PolarHBondContact O-N 2.99Å |
| 962 | Q | 89.7 | Confident | 89.9 | Confident | 79.75 Ų | 79.75 | 55.5 Ų | 55.5 | 37% | 0.373 | 31% | 0.309 | S | S | . | . | H | α-helix | trans | -59.7 | -50.6 | 178.3 | -171.1 | -179.2 | -1.5 | 0 | 0 | 112.9 | L909 C960 T964 F966 | L909-Q962 HydrophobicContact CB-CG 4.46Å; L909-Q962 HydrophobicContact CD2-CG 4.2Å; L909-Q962 VanDerWaalsContact O-CD 3.25Å; L909-Q962 WeakPolarHBondContact O-CG 3.43Å; L909-Q962 PolarHBondContact O-NE2 3.19Å; C960-Q962 PolarHBondContact O-N 3.05Å; Q962-T964 VanDerWaalsContact C-N 3.3Å; Q962-T964 PolarHBondContact O-N 3.47Å; Q962-F966 WeakPolarHBondContact O-CB 3.48Å; Q962-F966 PolarHBondContact O-N 3.23Å; Q962-F966 VanDerWaalsContact O-N 3.08Å |
| 963 | N | 92.2 | Very high | 90.4 | Very high | 15.25 Ų | 15.25 | 51.9 Ų | 51.9 | 8% | 0.082 | 29% | 0.29 | C | S | . | . | H | α-helix | trans | -67.4 | -37.2 | 179.7 | -67.6 | -6 | 0 | 0 | 0 | 110.5 | F950 N958 C960 F966 V967 Y1004 | F950-N963 HydrophobicContact CD1-CB 4.28Å; F950-N963 WeakPolarHBondContact CD1-ND2 3.42Å; F950-N963 HydrophobicContact CD2-CB 4.32Å; F950-N963 HydrophobicContact CE1-CB 4.05Å; F950-N963 VanDerWaalsContact CE1-CG 3.45Å; F950-N963 VanDerWaalsContact CE1-OD1 3.29Å; F950-N963 WeakPolarHBondContact CE1-OD1 3.27Å; F950-N963 HydrophobicContact CE2-CB 4.1Å; F950-N963 HydrophobicContact CG-CB 4.41Å; F950-N963 HydrophobicContact CZ-CB 3.95Å; N958-N963 PolarHBondContact O-ND2 3.29Å; C960-N963 PolarHBondContact O-N 3.34Å; C960-N963 PolarHBondContact SG-N 3.17Å; C960-N963 VanDerWaalsContact SG-N 3.44Å; N963-F966 PolarHBondContact O-N 3.12Å; N963-V967 WeakPolarHBondContact O-CG2 3.4Å; N963-V967 PolarHBondContact O-N 3.1Å; N963-Y1004 HydrophobicContact CB-CE2 3.72Å; N963-Y1004 VanDerWaalsContact CB-OH 3.24Å; N963-Y1004 WeakPolarHBondContact CB-OH 3.34Å |
| 964 | T | 92.4 | Very high | 91 | Very high | 9.75 Ų | 9.75 | 43.3 Ų | 43.3 | 6% | 0.06 | 24% | 0.244 | C | C | . | . | H | α-helix | trans | -64.4 | -46.7 | 178.6 | -55.1 | 0 | 0 | 0 | 0 | 111.7 | C960 S961 Q962 F966 V967 E968 Y1004 L1008 Q1013 I1017 | C960-T964 WeakPolarHBondContact O-CB 3.35Å; C960-T964 PolarHBondContact O-N 3.26Å; C960-T964 PolarHBondContact O-OG1 3.23Å; C960-T964 VanDerWaalsContact O-OG1 3.05Å; S961-T964 PolarHBondContact O-N 3.1Å; Q962-T964 VanDerWaalsContact C-N 3.3Å; Q962-T964 PolarHBondContact O-N 3.47Å; T964-F966 VanDerWaalsContact C-N 3.32Å; T964-F966 PolarHBondContact O-N 3.21Å; T964-V967 PolarHBondContact O-N 3.18Å; T964-E968 PolarHBondContact O-N 3.17Å; T964-E968 VanDerWaalsContact O-N 3.09Å; T964-Y1004 PolarHBondContact N-OH 3.25Å; T964-Y1004 VanDerWaalsContact N-OH 3.11Å; T964-Y1004 PolarHBondContact OG1-OH 3.15Å; T964-L1008 HydrophobicContact CG2-CD1 4.41Å; T964-L1008 HydrophobicContact CG2-CD2 4.38Å; T964-Q1013 HydrophobicContact CG2-CG 4.39Å; T964-I1017 HydrophobicContact CG2-CD1 3.49Å; T964-I1017 VanDerWaalsContact CG2-CD1 3.47Å |
| 965 | D | 90.2 | Very high | 91.5 | Very high | 28 Ų | 28 | 40.3 Ų | 40.3 | 15% | 0.15 | 22% | 0.221 | C | C | . | . | H | α-helix | trans | -60.2 | -44 | 174.8 | -74.8 | -3.4 | 0 | 0 | 0 | 110.6 | S912 S961 V967 E968 H969 | S912-D965 PolarHBondContact N-OD2 2.92Å; S912-D965 PolarHBondContact OG-OD2 3.46Å; S961-D965 WeakPolarHBondContact O-CB 3.36Å; S961-D965 VanDerWaalsContact O-CG 3.28Å; S961-D965 PolarHBondContact O-N 2.99Å; D965-V967 PolarHBondContact O-N 3.13Å; D965-E968 PolarHBondContact O-N 3.12Å; D965-H969 PolarHBondContact O-CE1 3.37Å; D965-H969 PolarHBondContact O-N 3Å; D965-H969 PolarHBondContact O-ND1 3.11Å |
| 966 | F | 93.5 | Very high | 92.1 | Very high | 0 Ų | 0 | 38.7 Ų | 38.7 | 0% | 0 | 20% | 0.2 | C | C | . | . | H | α-helix | trans | -60.5 | -46 | 177.8 | -179.4 | -94.4 | 0 | 0 | 0 | 112.6 | L905 L908 L909 V946 T947 F950 Q962 N963 T964 E968 H969 V970 | L905-F966 HydrophobicContact CD1-CE2 3.66Å; L905-F966 HydrophobicContact CD1-CZ 3.76Å; L905-F966 HydrophobicContact CD2-CE2 4.39Å; L905-F966 HydrophobicContact CD2-CZ 4.35Å; L905-F966 HydrophobicContact CG-CE2 3.85Å; L905-F966 HydrophobicContact CG-CZ 3.95Å; L908-F966 HydrophobicContact CB-CD2 3.78Å; L908-F966 HydrophobicContact CB-CE2 4.09Å; L909-F966 HydrophobicContact CD2-CB 3.73Å; L909-F966 HydrophobicContact CD2-CD1 4.38Å; L909-F966 HydrophobicContact CD2-CD2 3.6Å; L909-F966 HydrophobicContact CD2-CE2 4.27Å; L909-F966 HydrophobicContact CD2-CG 3.64Å; L909-F966 HydrophobicContact CG-CB 4.47Å; L909-F966 HydrophobicContact CG-CD2 3.57Å; L909-F966 HydrophobicContact CG-CE2 3.98Å; L909-F966 HydrophobicContact CG-CG 4.17Å; V946-F966 HydrophobicContact CB-CE1 4.22Å; V946-F966 HydrophobicContact CB-CZ 3.96Å; V946-F966 HydrophobicContact CG1-CD1 4.25Å; V946-F966 HydrophobicContact CG1-CE1 3.6Å; V946-F966 HydrophobicContact CG1-CE2 4.09Å; V946-F966 HydrophobicContact CG1-CZ 3.5Å; V946-F966 VanDerWaalsContact CG1-CZ 3.45Å; V946-F966 HydrophobicContact CG2-CZ 4.44Å; T947-F966 HydrophobicContact CG2-CE1 3.97Å; F950-F966 AromaticContact CE2-CD1 3.87Å; F950-F966 HydrophobicContact CE2-CD1 3.87Å; F950-F966 HydrophobicContact CE2-CE1 4.43Å; F950-F966 HydrophobicContact CZ-CB 4.36Å; F950-F966 AromaticContact CZ-CD1 3.53Å; F950-F966 HydrophobicContact CZ-CD1 3.53Å; F950-F966 VanDerWaalsContact CZ-CD1 3.5Å; F950-F966 HydrophobicContact CZ-CE1 4.12Å; F950-F966 HydrophobicContact CZ-CG 4.18Å; Q962-F966 WeakPolarHBondContact O-CB 3.48Å; Q962-F966 PolarHBondContact O-N 3.23Å; Q962-F966 VanDerWaalsContact O-N 3.08Å; N963-F966 PolarHBondContact O-N 3.12Å; T964-F966 VanDerWaalsContact C-N 3.32Å; T964-F966 PolarHBondContact O-N 3.21Å; F966-E968 VanDerWaalsContact C-N 3.31Å; F966-E968 PolarHBondContact O-N 3.02Å; F966-H969 PolarHBondContact O-N 3.24Å; F966-V970 HydrophobicContact CD1-CB 4.48Å; F966-V970 HydrophobicContact CD1-CG1 4.43Å; F966-V970 HydrophobicContact CD1-CG2 3.94Å; F966-V970 HydrophobicContact CD2-CG2 4.15Å; F966-V970 HydrophobicContact CE1-CB 4.35Å; F966-V970 HydrophobicContact CE1-CG1 4.15Å; F966-V970 HydrophobicContact CE1-CG2 3.71Å; F966-V970 VanDerWaalsContact CE1-CG2 3.45Å; F966-V970 HydrophobicContact CE2-CG2 3.75Å; F966-V970 HydrophobicContact CG-CG2 4.26Å; F966-V970 HydrophobicContact CZ-CB 4.31Å; F966-V970 HydrophobicContact CZ-CG2 3.6Å; F966-V970 VanDerWaalsContact CZ-CG2 3.44Å; F966-V970 WeakPolarHBondContact O-CB 3.35Å; F966-V970 WeakPolarHBondContact O-CG2 3.37Å; F966-V970 PolarHBondContact O-N 3.3Å |
| 967 | V | 94.5 | Very high | 92.3 | Very high | 0.25 Ų | 0.25 | 32.5 Ų | 32.5 | 0% | 0.002 | 17% | 0.171 | C | C | . | . | H | α-helix | trans | -57.3 | -46.4 | 175.9 | 166.5 | 0 | 0 | 0 | 0 | 110.5 | F950 N963 T964 D965 H969 V970 V971 L1001 Y1004 I1017 I1021 | F950-V967 HydrophobicContact CD2-CG2 4.41Å; F950-V967 HydrophobicContact CE2-CG2 3.89Å; N963-V967 WeakPolarHBondContact O-CG2 3.4Å; N963-V967 PolarHBondContact O-N 3.1Å; T964-V967 PolarHBondContact O-N 3.18Å; D965-V967 PolarHBondContact O-N 3.13Å; V967-H969 VanDerWaalsContact C-N 3.33Å; V967-H969 PolarHBondContact O-N 3.21Å; V967-V970 PolarHBondContact O-N 2.98Å; V967-V971 HydrophobicContact CG1-CG2 4.33Å; V967-V971 WeakPolarHBondContact O-CB 3.35Å; V967-V971 WeakPolarHBondContact O-CG2 3.38Å; V967-V971 PolarHBondContact O-N 3.36Å; V967-V971 VanDerWaalsContact O-N 3.09Å; V967-L1001 HydrophobicContact CB-CD2 4.4Å; V967-L1001 HydrophobicContact CG1-CD2 4.07Å; V967-L1001 HydrophobicContact CG2-CD2 4.04Å; V967-Y1004 HydrophobicContact CB-CD1 4.34Å; V967-Y1004 HydrophobicContact CG1-CD1 4.41Å; V967-Y1004 HydrophobicContact CG2-CD1 3.71Å; V967-Y1004 HydrophobicContact CG2-CE1 4.05Å; V967-Y1004 HydrophobicContact CG2-CG 4.01Å; V967-I1017 HydrophobicContact CG1-CG2 3.81Å; V967-I1021 HydrophobicContact CG1-CD1 4.43Å |
| 968 | E | 92.7 | Very high | 92.1 | Very high | 44.5 Ų | 44.5 | 31.6 Ų | 31.6 | 21% | 0.208 | 17% | 0.166 | C | C | . | . | H | α-helix | trans | -60.8 | -41.9 | 178.2 | -173.5 | 174.5 | 178.7 | 0 | 0 | 112.4 | T964 D965 F966 Y972 I1017 K1020 | T964-E968 PolarHBondContact O-N 3.17Å; T964-E968 VanDerWaalsContact O-N 3.09Å; D965-E968 PolarHBondContact O-N 3.12Å; F966-E968 VanDerWaalsContact C-N 3.31Å; F966-E968 PolarHBondContact O-N 3.02Å; E968-Y972 PolarHBondContact O-N 3.27Å; E968-I1017 HydrophobicContact CB-CD1 4.36Å; E968-I1017 HydrophobicContact CB-CG1 4.16Å; E968-I1017 HydrophobicContact CG-CG1 4.36Å; E968-K1020 HydrophobicContact CG-CD 4.3Å; E968-K1020 IonicContact OE1-NZ 3.64Å; E968-K1020 PolarHBondContact OE1-NZ 3.29Å |
| 969 | H | 93.5 | Very high | 92.1 | Very high | 20 Ų | 20 | 30 Ų | 30 | 9% | 0.093 | 16% | 0.157 | C | C | . | . | H | α-helix | trans | -68.2 | -47.2 | 178.7 | -63.5 | 140.8 | 0 | 0 | 0 | 112.6 | L908 K924 D965 F966 V967 V971 Y972 V973 | L908-H969 HydrophobicContact CB-CB 4.42Å; L908-H969 HydrophobicContact CD1-CB 4.2Å; L908-H969 HydrophobicContact CD2-CB 4.18Å; L908-H969 HydrophobicContact CG-CB 4.48Å; K924-H969 HydrophobicContact CD-CB 4.33Å; K924-H969 HydrophobicContact CG-CB 4.47Å; D965-H969 PolarHBondContact O-CE1 3.37Å; D965-H969 PolarHBondContact O-N 3Å; D965-H969 PolarHBondContact O-ND1 3.11Å; F966-H969 PolarHBondContact O-N 3.24Å; V967-H969 VanDerWaalsContact C-N 3.33Å; V967-H969 PolarHBondContact O-N 3.21Å; H969-V971 VanDerWaalsContact C-N 3.34Å; H969-V971 PolarHBondContact O-N 3.18Å; H969-Y972 WeakPolarHBondContact O-CB 3.33Å; H969-Y972 PolarHBondContact O-N 3.22Å; H969-V973 WeakPolarHBondContact O-CG2 3.32Å; H969-V973 PolarHBondContact O-N 3.1Å |
| 970 | V | 95.1 | Very high | 91.6 | Very high | 0.75 Ų | 0.75 | 29.1 Ų | 29.1 | 1% | 0.005 | 15% | 0.153 | C | C | . | . | H | α-helix | trans | -67.5 | -38.2 | -177.2 | 150.6 | 0 | 0 | 0 | 0 | 111.5 | L905 L908 I943 F966 V967 Y972 V973 M974 L1001 | L905-V970 HydrophobicContact CD1-CG2 4.31Å; L908-V970 HydrophobicContact CD1-CG2 4.43Å; I943-V970 HydrophobicContact CB-CG1 4.4Å; I943-V970 HydrophobicContact CB-CG2 4.33Å; I943-V970 HydrophobicContact CD1-CG1 3.89Å; I943-V970 HydrophobicContact CD1-CG2 3.46Å; I943-V970 VanDerWaalsContact CD1-CG2 3.46Å; I943-V970 HydrophobicContact CG1-CG1 4.06Å; I943-V970 HydrophobicContact CG1-CG2 4.11Å; I943-V970 HydrophobicContact CG2-CG1 3.51Å; I943-V970 VanDerWaalsContact CG2-CG1 3.48Å; I943-V970 HydrophobicContact CG2-CG2 3.71Å; F966-V970 HydrophobicContact CD1-CB 4.48Å; F966-V970 HydrophobicContact CD1-CG1 4.43Å; F966-V970 HydrophobicContact CD1-CG2 3.94Å; F966-V970 HydrophobicContact CD2-CG2 4.15Å; F966-V970 HydrophobicContact CE1-CB 4.35Å; F966-V970 HydrophobicContact CE1-CG1 4.15Å; F966-V970 HydrophobicContact CE1-CG2 3.71Å; F966-V970 VanDerWaalsContact CE1-CG2 3.45Å; F966-V970 HydrophobicContact CE2-CG2 3.75Å; F966-V970 HydrophobicContact CG-CG2 4.26Å; F966-V970 HydrophobicContact CZ-CB 4.31Å; F966-V970 HydrophobicContact CZ-CG2 3.6Å; F966-V970 VanDerWaalsContact CZ-CG2 3.44Å; F966-V970 WeakPolarHBondContact O-CB 3.35Å; F966-V970 WeakPolarHBondContact O-CG2 3.37Å; F966-V970 PolarHBondContact O-N 3.3Å; V967-V970 PolarHBondContact O-N 2.98Å; V970-Y972 VanDerWaalsContact C-N 3.29Å; V970-Y972 PolarHBondContact O-N 3.23Å; V970-V973 PolarHBondContact O-N 3.14Å; V970-V973 VanDerWaalsContact O-N 3.14Å; V970-M974 HydrophobicContact CG1-CG 3.91Å; V970-M974 HydrophobicContact CG1-SD 3.62Å; V970-M974 HydrophobicContact CG2-CG 4.37Å; V970-M974 HydrophobicContact CG2-SD 4.41Å; V970-M974 WeakPolarHBondContact O-CB 3.32Å; V970-M974 VanDerWaalsContact O-CG 3.32Å; V970-M974 WeakPolarHBondContact O-CG 3.31Å; V970-M974 PolarHBondContact O-N 3.1Å; V970-L1001 HydrophobicContact CG1-CD1 4.47Å; V970-L1001 HydrophobicContact CG1-CD2 3.92Å |
| 971 | V | 95.7 | Very high | 90.8 | Very high | 2 Ų | 2 | 27.7 Ų | 27.7 | 1% | 0.012 | 14% | 0.143 | C | C | . | . | H | α-helix | trans | -59.8 | -42.1 | 175 | 171.1 | 0 | 0 | 0 | 0 | 110.9 | V967 H969 K975 L1001 K1020 I1021 L1024 | V967-V971 HydrophobicContact CG1-CG2 4.33Å; V967-V971 WeakPolarHBondContact O-CB 3.35Å; V967-V971 WeakPolarHBondContact O-CG2 3.38Å; V967-V971 PolarHBondContact O-N 3.36Å; V967-V971 VanDerWaalsContact O-N 3.09Å; H969-V971 VanDerWaalsContact C-N 3.34Å; H969-V971 PolarHBondContact O-N 3.18Å; V971-K975 VanDerWaalsContact O-CB 3.26Å; V971-K975 WeakPolarHBondContact O-CB 3.31Å; V971-K975 PolarHBondContact O-N 3.1Å; V971-K975 VanDerWaalsContact O-N 3.11Å; V971-L1001 HydrophobicContact CG2-CD1 4.02Å; V971-L1001 HydrophobicContact CG2-CD2 4.39Å; V971-K1020 VanDerWaalsContact CG1-C 3.45Å; V971-K1020 HydrophobicContact CG1-CB 3.69Å; V971-K1020 WeakPolarHBondContact CG1-O 3.24Å; V971-I1021 HydrophobicContact CG1-CG1 4.23Å; V971-I1021 HydrophobicContact CG2-CD1 4.44Å; V971-I1021 HydrophobicContact CG2-CG1 3.67Å; V971-L1024 HydrophobicContact CB-CD2 4.47Å; V971-L1024 HydrophobicContact CG1-CB 4.18Å; V971-L1024 HydrophobicContact CG1-CD2 4.16Å; V971-L1024 HydrophobicContact CG2-CD2 4.44Å |
| 972 | Y | 95 | Very high | 89.7 | Confident | 80.25 Ų | 80.25 | 25.8 Ų | 25.8 | 32% | 0.315 | 13% | 0.13 | S | C | . | . | H | α-helix | trans | -62.2 | -48 | 174.1 | 173.1 | -89.5 | 0 | 0 | 0 | 111.7 | K924 E968 H969 V970 K975 N976 | K924-Y972 HydrophobicContact CB-CD1 4.1Å; K924-Y972 HydrophobicContact CB-CE1 4.02Å; K924-Y972 HydrophobicContact CD-CD1 4.19Å; K924-Y972 HydrophobicContact CG-CD1 4.41Å; E968-Y972 PolarHBondContact O-N 3.27Å; H969-Y972 WeakPolarHBondContact O-CB 3.33Å; H969-Y972 PolarHBondContact O-N 3.22Å; V970-Y972 VanDerWaalsContact C-N 3.29Å; V970-Y972 PolarHBondContact O-N 3.23Å; Y972-K975 PolarHBondContact O-N 3.26Å; Y972-N976 VanDerWaalsContact CE1-ND2 3.3Å; Y972-N976 WeakPolarHBondContact CE1-ND2 3.43Å; Y972-N976 VanDerWaalsContact CE2-ND2 3.27Å; Y972-N976 WeakPolarHBondContact CE2-ND2 3.32Å; Y972-N976 PolarHBondContact O-N 3.17Å; Y972-N976 PolarHBondContact O-ND2 3.12Å |
| 973 | V | 95 | Very high | 88.5 | Confident | 0.75 Ų | 0.75 | 29.9 Ų | 29.9 | 1% | 0.005 | 15% | 0.147 | C | C | . | . | H | α-helix | trans | -63.1 | -53.2 | -178.2 | 174.6 | 0 | 0 | 0 | 0 | 110.8 | K924 C927 F939 H969 V970 K975 N976 V977 | K924-V973 HydrophobicContact CB-CG2 4.24Å; K924-V973 HydrophobicContact CG-CG2 4.13Å; C927-V973 HydrophobicContact CB-CG1 3.65Å; C927-V973 HydrophobicContact CB-CG2 4.42Å; F939-V973 HydrophobicContact CE1-CG1 3.67Å; F939-V973 HydrophobicContact CZ-CG1 4Å; H969-V973 WeakPolarHBondContact O-CG2 3.32Å; H969-V973 PolarHBondContact O-N 3.1Å; V970-V973 PolarHBondContact O-N 3.14Å; V970-V973 VanDerWaalsContact O-N 3.14Å; V973-K975 VanDerWaalsContact C-N 3.28Å; V973-K975 PolarHBondContact O-N 3.19Å; V973-N976 PolarHBondContact O-N 3.11Å; V973-N976 VanDerWaalsContact O-N 3.12Å; V973-V977 HydrophobicContact CG1-CG2 4.09Å; V973-V977 VanDerWaalsContact O-CG2 3.32Å; V973-V977 WeakPolarHBondContact O-CG2 3.36Å; V973-V977 PolarHBondContact O-N 3.02Å |
| 974 | M | 93.8 | Very high | 87 | Confident | 0 Ų | 0 | 33.2 Ų | 33.2 | 0% | 0 | 16% | 0.164 | C | C | . | . | H | α-helix | trans | -55.8 | -42.8 | 179.6 | -71.9 | 179.8 | 70.8 | 0 | 0 | 112 | F940 I943 V970 N976 V977 L978 I994 I997 M998 L1001 L1024 | F940-M974 HydrophobicContact CD1-CG 4.48Å; F940-M974 HydrophobicContact CE1-CB 4.47Å; F940-M974 HydrophobicContact CE1-CG 3.95Å; F940-M974 HydrophobicContact CE2-CE 4.43Å; F940-M974 HydrophobicContact CZ-CB 4.39Å; F940-M974 HydrophobicContact CZ-CE 4.43Å; F940-M974 HydrophobicContact CZ-CG 4.19Å; I943-M974 HydrophobicContact CD1-CG 4.06Å; I943-M974 HydrophobicContact CD1-SD 4.42Å; I943-M974 HydrophobicContact CG2-SD 4.25Å; V970-M974 HydrophobicContact CG1-CG 3.91Å; V970-M974 HydrophobicContact CG1-SD 3.62Å; V970-M974 HydrophobicContact CG2-CG 4.37Å; V970-M974 HydrophobicContact CG2-SD 4.41Å; V970-M974 WeakPolarHBondContact O-CB 3.32Å; V970-M974 VanDerWaalsContact O-CG 3.32Å; V970-M974 WeakPolarHBondContact O-CG 3.31Å; V970-M974 PolarHBondContact O-N 3.1Å; M974-N976 VanDerWaalsContact C-N 3.35Å; M974-N976 PolarHBondContact O-N 3.21Å; M974-V977 PolarHBondContact O-N 3.16Å; M974-L978 WeakPolarHBondContact O-CB 3.41Å; M974-L978 VanDerWaalsContact O-CG 3.31Å; M974-L978 WeakPolarHBondContact O-CG 3.38Å; M974-L978 PolarHBondContact O-N 3.11Å; M974-I994 HydrophobicContact CE-CD1 3.88Å; M974-I994 HydrophobicContact CE-CG1 3.87Å; M974-I994 HydrophobicContact CE-CG2 4.07Å; M974-I997 HydrophobicContact CE-CB 4.33Å; M974-I997 HydrophobicContact CE-CD1 4.39Å; M974-I997 HydrophobicContact CE-CG2 3.7Å; M974-I997 HydrophobicContact SD-CG2 3.7Å; M974-M998 HydrophobicContact CE-SD 4.39Å; M974-L1001 HydrophobicContact SD-CD1 4.08Å; M974-L1024 HydrophobicContact CB-CD1 4.02Å; M974-L1024 HydrophobicContact CB-CD2 4.12Å; M974-L1024 HydrophobicContact CE-CD2 4.45Å; M974-L1024 HydrophobicContact SD-CD2 4.42Å |
| 975 | K | 94 | Very high | 85.2 | Confident | 52 Ų | 52 | 37.1 Ų | 37.1 | 23% | 0.226 | 18% | 0.184 | C | C | . | . | H | α-helix | trans | -58.7 | -47.7 | 178.5 | -177.9 | -173.7 | 173.3 | -171.5 | 0 | 111.2 | V971 Y972 V973 L979 Q1023 L1024 V1027 | V971-K975 VanDerWaalsContact O-CB 3.26Å; V971-K975 WeakPolarHBondContact O-CB 3.31Å; V971-K975 PolarHBondContact O-N 3.1Å; V971-K975 VanDerWaalsContact O-N 3.11Å; Y972-K975 PolarHBondContact O-N 3.26Å; V973-K975 VanDerWaalsContact C-N 3.28Å; V973-K975 PolarHBondContact O-N 3.19Å; K975-L979 HydrophobicContact CG-CD1 4.18Å; K975-L979 WeakPolarHBondContact O-CB 3.35Å; K975-L979 VanDerWaalsContact O-CG 3.27Å; K975-L979 WeakPolarHBondContact O-CG 3.23Å; K975-L979 PolarHBondContact O-N 3.19Å; K975-L979 VanDerWaalsContact O-N 3.08Å; K975-Q1023 HydrophobicContact CD-CB 4.4Å; K975-L1024 HydrophobicContact CB-CB 4.49Å; K975-L1024 HydrophobicContact CB-CD1 4.02Å; K975-V1027 HydrophobicContact CG-CG2 4.09Å |
| 976 | N | 93.1 | Very high | 83.4 | Confident | 19.25 Ų | 19.25 | 37.3 Ų | 37.3 | 10% | 0.103 | 19% | 0.19 | C | C | . | . | H | α-helix | trans | -73.4 | -36.5 | -177.7 | -66.2 | -47.1 | 0 | 0 | 0 | 112.4 | Y929 Y972 V973 M974 L978 L979 N980 | Y929-N976 HydrophobicContact CE1-CB 4.39Å; Y929-N976 PolarHBondContact OH-OD1 3.29Å; Y972-N976 VanDerWaalsContact CE1-ND2 3.3Å; Y972-N976 WeakPolarHBondContact CE1-ND2 3.43Å; Y972-N976 VanDerWaalsContact CE2-ND2 3.27Å; Y972-N976 WeakPolarHBondContact CE2-ND2 3.32Å; Y972-N976 PolarHBondContact O-N 3.17Å; Y972-N976 PolarHBondContact O-ND2 3.12Å; V973-N976 PolarHBondContact O-N 3.11Å; V973-N976 VanDerWaalsContact O-N 3.12Å; M974-N976 VanDerWaalsContact C-N 3.35Å; M974-N976 PolarHBondContact O-N 3.21Å; N976-L978 PolarHBondContact O-N 3.28Å; N976-L979 PolarHBondContact O-N 3.16Å; N976-N980 VanDerWaalsContact O-CG 3.28Å; N976-N980 PolarHBondContact O-N 3.14Å; N976-N980 VanDerWaalsContact O-N 3.12Å; N976-N980 PolarHBondContact O-ND2 3.11Å; N976-N980 VanDerWaalsContact O-ND2 3.09Å |
| 977 | V | 90.4 | Very high | 81.4 | Confident | 4.5 Ų | 4.5 | 46.6 Ų | 46.6 | 3% | 0.027 | 23% | 0.225 | C | C | . | . | H | α-helix | trans | -57.5 | -50.7 | 172.9 | 171.8 | 0 | 0 | 0 | 0 | 110.2 | C927 I936 F940 V973 M974 L979 N980 C981 | C927-V977 VanDerWaalsContact O-CG2 3.26Å; C927-V977 WeakPolarHBondContact O-CG2 3.36Å; I936-V977 HydrophobicContact CD1-CG1 3.99Å; I936-V977 HydrophobicContact CG1-CG1 4.18Å; I936-V977 HydrophobicContact CG2-CG1 3.71Å; F940-V977 HydrophobicContact CE1-CG1 4.21Å; F940-V977 HydrophobicContact CZ-CB 4.45Å; F940-V977 HydrophobicContact CZ-CG1 3.99Å; V973-V977 HydrophobicContact CG1-CG2 4.09Å; V973-V977 VanDerWaalsContact O-CG2 3.32Å; V973-V977 WeakPolarHBondContact O-CG2 3.36Å; V973-V977 PolarHBondContact O-N 3.02Å; M974-V977 PolarHBondContact O-N 3.16Å; V977-L979 PolarHBondContact O-N 3.3Å; V977-N980 WeakPolarHBondContact O-CB 3.46Å; V977-N980 PolarHBondContact O-N 3.21Å; V977-N980 VanDerWaalsContact O-N 3.13Å; V977-C981 PolarHBondContact O-N 2.99Å; V977-C981 PolarHBondContact O-SG 3.23Å |
| 978 | L | 87.2 | Confident | 79.4 | Confident | 4.25 Ų | 4.25 | 51 Ų | 51 | 2% | 0.022 | 25% | 0.252 | C | S | . | . | H | α-helix | trans | -66.4 | -37.2 | -179.1 | -68.9 | 171.1 | 0 | 0 | 0 | 113.1 | F940 M974 N976 N980 C981 S982 L991 I994 L1024 V1027 V1028 V1035 | F940-L978 HydrophobicContact CE2-CD2 4.1Å; F940-L978 HydrophobicContact CE2-CG 4.45Å; F940-L978 HydrophobicContact CZ-CD2 4.25Å; F940-L978 HydrophobicContact CZ-CG 4.26Å; M974-L978 WeakPolarHBondContact O-CB 3.41Å; M974-L978 VanDerWaalsContact O-CG 3.31Å; M974-L978 WeakPolarHBondContact O-CG 3.38Å; M974-L978 PolarHBondContact O-N 3.11Å; N976-L978 PolarHBondContact O-N 3.28Å; L978-N980 PolarHBondContact O-N 3.03Å; L978-C981 PolarHBondContact O-N 3.13Å; L978-S982 PolarHBondContact O-N 3.38Å; L978-S982 VanDerWaalsContact O-N 3.09Å; L978-L991 HydrophobicContact CD2-CD1 3.51Å; L978-L991 HydrophobicContact CD2-CD2 4.18Å; L978-I994 HydrophobicContact CD1-CD1 3.97Å; L978-I994 HydrophobicContact CD2-CD1 3.76Å; L978-L1024 HydrophobicContact CD1-CD1 3.92Å; L978-V1027 HydrophobicContact CB-CG1 3.74Å; L978-V1028 HydrophobicContact CD1-CG2 3.6Å; L978-V1035 HydrophobicContact CD2-CG2 4.29Å |
| 979 | L | 87.6 | Confident | 77.6 | Confident | 70 Ų | 70 | 49.4 Ų | 49.4 | 37% | 0.366 | 25% | 0.246 | S | C | . | . | H | α-helix | trans | -61.3 | -33.5 | 173.1 | -77 | 171.4 | 0 | 0 | 0 | 112.2 | K975 N976 V977 S982 V1027 | K975-L979 HydrophobicContact CG-CD1 4.18Å; K975-L979 WeakPolarHBondContact O-CB 3.35Å; K975-L979 VanDerWaalsContact O-CG 3.27Å; K975-L979 WeakPolarHBondContact O-CG 3.23Å; K975-L979 PolarHBondContact O-N 3.19Å; K975-L979 VanDerWaalsContact O-N 3.08Å; N976-L979 PolarHBondContact O-N 3.16Å; V977-L979 PolarHBondContact O-N 3.3Å; L979-S982 PolarHBondContact O-OG 2.97Å; L979-S982 VanDerWaalsContact O-OG 3.09Å; L979-V1027 HydrophobicContact CD1-CG2 4.41Å; L979-V1027 HydrophobicContact CD2-CG1 4.02Å; L979-V1027 HydrophobicContact CD2-CG2 3.85Å; L979-V1027 HydrophobicContact CG-CG1 3.95Å; L979-V1027 HydrophobicContact CG-CG2 4.06Å |
| 980 | N | 80.5 | Confident | 75.9 | Confident | 50.75 Ų | 50.75 | 55.2 Ų | 55.2 | 27% | 0.271 | 27% | 0.273 | S | S | . | . | H | α-helix | trans | -79.9 | -33.1 | 176.8 | -67.7 | -32.3 | 0 | 0 | 0 | 112.5 | S928 Y929 N976 V977 L978 S982 K983 | S928-N980 PolarHBondContact O-ND2 3.38Å; S928-N980 VanDerWaalsContact O-ND2 3.08Å; Y929-N980 WeakPolarHBondContact CD1-ND2 3.33Å; N976-N980 VanDerWaalsContact O-CG 3.28Å; N976-N980 PolarHBondContact O-N 3.14Å; N976-N980 VanDerWaalsContact O-N 3.12Å; N976-N980 PolarHBondContact O-ND2 3.11Å; N976-N980 VanDerWaalsContact O-ND2 3.09Å; V977-N980 WeakPolarHBondContact O-CB 3.46Å; V977-N980 PolarHBondContact O-N 3.21Å; V977-N980 VanDerWaalsContact O-N 3.13Å; L978-N980 PolarHBondContact O-N 3.03Å; N980-S982 VanDerWaalsContact C-N 3.31Å; N980-S982 PolarHBondContact O-N 3.26Å; N980-K983 PolarHBondContact O-N 3.05Å |
| 981 | C | 74 | Confident | 74.4 | Confident | 11.25 Ų | 11.25 | 56.4 Ų | 56.4 | 8% | 0.076 | 28% | 0.279 | C | S | . | . | H | α-helix | trans | -62.9 | -31.9 | 176 | -68.2 | 0 | 0 | 0 | 0 | 113.1 | I936 V977 L978 K983 L984 L991 | I936-C981 VanDerWaalsContact CD1-SG 3.54Å; I936-C981 WeakPolarHBondContact CD1-SG 3.4Å; V977-C981 PolarHBondContact O-N 2.99Å; V977-C981 PolarHBondContact O-SG 3.23Å; L978-C981 PolarHBondContact O-N 3.13Å; C981-K983 PolarHBondContact O-N 3.14Å; C981-L984 WeakPolarHBondContact O-CB 3.47Å; C981-L984 PolarHBondContact O-N 3.2Å; C981-L991 HydrophobicContact CB-CD1 4.43Å |
| 982 | S | 64.5 | Low | 73.1 | Confident | 49.5 Ų | 49.5 | 58.1 Ų | 58.1 | 35% | 0.346 | 29% | 0.289 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -58.9 | -13.7 | 178.5 | 70.9 | 0 | 0 | 0 | 0 | 114.6 | L978 L979 N980 N1031 | L978-S982 PolarHBondContact O-N 3.38Å; L978-S982 VanDerWaalsContact O-N 3.09Å; L979-S982 PolarHBondContact O-OG 2.97Å; L979-S982 VanDerWaalsContact O-OG 3.09Å; N980-S982 VanDerWaalsContact C-N 3.31Å; N980-S982 PolarHBondContact O-N 3.26Å; S982-N1031 WeakPolarHBondContact CA-OD1 3.44Å; S982-N1031 WeakPolarHBondContact CB-OD1 3.37Å |
| 983 | K | 64.6 | Low | 72.3 | Confident | 165.5 Ų | 165.5 | 55.5 Ų | 55.5 | 72% | 0.72 | 28% | 0.283 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -96.2 | -5.8 | 177.4 | -58.7 | -179.4 | -179 | 176.7 | 0 | 113.5 | N980 C981 | N980-K983 PolarHBondContact O-N 3.05Å; C981-K983 PolarHBondContact O-N 3.14Å |
| 984 | L | 59.7 | Low | 71.9 | Confident | 84 Ų | 84 | 55.6 Ų | 55.6 | 44% | 0.44 | 28% | 0.283 | S | S | . | . | S | Bend | trans | -108.2 | 151.2 | -173.9 | -67.9 | 163.6 | 0 | 0 | 0 | 110.2 | V933 C981 A986 T989 H1034 | V933-L984 HydrophobicContact CG2-CD1 4.21Å; C981-L984 WeakPolarHBondContact O-CB 3.47Å; C981-L984 PolarHBondContact O-N 3.2Å; L984-A986 PolarHBondContact O-N 3.03Å; L984-T989 HydrophobicContact CB-CG2 3.95Å; L984-T989 HydrophobicContact CD1-CG2 4.11Å; L984-H1034 PolarHBondContact O-CE1 2.92Å |
| 985 | D | 55.2 | Low | 71.7 | Confident | 90.75 Ų | 90.75 | 56.3 Ų | 56.3 | 49% | 0.485 | 29% | 0.286 | S | S | . | . | trans | -65.1 | 124.2 | -175.4 | -148.1 | -13.4 | 0 | 0 | 0 | 111.4 | R987 T988 T989 | D985-R987 PolarHBondContact O-N 3.17Å; D985-R987 PolarHBondContact OD1-N 3.2Å; D985-T988 PolarHBondContact O-N 3.34Å; D985-T988 VanDerWaalsContact O-N 3.1Å; D985-T988 PolarHBondContact O-OG1 3.37Å; D985-T988 VanDerWaalsContact O-OG1 3.07Å; D985-T989 PolarHBondContact O-N 2.96Å; D985-T989 PolarHBondContact O-OG1 3.39Å | ||
| 986 | A | 52.3 | Low | 71.5 | Confident | 33 Ų | 33 | 55.6 Ų | 55.6 | 27% | 0.273 | 29% | 0.287 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -58.2 | -23.7 | -172.6 | 0 | 0 | 0 | 0 | 0 | 114 | L984 T988 T989 H1034 | L984-A986 PolarHBondContact O-N 3.03Å; A986-T988 VanDerWaalsContact C-N 3.33Å; A986-T988 PolarHBondContact O-N 2.83Å; A986-T989 PolarHBondContact O-OG1 3.4Å; A986-T989 VanDerWaalsContact O-OG1 3.07Å; A986-H1034 VanDerWaalsContact CA-CE1 3.4Å; A986-H1034 WeakPolarHBondContact CA-CE1 3.45Å; A986-H1034 WeakPolarHBondContact CA-ND1 3.41Å; A986-H1034 VanDerWaalsContact CB-CE1 3.41Å; A986-H1034 WeakPolarHBondContact CB-CE1 3.38Å; A986-H1034 VanDerWaalsContact CB-ND1 3.3Å; A986-H1034 WeakPolarHBondContact CB-ND1 3.41Å; A986-H1034 PolarHBondContact N-CE1 2.72Å; A986-H1034 VanDerWaalsContact N-CE1 3.3Å |
| 987 | R | 51.3 | Low | 71.5 | Confident | 196.25 Ų | 196.25 | 54.8 Ų | 54.8 | 74% | 0.741 | 28% | 0.283 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -71.8 | -29.4 | -177.9 | -61.1 | -175.6 | -172.7 | -177 | 4.5 | 113.2 | D985 W1593 | D985-R987 PolarHBondContact O-N 3.17Å; D985-R987 PolarHBondContact OD1-N 3.2Å; R987-W1593 HydrophobicContact CG-CE3 4.45Å; R987-W1593 VanDerWaalsContact NH2-CH2 3.28Å |
| 988 | T | 52 | Low | 71.7 | Confident | 92.5 Ų | 92.5 | 54.6 Ų | 54.6 | 57% | 0.567 | 28% | 0.282 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -89.8 | -19.5 | -176 | 42.2 | 0 | 0 | 0 | 0 | 113.5 | D985 A986 Q990 | D985-T988 PolarHBondContact O-N 3.34Å; D985-T988 VanDerWaalsContact O-N 3.1Å; D985-T988 PolarHBondContact O-OG1 3.37Å; D985-T988 VanDerWaalsContact O-OG1 3.07Å; A986-T988 VanDerWaalsContact C-N 3.33Å; A986-T988 PolarHBondContact O-N 2.83Å; T988-Q990 PolarHBondContact O-N 2.97Å |
| 989 | T | 54.5 | Low | 71.9 | Confident | 10.5 Ų | 10.5 | 55.9 Ų | 55.9 | 6% | 0.064 | 29% | 0.288 | C | S | . | . | trans | -97.4 | 90.3 | -176.7 | 5.4 | 0 | 0 | 0 | 0 | 111 | V933 L984 D985 A986 L991 R1565 | V933-T989 HydrophobicContact CG2-CG2 3.61Å; V933-T989 WeakPolarHBondContact CG2-OG1 3.17Å; L984-T989 HydrophobicContact CB-CG2 3.95Å; L984-T989 HydrophobicContact CD1-CG2 4.11Å; D985-T989 PolarHBondContact O-N 2.96Å; D985-T989 PolarHBondContact O-OG1 3.39Å; A986-T989 PolarHBondContact O-OG1 3.4Å; A986-T989 VanDerWaalsContact O-OG1 3.07Å; T989-L991 HydrophobicContact CG2-CD1 3.6Å; T989-L991 HydrophobicContact CG2-CD2 4.48Å; T989-L991 HydrophobicContact CG2-CG 3.68Å; T989-L991 PolarHBondContact O-N 3.28Å; T989-R1565 PolarHBondContact O-NH2 3.37Å | ||
| 990 | Q | 58 | Low | 72.2 | Confident | 141.75 Ų | 141.75 | 53.5 Ų | 53.5 | 66% | 0.662 | 28% | 0.276 | S | S | * | . | trans | -70.9 | 86.3 | 165.1 | -69.9 | -174.9 | -8 | 0 | 0 | 109.7 | G937 H938 T988 V992 V1036 | G937-Q990 WeakPolarHBondContact CA-O 3.41Å; H938-Q990 PolarHBondContact CE1-OE1 3.14Å; T988-Q990 PolarHBondContact O-N 2.97Å; Q990-V992 PolarHBondContact O-N 3.19Å; Q990-V1036 HydrophobicContact CB-CG2 4.28Å | ||
| 991 | L | 63.7 | Low | 72.9 | Confident | 25.75 Ų | 25.75 | 51.2 Ų | 51.2 | 14% | 0.135 | 26% | 0.263 | C | S | . | . | P | Polyproline II helix | trans | -74.2 | 132.1 | 177.4 | -75.2 | 157.4 | 0 | 0 | 0 | 110.4 | I936 F940 L978 C981 T989 H1034 V1035 V1036 | I936-L991 HydrophobicContact CB-CD2 4.09Å; I936-L991 HydrophobicContact CG2-CD2 3.65Å; F940-L991 HydrophobicContact CD2-CD2 3.98Å; F940-L991 HydrophobicContact CE2-CD2 3.68Å; F940-L991 HydrophobicContact CZ-CD2 4.48Å; L978-L991 HydrophobicContact CD2-CD1 3.51Å; L978-L991 HydrophobicContact CD2-CD2 4.18Å; C981-L991 HydrophobicContact CB-CD1 4.43Å; T989-L991 HydrophobicContact CG2-CD1 3.6Å; T989-L991 HydrophobicContact CG2-CD2 4.48Å; T989-L991 HydrophobicContact CG2-CG 3.68Å; T989-L991 PolarHBondContact O-N 3.28Å; L991-H1034 WeakPolarHBondContact CB-O 3.5Å; L991-H1034 HydrophobicContact CD1-CB 4.34Å; L991-H1034 VanDerWaalsContact CD1-O 3.29Å; L991-H1034 WeakPolarHBondContact CD1-O 3.23Å; L991-H1034 WeakPolarHBondContact CD2-O 3.34Å; L991-H1034 WeakPolarHBondContact CG-O 3.35Å; L991-H1034 PolarHBondContact N-O 3.25Å; L991-V1035 HydrophobicContact CD1-CG2 4.31Å; L991-V1036 HydrophobicContact CB-CB 4.39Å; L991-V1036 HydrophobicContact CB-CG2 3.48Å; L991-V1036 VanDerWaalsContact CB-CG2 3.48Å; L991-V1036 HydrophobicContact CD1-CG2 4.17Å; L991-V1036 HydrophobicContact CG-CG2 4.46Å; L991-V1036 WeakPolarHBondContact O-CB 3.13Å; L991-V1036 VanDerWaalsContact O-CG2 3.26Å; L991-V1036 WeakPolarHBondContact O-CG2 3.39Å; L991-V1036 PolarHBondContact O-N 3.19Å |
| 992 | V | 69.4 | Low | 73.8 | Confident | 38.5 Ų | 38.5 | 50.6 Ų | 50.6 | 23% | 0.233 | 26% | 0.26 | C | S | . | . | P | Polyproline II helix | trans | -73.1 | 151 | 173.5 | 173.1 | 0 | 0 | 0 | 0 | 109.8 | G937 F940 E941 Q990 I994 | G937-V992 VanDerWaalsContact CA-CG2 3.45Å; G937-V992 WeakPolarHBondContact O-CG2 3.42Å; F940-V992 HydrophobicContact CB-CG1 4.38Å; E941-V992 HydrophobicContact CG-CB 4.32Å; E941-V992 HydrophobicContact CG-CG1 3.91Å; E941-V992 HydrophobicContact CG-CG2 3.83Å; E941-V992 WeakPolarHBondContact OE1-CG2 3.33Å; Q990-V992 PolarHBondContact O-N 3.19Å; V992-I994 VanDerWaalsContact O-CG1 3.31Å; V992-I994 WeakPolarHBondContact O-CG1 3.5Å; V992-I994 PolarHBondContact O-N 2.9Å; V992-I994 VanDerWaalsContact O-N 3.1Å |
| 993 | C | 77.7 | Confident | 75.1 | Confident | 25.75 Ų | 25.75 | 52.7 Ų | 52.7 | 17% | 0.174 | 26% | 0.262 | C | S | . | . | P | Polyproline II helix | trans | -56.2 | 116.1 | 177.2 | -176.4 | 0 | 0 | 0 | 0 | 111.2 | E995 P996 V1036 Q1038 | C993-E995 VanDerWaalsContact C-N 3.32Å; C993-P996 WeakPolarHBondContact O-CD 3.46Å; C993-V1036 VanDerWaalsContact CA-O 3.28Å; C993-V1036 WeakPolarHBondContact CA-O 3.37Å; C993-Q1038 HydrophobicContact CB-CG 4.42Å |
| 994 | I | 85.7 | Confident | 76.5 | Confident | 2 Ų | 2 | 44.9 Ų | 44.9 | 1% | 0.01 | 23% | 0.229 | C | C | . | . | trans | -82.8 | -16.5 | -175.9 | -108.9 | 174.9 | 0 | 0 | 0 | 112.3 | F940 M974 L978 V992 I997 M998 V1028 V1035 F1037 | F940-I994 HydrophobicContact CD2-CD1 4.15Å; F940-I994 HydrophobicContact CD2-CG1 4.05Å; F940-I994 HydrophobicContact CE2-CD1 3.99Å; F940-I994 HydrophobicContact CE2-CG1 4.18Å; M974-I994 HydrophobicContact CE-CD1 3.88Å; M974-I994 HydrophobicContact CE-CG1 3.87Å; M974-I994 HydrophobicContact CE-CG2 4.07Å; L978-I994 HydrophobicContact CD1-CD1 3.97Å; L978-I994 HydrophobicContact CD2-CD1 3.76Å; V992-I994 VanDerWaalsContact O-CG1 3.31Å; V992-I994 WeakPolarHBondContact O-CG1 3.5Å; V992-I994 PolarHBondContact O-N 2.9Å; V992-I994 VanDerWaalsContact O-N 3.1Å; I994-I997 PolarHBondContact O-N 3.19Å; I994-M998 HydrophobicContact CD1-CG 4.4Å; I994-M998 HydrophobicContact CG1-CG 3.95Å; I994-M998 HydrophobicContact CG2-CG 3.87Å; I994-M998 VanDerWaalsContact CG2-CG 3.49Å; I994-M998 HydrophobicContact CG2-SD 4.39Å; I994-M998 WeakPolarHBondContact O-CG 3.31Å; I994-M998 PolarHBondContact O-N 3.15Å; I994-M998 VanDerWaalsContact O-N 3.12Å; I994-V1028 HydrophobicContact CD1-CG1 4.4Å; I994-V1028 HydrophobicContact CD1-CG2 3.69Å; I994-V1028 HydrophobicContact CG2-CG1 4.17Å; I994-V1028 HydrophobicContact CG2-CG2 4.4Å; I994-V1035 HydrophobicContact CB-CG1 4.03Å; I994-V1035 HydrophobicContact CD1-CB 4.42Å; I994-V1035 HydrophobicContact CD1-CG1 3.96Å; I994-V1035 HydrophobicContact CD1-CG2 3.79Å; I994-V1035 HydrophobicContact CG1-CG1 3.84Å; I994-V1035 HydrophobicContact CG2-CG1 3.58Å; I994-F1037 HydrophobicContact CG2-CE1 4.05Å | ||
| 995 | E | 89.5 | Confident | 78.1 | Confident | 15.25 Ų | 15.25 | 40.9 Ų | 40.9 | 7% | 0.071 | 21% | 0.208 | C | C | . | . | H | α-helix | trans | -53.7 | -49 | -173.3 | -56.7 | 178.5 | -176 | 0 | 0 | 113.4 | C993 I997 M998 L999 F1037 Q1038 S1039 F1043 | C993-E995 VanDerWaalsContact C-N 3.32Å; E995-I997 VanDerWaalsContact C-N 3.33Å; E995-I997 PolarHBondContact O-N 3.19Å; E995-M998 PolarHBondContact O-N 3.02Å; E995-L999 WeakPolarHBondContact O-CB 3.46Å; E995-L999 VanDerWaalsContact O-CG 3.27Å; E995-L999 WeakPolarHBondContact O-CG 3.42Å; E995-L999 PolarHBondContact O-N 3.09Å; E995-F1037 HydrophobicContact CG-CD1 3.89Å; E995-F1037 VanDerWaalsContact OE1-CA 3.28Å; E995-F1037 WeakPolarHBondContact OE1-CA 3.23Å; E995-F1037 VanDerWaalsContact OE1-CB 3.29Å; E995-F1037 WeakPolarHBondContact OE1-CB 3.32Å; E995-F1037 WeakPolarHBondContact OE1-CD1 3.29Å; E995-Q1038 VanDerWaalsContact CD-N 3.34Å; E995-Q1038 PolarHBondContact OE1-N 3.24Å; E995-S1039 PolarHBondContact OE1-N 3.23Å; E995-S1039 VanDerWaalsContact OE1-N 3.1Å; E995-S1039 PolarHBondContact OE2-N 3.17Å; E995-F1043 HydrophobicContact CB-CD2 3.68Å; E995-F1043 HydrophobicContact CB-CE2 3.93Å; E995-F1043 HydrophobicContact CB-CG 4.15Å; E995-F1043 HydrophobicContact CB-CZ 4.47Å; E995-F1043 HydrophobicContact CG-CB 4.06Å; E995-F1043 HydrophobicContact CG-CD1 4.09Å; E995-F1043 HydrophobicContact CG-CD2 3.77Å; E995-F1043 HydrophobicContact CG-CE1 4.44Å; E995-F1043 HydrophobicContact CG-CE2 4.18Å; E995-F1043 HydrophobicContact CG-CG 3.7Å; E995-F1043 HydrophobicContact CG-CZ 4.43Å |
| 996 | P | 89.9 | Confident | 79.7 | Confident | 37.5 Ų | 37.5 | 40.8 Ų | 40.8 | 24% | 0.244 | 20% | 0.204 | C | C | . | . | H | α-helix | trans | -64 | -38.9 | -176.6 | -22.3 | 35.8 | 0 | 0 | 0 | 112.4 | H944 C993 L999 N1000 | H944-P996 VanDerWaalsContact NE2-CB 3.28Å; H944-P996 WeakPolarHBondContact NE2-CB 3.45Å; C993-P996 WeakPolarHBondContact O-CD 3.46Å; P996-L999 PolarHBondContact O-N 3.11Å; P996-N1000 WeakPolarHBondContact O-CB 3.41Å; P996-N1000 VanDerWaalsContact O-CG 3.24Å; P996-N1000 PolarHBondContact O-N 3.34Å; P996-N1000 PolarHBondContact O-ND2 3.16Å; P996-N1000 PolarHBondContact O-OD1 3.29Å |
| 997 | I | 93.1 | Very high | 81.5 | Confident | 1.25 Ų | 1.25 | 42.7 Ų | 42.7 | 1% | 0.006 | 21% | 0.212 | C | C | . | . | H | α-helix | trans | -63.5 | -50.2 | 177.8 | -56.9 | 167.8 | 0 | 0 | 0 | 109.6 | F940 I943 H944 M974 I994 E995 L999 N1000 L1001 | F940-I997 HydrophobicContact CB-CD1 3.84Å; F940-I997 HydrophobicContact CG-CD1 4.34Å; F940-I997 WeakPolarHBondContact O-CD1 3.39Å; I943-I997 HydrophobicContact CG2-CD1 4.42Å; I943-I997 HydrophobicContact CG2-CG1 4.48Å; I943-I997 HydrophobicContact CG2-CG2 3.64Å; H944-I997 HydrophobicContact CB-CD1 4.15Å; H944-I997 HydrophobicContact CB-CG1 3.61Å; M974-I997 HydrophobicContact CE-CB 4.33Å; M974-I997 HydrophobicContact CE-CD1 4.39Å; M974-I997 HydrophobicContact CE-CG2 3.7Å; M974-I997 HydrophobicContact SD-CG2 3.7Å; I994-I997 PolarHBondContact O-N 3.19Å; E995-I997 VanDerWaalsContact C-N 3.33Å; E995-I997 PolarHBondContact O-N 3.19Å; I997-L999 VanDerWaalsContact C-N 3.31Å; I997-L999 PolarHBondContact O-N 3.22Å; I997-N1000 PolarHBondContact O-N 3.34Å; I997-N1000 VanDerWaalsContact O-N 3.15Å; I997-L1001 HydrophobicContact CG2-CD1 3.94Å; I997-L1001 HydrophobicContact CG2-CG 4.27Å; I997-L1001 VanDerWaalsContact O-CG 3.26Å; I997-L1001 WeakPolarHBondContact O-CG 3.34Å; I997-L1001 PolarHBondContact O-N 3.1Å |
| 998 | M | 94.6 | Very high | 83.3 | Confident | 1 Ų | 1 | 34.2 Ų | 34.2 | 1% | 0.005 | 18% | 0.181 | C | C | . | . | H | α-helix | trans | -62.3 | -40.3 | -178.8 | -69.8 | -58 | -62.6 | 0 | 0 | 112 | M974 I994 E995 L1001 C1002 I1021 L1024 I1025 V1028 F1043 | M974-M998 HydrophobicContact CE-SD 4.39Å; I994-M998 HydrophobicContact CD1-CG 4.4Å; I994-M998 HydrophobicContact CG1-CG 3.95Å; I994-M998 HydrophobicContact CG2-CG 3.87Å; I994-M998 VanDerWaalsContact CG2-CG 3.49Å; I994-M998 HydrophobicContact CG2-SD 4.39Å; I994-M998 WeakPolarHBondContact O-CG 3.31Å; I994-M998 PolarHBondContact O-N 3.15Å; I994-M998 VanDerWaalsContact O-N 3.12Å; E995-M998 PolarHBondContact O-N 3.02Å; M998-L1001 PolarHBondContact O-N 3.22Å; M998-L1001 HydrophobicContact SD-CD1 4.34Å; M998-C1002 WeakPolarHBondContact O-CB 3.3Å; M998-C1002 PolarHBondContact O-N 3.15Å; M998-C1002 PolarHBondContact O-SG 3.01Å; M998-C1002 VanDerWaalsContact O-SG 3.37Å; M998-I1021 HydrophobicContact CE-CG2 4.47Å; M998-L1024 HydrophobicContact CE-CD2 3.98Å; M998-L1024 HydrophobicContact CE-CG 3.93Å; M998-L1024 HydrophobicContact SD-CD2 3.55Å; M998-L1024 VanDerWaalsContact SD-CD2 3.55Å; M998-L1024 HydrophobicContact SD-CG 3.89Å; M998-I1025 HydrophobicContact CE-CB 4.4Å; M998-I1025 HydrophobicContact CE-CD1 4.15Å; M998-I1025 HydrophobicContact CE-CG1 3.26Å; M998-V1028 HydrophobicContact SD-CG2 4.48Å; M998-F1043 HydrophobicContact CB-CE2 3.85Å; M998-F1043 HydrophobicContact CB-CZ 3.75Å; M998-F1043 HydrophobicContact CG-CZ 4.18Å |
| 999 | L | 92.6 | Very high | 84.7 | Confident | 32 Ų | 32 | 36.6 Ų | 36.6 | 17% | 0.168 | 19% | 0.191 | C | C | . | . | H | α-helix | trans | -64 | -43.2 | 175.1 | -70 | 175.3 | 0 | 0 | 0 | 111.6 | E995 P996 I997 C1002 K1003 F1043 K1046 L1047 L1050 | E995-L999 WeakPolarHBondContact O-CB 3.46Å; E995-L999 VanDerWaalsContact O-CG 3.27Å; E995-L999 WeakPolarHBondContact O-CG 3.42Å; E995-L999 PolarHBondContact O-N 3.09Å; P996-L999 PolarHBondContact O-N 3.11Å; I997-L999 VanDerWaalsContact C-N 3.31Å; I997-L999 PolarHBondContact O-N 3.22Å; L999-C1002 PolarHBondContact O-N 2.98Å; L999-K1003 VanDerWaalsContact O-CB 3.31Å; L999-K1003 WeakPolarHBondContact O-CB 3.25Å; L999-K1003 VanDerWaalsContact O-CG 3.23Å; L999-K1003 WeakPolarHBondContact O-CG 3.39Å; L999-K1003 PolarHBondContact O-N 3.06Å; L999-F1043 HydrophobicContact CD1-CD2 4.44Å; L999-F1043 HydrophobicContact CD2-CD2 4.27Å; L999-F1043 HydrophobicContact CD2-CE2 4.32Å; L999-F1043 HydrophobicContact CG-CD2 4.16Å; L999-F1043 HydrophobicContact CG-CE2 4.12Å; L999-K1046 HydrophobicContact CD1-CD 4.31Å; L999-K1046 HydrophobicContact CD2-CB 4.38Å; L999-K1046 HydrophobicContact CD2-CD 3.76Å; L999-K1046 HydrophobicContact CD2-CG 4.02Å; L999-L1047 HydrophobicContact CD2-CD2 4.18Å; L999-L1050 HydrophobicContact CD2-CD1 4.41Å |
| 1000 | N | 93 | Very high | 85.9 | Confident | 19.5 Ų | 19.5 | 40.2 Ų | 40.2 | 10% | 0.104 | 21% | 0.212 | C | C | . | . | H | α-helix | trans | -63.2 | -43.1 | 176.6 | -71.3 | -9.7 | 0 | 0 | 0 | 111.8 | P996 I997 K1003 Y1004 | P996-N1000 WeakPolarHBondContact O-CB 3.41Å; P996-N1000 VanDerWaalsContact O-CG 3.24Å; P996-N1000 PolarHBondContact O-N 3.34Å; P996-N1000 PolarHBondContact O-ND2 3.16Å; P996-N1000 PolarHBondContact O-OD1 3.29Å; I997-N1000 PolarHBondContact O-N 3.34Å; I997-N1000 VanDerWaalsContact O-N 3.15Å; N1000-K1003 PolarHBondContact O-N 3.11Å; N1000-Y1004 VanDerWaalsContact O-CB 3.31Å; N1000-Y1004 WeakPolarHBondContact O-CB 3.39Å; N1000-Y1004 PolarHBondContact O-N 3.05Å |
| 1001 | L | 94.7 | Very high | 86.9 | Confident | 0.8 Ų | 0.8 | 34.6 Ų | 34.6 | 0% | 0.004 | 19% | 0.193 | C | C | . | . | H | α-helix | trans | -63.6 | -43 | 176.5 | -65.2 | 174.5 | 0 | 0 | 0 | 111.9 | T947 V967 V970 V971 M974 I997 M998 Y1004 A1005 I1021 L1024 | T947-L1001 HydrophobicContact CG2-CD2 4.08Å; V967-L1001 HydrophobicContact CB-CD2 4.4Å; V967-L1001 HydrophobicContact CG1-CD2 4.07Å; V967-L1001 HydrophobicContact CG2-CD2 4.04Å; V970-L1001 HydrophobicContact CG1-CD1 4.47Å; V970-L1001 HydrophobicContact CG1-CD2 3.92Å; V971-L1001 HydrophobicContact CG2-CD1 4.02Å; V971-L1001 HydrophobicContact CG2-CD2 4.39Å; M974-L1001 HydrophobicContact SD-CD1 4.08Å; I997-L1001 HydrophobicContact CG2-CD1 3.94Å; I997-L1001 HydrophobicContact CG2-CG 4.27Å; I997-L1001 VanDerWaalsContact O-CG 3.26Å; I997-L1001 WeakPolarHBondContact O-CG 3.34Å; I997-L1001 PolarHBondContact O-N 3.1Å; M998-L1001 PolarHBondContact O-N 3.22Å; M998-L1001 HydrophobicContact SD-CD1 4.34Å; L1001-Y1004 PolarHBondContact O-N 3.22Å; L1001-A1005 WeakPolarHBondContact O-CB 3.32Å; L1001-A1005 PolarHBondContact O-N 3.16Å; L1001-I1021 HydrophobicContact CB-CD1 4.38Å; L1001-L1024 HydrophobicContact CD1-CD2 4.39Å |
| 1002 | C | 93.9 | Very high | 87.7 | Confident | 0 Ų | 0 | 36.8 Ų | 36.8 | 0% | 0 | 21% | 0.211 | C | C | . | . | H | α-helix | trans | -68.3 | -43.2 | 178 | -70 | 0 | 0 | 0 | 0 | 112.1 | M998 L999 Y1004 A1005 H1006 L1047 L1050 W1054 | M998-C1002 WeakPolarHBondContact O-CB 3.3Å; M998-C1002 PolarHBondContact O-N 3.15Å; M998-C1002 PolarHBondContact O-SG 3.01Å; M998-C1002 VanDerWaalsContact O-SG 3.37Å; L999-C1002 PolarHBondContact O-N 2.98Å; C1002-Y1004 VanDerWaalsContact C-N 3.33Å; C1002-Y1004 PolarHBondContact O-N 3.17Å; C1002-A1005 PolarHBondContact O-N 3.15Å; C1002-H1006 VanDerWaalsContact O-CB 3.32Å; C1002-H1006 WeakPolarHBondContact O-CB 3.35Å; C1002-H1006 PolarHBondContact O-N 3.19Å; C1002-L1047 HydrophobicContact CB-CD2 4.31Å; C1002-L1050 HydrophobicContact CB-CD1 3.95Å; C1002-W1054 HydrophobicContact CB-CH2 4.35Å; C1002-W1054 HydrophobicContact CB-CZ2 4.37Å |
| 1003 | K | 91.5 | Very high | 88.4 | Confident | 93.2 Ų | 93.2 | 39.5 Ų | 39.5 | 41% | 0.405 | 22% | 0.22 | S | C | . | . | H | α-helix | trans | -58.5 | -46.2 | 173.7 | -76.3 | 174.8 | -179 | -179.3 | 0 | 110.8 | L999 N1000 A1005 H1006 V1007 | L999-K1003 VanDerWaalsContact O-CB 3.31Å; L999-K1003 WeakPolarHBondContact O-CB 3.25Å; L999-K1003 VanDerWaalsContact O-CG 3.23Å; L999-K1003 WeakPolarHBondContact O-CG 3.39Å; L999-K1003 PolarHBondContact O-N 3.06Å; N1000-K1003 PolarHBondContact O-N 3.11Å; K1003-A1005 PolarHBondContact O-N 3.05Å; K1003-H1006 WeakPolarHBondContact O-CB 3.44Å; K1003-H1006 PolarHBondContact O-N 3.29Å; K1003-V1007 PolarHBondContact O-N 3.22Å |
| 1004 | Y | 93.6 | Very high | 88.9 | Confident | 2.6 Ų | 2.6 | 38.6 Ų | 38.6 | 1% | 0.01 | 22% | 0.215 | C | C | . | . | H | α-helix | trans | -59.3 | -49.9 | 176.9 | -169.6 | -84.8 | 0 | 0 | 0 | 111.7 | F950 V957 C960 N963 T964 V967 N1000 L1001 C1002 H1006 V1007 L1008 | F950-Y1004 HydrophobicContact CB-CD2 4.19Å; F950-Y1004 HydrophobicContact CB-CE2 4.44Å; F950-Y1004 AromaticContact CD2-CD2 3.85Å; F950-Y1004 HydrophobicContact CD2-CD2 3.85Å; F950-Y1004 HydrophobicContact CD2-CE2 4.12Å; F950-Y1004 HydrophobicContact CG-CD2 4.39Å; F950-Y1004 HydrophobicContact CG-CE2 4.44Å; V957-Y1004 HydrophobicContact CG1-CD2 3.43Å; V957-Y1004 VanDerWaalsContact CG1-CD2 3.45Å; V957-Y1004 HydrophobicContact CG1-CE2 3.94Å; V957-Y1004 HydrophobicContact CG1-CG 4.22Å; C960-Y1004 PolarHBondContact N-OH 2.9Å; C960-Y1004 PolarHBondContact O-OH 3.21Å; N963-Y1004 HydrophobicContact CB-CE2 3.72Å; N963-Y1004 VanDerWaalsContact CB-OH 3.24Å; N963-Y1004 WeakPolarHBondContact CB-OH 3.34Å; T964-Y1004 PolarHBondContact N-OH 3.25Å; T964-Y1004 VanDerWaalsContact N-OH 3.11Å; T964-Y1004 PolarHBondContact OG1-OH 3.15Å; V967-Y1004 HydrophobicContact CB-CD1 4.34Å; V967-Y1004 HydrophobicContact CG1-CD1 4.41Å; V967-Y1004 HydrophobicContact CG2-CD1 3.71Å; V967-Y1004 HydrophobicContact CG2-CE1 4.05Å; V967-Y1004 HydrophobicContact CG2-CG 4.01Å; N1000-Y1004 VanDerWaalsContact O-CB 3.31Å; N1000-Y1004 WeakPolarHBondContact O-CB 3.39Å; N1000-Y1004 PolarHBondContact O-N 3.05Å; L1001-Y1004 PolarHBondContact O-N 3.22Å; C1002-Y1004 VanDerWaalsContact C-N 3.33Å; C1002-Y1004 PolarHBondContact O-N 3.17Å; Y1004-H1006 VanDerWaalsContact C-N 3.26Å; Y1004-H1006 PolarHBondContact O-N 3.17Å; Y1004-V1007 PolarHBondContact O-N 3.07Å; Y1004-L1008 HydrophobicContact CD1-CD1 4.44Å; Y1004-L1008 HydrophobicContact CD1-CD2 4.46Å; Y1004-L1008 HydrophobicContact CD1-CG 4.41Å; Y1004-L1008 HydrophobicContact CE1-CD1 4.37Å; Y1004-L1008 HydrophobicContact CE1-CD2 3.9Å; Y1004-L1008 HydrophobicContact CE1-CG 4.28Å |
| 1005 | A | 93 | Very high | 89.1 | Confident | 0 Ų | 0 | 39.1 Ų | 39.1 | 0% | 0 | 22% | 0.217 | C | C | . | . | H | α-helix | trans | -65.5 | -27.7 | 179.6 | 0 | 0 | 0 | 0 | 0 | 113.6 | L1001 C1002 K1003 V1007 L1008 I1017 K1018 I1021 W1054 | L1001-A1005 WeakPolarHBondContact O-CB 3.32Å; L1001-A1005 PolarHBondContact O-N 3.16Å; C1002-A1005 PolarHBondContact O-N 3.15Å; K1003-A1005 PolarHBondContact O-N 3.05Å; A1005-V1007 VanDerWaalsContact C-N 3.34Å; A1005-V1007 PolarHBondContact O-N 3.43Å; A1005-L1008 PolarHBondContact O-N 3.28Å; A1005-I1017 HydrophobicContact CB-CG2 4.31Å; A1005-K1018 HydrophobicContact CB-CG 4.14Å; A1005-K1018 WeakPolarHBondContact O-CE 3.41Å; A1005-I1021 HydrophobicContact CB-CD1 3.48Å; A1005-I1021 VanDerWaalsContact CB-CD1 3.46Å; A1005-W1054 HydrophobicContact CB-CH2 4.19Å; A1005-W1054 HydrophobicContact CB-CZ2 3.99Å |
| 1006 | H | 90.6 | Very high | 89.1 | Confident | 87.8 Ų | 87.8 | 40.9 Ų | 40.9 | 41% | 0.406 | 23% | 0.229 | S | C | . | . | H | α-helix | trans | -66.5 | -37.5 | 179 | -176.1 | 85.9 | 0 | 0 | 0 | 112.3 | C1002 K1003 Y1004 S1053 W1054 | C1002-H1006 VanDerWaalsContact O-CB 3.32Å; C1002-H1006 WeakPolarHBondContact O-CB 3.35Å; C1002-H1006 PolarHBondContact O-N 3.19Å; K1003-H1006 WeakPolarHBondContact O-CB 3.44Å; K1003-H1006 PolarHBondContact O-N 3.29Å; Y1004-H1006 VanDerWaalsContact C-N 3.26Å; Y1004-H1006 PolarHBondContact O-N 3.17Å; H1006-S1053 PolarHBondContact CE1-OG 3.34Å; H1006-S1053 VanDerWaalsContact CE1-OG 3.25Å; H1006-S1053 PolarHBondContact ND1-OG 3.33Å; H1006-W1054 AromaticContact ND1-CD1 3.98Å; H1006-W1054 AromaticContact ND1-NE1 3.57Å |
| 1007 | V | 90.2 | Very high | 89.2 | Confident | 73.6 Ų | 73.6 | 39.2 Ų | 39.2 | 45% | 0.446 | 22% | 0.218 | S | C | . | . | H | α-helix | trans | -84.7 | -10.3 | -177.7 | -165.4 | 0 | 0 | 0 | 0 | 112.6 | V957 I959 K1003 Y1004 A1005 D1009 | V957-V1007 HydrophobicContact CB-CG2 4.42Å; V957-V1007 HydrophobicContact CG2-CG2 4.32Å; I959-V1007 HydrophobicContact CD1-CB 3.89Å; I959-V1007 HydrophobicContact CD1-CG1 3.65Å; I959-V1007 VanDerWaalsContact CD1-O 3.26Å; I959-V1007 WeakPolarHBondContact CD1-O 3.24Å; K1003-V1007 PolarHBondContact O-N 3.22Å; Y1004-V1007 PolarHBondContact O-N 3.07Å; A1005-V1007 VanDerWaalsContact C-N 3.34Å; A1005-V1007 PolarHBondContact O-N 3.43Å; V1007-D1009 PolarHBondContact O-N 3.22Å |
| 1008 | L | 89.1 | Confident | 89.2 | Confident | 17.8 Ų | 17.8 | 40.1 Ų | 40.1 | 9% | 0.093 | 22% | 0.222 | C | C | . | . | S | Bend | trans | -62.5 | 134.9 | 177 | -71.8 | 176.9 | 0 | 0 | 0 | 112.4 | I959 T964 Y1004 A1005 A1014 I1017 | I959-L1008 HydrophobicContact CD1-CD2 4.44Å; I959-L1008 HydrophobicContact CG2-CD2 3.9Å; T964-L1008 HydrophobicContact CG2-CD1 4.41Å; T964-L1008 HydrophobicContact CG2-CD2 4.38Å; Y1004-L1008 HydrophobicContact CD1-CD1 4.44Å; Y1004-L1008 HydrophobicContact CD1-CD2 4.46Å; Y1004-L1008 HydrophobicContact CD1-CG 4.41Å; Y1004-L1008 HydrophobicContact CE1-CD1 4.37Å; Y1004-L1008 HydrophobicContact CE1-CD2 3.9Å; Y1004-L1008 HydrophobicContact CE1-CG 4.28Å; A1005-L1008 PolarHBondContact O-N 3.28Å; L1008-A1014 HydrophobicContact CB-CB 3.95Å; L1008-A1014 HydrophobicContact CD1-CB 4.37Å; L1008-I1017 HydrophobicContact CD1-CD1 4.06Å; L1008-I1017 HydrophobicContact CD1-CG2 4.37Å |
| 1009 | D | 80.6 | Confident | 89.2 | Confident | 142.2 Ų | 142.2 | 40.5 Ų | 40.5 | 76% | 0.76 | 23% | 0.225 | S | C | * | . | trans | -57.1 | 147.5 | 174.8 | -69.3 | -38.4 | 0 | 0 | 0 | 112.3 | V1007 G1011 A1014 | V1007-D1009 PolarHBondContact O-N 3.22Å; D1009-G1011 PolarHBondContact O-N 3.35Å; D1009-G1011 VanDerWaalsContact O-N 3.1Å; D1009-A1014 WeakPolarHBondContact O-CB 3.4Å | ||
| 1010 | V | 79.1 | Confident | 89.3 | Confident | 85 Ų | 85 | 41.8 Ų | 41.8 | 52% | 0.515 | 23% | 0.229 | S | C | . | . | S | Bend | trans | -64.8 | 113.3 | -179.5 | -176.7 | 0 | 0 | 0 | 0 | 109.9 | F1015 L1073 | V1010-F1015 HydrophobicContact CG1-CE1 3.84Å; V1010-F1015 HydrophobicContact CG1-CZ 3.57Å; V1010-L1073 HydrophobicContact CB-CD1 4.47Å; V1010-L1073 HydrophobicContact CG1-CD1 3.6Å; V1010-L1073 HydrophobicContact CG1-CD2 4.47Å |
| 1011 | G | 79.3 | Confident | 89.5 | Confident | 24.6 Ų | 24.6 | 40.9 Ų | 40.9 | 25% | 0.254 | 22% | 0.224 | S | C | . | . | S | Bend | trans | -171.3 | 169.6 | -179.5 | 0 | 0 | 0 | 0 | 0 | 112.9 | D1009 Q1013 A1014 F1015 | D1009-G1011 PolarHBondContact O-N 3.35Å; D1009-G1011 VanDerWaalsContact O-N 3.1Å; G1011-Q1013 VanDerWaalsContact C-N 3.33Å; G1011-Q1013 PolarHBondContact O-N 3.14Å; G1011-A1014 PolarHBondContact O-N 3.06Å; G1011-A1014 VanDerWaalsContact O-N 3.15Å; G1011-F1015 WeakPolarHBondContact O-CD1 3.16Å; G1011-F1015 VanDerWaalsContact O-CG 3.29Å; G1011-F1015 WeakPolarHBondContact O-CG 3.39Å; G1011-F1015 PolarHBondContact O-N 3.19Å |
| 1012 | S | 80.5 | Confident | 89.6 | Confident | 73.4 Ų | 73.4 | 40.9 Ų | 40.9 | 51% | 0.513 | 22% | 0.224 | S | C | . | . | H | α-helix | trans | -59 | -39.8 | -175.9 | 141.4 | 0 | 0 | 0 | 0 | 113.4 | F1015 T1016 | S1012-F1015 PolarHBondContact O-N 3.1Å; S1012-T1016 WeakPolarHBondContact O-CB 3.34Å; S1012-T1016 PolarHBondContact O-N 2.96Å; S1012-T1016 PolarHBondContact O-OG1 2.98Å |
| 1013 | Q | 84.1 | Confident | 89.7 | Confident | 93.2 Ų | 93.2 | 44.1 Ų | 44.1 | 44% | 0.436 | 24% | 0.239 | S | C | . | . | H | α-helix | trans | -66.1 | -44.8 | 176.4 | -171 | 177.1 | 17.1 | 0 | 0 | 111.4 | T964 G1011 F1015 T1016 I1017 | T964-Q1013 HydrophobicContact CG2-CG 4.39Å; G1011-Q1013 VanDerWaalsContact C-N 3.33Å; G1011-Q1013 PolarHBondContact O-N 3.14Å; Q1013-F1015 VanDerWaalsContact C-N 3.33Å; Q1013-F1015 PolarHBondContact O-N 3.33Å; Q1013-T1016 WeakPolarHBondContact O-CB 3.41Å; Q1013-T1016 PolarHBondContact O-N 2.99Å; Q1013-T1016 VanDerWaalsContact O-N 3.16Å; Q1013-I1017 HydrophobicContact CG-CD1 4.09Å; Q1013-I1017 WeakPolarHBondContact O-CG1 3.31Å; Q1013-I1017 PolarHBondContact O-N 2.91Å |
| 1014 | A | 88.1 | Confident | 89.9 | Confident | 7.4 Ų | 7.4 | 39.6 Ų | 39.6 | 6% | 0.061 | 22% | 0.22 | C | C | . | . | H | α-helix | trans | -61.1 | -42.1 | 176.8 | 0 | 0 | 0 | 0 | 0 | 111.7 | L1008 D1009 G1011 T1016 I1017 K1018 | L1008-A1014 HydrophobicContact CB-CB 3.95Å; L1008-A1014 HydrophobicContact CD1-CB 4.37Å; D1009-A1014 WeakPolarHBondContact O-CB 3.4Å; G1011-A1014 PolarHBondContact O-N 3.06Å; G1011-A1014 VanDerWaalsContact O-N 3.15Å; A1014-T1016 VanDerWaalsContact C-N 3.33Å; A1014-T1016 PolarHBondContact O-N 3.31Å; A1014-I1017 PolarHBondContact O-N 3.41Å; A1014-K1018 WeakPolarHBondContact O-CB 3.34Å; A1014-K1018 VanDerWaalsContact O-CG 3.31Å; A1014-K1018 WeakPolarHBondContact O-CG 3.42Å; A1014-K1018 PolarHBondContact O-N 3.21Å |
| 1015 | F | 89 | Confident | 89.9 | Confident | 13.8 Ų | 13.8 | 39.6 Ų | 39.6 | 6% | 0.061 | 22% | 0.22 | C | C | . | . | H | α-helix | trans | -62.4 | -40.4 | 174.9 | -63.6 | -19 | 0 | 0 | 0 | 112.3 | V1010 G1011 S1012 Q1013 S1019 L1073 L1082 L1085 | V1010-F1015 HydrophobicContact CG1-CE1 3.84Å; V1010-F1015 HydrophobicContact CG1-CZ 3.57Å; G1011-F1015 WeakPolarHBondContact O-CD1 3.16Å; G1011-F1015 VanDerWaalsContact O-CG 3.29Å; G1011-F1015 WeakPolarHBondContact O-CG 3.39Å; G1011-F1015 PolarHBondContact O-N 3.19Å; S1012-F1015 PolarHBondContact O-N 3.1Å; Q1013-F1015 VanDerWaalsContact C-N 3.33Å; Q1013-F1015 PolarHBondContact O-N 3.33Å; F1015-S1019 VanDerWaalsContact O-CB 3.3Å; F1015-S1019 WeakPolarHBondContact O-CB 3.36Å; F1015-S1019 PolarHBondContact O-N 3.11Å; F1015-S1019 PolarHBondContact O-OG 3.15Å; F1015-L1073 HydrophobicContact CE2-CD2 3.98Å; F1015-L1073 HydrophobicContact CZ-CD2 4.06Å; F1015-L1082 HydrophobicContact CD2-CB 4.36Å; F1015-L1082 HydrophobicContact CE1-CD1 4.34Å; F1015-L1082 HydrophobicContact CE2-CB 4.29Å; F1015-L1082 HydrophobicContact CE2-CD1 4.39Å; F1015-L1082 HydrophobicContact CZ-CD1 4.17Å; F1015-L1085 HydrophobicContact CB-CB 4.42Å; F1015-L1085 HydrophobicContact CB-CD2 4.32Å; F1015-L1085 HydrophobicContact CD1-CD2 3.58Å; F1015-L1085 HydrophobicContact CE1-CD2 4.14Å; F1015-L1085 HydrophobicContact CG-CD2 4.13Å |
| 1016 | T | 89.6 | Confident | 90 | Very high | 51.8 Ų | 51.8 | 43.4 Ų | 43.4 | 32% | 0.318 | 24% | 0.237 | S | C | . | . | H | α-helix | trans | -64.4 | -45.4 | 177.3 | -58.5 | 0 | 0 | 0 | 0 | 111.3 | S1012 Q1013 A1014 S1019 K1020 | S1012-T1016 WeakPolarHBondContact O-CB 3.34Å; S1012-T1016 PolarHBondContact O-N 2.96Å; S1012-T1016 PolarHBondContact O-OG1 2.98Å; Q1013-T1016 WeakPolarHBondContact O-CB 3.41Å; Q1013-T1016 PolarHBondContact O-N 2.99Å; Q1013-T1016 VanDerWaalsContact O-N 3.16Å; A1014-T1016 VanDerWaalsContact C-N 3.33Å; A1014-T1016 PolarHBondContact O-N 3.31Å; T1016-S1019 PolarHBondContact O-N 3.24Å; T1016-K1020 HydrophobicContact CG2-CD 4.31Å; T1016-K1020 WeakPolarHBondContact O-CB 3.22Å; T1016-K1020 VanDerWaalsContact O-CG 3.31Å; T1016-K1020 WeakPolarHBondContact O-CG 3.39Å; T1016-K1020 PolarHBondContact O-N 3.03Å |
| 1017 | I | 92.3 | Very high | 90 | Very high | 1.2 Ų | 1.2 | 39.9 Ų | 39.9 | 1% | 0.006 | 22% | 0.221 | C | C | . | . | H | α-helix | trans | -63.3 | -50.1 | 177.8 | -69 | 170.5 | 0 | 0 | 0 | 110.7 | T964 V967 E968 A1005 L1008 Q1013 A1014 S1019 K1020 I1021 | T964-I1017 HydrophobicContact CG2-CD1 3.49Å; T964-I1017 VanDerWaalsContact CG2-CD1 3.47Å; V967-I1017 HydrophobicContact CG1-CG2 3.81Å; E968-I1017 HydrophobicContact CB-CD1 4.36Å; E968-I1017 HydrophobicContact CB-CG1 4.16Å; E968-I1017 HydrophobicContact CG-CG1 4.36Å; A1005-I1017 HydrophobicContact CB-CG2 4.31Å; L1008-I1017 HydrophobicContact CD1-CD1 4.06Å; L1008-I1017 HydrophobicContact CD1-CG2 4.37Å; Q1013-I1017 HydrophobicContact CG-CD1 4.09Å; Q1013-I1017 WeakPolarHBondContact O-CG1 3.31Å; Q1013-I1017 PolarHBondContact O-N 2.91Å; A1014-I1017 PolarHBondContact O-N 3.41Å; I1017-S1019 VanDerWaalsContact C-N 3.29Å; I1017-S1019 PolarHBondContact O-N 2.95Å; I1017-K1020 PolarHBondContact O-N 3.15Å; I1017-K1020 VanDerWaalsContact O-N 3.14Å; I1017-I1021 HydrophobicContact CG2-CD1 3.81Å; I1017-I1021 HydrophobicContact CG2-CG1 4.42Å; I1017-I1021 WeakPolarHBondContact O-CG1 3.39Å; I1017-I1021 PolarHBondContact O-N 3.28Å |
| 1018 | K | 94.7 | Very high | 90 | Very high | 20.4 Ų | 20.4 | 36.5 Ų | 36.5 | 9% | 0.089 | 20% | 0.2 | C | C | . | . | H | α-helix | trans | -57.6 | -42.4 | 177.1 | -72.5 | 176.1 | 177.9 | 179.5 | 0 | 111.6 | A1005 A1014 K1020 I1021 C1022 W1054 L1085 | A1005-K1018 HydrophobicContact CB-CG 4.14Å; A1005-K1018 WeakPolarHBondContact O-CE 3.41Å; A1014-K1018 WeakPolarHBondContact O-CB 3.34Å; A1014-K1018 VanDerWaalsContact O-CG 3.31Å; A1014-K1018 WeakPolarHBondContact O-CG 3.42Å; A1014-K1018 PolarHBondContact O-N 3.21Å; K1018-K1020 PolarHBondContact O-N 3.18Å; K1018-I1021 PolarHBondContact O-N 3.11Å; K1018-C1022 PolarHBondContact O-N 3.14Å; K1018-C1022 PolarHBondContact O-SG 3.32Å; K1018-W1054 HydrophobicContact CB-CD2 4.41Å; K1018-W1054 HydrophobicContact CB-CE3 3.92Å; K1018-W1054 HydrophobicContact CB-CZ3 4.09Å; K1018-W1054 HydrophobicContact CD-CB 4.41Å; K1018-W1054 HydrophobicContact CD-CD2 3.89Å; K1018-W1054 HydrophobicContact CD-CE3 4.28Å; K1018-W1054 HydrophobicContact CD-CG 3.95Å; K1018-W1054 HydrophobicContact CG-CD2 4.01Å; K1018-W1054 HydrophobicContact CG-CE3 3.99Å; K1018-W1054 HydrophobicContact CG-CG 4.49Å; K1018-W1054 HydrophobicContact CG-CH2 4.35Å; K1018-W1054 HydrophobicContact CG-CZ2 4.33Å; K1018-W1054 HydrophobicContact CG-CZ3 4.17Å; K1018-L1085 HydrophobicContact CB-CD1 3.46Å; K1018-L1085 VanDerWaalsContact CB-CD1 3.45Å; K1018-L1085 HydrophobicContact CD-CD2 4.44Å |
| 1019 | S | 93.8 | Very high | 90 | Very high | 10.6 Ų | 10.6 | 36.3 Ų | 36.3 | 7% | 0.074 | 20% | 0.199 | C | C | . | . | H | α-helix | trans | -61.4 | -45.1 | 175.8 | -59.3 | 0 | 0 | 0 | 0 | 112 | F1015 T1016 I1017 C1022 Q1023 L1085 | F1015-S1019 VanDerWaalsContact O-CB 3.3Å; F1015-S1019 WeakPolarHBondContact O-CB 3.36Å; F1015-S1019 PolarHBondContact O-N 3.11Å; F1015-S1019 PolarHBondContact O-OG 3.15Å; T1016-S1019 PolarHBondContact O-N 3.24Å; I1017-S1019 VanDerWaalsContact C-N 3.29Å; I1017-S1019 PolarHBondContact O-N 2.95Å; S1019-C1022 WeakPolarHBondContact O-CB 3.41Å; S1019-C1022 PolarHBondContact O-N 2.87Å; S1019-Q1023 WeakPolarHBondContact O-CG 3.45Å; S1019-Q1023 PolarHBondContact O-N 3.21Å; S1019-L1085 VanDerWaalsContact OG-CA 3.31Å; S1019-L1085 WeakPolarHBondContact OG-CA 3.43Å |
| 1020 | K | 94.8 | Very high | 90.2 | Very high | 58.8 Ų | 58.8 | 33.9 Ų | 33.9 | 26% | 0.256 | 19% | 0.19 | S | C | . | . | H | α-helix | trans | -64.2 | -39.5 | 176.8 | -72.9 | 175.6 | 178.1 | -179.9 | 0 | 112.1 | E968 V971 T1016 I1017 K1018 Q1023 L1024 | E968-K1020 HydrophobicContact CG-CD 4.3Å; E968-K1020 IonicContact OE1-NZ 3.64Å; E968-K1020 PolarHBondContact OE1-NZ 3.29Å; V971-K1020 VanDerWaalsContact CG1-C 3.45Å; V971-K1020 HydrophobicContact CG1-CB 3.69Å; V971-K1020 WeakPolarHBondContact CG1-O 3.24Å; T1016-K1020 HydrophobicContact CG2-CD 4.31Å; T1016-K1020 WeakPolarHBondContact O-CB 3.22Å; T1016-K1020 VanDerWaalsContact O-CG 3.31Å; T1016-K1020 WeakPolarHBondContact O-CG 3.39Å; T1016-K1020 PolarHBondContact O-N 3.03Å; I1017-K1020 PolarHBondContact O-N 3.15Å; I1017-K1020 VanDerWaalsContact O-N 3.14Å; K1018-K1020 PolarHBondContact O-N 3.18Å; K1020-Q1023 WeakPolarHBondContact O-CB 3.37Å; K1020-Q1023 PolarHBondContact O-N 3.08Å; K1020-L1024 PolarHBondContact O-N 3.27Å |
| 1021 | I | 96.7 | Very high | 90.1 | Very high | 0 Ų | 0 | 30.8 Ų | 30.8 | 0% | 0 | 17% | 0.17 | C | C | . | . | H | α-helix | trans | -62.9 | -44.7 | 174.9 | -70 | 169.3 | 0 | 0 | 0 | 110.3 | V967 V971 M998 L1001 A1005 I1017 K1018 Q1023 L1024 I1025 W1054 | V967-I1021 HydrophobicContact CG1-CD1 4.43Å; V971-I1021 HydrophobicContact CG1-CG1 4.23Å; V971-I1021 HydrophobicContact CG2-CD1 4.44Å; V971-I1021 HydrophobicContact CG2-CG1 3.67Å; M998-I1021 HydrophobicContact CE-CG2 4.47Å; L1001-I1021 HydrophobicContact CB-CD1 4.38Å; A1005-I1021 HydrophobicContact CB-CD1 3.48Å; A1005-I1021 VanDerWaalsContact CB-CD1 3.46Å; I1017-I1021 HydrophobicContact CG2-CD1 3.81Å; I1017-I1021 HydrophobicContact CG2-CG1 4.42Å; I1017-I1021 WeakPolarHBondContact O-CG1 3.39Å; I1017-I1021 PolarHBondContact O-N 3.28Å; K1018-I1021 PolarHBondContact O-N 3.11Å; I1021-Q1023 VanDerWaalsContact C-N 3.3Å; I1021-Q1023 PolarHBondContact O-N 3.19Å; I1021-L1024 CarbonylContact O-C 3.53Å; I1021-L1024 WeakPolarHBondContact O-CA 3.32Å; I1021-L1024 WeakPolarHBondContact O-CB 3.41Å; I1021-L1024 PolarHBondContact O-N 3.33Å; I1021-L1024 VanDerWaalsContact O-N 3.08Å; I1021-I1025 HydrophobicContact CG2-CD1 3.91Å; I1021-I1025 HydrophobicContact CG2-CG1 4.35Å; I1021-I1025 WeakPolarHBondContact O-CG1 3.34Å; I1021-I1025 PolarHBondContact O-N 3.07Å; I1021-W1054 HydrophobicContact CB-CH2 4.49Å; I1021-W1054 HydrophobicContact CD1-CH2 4.41Å; I1021-W1054 HydrophobicContact CG2-CH2 4.04Å; I1021-W1054 HydrophobicContact CG2-CZ3 4.28Å |
| 1022 | C | 96.8 | Very high | 90.1 | Very high | 1 Ų | 1 | 32.4 Ų | 32.4 | 1% | 0.007 | 17% | 0.169 | C | C | . | . | H | α-helix | trans | -59.5 | -40.7 | 175.8 | -68.5 | 0 | 0 | 0 | 0 | 112.1 | K1018 S1019 L1024 I1025 K1026 C1088 C1089 A1092 | K1018-C1022 PolarHBondContact O-N 3.14Å; K1018-C1022 PolarHBondContact O-SG 3.32Å; S1019-C1022 WeakPolarHBondContact O-CB 3.41Å; S1019-C1022 PolarHBondContact O-N 2.87Å; C1022-L1024 VanDerWaalsContact C-N 3.34Å; C1022-L1024 PolarHBondContact O-N 3.29Å; C1022-I1025 PolarHBondContact O-N 3.04Å; C1022-K1026 PolarHBondContact O-N 3.26Å; C1022-C1088 HydrophobicContact CB-CB 3.83Å; C1022-C1088 WeakPolarHBondContact CB-O 3.38Å; C1022-C1089 VanDerWaalsContact SG-SG 3.67Å; C1022-A1092 HydrophobicContact CB-CB 3.91Å |
| 1023 | Q | 95.5 | Very high | 89.6 | Confident | 67.4 Ų | 67.4 | 32.7 Ų | 32.7 | 32% | 0.315 | 17% | 0.165 | S | C | . | . | H | α-helix | trans | -64.2 | -38.2 | 173.9 | -67.6 | 173.9 | 12.7 | 0 | 0 | 112.5 | K975 S1019 K1020 I1021 K1026 V1027 | K975-Q1023 HydrophobicContact CD-CB 4.4Å; S1019-Q1023 WeakPolarHBondContact O-CG 3.45Å; S1019-Q1023 PolarHBondContact O-N 3.21Å; K1020-Q1023 WeakPolarHBondContact O-CB 3.37Å; K1020-Q1023 PolarHBondContact O-N 3.08Å; I1021-Q1023 VanDerWaalsContact C-N 3.3Å; I1021-Q1023 PolarHBondContact O-N 3.19Å; Q1023-K1026 PolarHBondContact O-N 2.85Å; Q1023-V1027 WeakPolarHBondContact O-CG2 3.39Å; Q1023-V1027 PolarHBondContact O-N 3.16Å; Q1023-V1027 VanDerWaalsContact O-N 3.15Å |
| 1024 | L | 95.2 | Very high | 88.9 | Confident | 0 Ų | 0 | 30.6 Ų | 30.6 | 0% | 0 | 16% | 0.155 | C | C | . | . | H | α-helix | trans | -64 | -46.8 | 173.9 | 173.3 | 60.2 | 0 | 0 | 0 | 111 | V971 M974 K975 L978 M998 L1001 K1020 I1021 C1022 K1026 V1027 V1028 | V971-L1024 HydrophobicContact CB-CD2 4.47Å; V971-L1024 HydrophobicContact CG1-CB 4.18Å; V971-L1024 HydrophobicContact CG1-CD2 4.16Å; V971-L1024 HydrophobicContact CG2-CD2 4.44Å; M974-L1024 HydrophobicContact CB-CD1 4.02Å; M974-L1024 HydrophobicContact CB-CD2 4.12Å; M974-L1024 HydrophobicContact CE-CD2 4.45Å; M974-L1024 HydrophobicContact SD-CD2 4.42Å; K975-L1024 HydrophobicContact CB-CB 4.49Å; K975-L1024 HydrophobicContact CB-CD1 4.02Å; L978-L1024 HydrophobicContact CD1-CD1 3.92Å; M998-L1024 HydrophobicContact CE-CD2 3.98Å; M998-L1024 HydrophobicContact CE-CG 3.93Å; M998-L1024 HydrophobicContact SD-CD2 3.55Å; M998-L1024 VanDerWaalsContact SD-CD2 3.55Å; M998-L1024 HydrophobicContact SD-CG 3.89Å; L1001-L1024 HydrophobicContact CD1-CD2 4.39Å; K1020-L1024 PolarHBondContact O-N 3.27Å; I1021-L1024 CarbonylContact O-C 3.53Å; I1021-L1024 WeakPolarHBondContact O-CA 3.32Å; I1021-L1024 WeakPolarHBondContact O-CB 3.41Å; I1021-L1024 PolarHBondContact O-N 3.33Å; I1021-L1024 VanDerWaalsContact O-N 3.08Å; C1022-L1024 VanDerWaalsContact C-N 3.34Å; C1022-L1024 PolarHBondContact O-N 3.29Å; L1024-K1026 VanDerWaalsContact C-N 3.28Å; L1024-K1026 PolarHBondContact O-N 3.18Å; L1024-V1027 CarbonylContact O-C 3.59Å; L1024-V1027 WeakPolarHBondContact O-CA 3.42Å; L1024-V1027 WeakPolarHBondContact O-CB 3.21Å; L1024-V1027 PolarHBondContact O-N 3.1Å; L1024-V1028 HydrophobicContact CD1-CG2 4.1Å; L1024-V1028 HydrophobicContact CG-CG2 4.35Å; L1024-V1028 WeakPolarHBondContact O-CG2 3.2Å; L1024-V1028 PolarHBondContact O-N 3.15Å |
| 1025 | I | 95.3 | Very high | 88.2 | Confident | 1.6 Ų | 1.6 | 30.8 Ų | 30.8 | 1% | 0.008 | 16% | 0.155 | C | C | . | . | H | α-helix | trans | -55.7 | -45.3 | 176.5 | -69.8 | 171.7 | 0 | 0 | 0 | 110.8 | M998 I1021 C1022 V1027 V1028 M1029 L1047 I1051 A1092 L1096 | M998-I1025 HydrophobicContact CE-CB 4.4Å; M998-I1025 HydrophobicContact CE-CD1 4.15Å; M998-I1025 HydrophobicContact CE-CG1 3.26Å; I1021-I1025 HydrophobicContact CG2-CD1 3.91Å; I1021-I1025 HydrophobicContact CG2-CG1 4.35Å; I1021-I1025 WeakPolarHBondContact O-CG1 3.34Å; I1021-I1025 PolarHBondContact O-N 3.07Å; C1022-I1025 PolarHBondContact O-N 3.04Å; I1025-V1027 VanDerWaalsContact C-N 3.31Å; I1025-V1027 PolarHBondContact O-N 3.01Å; I1025-V1028 PolarHBondContact O-N 3.35Å; I1025-M1029 HydrophobicContact CG2-CG 4.34Å; I1025-M1029 WeakPolarHBondContact O-CB 3.04Å; I1025-M1029 WeakPolarHBondContact O-CG 3.4Å; I1025-M1029 PolarHBondContact O-N 3.18Å; I1025-L1047 HydrophobicContact CD1-CD1 4.25Å; I1025-L1047 HydrophobicContact CD1-CD2 4.41Å; I1025-L1047 HydrophobicContact CG1-CD1 4.35Å; I1025-L1047 HydrophobicContact CG2-CD1 4.39Å; I1025-I1051 HydrophobicContact CD1-CD1 3.42Å; I1025-I1051 VanDerWaalsContact CD1-CD1 3.43Å; I1025-I1051 HydrophobicContact CD1-CG1 4.17Å; I1025-I1051 HydrophobicContact CG2-CD1 4.41Å; I1025-A1092 HydrophobicContact CB-CB 4.38Å; I1025-A1092 HydrophobicContact CG2-CB 4.16Å; I1025-L1096 HydrophobicContact CG2-CD1 3.83Å; I1025-L1096 HydrophobicContact CG2-CD2 3.97Å; I1025-L1096 HydrophobicContact CG2-CG 3.85Å |
| 1026 | K | 93.6 | Very high | 87.5 | Confident | 80.4 Ų | 80.4 | 31.9 Ų | 31.9 | 35% | 0.35 | 16% | 0.163 | S | C | . | . | H | α-helix | trans | -56.4 | -45.5 | 175 | -174.7 | -175.6 | 177.7 | -173.2 | 0 | 111.6 | C1022 Q1023 L1024 M1029 T1030 M1091 T1095 | C1022-K1026 PolarHBondContact O-N 3.26Å; Q1023-K1026 PolarHBondContact O-N 2.85Å; L1024-K1026 VanDerWaalsContact C-N 3.28Å; L1024-K1026 PolarHBondContact O-N 3.18Å; K1026-M1029 PolarHBondContact O-N 3.22Å; K1026-T1030 WeakPolarHBondContact O-CB 3.36Å; K1026-T1030 PolarHBondContact O-N 3.17Å; K1026-T1030 PolarHBondContact O-OG1 3.23Å; K1026-M1091 HydrophobicContact CD-CE 4.15Å; K1026-T1095 HydrophobicContact CG-CG2 4Å |
| 1027 | V | 91.3 | Very high | 86.9 | Confident | 14 Ų | 14 | 30.7 Ų | 30.7 | 9% | 0.085 | 15% | 0.153 | C | C | . | . | H | α-helix | trans | -64.6 | -43 | 178.1 | 171.3 | 0 | 0 | 0 | 0 | 111.5 | K975 L978 L979 Q1023 L1024 I1025 M1029 T1030 N1031 | K975-V1027 HydrophobicContact CG-CG2 4.09Å; L978-V1027 HydrophobicContact CB-CG1 3.74Å; L979-V1027 HydrophobicContact CD1-CG2 4.41Å; L979-V1027 HydrophobicContact CD2-CG1 4.02Å; L979-V1027 HydrophobicContact CD2-CG2 3.85Å; L979-V1027 HydrophobicContact CG-CG1 3.95Å; L979-V1027 HydrophobicContact CG-CG2 4.06Å; Q1023-V1027 WeakPolarHBondContact O-CG2 3.39Å; Q1023-V1027 PolarHBondContact O-N 3.16Å; Q1023-V1027 VanDerWaalsContact O-N 3.15Å; L1024-V1027 CarbonylContact O-C 3.59Å; L1024-V1027 WeakPolarHBondContact O-CA 3.42Å; L1024-V1027 WeakPolarHBondContact O-CB 3.21Å; L1024-V1027 PolarHBondContact O-N 3.1Å; I1025-V1027 VanDerWaalsContact C-N 3.31Å; I1025-V1027 PolarHBondContact O-N 3.01Å; V1027-M1029 PolarHBondContact O-N 3.3Å; V1027-T1030 PolarHBondContact O-N 3.08Å; V1027-N1031 WeakPolarHBondContact O-CB 3.43Å; V1027-N1031 PolarHBondContact O-N 3.03Å; V1027-N1031 VanDerWaalsContact O-N 3.1Å; V1027-N1031 PolarHBondContact O-ND2 3.32Å |
| 1028 | V | 90 | Very high | 86 | Confident | 1.6 Ų | 1.6 | 34.4 Ų | 34.4 | 1% | 0.01 | 17% | 0.17 | C | C | . | . | H | α-helix | trans | -60.1 | -47.2 | 177.1 | 176.8 | 0 | 0 | 0 | 0 | 110.5 | L978 I994 M998 L1024 I1025 T1030 N1031 R1032 V1035 F1037 | L978-V1028 HydrophobicContact CD1-CG2 3.6Å; I994-V1028 HydrophobicContact CD1-CG1 4.4Å; I994-V1028 HydrophobicContact CD1-CG2 3.69Å; I994-V1028 HydrophobicContact CG2-CG1 4.17Å; I994-V1028 HydrophobicContact CG2-CG2 4.4Å; M998-V1028 HydrophobicContact SD-CG2 4.48Å; L1024-V1028 HydrophobicContact CD1-CG2 4.1Å; L1024-V1028 HydrophobicContact CG-CG2 4.35Å; L1024-V1028 WeakPolarHBondContact O-CG2 3.2Å; L1024-V1028 PolarHBondContact O-N 3.15Å; I1025-V1028 PolarHBondContact O-N 3.35Å; V1028-T1030 PolarHBondContact O-N 3.46Å; V1028-N1031 CarbonylContact O-C 3.41Å; V1028-N1031 VanDerWaalsContact O-C 3.29Å; V1028-N1031 PolarHBondContact O-N 3.08Å; V1028-R1032 WeakPolarHBondContact O-CA 3.29Å; V1028-R1032 PolarHBondContact O-N 3.14Å; V1028-R1032 VanDerWaalsContact O-N 3.12Å; V1028-V1035 HydrophobicContact CG1-CG1 4.41Å; V1028-F1037 HydrophobicContact CG1-CE1 4.27Å; V1028-F1037 HydrophobicContact CG1-CZ 4.1Å |
| 1029 | M | 89.2 | Confident | 85.2 | Confident | 13.6 Ų | 13.6 | 34.5 Ų | 34.5 | 7% | 0.067 | 17% | 0.174 | C | C | . | . | H | α-helix | trans | -71 | -32 | -179.8 | -65.9 | -63.4 | 97 | 0 | 0 | 113.3 | I1025 K1026 V1027 N1031 R1032 F1037 F1043 R1044 T1095 L1096 | I1025-M1029 HydrophobicContact CG2-CG 4.34Å; I1025-M1029 WeakPolarHBondContact O-CB 3.04Å; I1025-M1029 WeakPolarHBondContact O-CG 3.4Å; I1025-M1029 PolarHBondContact O-N 3.18Å; K1026-M1029 PolarHBondContact O-N 3.22Å; V1027-M1029 PolarHBondContact O-N 3.3Å; M1029-N1031 VanDerWaalsContact C-N 3.27Å; M1029-N1031 PolarHBondContact O-N 3.12Å; M1029-R1032 WeakPolarHBondContact O-CB 3.34Å; M1029-R1032 PolarHBondContact O-N 3.17Å; M1029-F1037 HydrophobicContact CE-CE1 3.79Å; M1029-F1037 HydrophobicContact CE-CZ 3.55Å; M1029-F1043 HydrophobicContact CE-CD1 4.46Å; M1029-F1043 HydrophobicContact CE-CE1 4.03Å; M1029-R1044 HydrophobicContact SD-CG 3.96Å; M1029-T1095 HydrophobicContact CB-CG2 3.59Å; M1029-T1095 HydrophobicContact CG-CG2 4.47Å; M1029-L1096 HydrophobicContact CG-CD2 3.8Å; M1029-L1096 HydrophobicContact CG-CG 4.37Å; M1029-L1096 HydrophobicContact SD-CD2 3.74Å |
| 1030 | T | 84.3 | Confident | 84.7 | Confident | 92.4 Ų | 92.4 | 36.2 Ų | 36.2 | 57% | 0.567 | 18% | 0.181 | S | C | * | . | H | α-helix | trans | -67.9 | -31.3 | 174.3 | -52.2 | 0 | 0 | 0 | 0 | 111.1 | K1026 V1027 V1028 | K1026-T1030 WeakPolarHBondContact O-CB 3.36Å; K1026-T1030 PolarHBondContact O-N 3.17Å; K1026-T1030 PolarHBondContact O-OG1 3.23Å; V1027-T1030 PolarHBondContact O-N 3.08Å; V1028-T1030 PolarHBondContact O-N 3.46Å |
| 1031 | N | 78 | Confident | 84.2 | Confident | 19 Ų | 19 | 35.1 Ų | 35.1 | 10% | 0.102 | 18% | 0.178 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -102.3 | 26.3 | 177.3 | -64.9 | -59.3 | 0 | 0 | 0 | 112.7 | S982 V1027 V1028 M1029 D1033 H1034 V1035 | S982-N1031 WeakPolarHBondContact CA-OD1 3.44Å; S982-N1031 WeakPolarHBondContact CB-OD1 3.37Å; V1027-N1031 WeakPolarHBondContact O-CB 3.43Å; V1027-N1031 PolarHBondContact O-N 3.03Å; V1027-N1031 VanDerWaalsContact O-N 3.1Å; V1027-N1031 PolarHBondContact O-ND2 3.32Å; V1028-N1031 CarbonylContact O-C 3.41Å; V1028-N1031 VanDerWaalsContact O-C 3.29Å; V1028-N1031 PolarHBondContact O-N 3.08Å; M1029-N1031 VanDerWaalsContact C-N 3.27Å; M1029-N1031 PolarHBondContact O-N 3.12Å; N1031-D1033 PolarHBondContact O-N 3.06Å; N1031-D1033 VanDerWaalsContact O-N 3.09Å; N1031-H1034 PolarHBondContact O-N 3.1Å; N1031-V1035 HydrophobicContact CB-CG2 4.43Å; N1031-V1035 WeakPolarHBondContact O-CG2 3.09Å; N1031-V1035 PolarHBondContact O-N 3.19Å |
| 1032 | R | 78.9 | Confident | 83.5 | Confident | 58.4 Ų | 58.4 | 40.2 Ų | 40.2 | 22% | 0.22 | 20% | 0.197 | C | C | . | . | G | 310 helix | trans | -56.3 | -29.2 | -173.7 | 68.6 | 177.2 | -177.4 | -171.7 | -2.3 | 113.5 | V1028 M1029 H1034 V1035 F1037 E1040 D1099 | V1028-R1032 WeakPolarHBondContact O-CA 3.29Å; V1028-R1032 PolarHBondContact O-N 3.14Å; V1028-R1032 VanDerWaalsContact O-N 3.12Å; M1029-R1032 WeakPolarHBondContact O-CB 3.34Å; M1029-R1032 PolarHBondContact O-N 3.17Å; R1032-H1034 VanDerWaalsContact C-N 3.26Å; R1032-H1034 PolarHBondContact O-N 3.11Å; R1032-V1035 PolarHBondContact O-N 3.08Å; R1032-F1037 HydrophobicContact CB-CE2 4.01Å; R1032-F1037 HydrophobicContact CB-CZ 4.28Å; R1032-F1037 WeakPolarHBondContact O-CE2 3.3Å; R1032-E1040 IonicContact NH1-OE1 3.73Å; R1032-D1099 IonicContact CZ-OD2 3.79Å; R1032-D1099 IonicContact NH1-OD2 3.25Å; R1032-D1099 PolarHBondContact NH1-OD2 3.13Å; R1032-D1099 VanDerWaalsContact NH1-OD2 3.15Å; R1032-D1099 IonicContact NH2-OD2 3.19Å; R1032-D1099 PolarHBondContact NH2-OD2 3.25Å |
| 1033 | D | 70.3 | Confident | 83.1 | Confident | 80 Ų | 80 | 40.4 Ų | 40.4 | 43% | 0.428 | 20% | 0.198 | S | C | . | . | G | 310 helix | trans | -74.4 | -14 | -179.8 | -58.1 | -41.5 | 0 | 0 | 0 | 113.4 | N1031 R1572 A1590 | N1031-D1033 PolarHBondContact O-N 3.06Å; N1031-D1033 VanDerWaalsContact O-N 3.09Å; D1033-R1572 IonicContact OD1-CZ 3.93Å; D1033-R1572 IonicContact OD1-NH1 3.4Å; D1033-R1572 PolarHBondContact OD1-NH1 3.4Å; D1033-R1572 IonicContact OD1-NH2 3.43Å; D1033-R1572 PolarHBondContact OD1-NH2 3.29Å; D1033-A1590 HydrophobicContact CB-CB 3.4Å |
| 1034 | H | 68.4 | Low | 83 | Confident | 49.6 Ų | 49.6 | 37.5 Ų | 37.5 | 23% | 0.23 | 18% | 0.184 | C | C | . | . | G | 310 helix | trans | -105.8 | -6.2 | 178.5 | -58.7 | -67.6 | 0 | 0 | 0 | 113.1 | L984 A986 L991 N1031 R1032 R1565 | L984-H1034 PolarHBondContact O-CE1 2.92Å; A986-H1034 VanDerWaalsContact CA-CE1 3.4Å; A986-H1034 WeakPolarHBondContact CA-CE1 3.45Å; A986-H1034 WeakPolarHBondContact CA-ND1 3.41Å; A986-H1034 VanDerWaalsContact CB-CE1 3.41Å; A986-H1034 WeakPolarHBondContact CB-CE1 3.38Å; A986-H1034 VanDerWaalsContact CB-ND1 3.3Å; A986-H1034 WeakPolarHBondContact CB-ND1 3.41Å; A986-H1034 PolarHBondContact N-CE1 2.72Å; A986-H1034 VanDerWaalsContact N-CE1 3.3Å; L991-H1034 WeakPolarHBondContact CB-O 3.5Å; L991-H1034 HydrophobicContact CD1-CB 4.34Å; L991-H1034 VanDerWaalsContact CD1-O 3.29Å; L991-H1034 WeakPolarHBondContact CD1-O 3.23Å; L991-H1034 WeakPolarHBondContact CD2-O 3.34Å; L991-H1034 WeakPolarHBondContact CG-O 3.35Å; L991-H1034 PolarHBondContact N-O 3.25Å; N1031-H1034 PolarHBondContact O-N 3.1Å; R1032-H1034 VanDerWaalsContact C-N 3.26Å; R1032-H1034 PolarHBondContact O-N 3.11Å; H1034-R1565 PolarHBondContact O-NH1 2.86Å |
| 1035 | V | 74.3 | Confident | 82.7 | Confident | 11.6 Ų | 11.6 | 38.2 Ų | 38.2 | 7% | 0.07 | 19% | 0.187 | C | C | . | . | S | Bend | trans | -107.8 | 137.6 | -177.4 | 178.2 | 0 | 0 | 0 | 0 | 109.2 | L978 L991 I994 V1028 N1031 R1032 F1037 | L978-V1035 HydrophobicContact CD2-CG2 4.29Å; L991-V1035 HydrophobicContact CD1-CG2 4.31Å; I994-V1035 HydrophobicContact CB-CG1 4.03Å; I994-V1035 HydrophobicContact CD1-CB 4.42Å; I994-V1035 HydrophobicContact CD1-CG1 3.96Å; I994-V1035 HydrophobicContact CD1-CG2 3.79Å; I994-V1035 HydrophobicContact CG1-CG1 3.84Å; I994-V1035 HydrophobicContact CG2-CG1 3.58Å; V1028-V1035 HydrophobicContact CG1-CG1 4.41Å; N1031-V1035 HydrophobicContact CB-CG2 4.43Å; N1031-V1035 WeakPolarHBondContact O-CG2 3.09Å; N1031-V1035 PolarHBondContact O-N 3.19Å; R1032-V1035 PolarHBondContact O-N 3.08Å; V1035-F1037 HydrophobicContact CB-CE2 3.98Å; V1035-F1037 HydrophobicContact CB-CZ 4.05Å; V1035-F1037 HydrophobicContact CG1-CD1 4.45Å; V1035-F1037 HydrophobicContact CG1-CE1 4.2Å; V1035-F1037 HydrophobicContact CG1-CE2 4.09Å; V1035-F1037 HydrophobicContact CG1-CZ 3.84Å; V1035-F1037 WeakPolarHBondContact O-CD2 3.32Å; V1035-F1037 WeakPolarHBondContact O-CE2 3.38Å; V1035-F1037 PolarHBondContact O-N 3.39Å |
| 1036 | V | 73.9 | Confident | 82.5 | Confident | 37 Ų | 37 | 41.4 Ų | 41.4 | 22% | 0.224 | 20% | 0.201 | C | C | . | . | trans | -84 | 126.7 | 175.5 | -180 | 0 | 0 | 0 | 0 | 109.5 | Q990 L991 C993 N1562 L1606 | Q990-V1036 HydrophobicContact CB-CG2 4.28Å; L991-V1036 HydrophobicContact CB-CB 4.39Å; L991-V1036 HydrophobicContact CB-CG2 3.48Å; L991-V1036 VanDerWaalsContact CB-CG2 3.48Å; L991-V1036 HydrophobicContact CD1-CG2 4.17Å; L991-V1036 HydrophobicContact CG-CG2 4.46Å; L991-V1036 WeakPolarHBondContact O-CB 3.13Å; L991-V1036 VanDerWaalsContact O-CG2 3.26Å; L991-V1036 WeakPolarHBondContact O-CG2 3.39Å; L991-V1036 PolarHBondContact O-N 3.19Å; C993-V1036 VanDerWaalsContact CA-O 3.28Å; C993-V1036 WeakPolarHBondContact CA-O 3.37Å; V1036-N1562 HydrophobicContact CG1-CB 3.7Å; V1036-N1562 WeakPolarHBondContact CG1-OD1 3.37Å; V1036-L1606 HydrophobicContact CG1-CD2 4.41Å | ||
| 1037 | F | 76.6 | Confident | 82.5 | Confident | 25.6 Ų | 25.6 | 37.6 Ų | 37.6 | 11% | 0.112 | 19% | 0.185 | C | C | . | . | trans | -113 | 139.5 | 174.1 | -64.9 | -76.6 | 0 | 0 | 0 | 109.8 | I994 E995 V1028 M1029 R1032 V1035 E1040 F1043 N1562 | I994-F1037 HydrophobicContact CG2-CE1 4.05Å; E995-F1037 HydrophobicContact CG-CD1 3.89Å; E995-F1037 VanDerWaalsContact OE1-CA 3.28Å; E995-F1037 WeakPolarHBondContact OE1-CA 3.23Å; E995-F1037 VanDerWaalsContact OE1-CB 3.29Å; E995-F1037 WeakPolarHBondContact OE1-CB 3.32Å; E995-F1037 WeakPolarHBondContact OE1-CD1 3.29Å; V1028-F1037 HydrophobicContact CG1-CE1 4.27Å; V1028-F1037 HydrophobicContact CG1-CZ 4.1Å; M1029-F1037 HydrophobicContact CE-CE1 3.79Å; M1029-F1037 HydrophobicContact CE-CZ 3.55Å; R1032-F1037 HydrophobicContact CB-CE2 4.01Å; R1032-F1037 HydrophobicContact CB-CZ 4.28Å; R1032-F1037 WeakPolarHBondContact O-CE2 3.3Å; V1035-F1037 HydrophobicContact CB-CE2 3.98Å; V1035-F1037 HydrophobicContact CB-CZ 4.05Å; V1035-F1037 HydrophobicContact CG1-CD1 4.45Å; V1035-F1037 HydrophobicContact CG1-CE1 4.2Å; V1035-F1037 HydrophobicContact CG1-CE2 4.09Å; V1035-F1037 HydrophobicContact CG1-CZ 3.84Å; V1035-F1037 WeakPolarHBondContact O-CD2 3.32Å; V1035-F1037 WeakPolarHBondContact O-CE2 3.38Å; V1035-F1037 PolarHBondContact O-N 3.39Å; F1037-E1040 HydrophobicContact CB-CB 3.88Å; F1037-E1040 HydrophobicContact CB-CG 4.36Å; F1037-E1040 HydrophobicContact CD1-CB 4.37Å; F1037-E1040 HydrophobicContact CD1-CG 4.25Å; F1037-E1040 HydrophobicContact CD2-CB 4.34Å; F1037-E1040 HydrophobicContact CD2-CG 4.07Å; F1037-E1040 HydrophobicContact CE2-CG 4.41Å; F1037-E1040 HydrophobicContact CG-CB 4Å; F1037-E1040 HydrophobicContact CG-CG 4.03Å; F1037-F1043 HydrophobicContact CD1-CD1 4.05Å; F1037-F1043 HydrophobicContact CD1-CE1 4.31Å; F1037-F1043 AromaticContact CE1-CD1 3.94Å; F1037-F1043 HydrophobicContact CE1-CD1 3.94Å; F1037-F1043 AromaticContact CE1-CE1 3.84Å; F1037-F1043 HydrophobicContact CE1-CE1 3.84Å; F1037-N1562 PolarHBondContact O-ND2 3.08Å; F1037-N1562 PolarHBondContact O-OD1 3.44Å; F1037-N1562 VanDerWaalsContact O-OD1 3.09Å | ||
| 1038 | Q | 74.8 | Confident | 82.6 | Confident | 78.4 Ų | 78.4 | 36.9 Ų | 36.9 | 37% | 0.366 | 18% | 0.181 | S | C | . | . | S | Bend | trans | -78.6 | -46.6 | 170.5 | -107.9 | 175.3 | 2.4 | 0 | 0 | 109.9 | C993 E995 E1559 Q1610 N1653 | C993-Q1038 HydrophobicContact CB-CG 4.42Å; E995-Q1038 VanDerWaalsContact CD-N 3.34Å; E995-Q1038 PolarHBondContact OE1-N 3.24Å; Q1038-E1559 HydrophobicContact CG-CG 4.3Å; Q1038-E1559 PolarHBondContact NE2-OE1 3.38Å; Q1038-Q1610 VanDerWaalsContact CA-NE2 3.32Å; Q1038-Q1610 HydrophobicContact CB-CG 4.34Å; Q1038-Q1610 HydrophobicContact CG-CG 4.05Å; Q1038-Q1610 PolarHBondContact O-NE2 2.98Å; Q1038-N1653 PolarHBondContact O-ND2 3.33Å |
| 1039 | S | 78.4 | Confident | 82.5 | Confident | 24.4 Ų | 24.4 | 39.3 Ų | 39.3 | 17% | 0.171 | 19% | 0.193 | C | C | . | . | S | Bend | trans | -147.8 | 77.9 | 179 | -138.9 | 0 | 0 | 0 | 0 | 110.1 | E995 I1041 R1042 F1043 D1555 | E995-S1039 PolarHBondContact OE1-N 3.23Å; E995-S1039 VanDerWaalsContact OE1-N 3.1Å; E995-S1039 PolarHBondContact OE2-N 3.17Å; S1039-I1041 VanDerWaalsContact C-N 3.28Å; S1039-I1041 PolarHBondContact O-N 3.36Å; S1039-I1041 VanDerWaalsContact O-N 3.11Å; S1039-R1042 PolarHBondContact O-N 2.97Å; S1039-R1042 VanDerWaalsContact O-N 3.08Å; S1039-R1042 WeakPolarHBondContact OG-CB 3.35Å; S1039-R1042 WeakPolarHBondContact OG-CD 3.28Å; S1039-R1042 WeakPolarHBondContact OG-CG 3.25Å; S1039-F1043 VanDerWaalsContact O-CB 3.28Å; S1039-F1043 WeakPolarHBondContact O-CB 3.38Å; S1039-F1043 PolarHBondContact O-N 3.05Å; S1039-D1555 PolarHBondContact OG-OD1 2.98Å |
| 1040 | E | 82.8 | Confident | 82.6 | Confident | 46.4 Ų | 46.4 | 40.1 Ų | 40.1 | 22% | 0.217 | 20% | 0.198 | C | C | . | . | H | α-helix | trans | -50.5 | -45 | -173.3 | -168.3 | -162 | 145.2 | 0 | 0 | 112.6 | R1032 F1037 R1042 F1043 R1044 | R1032-E1040 IonicContact NH1-OE1 3.73Å; F1037-E1040 HydrophobicContact CB-CB 3.88Å; F1037-E1040 HydrophobicContact CB-CG 4.36Å; F1037-E1040 HydrophobicContact CD1-CB 4.37Å; F1037-E1040 HydrophobicContact CD1-CG 4.25Å; F1037-E1040 HydrophobicContact CD2-CB 4.34Å; F1037-E1040 HydrophobicContact CD2-CG 4.07Å; F1037-E1040 HydrophobicContact CE2-CG 4.41Å; F1037-E1040 HydrophobicContact CG-CB 4Å; F1037-E1040 HydrophobicContact CG-CG 4.03Å; E1040-R1042 PolarHBondContact O-N 3.07Å; E1040-F1043 PolarHBondContact O-N 3.05Å; E1040-R1044 HydrophobicContact CG-CG 4.37Å; E1040-R1044 WeakPolarHBondContact O-CB 3.37Å; E1040-R1044 WeakPolarHBondContact O-CD 3.34Å; E1040-R1044 VanDerWaalsContact O-CG 3.25Å; E1040-R1044 WeakPolarHBondContact O-CG 3.32Å; E1040-R1044 PolarHBondContact O-N 3.09Å; E1040-R1044 WeakPolarHBondContact OE1-CD 3.42Å; E1040-R1044 IonicContact OE1-CZ 3.69Å; E1040-R1044 IonicContact OE1-NE 3.27Å; E1040-R1044 IonicContact OE1-NH1 3.4Å; E1040-R1044 PolarHBondContact OE1-NH1 3Å |
| 1041 | I | 82.9 | Confident | 83.1 | Confident | 35.4 Ų | 35.4 | 35.7 Ų | 35.7 | 18% | 0.182 | 17% | 0.171 | C | C | . | . | H | α-helix | trans | -64.7 | -46.9 | -176.5 | -62.2 | 174.2 | 0 | 0 | 0 | 111.2 | S1039 R1044 N1045 L1100 P1101 Q1103 A1575 A1576 A1579 G1650 | S1039-I1041 VanDerWaalsContact C-N 3.28Å; S1039-I1041 PolarHBondContact O-N 3.36Å; S1039-I1041 VanDerWaalsContact O-N 3.11Å; I1041-R1044 PolarHBondContact O-N 3.21Å; I1041-N1045 PolarHBondContact O-N 3.08Å; I1041-N1045 PolarHBondContact O-ND2 3.12Å; I1041-L1100 HydrophobicContact CB-CD1 4.41Å; I1041-L1100 HydrophobicContact CG2-CD1 3.99Å; I1041-P1101 HydrophobicContact CD1-CG 4.36Å; I1041-P1101 HydrophobicContact CG2-CG 4.27Å; I1041-Q1103 HydrophobicContact CG2-CG 4.28Å; I1041-A1575 HydrophobicContact CD1-CB 3.93Å; I1041-A1575 VanDerWaalsContact CD1-O 3.3Å; I1041-A1575 WeakPolarHBondContact CD1-O 3.46Å; I1041-A1576 HydrophobicContact CD1-CB 4.28Å; I1041-A1579 HydrophobicContact CD1-CB 3.74Å; I1041-A1579 HydrophobicContact CG2-CB 3.93Å; I1041-G1650 WeakPolarHBondContact CD1-O 3.29Å |
| 1042 | R | 83.6 | Confident | 83.7 | Confident | 106.8 Ų | 106.8 | 35.1 Ų | 35.1 | 40% | 0.403 | 17% | 0.169 | S | C | . | . | H | α-helix | trans | -65.4 | -44.5 | 177.9 | -70.1 | -178 | 178.7 | 168.5 | -1.2 | 111 | S1039 E1040 R1044 N1045 K1046 D1555 D1614 E1617 | S1039-R1042 PolarHBondContact O-N 2.97Å; S1039-R1042 VanDerWaalsContact O-N 3.08Å; S1039-R1042 WeakPolarHBondContact OG-CB 3.35Å; S1039-R1042 WeakPolarHBondContact OG-CD 3.28Å; S1039-R1042 WeakPolarHBondContact OG-CG 3.25Å; E1040-R1042 PolarHBondContact O-N 3.07Å; R1042-R1044 VanDerWaalsContact C-N 3.33Å; R1042-R1044 PolarHBondContact O-N 3.16Å; R1042-N1045 PolarHBondContact O-N 3.18Å; R1042-K1046 WeakPolarHBondContact O-CB 3.27Å; R1042-K1046 PolarHBondContact O-N 3.03Å; R1042-D1555 IonicContact CZ-OD1 3.27Å; R1042-D1555 IonicContact NH1-OD1 2.7Å; R1042-D1555 PolarHBondContact NH1-OD1 2.96Å; R1042-D1555 IonicContact NH1-OD2 3.18Å; R1042-D1555 PolarHBondContact NH1-OD2 2.94Å; R1042-D1614 IonicContact NH1-OD1 2.75Å; R1042-D1614 IonicContact NH1-OD2 3.25Å; R1042-D1614 PolarHBondContact NH1-OD2 3.37Å; R1042-D1614 VanDerWaalsContact NH1-OD2 3.15Å; R1042-E1617 IonicContact CZ-OE1 2.7Å; R1042-E1617 IonicContact NE-OE1 2.84Å; R1042-E1617 IonicContact NH1-OE1 2.56Å; R1042-E1617 PolarHBondContact NH1-OE1 3.25Å; R1042-E1617 IonicContact NH2-OE1 3.72Å |
| 1043 | F | 88.4 | Confident | 84.1 | Confident | 5.6 Ų | 5.6 | 35.4 Ų | 35.4 | 3% | 0.025 | 18% | 0.18 | C | C | . | . | H | α-helix | trans | -56.3 | -47.4 | 176.9 | 171 | -113.3 | 0 | 0 | 0 | 111.7 | E995 M998 L999 M1029 F1037 S1039 E1040 K1046 L1047 | E995-F1043 HydrophobicContact CB-CD2 3.68Å; E995-F1043 HydrophobicContact CB-CE2 3.93Å; E995-F1043 HydrophobicContact CB-CG 4.15Å; E995-F1043 HydrophobicContact CB-CZ 4.47Å; E995-F1043 HydrophobicContact CG-CB 4.06Å; E995-F1043 HydrophobicContact CG-CD1 4.09Å; E995-F1043 HydrophobicContact CG-CD2 3.77Å; E995-F1043 HydrophobicContact CG-CE1 4.44Å; E995-F1043 HydrophobicContact CG-CE2 4.18Å; E995-F1043 HydrophobicContact CG-CG 3.7Å; E995-F1043 HydrophobicContact CG-CZ 4.43Å; M998-F1043 HydrophobicContact CB-CE2 3.85Å; M998-F1043 HydrophobicContact CB-CZ 3.75Å; M998-F1043 HydrophobicContact CG-CZ 4.18Å; L999-F1043 HydrophobicContact CD1-CD2 4.44Å; L999-F1043 HydrophobicContact CD2-CD2 4.27Å; L999-F1043 HydrophobicContact CD2-CE2 4.32Å; L999-F1043 HydrophobicContact CG-CD2 4.16Å; L999-F1043 HydrophobicContact CG-CE2 4.12Å; M1029-F1043 HydrophobicContact CE-CD1 4.46Å; M1029-F1043 HydrophobicContact CE-CE1 4.03Å; F1037-F1043 HydrophobicContact CD1-CD1 4.05Å; F1037-F1043 HydrophobicContact CD1-CE1 4.31Å; F1037-F1043 AromaticContact CE1-CD1 3.94Å; F1037-F1043 HydrophobicContact CE1-CD1 3.94Å; F1037-F1043 AromaticContact CE1-CE1 3.84Å; F1037-F1043 HydrophobicContact CE1-CE1 3.84Å; S1039-F1043 VanDerWaalsContact O-CB 3.28Å; S1039-F1043 WeakPolarHBondContact O-CB 3.38Å; S1039-F1043 PolarHBondContact O-N 3.05Å; E1040-F1043 PolarHBondContact O-N 3.05Å; F1043-K1046 PolarHBondContact O-N 3.1Å; F1043-L1047 HydrophobicContact CD1-CD1 4.3Å; F1043-L1047 HydrophobicContact CD2-CD1 4.41Å; F1043-L1047 HydrophobicContact CD2-CG 4.32Å; F1043-L1047 HydrophobicContact CE1-CD1 3.61Å; F1043-L1047 HydrophobicContact CE1-CG 4.43Å; F1043-L1047 HydrophobicContact CE2-CD1 3.74Å; F1043-L1047 HydrophobicContact CE2-CD2 4.27Å; F1043-L1047 HydrophobicContact CE2-CG 3.91Å; F1043-L1047 HydrophobicContact CZ-CD1 3.3Å; F1043-L1047 HydrophobicContact CZ-CD2 4.46Å; F1043-L1047 HydrophobicContact CZ-CG 4.02Å; F1043-L1047 WeakPolarHBondContact O-CG 3.37Å; F1043-L1047 PolarHBondContact O-N 3.29Å |
| 1044 | R | 92.1 | Very high | 85.1 | Confident | 6.2 Ų | 6.2 | 32 Ų | 32 | 2% | 0.023 | 16% | 0.161 | C | C | . | . | H | α-helix | trans | -66.3 | -44.1 | 179.7 | -71.5 | 170.2 | 63.2 | -176.6 | -3.3 | 112.6 | M1029 E1040 I1041 R1042 K1046 L1047 I1048 L1096 R1098 L1100 | M1029-R1044 HydrophobicContact SD-CG 3.96Å; E1040-R1044 HydrophobicContact CG-CG 4.37Å; E1040-R1044 WeakPolarHBondContact O-CB 3.37Å; E1040-R1044 WeakPolarHBondContact O-CD 3.34Å; E1040-R1044 VanDerWaalsContact O-CG 3.25Å; E1040-R1044 WeakPolarHBondContact O-CG 3.32Å; E1040-R1044 PolarHBondContact O-N 3.09Å; E1040-R1044 WeakPolarHBondContact OE1-CD 3.42Å; E1040-R1044 IonicContact OE1-CZ 3.69Å; E1040-R1044 IonicContact OE1-NE 3.27Å; E1040-R1044 IonicContact OE1-NH1 3.4Å; E1040-R1044 PolarHBondContact OE1-NH1 3Å; I1041-R1044 PolarHBondContact O-N 3.21Å; R1042-R1044 VanDerWaalsContact C-N 3.33Å; R1042-R1044 PolarHBondContact O-N 3.16Å; R1044-K1046 VanDerWaalsContact C-N 3.32Å; R1044-K1046 PolarHBondContact O-N 3.3Å; R1044-L1047 PolarHBondContact O-N 3.2Å; R1044-I1048 VanDerWaalsContact O-CG1 3.31Å; R1044-I1048 WeakPolarHBondContact O-CG1 3.37Å; R1044-I1048 PolarHBondContact O-N 3.07Å; R1044-L1096 HydrophobicContact CB-CD2 4.25Å; R1044-L1096 HydrophobicContact CG-CD2 3.92Å; R1044-L1096 VanDerWaalsContact CZ-O 3.25Å; R1044-L1096 PolarHBondContact NE-O 3Å; R1044-L1096 VanDerWaalsContact NH2-C 3.33Å; R1044-L1096 PolarHBondContact NH2-O 2.94Å; R1044-R1098 PolarHBondContact NH2-O 3.17Å; R1044-L1100 HydrophobicContact CB-CD1 3.79Å; R1044-L1100 HydrophobicContact CB-CD2 3.94Å; R1044-L1100 HydrophobicContact CB-CG 4.49Å |
| 1045 | N | 90.6 | Very high | 86.1 | Confident | 13.6 Ų | 13.6 | 30.3 Ų | 30.3 | 7% | 0.073 | 15% | 0.153 | C | C | . | . | H | α-helix | trans | -57.5 | -46 | 174.7 | -84.4 | -79.4 | 0 | 0 | 0 | 111 | I1041 R1042 L1047 I1048 D1049 P1101 L1102 Q1103 | I1041-N1045 PolarHBondContact O-N 3.08Å; I1041-N1045 PolarHBondContact O-ND2 3.12Å; R1042-N1045 PolarHBondContact O-N 3.18Å; N1045-L1047 VanDerWaalsContact C-N 3.35Å; N1045-L1047 PolarHBondContact O-N 3.09Å; N1045-I1048 PolarHBondContact O-N 3.2Å; N1045-D1049 PolarHBondContact O-N 3.18Å; N1045-D1049 VanDerWaalsContact O-N 3.12Å; N1045-P1101 PolarHBondContact ND2-O 2.94Å; N1045-P1101 VanDerWaalsContact ND2-O 3.14Å; N1045-L1102 WeakPolarHBondContact OD1-CA 3.47Å; N1045-Q1103 PolarHBondContact OD1-N 3.05Å; N1045-Q1103 VanDerWaalsContact OD1-N 3.15Å; N1045-Q1103 PolarHBondContact OD1-O 2.57Å |
| 1046 | K | 90.8 | Very high | 86.4 | Confident | 68.4 Ų | 68.4 | 32 Ų | 32 | 30% | 0.297 | 16% | 0.162 | S | C | . | . | H | α-helix | trans | -62.9 | -40.5 | 178.3 | -165.6 | 159.8 | -173.3 | 109.8 | 0 | 112.8 | L999 R1042 F1043 R1044 D1049 L1050 E1105 | L999-K1046 HydrophobicContact CD1-CD 4.31Å; L999-K1046 HydrophobicContact CD2-CB 4.38Å; L999-K1046 HydrophobicContact CD2-CD 3.76Å; L999-K1046 HydrophobicContact CD2-CG 4.02Å; R1042-K1046 WeakPolarHBondContact O-CB 3.27Å; R1042-K1046 PolarHBondContact O-N 3.03Å; F1043-K1046 PolarHBondContact O-N 3.1Å; R1044-K1046 VanDerWaalsContact C-N 3.32Å; R1044-K1046 PolarHBondContact O-N 3.3Å; K1046-D1049 PolarHBondContact O-N 3.11Å; K1046-L1050 HydrophobicContact CG-CD1 4.33Å; K1046-L1050 WeakPolarHBondContact O-CG 3.37Å; K1046-L1050 PolarHBondContact O-N 3.29Å; K1046-L1050 VanDerWaalsContact O-N 3.15Å; K1046-E1105 WeakPolarHBondContact CD-OE1 3.42Å; K1046-E1105 WeakPolarHBondContact CE-OE1 3.43Å; K1046-E1105 IonicContact NZ-OE1 3.23Å; K1046-E1105 PolarHBondContact NZ-OE1 3.18Å; K1046-E1105 IonicContact NZ-OE2 2.68Å; K1046-E1105 PolarHBondContact NZ-OE2 3.4Å |
| 1047 | L | 93.1 | Very high | 86.2 | Confident | 1 Ų | 1 | 31.5 Ų | 31.5 | 1% | 0.005 | 16% | 0.16 | C | C | . | . | H | α-helix | trans | -66.6 | -38.8 | 175.2 | -75.3 | -172 | 0 | 0 | 0 | 112.7 | L999 C1002 I1025 F1043 R1044 N1045 D1049 L1050 I1051 L1096 | L999-L1047 HydrophobicContact CD2-CD2 4.18Å; C1002-L1047 HydrophobicContact CB-CD2 4.31Å; I1025-L1047 HydrophobicContact CD1-CD1 4.25Å; I1025-L1047 HydrophobicContact CD1-CD2 4.41Å; I1025-L1047 HydrophobicContact CG1-CD1 4.35Å; I1025-L1047 HydrophobicContact CG2-CD1 4.39Å; F1043-L1047 HydrophobicContact CD1-CD1 4.3Å; F1043-L1047 HydrophobicContact CD2-CD1 4.41Å; F1043-L1047 HydrophobicContact CD2-CG 4.32Å; F1043-L1047 HydrophobicContact CE1-CD1 3.61Å; F1043-L1047 HydrophobicContact CE1-CG 4.43Å; F1043-L1047 HydrophobicContact CE2-CD1 3.74Å; F1043-L1047 HydrophobicContact CE2-CD2 4.27Å; F1043-L1047 HydrophobicContact CE2-CG 3.91Å; F1043-L1047 HydrophobicContact CZ-CD1 3.3Å; F1043-L1047 HydrophobicContact CZ-CD2 4.46Å; F1043-L1047 HydrophobicContact CZ-CG 4.02Å; F1043-L1047 WeakPolarHBondContact O-CG 3.37Å; F1043-L1047 PolarHBondContact O-N 3.29Å; R1044-L1047 PolarHBondContact O-N 3.2Å; N1045-L1047 VanDerWaalsContact C-N 3.35Å; N1045-L1047 PolarHBondContact O-N 3.09Å; L1047-D1049 VanDerWaalsContact C-N 3.3Å; L1047-D1049 PolarHBondContact O-N 3.43Å; L1047-L1050 PolarHBondContact O-N 3.13Å; L1047-I1051 HydrophobicContact CB-CD1 4.47Å; L1047-I1051 WeakPolarHBondContact O-CB 3.33Å; L1047-I1051 WeakPolarHBondContact O-CD1 3.29Å; L1047-I1051 VanDerWaalsContact O-CG1 3.24Å; L1047-I1051 WeakPolarHBondContact O-CG1 3.34Å; L1047-I1051 PolarHBondContact O-N 3.11Å; L1047-L1096 HydrophobicContact CB-CD1 3.92Å; L1047-L1096 HydrophobicContact CB-CD2 4.29Å; L1047-L1096 HydrophobicContact CD1-CD2 4.05Å |
| 1048 | I | 92.7 | Very high | 85.6 | Confident | 0.8 Ų | 0.8 | 33.3 Ų | 33.3 | 0% | 0.004 | 17% | 0.17 | C | C | . | . | H | α-helix | trans | -60.1 | -47.7 | 177.1 | -72.5 | 162.6 | 0 | 0 | 0 | 110.1 | R1044 N1045 L1050 I1051 A1052 L1093 L1096 V1097 L1100 F1125 | R1044-I1048 VanDerWaalsContact O-CG1 3.31Å; R1044-I1048 WeakPolarHBondContact O-CG1 3.37Å; R1044-I1048 PolarHBondContact O-N 3.07Å; N1045-I1048 PolarHBondContact O-N 3.2Å; I1048-L1050 VanDerWaalsContact C-N 3.32Å; I1048-L1050 PolarHBondContact O-N 3.29Å; I1048-I1051 PolarHBondContact O-N 3.19Å; I1048-A1052 WeakPolarHBondContact O-CB 3.36Å; I1048-A1052 PolarHBondContact O-N 3.24Å; I1048-L1093 HydrophobicContact CB-CD2 4.12Å; I1048-L1093 HydrophobicContact CG1-CD2 3.95Å; I1048-L1093 HydrophobicContact CG2-CD2 3.96Å; I1048-L1096 HydrophobicContact CD1-CB 4.11Å; I1048-L1096 HydrophobicContact CG1-CB 3.76Å; I1048-L1096 HydrophobicContact CG1-CD1 4.11Å; I1048-L1096 HydrophobicContact CG1-CG 4.49Å; I1048-V1097 HydrophobicContact CD1-CB 4.5Å; I1048-V1097 HydrophobicContact CD1-CG1 3.6Å; I1048-V1097 HydrophobicContact CD1-CG2 3.62Å; I1048-V1097 HydrophobicContact CG1-CG1 4.29Å; I1048-V1097 HydrophobicContact CG1-CG2 4.1Å; I1048-L1100 HydrophobicContact CD1-CD2 3.18Å; I1048-F1125 HydrophobicContact CG2-CD1 4.04Å; I1048-F1125 HydrophobicContact CG2-CD2 4.3Å; I1048-F1125 HydrophobicContact CG2-CE1 3.59Å; I1048-F1125 HydrophobicContact CG2-CE2 3.86Å; I1048-F1125 HydrophobicContact CG2-CG 4.39Å; I1048-F1125 HydrophobicContact CG2-CZ 3.49Å; I1048-F1125 VanDerWaalsContact CG2-CZ 3.46Å |
| 1049 | D | 89.3 | Confident | 84.5 | Confident | 51 Ų | 51 | 32 Ų | 32 | 27% | 0.273 | 17% | 0.169 | S | C | . | . | H | α-helix | trans | -60 | -43.4 | 178.5 | -105 | -28.2 | 0 | 0 | 0 | 112.2 | N1045 K1046 L1047 S1053 K1124 F1125 | N1045-D1049 PolarHBondContact O-N 3.18Å; N1045-D1049 VanDerWaalsContact O-N 3.12Å; K1046-D1049 PolarHBondContact O-N 3.11Å; L1047-D1049 VanDerWaalsContact C-N 3.3Å; L1047-D1049 PolarHBondContact O-N 3.43Å; D1049-S1053 PolarHBondContact O-N 3.09Å; D1049-K1124 IonicContact OD1-NZ 3.35Å; D1049-K1124 PolarHBondContact OD1-NZ 3.2Å; D1049-F1125 VanDerWaalsContact OD1-CZ 3.26Å; D1049-F1125 WeakPolarHBondContact OD1-CZ 3.32Å |
| 1050 | L | 90.8 | Very high | 83 | Confident | 30 Ų | 30 | 35.5 Ų | 35.5 | 16% | 0.157 | 19% | 0.193 | C | C | . | . | H | α-helix | trans | -64.5 | -47.4 | 177.5 | -71.9 | 171.3 | 0 | 0 | 0 | 112.5 | L999 C1002 K1046 L1047 I1048 S1053 W1054 | L999-L1050 HydrophobicContact CD2-CD1 4.41Å; C1002-L1050 HydrophobicContact CB-CD1 3.95Å; K1046-L1050 HydrophobicContact CG-CD1 4.33Å; K1046-L1050 WeakPolarHBondContact O-CG 3.37Å; K1046-L1050 PolarHBondContact O-N 3.29Å; K1046-L1050 VanDerWaalsContact O-N 3.15Å; L1047-L1050 PolarHBondContact O-N 3.13Å; I1048-L1050 VanDerWaalsContact C-N 3.32Å; I1048-L1050 PolarHBondContact O-N 3.29Å; L1050-S1053 PolarHBondContact O-N 3.24Å; L1050-S1053 PolarHBondContact O-OG 3.17Å; L1050-S1053 VanDerWaalsContact O-OG 3.04Å; L1050-W1054 PolarHBondContact O-NE1 3.32Å |
| 1051 | I | 93.3 | Very high | 81.1 | Confident | 0 Ų | 0 | 37.2 Ų | 37.2 | 0% | 0 | 21% | 0.21 | C | C | . | . | H | α-helix | trans | -72.8 | -37.7 | -177.2 | -63.1 | 166.3 | 0 | 0 | 0 | 111.2 | I1025 L1047 I1048 S1053 W1054 C1089 A1092 L1093 L1096 | I1025-I1051 HydrophobicContact CD1-CD1 3.42Å; I1025-I1051 VanDerWaalsContact CD1-CD1 3.43Å; I1025-I1051 HydrophobicContact CD1-CG1 4.17Å; I1025-I1051 HydrophobicContact CG2-CD1 4.41Å; L1047-I1051 HydrophobicContact CB-CD1 4.47Å; L1047-I1051 WeakPolarHBondContact O-CB 3.33Å; L1047-I1051 WeakPolarHBondContact O-CD1 3.29Å; L1047-I1051 VanDerWaalsContact O-CG1 3.24Å; L1047-I1051 WeakPolarHBondContact O-CG1 3.34Å; L1047-I1051 PolarHBondContact O-N 3.11Å; I1048-I1051 PolarHBondContact O-N 3.19Å; I1051-S1053 PolarHBondContact O-N 3.2Å; I1051-W1054 HydrophobicContact CG1-CE3 4.34Å; I1051-W1054 HydrophobicContact CG1-CZ3 4.18Å; I1051-W1054 HydrophobicContact CG2-CE3 4.42Å; I1051-W1054 WeakPolarHBondContact O-CB 3.42Å; I1051-W1054 PolarHBondContact O-N 3.05Å; I1051-C1089 HydrophobicContact CG2-CB 3.83Å; I1051-A1092 HydrophobicContact CD1-CB 4.25Å; I1051-L1093 HydrophobicContact CB-CD2 4.05Å; I1051-L1093 HydrophobicContact CB-CG 4.41Å; I1051-L1093 HydrophobicContact CG2-CD1 4.2Å; I1051-L1093 HydrophobicContact CG2-CD2 4.06Å; I1051-L1093 HydrophobicContact CG2-CG 3.85Å; I1051-L1096 HydrophobicContact CD1-CD1 3.45Å; I1051-L1096 VanDerWaalsContact CD1-CD1 3.45Å |
| 1052 | A | 91 | Very high | 79.1 | Confident | 7.4 Ų | 7.4 | 37.3 Ų | 37.3 | 6% | 0.061 | 21% | 0.213 | C | C | . | . | H | α-helix | trans | -57.8 | -36.1 | 176.4 | 0 | 0 | 0 | 0 | 0 | 111.3 | I1048 W1054 I1055 F1125 L1128 | I1048-A1052 WeakPolarHBondContact O-CB 3.36Å; I1048-A1052 PolarHBondContact O-N 3.24Å; A1052-W1054 PolarHBondContact O-N 3.06Å; A1052-I1055 PolarHBondContact O-N 3.13Å; A1052-F1125 HydrophobicContact CB-CD1 4.06Å; A1052-F1125 HydrophobicContact CB-CE1 3.82Å; A1052-L1128 HydrophobicContact CB-CD2 3.72Å |
| 1053 | S | 89 | Confident | 76.9 | Confident | 64.8 Ų | 64.8 | 36.2 Ų | 36.2 | 45% | 0.453 | 22% | 0.222 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -66.3 | -17.2 | 175.4 | 83.2 | 0 | 0 | 0 | 0 | 114.3 | H1006 D1049 L1050 I1051 | H1006-S1053 PolarHBondContact CE1-OG 3.34Å; H1006-S1053 VanDerWaalsContact CE1-OG 3.25Å; H1006-S1053 PolarHBondContact ND1-OG 3.33Å; D1049-S1053 PolarHBondContact O-N 3.09Å; L1050-S1053 PolarHBondContact O-N 3.24Å; L1050-S1053 PolarHBondContact O-OG 3.17Å; L1050-S1053 VanDerWaalsContact O-OG 3.04Å; I1051-S1053 PolarHBondContact O-N 3.2Å |
| 1054 | W | 90.8 | Very high | 74.5 | Confident | 7.2 Ų | 7.2 | 39.4 Ų | 39.4 | 3% | 0.027 | 25% | 0.25 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -85.4 | -14.8 | 178.7 | -60.1 | -11.4 | 0 | 0 | 0 | 113.2 | C1002 A1005 H1006 K1018 I1021 L1050 I1051 A1052 I1056 | C1002-W1054 HydrophobicContact CB-CH2 4.35Å; C1002-W1054 HydrophobicContact CB-CZ2 4.37Å; A1005-W1054 HydrophobicContact CB-CH2 4.19Å; A1005-W1054 HydrophobicContact CB-CZ2 3.99Å; H1006-W1054 AromaticContact ND1-CD1 3.98Å; H1006-W1054 AromaticContact ND1-NE1 3.57Å; K1018-W1054 HydrophobicContact CB-CD2 4.41Å; K1018-W1054 HydrophobicContact CB-CE3 3.92Å; K1018-W1054 HydrophobicContact CB-CZ3 4.09Å; K1018-W1054 HydrophobicContact CD-CB 4.41Å; K1018-W1054 HydrophobicContact CD-CD2 3.89Å; K1018-W1054 HydrophobicContact CD-CE3 4.28Å; K1018-W1054 HydrophobicContact CD-CG 3.95Å; K1018-W1054 HydrophobicContact CG-CD2 4.01Å; K1018-W1054 HydrophobicContact CG-CE3 3.99Å; K1018-W1054 HydrophobicContact CG-CG 4.49Å; K1018-W1054 HydrophobicContact CG-CH2 4.35Å; K1018-W1054 HydrophobicContact CG-CZ2 4.33Å; K1018-W1054 HydrophobicContact CG-CZ3 4.17Å; I1021-W1054 HydrophobicContact CB-CH2 4.49Å; I1021-W1054 HydrophobicContact CD1-CH2 4.41Å; I1021-W1054 HydrophobicContact CG2-CH2 4.04Å; I1021-W1054 HydrophobicContact CG2-CZ3 4.28Å; L1050-W1054 PolarHBondContact O-NE1 3.32Å; I1051-W1054 HydrophobicContact CG1-CE3 4.34Å; I1051-W1054 HydrophobicContact CG1-CZ3 4.18Å; I1051-W1054 HydrophobicContact CG2-CE3 4.42Å; I1051-W1054 WeakPolarHBondContact O-CB 3.42Å; I1051-W1054 PolarHBondContact O-N 3.05Å; A1052-W1054 PolarHBondContact O-N 3.06Å; W1054-I1056 PolarHBondContact O-N 3.12Å |
| 1055 | I | 88.4 | Confident | 72 | Confident | 14.2 Ų | 14.2 | 42.6 Ų | 42.6 | 7% | 0.073 | 28% | 0.277 | C | S | . | . | trans | -77.8 | 123.6 | -179.4 | -64 | 170.6 | 0 | 0 | 0 | 109.2 | A1052 C1089 M1090 L1093 L1128 L1132 | A1052-I1055 PolarHBondContact O-N 3.13Å; I1055-C1089 HydrophobicContact CD1-CB 4.19Å; I1055-C1089 HydrophobicContact CG1-CB 3.79Å; I1055-M1090 HydrophobicContact CD1-CG 4.33Å; I1055-M1090 HydrophobicContact CD1-SD 3.43Å; I1055-M1090 WeakPolarHBondContact CD1-SD 3.34Å; I1055-L1093 HydrophobicContact CD1-CD1 3.55Å; I1055-L1093 VanDerWaalsContact CD1-CD1 3.48Å; I1055-L1128 HydrophobicContact CB-CD1 4.38Å; I1055-L1128 HydrophobicContact CD1-CD2 4.13Å; I1055-L1128 HydrophobicContact CG2-CD1 4.16Å; I1055-L1132 HydrophobicContact CG2-CD1 4.1Å; I1055-L1132 HydrophobicContact CG2-CD2 4.18Å | ||
| 1056 | I | 80.1 | Confident | 69.7 | Low | 47.8 Ų | 47.8 | 45.1 Ų | 45.1 | 25% | 0.245 | 29% | 0.293 | C | S | . | . | trans | -109.5 | 113.1 | 175.3 | -56.1 | 174.7 | 0 | 0 | 0 | 108 | W1054 C1062 L1082 N1086 | W1054-I1056 PolarHBondContact O-N 3.12Å; I1056-C1062 VanDerWaalsContact CG2-SG 3.57Å; I1056-L1082 HydrophobicContact CB-CD1 4.24Å; I1056-L1082 HydrophobicContact CB-CD2 4.48Å; I1056-L1082 HydrophobicContact CD1-CD1 4.04Å; I1056-L1082 HydrophobicContact CG1-CD1 4.41Å; I1056-N1086 PolarHBondContact N-OD1 3.15Å; I1056-N1086 PolarHBondContact O-ND2 3.05Å; I1056-N1086 VanDerWaalsContact O-ND2 3.08Å | ||
| 1057 | C | 70.3 | Confident | 67.3 | Low | 27.2 Ų | 27.2 | 44.9 Ų | 44.9 | 18% | 0.184 | 30% | 0.295 | C | S | . | . | trans | -86.2 | 138.5 | 172.1 | -59.9 | 0 | 0 | 0 | 0 | 109.6 | S1061 C1062 N1131 D1135 | C1057-S1061 PolarHBondContact O-OG 3.18Å; C1057-C1062 PolarHBondContact O-SG 3.11Å; C1057-N1131 HydrophobicContact CB-CB 4.28Å; C1057-D1135 VanDerWaalsContact CA-OD2 3.26Å; C1057-D1135 WeakPolarHBondContact CA-OD2 3.31Å; C1057-D1135 VanDerWaalsContact CB-OD2 3.31Å; C1057-D1135 WeakPolarHBondContact CB-OD2 3.36Å | ||
| 1058 | N | 63.4 | Low | 64.8 | Low | 63.4 Ų | 63.4 | 52.3 Ų | 52.3 | 34% | 0.339 | 33% | 0.331 | S | S | . | . | trans | 36.5 | 104.8 | 179.3 | -123.2 | -21.9 | 0 | 0 | 0 | 115 | S1060 S1061 C1062 D1135 | N1058-S1060 PolarHBondContact O-N 3.17Å; N1058-S1060 VanDerWaalsContact O-N 3.07Å; N1058-S1060 PolarHBondContact OD1-OG 3.06Å; N1058-S1061 VanDerWaalsContact CB-OG 3.25Å; N1058-S1061 WeakPolarHBondContact CB-OG 3.25Å; N1058-S1061 PolarHBondContact O-N 3.08Å; N1058-S1061 VanDerWaalsContact O-N 3.08Å; N1058-S1061 PolarHBondContact O-OG 2.99Å; N1058-C1062 PolarHBondContact O-N 3.04Å; N1058-D1135 WeakPolarHBondContact CB-OD1 3.43Å; N1058-D1135 PolarHBondContact N-OD2 3.24Å; N1058-D1135 PolarHBondContact ND2-OD1 3.06Å; N1058-D1135 PolarHBondContact OD1-OD1 2.65Å; N1058-D1135 VanDerWaalsContact OD1-OD1 3.1Å | ||
| 1059 | P | 51.7 | Low | 62.4 | Low | 50.8 Ų | 50.8 | 59.2 Ų | 59.2 | 33% | 0.33 | 37% | 0.368 | S | S | . | . | G | 310 helix | trans | -63.3 | -14.4 | -175.9 | 16.4 | -21.6 | 0 | 0 | 0 | 114.4 | S1061 C1062 I1067 F1074 L1082 | P1059-S1061 VanDerWaalsContact C-N 3.3Å; P1059-S1061 PolarHBondContact O-N 3.37Å; P1059-C1062 WeakPolarHBondContact O-CB 3.47Å; P1059-C1062 PolarHBondContact O-N 3.2Å; P1059-I1067 HydrophobicContact CB-CG1 4.37Å; P1059-I1067 WeakPolarHBondContact O-CD1 3.37Å; P1059-F1074 HydrophobicContact CB-CE1 3.84Å; P1059-F1074 VanDerWaalsContact CB-CE1 3.49Å; P1059-F1074 HydrophobicContact CB-CZ 3.66Å; P1059-F1074 HydrophobicContact CG-CE1 3.89Å; P1059-F1074 HydrophobicContact CG-CZ 4.39Å; P1059-L1082 HydrophobicContact CB-CD2 4.19Å |
| 1060 | S | 48.3 | Very low | 60 | Low | 97.8 Ų | 97.8 | 58.3 Ų | 58.3 | 68% | 0.684 | 37% | 0.365 | S | S | * | . | G | 310 helix | trans | -72 | -15.8 | 174.3 | 41.1 | 0 | 0 | 0 | 0 | 114.2 | N1058 | N1058-S1060 PolarHBondContact O-N 3.17Å; N1058-S1060 VanDerWaalsContact O-N 3.07Å; N1058-S1060 PolarHBondContact OD1-OG 3.06Å |
| 1061 | S | 43 | Very low | 57.7 | Low | 82.2 Ų | 82.2 | 60.6 Ų | 60.6 | 58% | 0.575 | 38% | 0.384 | S | S | * | . | G | 310 helix | trans | -106.7 | -2.6 | -179.3 | 33.3 | 0 | 0 | 0 | 0 | 114.3 | C1057 N1058 P1059 S1063 | C1057-S1061 PolarHBondContact O-OG 3.18Å; N1058-S1061 VanDerWaalsContact CB-OG 3.25Å; N1058-S1061 WeakPolarHBondContact CB-OG 3.25Å; N1058-S1061 PolarHBondContact O-N 3.08Å; N1058-S1061 VanDerWaalsContact O-N 3.08Å; N1058-S1061 PolarHBondContact O-OG 2.99Å; P1059-S1061 VanDerWaalsContact C-N 3.3Å; P1059-S1061 PolarHBondContact O-N 3.37Å; S1061-S1063 PolarHBondContact O-N 2.84Å |
| 1062 | C | 39.8 | Very low | 55.3 | Low | 36.8 Ų | 36.8 | 65.8 Ų | 65.8 | 25% | 0.249 | 42% | 0.418 | C | S | . | . | S | Bend | trans | -70.7 | 136 | 173.8 | -72.8 | 0 | 0 | 0 | 0 | 110.6 | I1056 C1057 N1058 P1059 A1064 V1066 I1067 | I1056-C1062 VanDerWaalsContact CG2-SG 3.57Å; C1057-C1062 PolarHBondContact O-SG 3.11Å; N1058-C1062 PolarHBondContact O-N 3.04Å; P1059-C1062 WeakPolarHBondContact O-CB 3.47Å; P1059-C1062 PolarHBondContact O-N 3.2Å; C1062-A1064 PolarHBondContact O-N 3.44Å; C1062-V1066 HydrophobicContact CB-CB 4.14Å; C1062-V1066 HydrophobicContact CB-CG1 4.24Å; C1062-I1067 HydrophobicContact CB-CD1 4.42Å; C1062-I1067 HydrophobicContact CB-CG1 4.27Å; C1062-I1067 VanDerWaalsContact O-CD1 3.25Å; C1062-I1067 WeakPolarHBondContact O-CD1 3.43Å |
| 1063 | S | 38.1 | Very low | 53 | Low | 83 Ų | 83 | 68.8 Ų | 68.8 | 58% | 0.58 | 43% | 0.432 | S | S | * | . | trans | -50.2 | 143.9 | 176.7 | 64.1 | 0 | 0 | 0 | 0 | 111.3 | S1061 A1065 V1066 I1067 | S1061-S1063 PolarHBondContact O-N 2.84Å; S1063-A1065 PolarHBondContact O-N 3.05Å; S1063-V1066 PolarHBondContact O-N 3.22Å; S1063-I1067 PolarHBondContact O-N 2.93Å | ||
| 1064 | A | 37.6 | Very low | 50.9 | Low | 74 Ų | 74 | 71.1 Ų | 71.1 | 61% | 0.612 | 43% | 0.434 | S | S | * | . | H | α-helix | trans | -48.6 | -20.7 | -176.8 | 0 | 0 | 0 | 0 | 0 | 114.9 | C1062 I1067 M1068 | C1062-A1064 PolarHBondContact O-N 3.44Å; A1064-I1067 PolarHBondContact O-N 2.95Å; A1064-M1068 HydrophobicContact CB-CG 4.33Å; A1064-M1068 HydrophobicContact CB-SD 4.32Å; A1064-M1068 WeakPolarHBondContact O-CA 3.15Å; A1064-M1068 VanDerWaalsContact O-CB 3.22Å; A1064-M1068 WeakPolarHBondContact O-CB 3.41Å; A1064-M1068 WeakPolarHBondContact O-CG 3.48Å; A1064-M1068 PolarHBondContact O-N 3.01Å; A1064-M1068 VanDerWaalsContact O-N 3.1Å |
| 1065 | A | 40.6 | Very low | 49.1 | Very low | 72.4 Ų | 72.4 | 73.4 Ų | 73.4 | 60% | 0.598 | 45% | 0.451 | S | S | * | . | H | α-helix | trans | -67.5 | -35.7 | 176.4 | 0 | 0 | 0 | 0 | 0 | 114.4 | S1063 N1069 | S1063-A1065 PolarHBondContact O-N 3.05Å; A1065-N1069 PolarHBondContact O-N 3.3Å |
| 1066 | V | 42.5 | Very low | 47.8 | Very low | 67.8 Ų | 67.8 | 77 Ų | 77 | 41% | 0.411 | 48% | 0.478 | S | S | . | . | H | α-helix | trans | -79.4 | -32.5 | 177.9 | 179 | 0 | 0 | 0 | 0 | 110.8 | C1062 S1063 M1068 N1069 C1070 | C1062-V1066 HydrophobicContact CB-CB 4.14Å; C1062-V1066 HydrophobicContact CB-CG1 4.24Å; S1063-V1066 PolarHBondContact O-N 3.22Å; V1066-M1068 VanDerWaalsContact C-N 3.34Å; V1066-M1068 PolarHBondContact O-N 3.48Å; V1066-N1069 PolarHBondContact O-N 3.08Å; V1066-C1070 WeakPolarHBondContact O-CB 3.43Å; V1066-C1070 PolarHBondContact O-N 3.29Å; V1066-C1070 PolarHBondContact O-SG 3.32Å |
| 1067 | I | 39.5 | Very low | 47.1 | Very low | 64 Ų | 64 | 81.9 Ų | 81.9 | 33% | 0.328 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -74.3 | -32.2 | -179 | -62.5 | 176.1 | 0 | 0 | 0 | 111.6 | P1059 C1062 S1063 A1064 N1069 C1070 S1071 F1074 | P1059-I1067 HydrophobicContact CB-CG1 4.37Å; P1059-I1067 WeakPolarHBondContact O-CD1 3.37Å; C1062-I1067 HydrophobicContact CB-CD1 4.42Å; C1062-I1067 HydrophobicContact CB-CG1 4.27Å; C1062-I1067 VanDerWaalsContact O-CD1 3.25Å; C1062-I1067 WeakPolarHBondContact O-CD1 3.43Å; S1063-I1067 PolarHBondContact O-N 2.93Å; A1064-I1067 PolarHBondContact O-N 2.95Å; I1067-N1069 PolarHBondContact O-N 3.19Å; I1067-C1070 CarbonylContact O-C 3.58Å; I1067-C1070 PolarHBondContact O-N 3.22Å; I1067-C1070 VanDerWaalsContact O-O 3.06Å; I1067-S1071 PolarHBondContact O-N 3.36Å; I1067-S1071 PolarHBondContact O-OG 3.17Å; I1067-F1074 HydrophobicContact CB-CE2 4.16Å; I1067-F1074 HydrophobicContact CG1-CE2 4.34Å; I1067-F1074 HydrophobicContact CG1-CZ 4.24Å; I1067-F1074 HydrophobicContact CG2-CD2 3.82Å; I1067-F1074 HydrophobicContact CG2-CE2 4.08Å; I1067-F1074 HydrophobicContact CG2-CZ 4.49Å |
| 1068 | M | 40.2 | Very low | 46.9 | Very low | 155 Ų | 155 | 81.6 Ų | 81.6 | 76% | 0.764 | 50% | 0.499 | S | S | * | . | H | α-helix | trans | -70 | -27 | -177.8 | -119.7 | -173.7 | -160.1 | 0 | 0 | 113.7 | A1064 V1066 C1070 | A1064-M1068 HydrophobicContact CB-CG 4.33Å; A1064-M1068 HydrophobicContact CB-SD 4.32Å; A1064-M1068 WeakPolarHBondContact O-CA 3.15Å; A1064-M1068 VanDerWaalsContact O-CB 3.22Å; A1064-M1068 WeakPolarHBondContact O-CB 3.41Å; A1064-M1068 WeakPolarHBondContact O-CG 3.48Å; A1064-M1068 PolarHBondContact O-N 3.01Å; A1064-M1068 VanDerWaalsContact O-N 3.1Å; V1066-M1068 VanDerWaalsContact C-N 3.34Å; V1066-M1068 PolarHBondContact O-N 3.48Å; M1068-C1070 VanDerWaalsContact C-N 3.29Å |
| 1069 | N | 42.6 | Very low | 47.2 | Very low | 146 Ų | 146 | 80.5 Ų | 80.5 | 78% | 0.781 | 50% | 0.495 | S | S | * | . | H | α-helix | trans | -93.6 | -9.9 | 175 | -77.8 | -9.7 | 0 | 0 | 0 | 113.8 | A1065 V1066 I1067 S1071 | A1065-N1069 PolarHBondContact O-N 3.3Å; V1066-N1069 PolarHBondContact O-N 3.08Å; I1067-N1069 PolarHBondContact O-N 3.19Å; N1069-S1071 PolarHBondContact O-N 3.39Å |
| 1070 | C | 40 | Very low | 48.3 | Very low | 32.6 Ų | 32.6 | 79.9 Ų | 79.9 | 22% | 0.22 | 49% | 0.49 | C | S | . | . | H | α-helix | trans | -101.9 | 42.9 | 178.2 | -65.3 | 0 | 0 | 0 | 0 | 112.5 | V1066 I1067 M1068 P1072 L1073 F1074 V1079 | V1066-C1070 WeakPolarHBondContact O-CB 3.43Å; V1066-C1070 PolarHBondContact O-N 3.29Å; V1066-C1070 PolarHBondContact O-SG 3.32Å; I1067-C1070 CarbonylContact O-C 3.58Å; I1067-C1070 PolarHBondContact O-N 3.22Å; I1067-C1070 VanDerWaalsContact O-O 3.06Å; M1068-C1070 VanDerWaalsContact C-N 3.29Å; C1070-P1072 VanDerWaalsContact C-N 3.28Å; C1070-P1072 VanDerWaalsContact O-N 3.15Å; C1070-L1073 HydrophobicContact CB-CB 4.2Å; C1070-L1073 HydrophobicContact CB-CD1 4.18Å; C1070-L1073 WeakPolarHBondContact O-CA 3.39Å; C1070-L1073 WeakPolarHBondContact O-CB 3.29Å; C1070-L1073 PolarHBondContact O-N 3.18Å; C1070-F1074 HydrophobicContact CB-CE2 4.11Å; C1070-F1074 WeakPolarHBondContact O-CD2 3.42Å; C1070-F1074 WeakPolarHBondContact O-CE2 3.4Å; C1070-V1079 HydrophobicContact CB-CG2 4.28Å |
| 1071 | S | 42 | Very low | 49.7 | Very low | 78.2 Ų | 78.2 | 77 Ų | 77 | 55% | 0.547 | 47% | 0.468 | S | S | . | . | trans | -52 | -25.4 | 175.9 | -87.8 | 0 | 0 | 0 | 0 | 114 | I1067 N1069 L1073 F1074 | I1067-S1071 PolarHBondContact O-N 3.36Å; I1067-S1071 PolarHBondContact O-OG 3.17Å; N1069-S1071 PolarHBondContact O-N 3.39Å; S1071-L1073 VanDerWaalsContact C-N 3.33Å; S1071-L1073 PolarHBondContact O-N 3.12Å; S1071-F1074 CarbonylContact O-C 3.57Å; S1071-F1074 PolarHBondContact O-N 3.3Å | ||
| 1072 | P | 43.1 | Very low | 51.6 | Low | 109.6 Ų | 109.6 | 74.2 Ų | 74.2 | 71% | 0.712 | 45% | 0.447 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -75.1 | -2.8 | 177.4 | 12.6 | -9.3 | 0 | 0 | 0 | 114.6 | C1070 F1074 M1142 | C1070-P1072 VanDerWaalsContact C-N 3.28Å; C1070-P1072 VanDerWaalsContact O-N 3.15Å; P1072-F1074 VanDerWaalsContact C-N 3.33Å; P1072-F1074 PolarHBondContact O-N 2.96Å; P1072-M1142 HydrophobicContact CB-SD 3.95Å |
| 1073 | L | 41.4 | Very low | 53.7 | Low | 70 Ų | 70 | 75.3 Ų | 75.3 | 37% | 0.366 | 45% | 0.445 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -96.6 | 10.7 | -179 | -83.7 | 136.9 | 0 | 0 | 0 | 113.2 | V1010 F1015 C1070 S1071 S1075 A1078 A1146 | V1010-L1073 HydrophobicContact CB-CD1 4.47Å; V1010-L1073 HydrophobicContact CG1-CD1 3.6Å; V1010-L1073 HydrophobicContact CG1-CD2 4.47Å; F1015-L1073 HydrophobicContact CE2-CD2 3.98Å; F1015-L1073 HydrophobicContact CZ-CD2 4.06Å; C1070-L1073 HydrophobicContact CB-CB 4.2Å; C1070-L1073 HydrophobicContact CB-CD1 4.18Å; C1070-L1073 WeakPolarHBondContact O-CA 3.39Å; C1070-L1073 WeakPolarHBondContact O-CB 3.29Å; C1070-L1073 PolarHBondContact O-N 3.18Å; S1071-L1073 VanDerWaalsContact C-N 3.33Å; S1071-L1073 PolarHBondContact O-N 3.12Å; L1073-S1075 VanDerWaalsContact C-N 3.29Å; L1073-S1075 PolarHBondContact O-N 2.95Å; L1073-A1078 HydrophobicContact CB-CB 4.33Å; L1073-A1078 HydrophobicContact CD2-CB 4.01Å; L1073-A1078 WeakPolarHBondContact O-CB 3.38Å; L1073-A1146 HydrophobicContact CD2-CB 3.39Å |
| 1074 | F | 46 | Very low | 56 | Low | 113.6 Ų | 113.6 | 74.1 Ų | 74.1 | 50% | 0.498 | 43% | 0.431 | S | S | . | . | trans | -95.2 | 49.3 | 171.1 | -71.4 | -76.3 | 0 | 0 | 0 | 111.3 | P1059 I1067 C1070 S1071 P1072 S1076 A1078 V1079 T1186 | P1059-F1074 HydrophobicContact CB-CE1 3.84Å; P1059-F1074 VanDerWaalsContact CB-CE1 3.49Å; P1059-F1074 HydrophobicContact CB-CZ 3.66Å; P1059-F1074 HydrophobicContact CG-CE1 3.89Å; P1059-F1074 HydrophobicContact CG-CZ 4.39Å; I1067-F1074 HydrophobicContact CB-CE2 4.16Å; I1067-F1074 HydrophobicContact CG1-CE2 4.34Å; I1067-F1074 HydrophobicContact CG1-CZ 4.24Å; I1067-F1074 HydrophobicContact CG2-CD2 3.82Å; I1067-F1074 HydrophobicContact CG2-CE2 4.08Å; I1067-F1074 HydrophobicContact CG2-CZ 4.49Å; C1070-F1074 HydrophobicContact CB-CE2 4.11Å; C1070-F1074 WeakPolarHBondContact O-CD2 3.42Å; C1070-F1074 WeakPolarHBondContact O-CE2 3.4Å; S1071-F1074 CarbonylContact O-C 3.57Å; S1071-F1074 PolarHBondContact O-N 3.3Å; P1072-F1074 VanDerWaalsContact C-N 3.33Å; P1072-F1074 PolarHBondContact O-N 2.96Å; F1074-S1076 PolarHBondContact O-N 3.28Å; F1074-S1076 VanDerWaalsContact O-N 3.16Å; F1074-A1078 HydrophobicContact CD1-CB 4Å; F1074-A1078 HydrophobicContact CE1-CB 4.14Å; F1074-V1079 HydrophobicContact CD1-CG2 4.37Å; F1074-T1186 HydrophobicContact CE1-CG2 3.96Å | ||
| 1075 | S | 51.8 | Low | 58.5 | Low | 55.2 Ų | 55.2 | 70.6 Ų | 70.6 | 39% | 0.386 | 40% | 0.402 | S | S | . | . | S | Bend | trans | -63.4 | 141.5 | 165.5 | 67.3 | 0 | 0 | 0 | 0 | 109.3 | L1073 E1077 A1078 V1079 V1080 | L1073-S1075 VanDerWaalsContact C-N 3.29Å; L1073-S1075 PolarHBondContact O-N 2.95Å; S1075-E1077 PolarHBondContact O-N 3Å; S1075-A1078 PolarHBondContact O-N 2.9Å; S1075-A1078 WeakPolarHBondContact OG-CB 3.24Å; S1075-A1078 PolarHBondContact OG-N 3.3Å; S1075-V1079 PolarHBondContact O-N 3.49Å; S1075-V1080 VanDerWaalsContact OG-CG2 3.29Å; S1075-V1080 WeakPolarHBondContact OG-CG2 3.43Å |
| 1076 | S | 61.5 | Low | 60.9 | Low | 89 Ų | 89 | 67.7 Ų | 67.7 | 62% | 0.622 | 38% | 0.376 | S | S | * | . | H | α-helix | trans | -51 | -18.4 | 172.6 | 177.5 | 0 | 0 | 0 | 0 | 112.6 | F1074 A1078 V1079 V1080 | F1074-S1076 PolarHBondContact O-N 3.28Å; F1074-S1076 VanDerWaalsContact O-N 3.16Å; S1076-A1078 PolarHBondContact O-N 3.2Å; S1076-V1079 WeakPolarHBondContact O-CB 3.31Å; S1076-V1079 PolarHBondContact O-N 3.02Å; S1076-V1080 VanDerWaalsContact O-CG2 3.25Å; S1076-V1080 WeakPolarHBondContact O-CG2 3.39Å; S1076-V1080 PolarHBondContact O-N 3.13Å |
| 1077 | E | 65.3 | Low | 63.3 | Low | 150.8 Ų | 150.8 | 64.8 Ų | 64.8 | 71% | 0.705 | 36% | 0.358 | S | S | * | . | H | α-helix | trans | -75.8 | -35.8 | -178 | -165.7 | 169 | -166.5 | 0 | 0 | 113 | S1075 V1079 V1080 T1081 | S1075-E1077 PolarHBondContact O-N 3Å; E1077-V1079 VanDerWaalsContact C-N 3.34Å; E1077-V1079 PolarHBondContact O-N 3.23Å; E1077-V1080 WeakPolarHBondContact O-CB 3.28Å; E1077-V1080 PolarHBondContact O-N 3.22Å; E1077-T1081 WeakPolarHBondContact O-CG2 3.5Å; E1077-T1081 PolarHBondContact O-N 3.08Å; E1077-T1081 VanDerWaalsContact O-N 3.11Å; E1077-T1081 PolarHBondContact O-OG1 3.21Å; E1077-T1081 VanDerWaalsContact O-OG1 3.08Å |
| 1078 | A | 65.7 | Low | 65.9 | Low | 20.8 Ų | 20.8 | 62 Ų | 62 | 17% | 0.172 | 35% | 0.345 | C | S | . | . | H | α-helix | trans | -68.4 | -33.6 | 176.9 | 0 | 0 | 0 | 0 | 0 | 112.9 | L1073 F1074 S1075 S1076 V1080 T1081 L1082 | L1073-A1078 HydrophobicContact CB-CB 4.33Å; L1073-A1078 HydrophobicContact CD2-CB 4.01Å; L1073-A1078 WeakPolarHBondContact O-CB 3.38Å; F1074-A1078 HydrophobicContact CD1-CB 4Å; F1074-A1078 HydrophobicContact CE1-CB 4.14Å; S1075-A1078 PolarHBondContact O-N 2.9Å; S1075-A1078 WeakPolarHBondContact OG-CB 3.24Å; S1075-A1078 PolarHBondContact OG-N 3.3Å; S1076-A1078 PolarHBondContact O-N 3.2Å; A1078-V1080 VanDerWaalsContact C-N 3.28Å; A1078-V1080 PolarHBondContact O-N 3.23Å; A1078-T1081 VanDerWaalsContact CA-OG1 3.31Å; A1078-T1081 WeakPolarHBondContact CA-OG1 3.45Å; A1078-T1081 PolarHBondContact O-N 3.19Å; A1078-T1081 PolarHBondContact O-OG1 3.1Å; A1078-L1082 WeakPolarHBondContact O-CB 3.4Å; A1078-L1082 PolarHBondContact O-N 3.1Å |
| 1079 | V | 71.2 | Confident | 68.5 | Low | 41.2 Ų | 41.2 | 54.6 Ų | 54.6 | 25% | 0.25 | 31% | 0.308 | C | S | . | . | H | α-helix | trans | -67.4 | -36.5 | 173 | 177.1 | 0 | 0 | 0 | 0 | 111.2 | C1070 F1074 S1075 S1076 E1077 L1082 R1083 | C1070-V1079 HydrophobicContact CB-CG2 4.28Å; F1074-V1079 HydrophobicContact CD1-CG2 4.37Å; S1075-V1079 PolarHBondContact O-N 3.49Å; S1076-V1079 WeakPolarHBondContact O-CB 3.31Å; S1076-V1079 PolarHBondContact O-N 3.02Å; E1077-V1079 VanDerWaalsContact C-N 3.34Å; E1077-V1079 PolarHBondContact O-N 3.23Å; V1079-L1082 PolarHBondContact O-N 3.4Å; V1079-R1083 VanDerWaalsContact O-CG 3.3Å; V1079-R1083 WeakPolarHBondContact O-CG 3.36Å; V1079-R1083 PolarHBondContact O-N 3.07Å; V1079-R1083 VanDerWaalsContact O-N 3.13Å |
| 1080 | V | 75 | Confident | 71 | Confident | 38 Ų | 38 | 47.7 Ų | 47.7 | 23% | 0.23 | 27% | 0.271 | C | S | . | . | H | α-helix | trans | -67.6 | -43.7 | 177.4 | 172.3 | 0 | 0 | 0 | 0 | 111 | S1075 S1076 E1077 A1078 L1082 R1083 E1084 | S1075-V1080 VanDerWaalsContact OG-CG2 3.29Å; S1075-V1080 WeakPolarHBondContact OG-CG2 3.43Å; S1076-V1080 VanDerWaalsContact O-CG2 3.25Å; S1076-V1080 WeakPolarHBondContact O-CG2 3.39Å; S1076-V1080 PolarHBondContact O-N 3.13Å; E1077-V1080 WeakPolarHBondContact O-CB 3.28Å; E1077-V1080 PolarHBondContact O-N 3.22Å; A1078-V1080 VanDerWaalsContact C-N 3.28Å; A1078-V1080 PolarHBondContact O-N 3.23Å; V1080-L1082 VanDerWaalsContact C-N 3.33Å; V1080-L1082 PolarHBondContact O-N 2.86Å; V1080-R1083 PolarHBondContact O-N 3.16Å; V1080-E1084 PolarHBondContact O-N 2.99Å; V1080-E1084 VanDerWaalsContact O-N 3.09Å |
| 1081 | T | 77.8 | Confident | 73.5 | Confident | 36.2 Ų | 36.2 | 49.2 Ų | 49.2 | 22% | 0.222 | 28% | 0.276 | C | S | . | . | H | α-helix | trans | -66.8 | -36.6 | 177.3 | 50.6 | 0 | 0 | 0 | 0 | 112.5 | E1077 A1078 R1083 E1084 L1085 | E1077-T1081 WeakPolarHBondContact O-CG2 3.5Å; E1077-T1081 PolarHBondContact O-N 3.08Å; E1077-T1081 VanDerWaalsContact O-N 3.11Å; E1077-T1081 PolarHBondContact O-OG1 3.21Å; E1077-T1081 VanDerWaalsContact O-OG1 3.08Å; A1078-T1081 VanDerWaalsContact CA-OG1 3.31Å; A1078-T1081 WeakPolarHBondContact CA-OG1 3.45Å; A1078-T1081 PolarHBondContact O-N 3.19Å; A1078-T1081 PolarHBondContact O-OG1 3.1Å; T1081-R1083 VanDerWaalsContact C-N 3.34Å; T1081-R1083 PolarHBondContact O-N 3.46Å; T1081-E1084 PolarHBondContact O-N 3.22Å; T1081-L1085 WeakPolarHBondContact O-CB 3.34Å; T1081-L1085 PolarHBondContact O-N 3.1Å |
| 1082 | L | 82.9 | Confident | 76.1 | Confident | 25 Ų | 25 | 45.5 Ų | 45.5 | 13% | 0.131 | 25% | 0.25 | C | C | . | . | H | α-helix | trans | -63.9 | -41 | 173.5 | -179.6 | 60.8 | 0 | 0 | 0 | 112.4 | F1015 I1056 P1059 A1078 V1079 V1080 E1084 L1085 N1086 | F1015-L1082 HydrophobicContact CD2-CB 4.36Å; F1015-L1082 HydrophobicContact CE1-CD1 4.34Å; F1015-L1082 HydrophobicContact CE2-CB 4.29Å; F1015-L1082 HydrophobicContact CE2-CD1 4.39Å; F1015-L1082 HydrophobicContact CZ-CD1 4.17Å; I1056-L1082 HydrophobicContact CB-CD1 4.24Å; I1056-L1082 HydrophobicContact CB-CD2 4.48Å; I1056-L1082 HydrophobicContact CD1-CD1 4.04Å; I1056-L1082 HydrophobicContact CG1-CD1 4.41Å; P1059-L1082 HydrophobicContact CB-CD2 4.19Å; A1078-L1082 WeakPolarHBondContact O-CB 3.4Å; A1078-L1082 PolarHBondContact O-N 3.1Å; V1079-L1082 PolarHBondContact O-N 3.4Å; V1080-L1082 VanDerWaalsContact C-N 3.33Å; V1080-L1082 PolarHBondContact O-N 2.86Å; L1082-E1084 VanDerWaalsContact C-N 3.34Å; L1082-L1085 HydrophobicContact CD1-CD2 4.4Å; L1082-L1085 WeakPolarHBondContact O-CB 3.36Å; L1082-L1085 PolarHBondContact O-N 3.27Å; L1082-N1086 PolarHBondContact O-N 3.28Å |
| 1083 | R | 82.2 | Confident | 78.6 | Confident | 58.2 Ų | 58.2 | 40.3 Ų | 40.3 | 22% | 0.22 | 22% | 0.216 | C | C | . | . | H | α-helix | trans | -65.3 | -40 | 176.3 | -73.3 | 173.2 | -177.5 | -169.4 | -2.9 | 112.2 | V1079 V1080 T1081 L1085 N1086 L1087 Y1139 M1197 | V1079-R1083 VanDerWaalsContact O-CG 3.3Å; V1079-R1083 WeakPolarHBondContact O-CG 3.36Å; V1079-R1083 PolarHBondContact O-N 3.07Å; V1079-R1083 VanDerWaalsContact O-N 3.13Å; V1080-R1083 PolarHBondContact O-N 3.16Å; T1081-R1083 VanDerWaalsContact C-N 3.34Å; T1081-R1083 PolarHBondContact O-N 3.46Å; R1083-L1085 VanDerWaalsContact C-N 3.3Å; R1083-L1085 PolarHBondContact O-N 3.04Å; R1083-N1086 PolarHBondContact O-N 3.26Å; R1083-L1087 WeakPolarHBondContact O-CB 3.32Å; R1083-L1087 PolarHBondContact O-N 3.04Å; R1083-Y1139 VanDerWaalsContact NH1-CE2 3.32Å; R1083-Y1139 VanDerWaalsContact NH1-CZ 3.29Å; R1083-Y1139 PolarHBondContact NH1-OH 3.01Å; R1083-Y1139 VanDerWaalsContact NH2-CE2 3.26Å; R1083-M1197 HydrophobicContact CG-SD 4.42Å |
| 1084 | E | 86.4 | Confident | 81 | Confident | 57.8 Ų | 57.8 | 37.6 Ų | 37.6 | 27% | 0.27 | 20% | 0.203 | S | C | . | . | H | α-helix | trans | -62.5 | -40 | 174.6 | -169.1 | 63.5 | -153 | 0 | 0 | 111.4 | V1080 T1081 L1082 L1087 C1088 R1196 | V1080-E1084 PolarHBondContact O-N 2.99Å; V1080-E1084 VanDerWaalsContact O-N 3.09Å; T1081-E1084 PolarHBondContact O-N 3.22Å; L1082-E1084 VanDerWaalsContact C-N 3.34Å; E1084-L1087 PolarHBondContact O-N 2.91Å; E1084-C1088 WeakPolarHBondContact O-CB 3.35Å; E1084-C1088 PolarHBondContact O-N 3.32Å; E1084-C1088 PolarHBondContact O-SG 3.03Å; E1084-R1196 IonicContact OE2-CZ 3.11Å; E1084-R1196 IonicContact OE2-NE 3.4Å; E1084-R1196 PolarHBondContact OE2-NE 3.15Å; E1084-R1196 IonicContact OE2-NH1 3.2Å; E1084-R1196 PolarHBondContact OE2-NH1 3.2Å; E1084-R1196 IonicContact OE2-NH2 3.5Å |
| 1085 | L | 90.6 | Very high | 83.2 | Confident | 1.8 Ų | 1.8 | 33.9 Ų | 33.9 | 1% | 0.009 | 19% | 0.19 | C | C | . | . | H | α-helix | trans | -61 | -50.9 | 173 | 173.6 | 63.1 | 0 | 0 | 0 | 111.4 | F1015 K1018 S1019 T1081 L1082 R1083 L1087 C1088 C1089 | F1015-L1085 HydrophobicContact CB-CB 4.42Å; F1015-L1085 HydrophobicContact CB-CD2 4.32Å; F1015-L1085 HydrophobicContact CD1-CD2 3.58Å; F1015-L1085 HydrophobicContact CE1-CD2 4.14Å; F1015-L1085 HydrophobicContact CG-CD2 4.13Å; K1018-L1085 HydrophobicContact CB-CD1 3.46Å; K1018-L1085 VanDerWaalsContact CB-CD1 3.45Å; K1018-L1085 HydrophobicContact CD-CD2 4.44Å; S1019-L1085 VanDerWaalsContact OG-CA 3.31Å; S1019-L1085 WeakPolarHBondContact OG-CA 3.43Å; T1081-L1085 WeakPolarHBondContact O-CB 3.34Å; T1081-L1085 PolarHBondContact O-N 3.1Å; L1082-L1085 HydrophobicContact CD1-CD2 4.4Å; L1082-L1085 WeakPolarHBondContact O-CB 3.36Å; L1082-L1085 PolarHBondContact O-N 3.27Å; R1083-L1085 VanDerWaalsContact C-N 3.3Å; R1083-L1085 PolarHBondContact O-N 3.04Å; L1085-L1087 VanDerWaalsContact C-N 3.28Å; L1085-L1087 PolarHBondContact O-N 3.11Å; L1085-C1088 PolarHBondContact O-N 3.04Å; L1085-C1088 VanDerWaalsContact O-N 3.11Å; L1085-C1089 VanDerWaalsContact CD1-SG 3.59Å; L1085-C1089 WeakPolarHBondContact O-CB 3.38Å; L1085-C1089 PolarHBondContact O-N 3.3Å; L1085-C1089 PolarHBondContact O-SG 3.13Å; L1085-C1089 VanDerWaalsContact O-SG 3.34Å |
| 1086 | N | 90.7 | Very high | 85.2 | Confident | 11 Ų | 11 | 31.2 Ų | 31.2 | 6% | 0.059 | 17% | 0.172 | C | C | . | . | H | α-helix | trans | -58.1 | -41.8 | 178.6 | -77.3 | -7.7 | 0 | 0 | 0 | 111.3 | I1056 L1082 R1083 C1089 M1090 L1200 | I1056-N1086 PolarHBondContact N-OD1 3.15Å; I1056-N1086 PolarHBondContact O-ND2 3.05Å; I1056-N1086 VanDerWaalsContact O-ND2 3.08Å; L1082-N1086 PolarHBondContact O-N 3.28Å; R1083-N1086 PolarHBondContact O-N 3.26Å; N1086-C1089 PolarHBondContact O-N 3.14Å; N1086-M1090 WeakPolarHBondContact O-CB 3.28Å; N1086-M1090 VanDerWaalsContact O-CG 3.32Å; N1086-M1090 WeakPolarHBondContact O-CG 3.43Å; N1086-M1090 PolarHBondContact O-N 3.3Å; N1086-L1200 HydrophobicContact CB-CD1 4.31Å; N1086-L1200 HydrophobicContact CB-CD2 4.44Å |
| 1087 | L | 92.5 | Very high | 86.6 | Confident | 6.6 Ų | 6.6 | 27.1 Ų | 27.1 | 4% | 0.035 | 14% | 0.143 | C | C | . | . | H | α-helix | trans | -60 | -49.4 | 174.4 | 175.1 | 61.3 | 0 | 0 | 0 | 111.7 | R1083 E1084 L1085 C1089 M1090 M1091 R1199 L1200 A1203 | R1083-L1087 WeakPolarHBondContact O-CB 3.32Å; R1083-L1087 PolarHBondContact O-N 3.04Å; E1084-L1087 PolarHBondContact O-N 2.91Å; L1085-L1087 VanDerWaalsContact C-N 3.28Å; L1085-L1087 PolarHBondContact O-N 3.11Å; L1087-C1089 PolarHBondContact O-N 3.05Å; L1087-M1090 PolarHBondContact O-N 3.16Å; L1087-M1091 HydrophobicContact CD1-CG 4.13Å; L1087-M1091 HydrophobicContact CD1-SD 3.96Å; L1087-M1091 HydrophobicContact CG-SD 4.03Å; L1087-M1091 VanDerWaalsContact O-CG 3.27Å; L1087-M1091 WeakPolarHBondContact O-CG 3.38Å; L1087-M1091 PolarHBondContact O-N 3.06Å; L1087-R1199 HydrophobicContact CD1-CB 3.91Å; L1087-R1199 HydrophobicContact CD2-CB 4.37Å; L1087-L1200 HydrophobicContact CB-CD1 4.35Å; L1087-L1200 HydrophobicContact CD1-CB 4.27Å; L1087-A1203 HydrophobicContact CD1-CB 4.46Å |
| 1088 | C | 94.2 | Very high | 87.6 | Confident | 6 Ų | 6 | 25.6 Ų | 25.6 | 4% | 0.041 | 13% | 0.131 | C | C | . | . | H | α-helix | trans | -61.9 | -43.6 | 178.6 | -70.6 | 0 | 0 | 0 | 0 | 111.9 | C1022 E1084 L1085 M1090 M1091 A1092 | C1022-C1088 HydrophobicContact CB-CB 3.83Å; C1022-C1088 WeakPolarHBondContact CB-O 3.38Å; E1084-C1088 WeakPolarHBondContact O-CB 3.35Å; E1084-C1088 PolarHBondContact O-N 3.32Å; E1084-C1088 PolarHBondContact O-SG 3.03Å; L1085-C1088 PolarHBondContact O-N 3.04Å; L1085-C1088 VanDerWaalsContact O-N 3.11Å; C1088-M1090 PolarHBondContact O-N 2.8Å; C1088-M1091 PolarHBondContact O-N 2.96Å; C1088-A1092 WeakPolarHBondContact O-CB 3.37Å; C1088-A1092 PolarHBondContact O-N 3.17Å |
| 1089 | C | 95.2 | Very high | 88.4 | Confident | 0 Ų | 0 | 29.2 Ų | 29.2 | 0% | 0 | 15% | 0.147 | C | C | . | . | H | α-helix | trans | -58.4 | -48.3 | 175.8 | -68.5 | 0 | 0 | 0 | 0 | 111 | C1022 I1051 I1055 L1085 N1086 L1087 M1091 A1092 L1093 | C1022-C1089 VanDerWaalsContact SG-SG 3.67Å; I1051-C1089 HydrophobicContact CG2-CB 3.83Å; I1055-C1089 HydrophobicContact CD1-CB 4.19Å; I1055-C1089 HydrophobicContact CG1-CB 3.79Å; L1085-C1089 VanDerWaalsContact CD1-SG 3.59Å; L1085-C1089 WeakPolarHBondContact O-CB 3.38Å; L1085-C1089 PolarHBondContact O-N 3.3Å; L1085-C1089 PolarHBondContact O-SG 3.13Å; L1085-C1089 VanDerWaalsContact O-SG 3.34Å; N1086-C1089 PolarHBondContact O-N 3.14Å; L1087-C1089 PolarHBondContact O-N 3.05Å; C1089-M1091 PolarHBondContact O-N 3.2Å; C1089-A1092 PolarHBondContact O-N 2.81Å; C1089-L1093 WeakPolarHBondContact O-CB 3.24Å; C1089-L1093 WeakPolarHBondContact O-CG 3.29Å; C1089-L1093 PolarHBondContact O-N 3.15Å |
| 1090 | M | 94.5 | Very high | 89.1 | Confident | 0.2 Ų | 0.2 | 27.2 Ų | 27.2 | 0% | 0.001 | 14% | 0.135 | C | C | . | . | H | α-helix | trans | -66.7 | -36.2 | -180 | -71.2 | -46.5 | -60.3 | 0 | 0 | 113.3 | I1055 N1086 L1087 C1088 A1092 L1093 A1094 F1129 L1132 L1200 A1203 T1204 A1207 | I1055-M1090 HydrophobicContact CD1-CG 4.33Å; I1055-M1090 HydrophobicContact CD1-SD 3.43Å; I1055-M1090 WeakPolarHBondContact CD1-SD 3.34Å; N1086-M1090 WeakPolarHBondContact O-CB 3.28Å; N1086-M1090 VanDerWaalsContact O-CG 3.32Å; N1086-M1090 WeakPolarHBondContact O-CG 3.43Å; N1086-M1090 PolarHBondContact O-N 3.3Å; L1087-M1090 PolarHBondContact O-N 3.16Å; C1088-M1090 PolarHBondContact O-N 2.8Å; M1090-A1092 VanDerWaalsContact C-N 3.33Å; M1090-A1092 PolarHBondContact O-N 3.2Å; M1090-L1093 PolarHBondContact O-N 3.1Å; M1090-L1093 HydrophobicContact SD-CD1 4Å; M1090-A1094 VanDerWaalsContact O-CB 3.26Å; M1090-A1094 WeakPolarHBondContact O-CB 3.29Å; M1090-A1094 PolarHBondContact O-N 3.13Å; M1090-F1129 HydrophobicContact CE-CD1 3.53Å; M1090-F1129 VanDerWaalsContact CE-CD1 3.5Å; M1090-F1129 HydrophobicContact CE-CE1 3.66Å; M1090-F1129 HydrophobicContact CE-CG 4.18Å; M1090-F1129 HydrophobicContact CE-CZ 4.33Å; M1090-F1129 HydrophobicContact SD-CD1 4.02Å; M1090-F1129 HydrophobicContact SD-CE1 4.01Å; M1090-L1132 HydrophobicContact CE-CD2 4.43Å; M1090-L1132 HydrophobicContact CG-CD2 3.31Å; M1090-L1132 HydrophobicContact SD-CD2 3.58Å; M1090-L1132 VanDerWaalsContact SD-CD2 3.54Å; M1090-L1200 HydrophobicContact CB-CD1 4.11Å; M1090-L1200 HydrophobicContact CG-CD1 3.8Å; M1090-A1203 HydrophobicContact CB-CB 3.95Å; M1090-T1204 HydrophobicContact CE-CG2 3.91Å; M1090-A1207 HydrophobicContact CE-CB 3.6Å |
| 1091 | M | 94.3 | Very high | 89.5 | Confident | 65 Ų | 65 | 26.8 Ų | 26.8 | 32% | 0.32 | 13% | 0.133 | S | C | . | . | H | α-helix | trans | -64.7 | -38.9 | 173.2 | -70.5 | 177.1 | 70.7 | 0 | 0 | 112 | K1026 L1087 C1088 C1089 T1095 A1203 | K1026-M1091 HydrophobicContact CD-CE 4.15Å; L1087-M1091 HydrophobicContact CD1-CG 4.13Å; L1087-M1091 HydrophobicContact CD1-SD 3.96Å; L1087-M1091 HydrophobicContact CG-SD 4.03Å; L1087-M1091 VanDerWaalsContact O-CG 3.27Å; L1087-M1091 WeakPolarHBondContact O-CG 3.38Å; L1087-M1091 PolarHBondContact O-N 3.06Å; C1088-M1091 PolarHBondContact O-N 2.96Å; C1089-M1091 PolarHBondContact O-N 3.2Å; M1091-T1095 PolarHBondContact O-N 3.12Å; M1091-T1095 PolarHBondContact O-OG1 3.27Å; M1091-A1203 HydrophobicContact CG-CB 3.99Å |
| 1092 | A | 95.3 | Very high | 89.8 | Confident | 0 Ų | 0 | 25.2 Ų | 25.2 | 0% | 0 | 12% | 0.123 | C | C | . | . | H | α-helix | trans | -67.6 | -46.3 | 175.2 | 0 | 0 | 0 | 0 | 0 | 111.4 | C1022 I1025 I1051 C1088 C1089 M1090 A1094 T1095 L1096 | C1022-A1092 HydrophobicContact CB-CB 3.91Å; I1025-A1092 HydrophobicContact CB-CB 4.38Å; I1025-A1092 HydrophobicContact CG2-CB 4.16Å; I1051-A1092 HydrophobicContact CD1-CB 4.25Å; C1088-A1092 WeakPolarHBondContact O-CB 3.37Å; C1088-A1092 PolarHBondContact O-N 3.17Å; C1089-A1092 PolarHBondContact O-N 2.81Å; M1090-A1092 VanDerWaalsContact C-N 3.33Å; M1090-A1092 PolarHBondContact O-N 3.2Å; A1092-A1094 VanDerWaalsContact C-N 3.35Å; A1092-A1094 PolarHBondContact O-N 3.19Å; A1092-T1095 PolarHBondContact O-N 3.17Å; A1092-T1095 VanDerWaalsContact O-N 3.14Å; A1092-T1095 PolarHBondContact O-OG1 2.82Å; A1092-L1096 WeakPolarHBondContact O-CB 3.35Å; A1092-L1096 WeakPolarHBondContact O-CG 3.41Å; A1092-L1096 PolarHBondContact O-N 3.12Å |
| 1093 | L | 95.5 | Very high | 89.6 | Confident | 0 Ų | 0 | 26.2 Ų | 26.2 | 0% | 0 | 13% | 0.127 | C | C | . | . | H | α-helix | trans | -61.1 | -42.9 | 177 | -71.6 | 176.1 | 0 | 0 | 0 | 111.9 | I1048 I1051 I1055 C1089 M1090 T1095 L1096 V1097 F1129 | I1048-L1093 HydrophobicContact CB-CD2 4.12Å; I1048-L1093 HydrophobicContact CG1-CD2 3.95Å; I1048-L1093 HydrophobicContact CG2-CD2 3.96Å; I1051-L1093 HydrophobicContact CB-CD2 4.05Å; I1051-L1093 HydrophobicContact CB-CG 4.41Å; I1051-L1093 HydrophobicContact CG2-CD1 4.2Å; I1051-L1093 HydrophobicContact CG2-CD2 4.06Å; I1051-L1093 HydrophobicContact CG2-CG 3.85Å; I1055-L1093 HydrophobicContact CD1-CD1 3.55Å; I1055-L1093 VanDerWaalsContact CD1-CD1 3.48Å; C1089-L1093 WeakPolarHBondContact O-CB 3.24Å; C1089-L1093 WeakPolarHBondContact O-CG 3.29Å; C1089-L1093 PolarHBondContact O-N 3.15Å; M1090-L1093 PolarHBondContact O-N 3.1Å; M1090-L1093 HydrophobicContact SD-CD1 4Å; L1093-T1095 PolarHBondContact O-N 3.03Å; L1093-L1096 HydrophobicContact CD2-CD1 4.45Å; L1093-L1096 PolarHBondContact O-N 3.06Å; L1093-L1096 VanDerWaalsContact O-N 3.1Å; L1093-V1097 WeakPolarHBondContact O-CB 3.29Å; L1093-V1097 WeakPolarHBondContact O-CG2 3.39Å; L1093-V1097 PolarHBondContact O-N 3.13Å; L1093-F1129 HydrophobicContact CB-CZ 4.46Å; L1093-F1129 HydrophobicContact CD1-CE1 3.77Å; L1093-F1129 HydrophobicContact CD1-CZ 4.16Å |
| 1094 | A | 92.7 | Very high | 89.2 | Confident | 12.2 Ų | 12.2 | 24.8 Ų | 24.8 | 10% | 0.101 | 13% | 0.126 | C | C | . | . | H | α-helix | trans | -57.4 | -36.1 | 175.3 | 0 | 0 | 0 | 0 | 0 | 112.7 | M1090 A1092 Q1206 A1207 | M1090-A1094 VanDerWaalsContact O-CB 3.26Å; M1090-A1094 WeakPolarHBondContact O-CB 3.29Å; M1090-A1094 PolarHBondContact O-N 3.13Å; A1092-A1094 VanDerWaalsContact C-N 3.35Å; A1092-A1094 PolarHBondContact O-N 3.19Å; A1094-Q1206 HydrophobicContact CB-CB 4.12Å; A1094-Q1206 HydrophobicContact CB-CG 4.16Å; A1094-A1207 HydrophobicContact CB-CB 4.02Å |
| 1095 | T | 92.7 | Very high | 88.2 | Confident | 36.2 Ų | 36.2 | 28.6 Ų | 28.6 | 22% | 0.222 | 14% | 0.144 | C | C | . | . | H | α-helix | trans | -77.5 | -34.8 | 174.2 | 39 | 0 | 0 | 0 | 0 | 113.2 | K1026 M1029 M1091 A1092 L1093 V1097 | K1026-T1095 HydrophobicContact CG-CG2 4Å; M1029-T1095 HydrophobicContact CB-CG2 3.59Å; M1029-T1095 HydrophobicContact CG-CG2 4.47Å; M1091-T1095 PolarHBondContact O-N 3.12Å; M1091-T1095 PolarHBondContact O-OG1 3.27Å; A1092-T1095 PolarHBondContact O-N 3.17Å; A1092-T1095 VanDerWaalsContact O-N 3.14Å; A1092-T1095 PolarHBondContact O-OG1 2.82Å; L1093-T1095 PolarHBondContact O-N 3.03Å; T1095-V1097 PolarHBondContact O-N 3.12Å |
| 1096 | L | 93.6 | Very high | 86.7 | Confident | 0 Ų | 0 | 35 Ų | 35 | 0% | 0 | 17% | 0.174 | C | C | . | . | H | α-helix | trans | -75.1 | -28.6 | -178.1 | -77.8 | 169.9 | 0 | 0 | 0 | 113.6 | I1025 M1029 R1044 L1047 I1048 I1051 A1092 L1093 L1100 | I1025-L1096 HydrophobicContact CG2-CD1 3.83Å; I1025-L1096 HydrophobicContact CG2-CD2 3.97Å; I1025-L1096 HydrophobicContact CG2-CG 3.85Å; M1029-L1096 HydrophobicContact CG-CD2 3.8Å; M1029-L1096 HydrophobicContact CG-CG 4.37Å; M1029-L1096 HydrophobicContact SD-CD2 3.74Å; R1044-L1096 HydrophobicContact CB-CD2 4.25Å; R1044-L1096 HydrophobicContact CG-CD2 3.92Å; R1044-L1096 VanDerWaalsContact CZ-O 3.25Å; R1044-L1096 PolarHBondContact NE-O 3Å; R1044-L1096 VanDerWaalsContact NH2-C 3.33Å; R1044-L1096 PolarHBondContact NH2-O 2.94Å; L1047-L1096 HydrophobicContact CB-CD1 3.92Å; L1047-L1096 HydrophobicContact CB-CD2 4.29Å; L1047-L1096 HydrophobicContact CD1-CD2 4.05Å; I1048-L1096 HydrophobicContact CD1-CB 4.11Å; I1048-L1096 HydrophobicContact CG1-CB 3.76Å; I1048-L1096 HydrophobicContact CG1-CD1 4.11Å; I1048-L1096 HydrophobicContact CG1-CG 4.49Å; I1051-L1096 HydrophobicContact CD1-CD1 3.45Å; I1051-L1096 VanDerWaalsContact CD1-CD1 3.45Å; A1092-L1096 WeakPolarHBondContact O-CB 3.35Å; A1092-L1096 WeakPolarHBondContact O-CG 3.41Å; A1092-L1096 PolarHBondContact O-N 3.12Å; L1093-L1096 HydrophobicContact CD2-CD1 4.45Å; L1093-L1096 PolarHBondContact O-N 3.06Å; L1093-L1096 VanDerWaalsContact O-N 3.1Å; L1096-L1100 WeakPolarHBondContact O-CD2 3.21Å |
| 1097 | V | 91.2 | Very high | 84.9 | Confident | 1.4 Ų | 1.4 | 40.5 Ų | 40.5 | 1% | 0.008 | 21% | 0.208 | C | C | . | . | H | α-helix | trans | -88.5 | -19.8 | -175.3 | -165.1 | 0 | 0 | 0 | 0 | 112.5 | I1048 L1093 T1095 D1099 L1100 A1207 L1211 | I1048-V1097 HydrophobicContact CD1-CB 4.5Å; I1048-V1097 HydrophobicContact CD1-CG1 3.6Å; I1048-V1097 HydrophobicContact CD1-CG2 3.62Å; I1048-V1097 HydrophobicContact CG1-CG1 4.29Å; I1048-V1097 HydrophobicContact CG1-CG2 4.1Å; L1093-V1097 WeakPolarHBondContact O-CB 3.29Å; L1093-V1097 WeakPolarHBondContact O-CG2 3.39Å; L1093-V1097 PolarHBondContact O-N 3.13Å; T1095-V1097 PolarHBondContact O-N 3.12Å; V1097-D1099 PolarHBondContact O-N 3.1Å; V1097-L1100 VanDerWaalsContact O-CB 3.25Å; V1097-L1100 WeakPolarHBondContact O-CB 3.23Å; V1097-L1100 PolarHBondContact O-N 3.16Å; V1097-L1100 VanDerWaalsContact O-N 3.09Å; V1097-A1207 HydrophobicContact CG2-CB 4.32Å; V1097-A1207 VanDerWaalsContact CG2-O 3.27Å; V1097-A1207 WeakPolarHBondContact CG2-O 3.33Å; V1097-L1211 HydrophobicContact CB-CB 4.38Å; V1097-L1211 HydrophobicContact CG1-CB 3.83Å; V1097-L1211 HydrophobicContact CG1-CD1 3.77Å; V1097-L1211 HydrophobicContact CG1-CG 4.24Å; V1097-L1211 VanDerWaalsContact CG1-N 3.26Å |
| 1098 | R | 86.4 | Confident | 83 | Confident | 120.6 Ų | 120.6 | 42.4 Ų | 42.4 | 46% | 0.455 | 22% | 0.22 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -61.3 | 120.1 | -177.4 | -165.8 | -175.8 | 89.8 | 169.8 | 2.8 | 112.5 | R1044 L1100 | R1044-R1098 PolarHBondContact NH2-O 3.17Å; R1098-L1100 VanDerWaalsContact C-N 3.26Å; R1098-L1100 PolarHBondContact O-N 3.24Å |
| 1099 | D | 81.1 | Confident | 81 | Confident | 94.8 Ų | 94.8 | 48.8 Ų | 48.8 | 51% | 0.507 | 25% | 0.254 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 63.5 | 25.1 | -175.9 | -36.8 | -47.2 | 0 | 0 | 0 | 113.7 | R1032 V1097 P1101 | R1032-D1099 IonicContact CZ-OD2 3.79Å; R1032-D1099 IonicContact NH1-OD2 3.25Å; R1032-D1099 PolarHBondContact NH1-OD2 3.13Å; R1032-D1099 VanDerWaalsContact NH1-OD2 3.15Å; R1032-D1099 IonicContact NH2-OD2 3.19Å; R1032-D1099 PolarHBondContact NH2-OD2 3.25Å; V1097-D1099 PolarHBondContact O-N 3.1Å; D1099-P1101 WeakPolarHBondContact O-CD 3.27Å |
| 1100 | L | 86.4 | Confident | 79.2 | Confident | 0.6 Ų | 0.6 | 53.7 Ų | 53.7 | 0% | 0.003 | 28% | 0.28 | C | S | . | . | trans | -102.9 | 112.2 | -179.5 | -172.1 | 70.2 | 0 | 0 | 0 | 112.8 | I1041 R1044 I1048 L1096 V1097 R1098 L1102 A1214 N1215 | I1041-L1100 HydrophobicContact CB-CD1 4.41Å; I1041-L1100 HydrophobicContact CG2-CD1 3.99Å; R1044-L1100 HydrophobicContact CB-CD1 3.79Å; R1044-L1100 HydrophobicContact CB-CD2 3.94Å; R1044-L1100 HydrophobicContact CB-CG 4.49Å; I1048-L1100 HydrophobicContact CD1-CD2 3.18Å; L1096-L1100 WeakPolarHBondContact O-CD2 3.21Å; V1097-L1100 VanDerWaalsContact O-CB 3.25Å; V1097-L1100 WeakPolarHBondContact O-CB 3.23Å; V1097-L1100 PolarHBondContact O-N 3.16Å; V1097-L1100 VanDerWaalsContact O-N 3.09Å; R1098-L1100 VanDerWaalsContact C-N 3.26Å; R1098-L1100 PolarHBondContact O-N 3.24Å; L1100-L1102 PolarHBondContact O-N 3.16Å; L1100-A1214 VanDerWaalsContact O-CB 3.27Å; L1100-A1214 WeakPolarHBondContact O-CB 3.36Å; L1100-N1215 PolarHBondContact O-ND2 3.03Å; L1100-N1215 VanDerWaalsContact O-ND2 3.13Å | ||
| 1101 | P | 82.2 | Confident | 77.4 | Confident | 30 Ų | 30 | 58.7 Ų | 58.7 | 20% | 0.195 | 31% | 0.31 | C | S | . | . | trans | -70 | 129 | 165 | 28.2 | -31.8 | 0 | 0 | 0 | 110 | I1041 N1045 D1099 A1579 Q1580 | I1041-P1101 HydrophobicContact CD1-CG 4.36Å; I1041-P1101 HydrophobicContact CG2-CG 4.27Å; N1045-P1101 PolarHBondContact ND2-O 2.94Å; N1045-P1101 VanDerWaalsContact ND2-O 3.14Å; D1099-P1101 WeakPolarHBondContact O-CD 3.27Å; P1101-A1579 HydrophobicContact CG-CB 3.8Å; P1101-Q1580 HydrophobicContact CB-CG 4.06Å | ||
| 1102 | L | 84.9 | Confident | 75.7 | Confident | 2.2 Ų | 2.2 | 60.8 Ų | 60.8 | 1% | 0.012 | 32% | 0.323 | C | S | . | . | trans | -67.8 | 136.1 | 177.1 | -70.2 | 174.3 | 0 | 0 | 0 | 110.7 | N1045 L1100 K1118 L1121 F1122 F1125 L1211 N1215 | N1045-L1102 WeakPolarHBondContact OD1-CA 3.47Å; L1100-L1102 PolarHBondContact O-N 3.16Å; L1102-K1118 VanDerWaalsContact O-CE 3.29Å; L1102-K1118 WeakPolarHBondContact O-CE 3.35Å; L1102-K1118 WeakPolarHBondContact O-CG 3.32Å; L1102-L1121 HydrophobicContact CD1-CB 4.42Å; L1102-F1122 HydrophobicContact CD1-CB 3.88Å; L1102-F1122 HydrophobicContact CD1-CD2 4.22Å; L1102-F1122 HydrophobicContact CD1-CG 4.46Å; L1102-F1125 HydrophobicContact CD2-CD2 4.22Å; L1102-F1125 HydrophobicContact CD2-CE2 4.09Å; L1102-L1211 HydrophobicContact CD1-CD1 4.05Å; L1102-L1211 HydrophobicContact CD2-CD1 4.17Å; L1102-L1211 HydrophobicContact CG-CD1 4.32Å; L1102-N1215 PolarHBondContact N-OD1 3.22Å | ||
| 1103 | Q | 78.4 | Confident | 74.2 | Confident | 45.4 Ų | 45.4 | 63.1 Ų | 63.1 | 21% | 0.212 | 34% | 0.337 | C | S | . | . | trans | -133 | 136.5 | 175.8 | -65.7 | -172.1 | -26.2 | 0 | 0 | 110 | I1041 N1045 A1579 G1650 | I1041-Q1103 HydrophobicContact CG2-CG 4.28Å; N1045-Q1103 PolarHBondContact OD1-N 3.05Å; N1045-Q1103 VanDerWaalsContact OD1-N 3.15Å; N1045-Q1103 PolarHBondContact OD1-O 2.57Å; Q1103-A1579 HydrophobicContact CG-CB 4.5Å; Q1103-A1579 PolarHBondContact NE2-O 2.84Å; Q1103-G1650 PolarHBondContact NE2-O 2.95Å | ||
| 1104 | S | 73.4 | Confident | 72.6 | Confident | 28 Ų | 28 | 65.1 Ų | 65.1 | 20% | 0.196 | 35% | 0.347 | C | S | . | . | trans | -77.9 | 146.4 | 168.9 | 56 | 0 | 0 | 0 | 0 | 110.9 | E1106 | S1104-E1106 VanDerWaalsContact C-N 3.27Å; S1104-E1106 PolarHBondContact O-N 3.03Å; S1104-E1106 PolarHBondContact OG-O 3.13Å | ||
| 1105 | E | 65.7 | Low | 71.4 | Confident | 139.2 Ų | 139.2 | 66.2 Ų | 66.2 | 65% | 0.65 | 36% | 0.36 | S | S | * | . | S | Bend | trans | -66.4 | -26.5 | 172.8 | -76 | -165.2 | 144.6 | 0 | 0 | 112.4 | K1046 T1107 | K1046-E1105 WeakPolarHBondContact CD-OE1 3.42Å; K1046-E1105 WeakPolarHBondContact CE-OE1 3.43Å; K1046-E1105 IonicContact NZ-OE1 3.23Å; K1046-E1105 PolarHBondContact NZ-OE1 3.18Å; K1046-E1105 IonicContact NZ-OE2 2.68Å; K1046-E1105 PolarHBondContact NZ-OE2 3.4Å; E1105-T1107 PolarHBondContact O-N 3.21Å; E1105-T1107 VanDerWaalsContact O-N 3.14Å |
| 1106 | E | 58.7 | Low | 70.5 | Confident | 134.6 Ų | 134.6 | 69.7 Ų | 69.7 | 63% | 0.629 | 38% | 0.375 | S | S | * | . | S | Bend | trans | -75.5 | 112.5 | 178.4 | -66.1 | -175 | 174.9 | 0 | 0 | 111.1 | S1104 T1108 | S1104-E1106 VanDerWaalsContact C-N 3.27Å; S1104-E1106 PolarHBondContact O-N 3.03Å; S1104-E1106 PolarHBondContact OG-O 3.13Å; E1106-T1108 VanDerWaalsContact C-N 3.28Å; E1106-T1108 PolarHBondContact O-N 3.08Å; E1106-T1108 VanDerWaalsContact O-N 3.11Å |
| 1107 | T | 54 | Low | 69.6 | Low | 127.6 Ų | 127.6 | 71 Ų | 71 | 78% | 0.783 | 38% | 0.382 | S | S | * | . | trans | -74.3 | 85.7 | 170.1 | 46.4 | 0 | 0 | 0 | 0 | 109.2 | E1105 | E1105-T1107 PolarHBondContact O-N 3.21Å; E1105-T1107 VanDerWaalsContact O-N 3.14Å | ||
| 1108 | T | 52.2 | Low | 69 | Low | 45.4 Ų | 45.4 | 72.9 Ų | 72.9 | 28% | 0.279 | 39% | 0.39 | S | S | . | . | trans | -98.5 | 130.4 | 168.9 | 45.7 | 0 | 0 | 0 | 0 | 109.3 | E1106 N1110 T1113 L1114 | E1106-T1108 VanDerWaalsContact C-N 3.28Å; E1106-T1108 PolarHBondContact O-N 3.08Å; E1106-T1108 VanDerWaalsContact O-N 3.11Å; T1108-N1110 VanDerWaalsContact C-N 3.27Å; T1108-N1110 PolarHBondContact O-N 3.12Å; T1108-N1110 VanDerWaalsContact O-N 3.13Å; T1108-T1113 HydrophobicContact CG2-CG2 4.32Å; T1108-L1114 WeakPolarHBondContact O-CD1 3.45Å | ||
| 1109 | N | 52.6 | Low | 68.8 | Low | 140.8 Ų | 140.8 | 68.3 Ų | 68.3 | 75% | 0.753 | 38% | 0.376 | S | S | * | . | trans | -75.6 | -2.6 | -179.1 | -70.5 | -11.7 | 0 | 0 | 0 | 113.4 | ||||
| 1110 | N | 56.9 | Low | 69 | Low | 102.8 Ų | 102.8 | 69.4 Ų | 69.4 | 55% | 0.55 | 38% | 0.379 | S | S | . | . | trans | -94 | 116.6 | -176.9 | -120.9 | -1.6 | 0 | 0 | 0 | 110.5 | T1108 D1112 T1113 L1114 | T1108-N1110 VanDerWaalsContact C-N 3.27Å; T1108-N1110 PolarHBondContact O-N 3.12Å; T1108-N1110 VanDerWaalsContact O-N 3.13Å; N1110-D1112 VanDerWaalsContact C-N 3.28Å; N1110-D1112 PolarHBondContact O-N 3.27Å; N1110-D1112 PolarHBondContact OD1-N 3.26Å; N1110-T1113 VanDerWaalsContact CB-OG1 3.3Å; N1110-T1113 WeakPolarHBondContact CB-OG1 3.4Å; N1110-T1113 PolarHBondContact ND2-OG1 3.27Å; N1110-T1113 WeakPolarHBondContact O-CA 3.41Å; N1110-T1113 WeakPolarHBondContact O-CB 3.36Å; N1110-T1113 PolarHBondContact O-N 3.35Å; N1110-L1114 PolarHBondContact O-N 3.22Å; N1110-L1114 VanDerWaalsContact O-N 3.09Å | ||
| 1111 | V | 57.6 | Low | 69 | Low | 105.6 Ų | 105.6 | 70.8 Ų | 70.8 | 64% | 0.64 | 39% | 0.386 | S | S | * | . | H | α-helix | trans | -57.8 | -39.2 | -176.7 | -178.4 | 0 | 0 | 0 | 0 | 112 | T1113 L1114 G1115 D1585 | V1111-T1113 VanDerWaalsContact C-N 3.3Å; V1111-T1113 PolarHBondContact O-N 3.19Å; V1111-L1114 WeakPolarHBondContact O-CB 3.43Å; V1111-L1114 PolarHBondContact O-N 3.19Å; V1111-L1114 VanDerWaalsContact O-N 3.13Å; V1111-G1115 PolarHBondContact O-N 3.07Å; V1111-G1115 VanDerWaalsContact O-N 3.13Å; V1111-D1585 WeakPolarHBondContact CG2-OD1 3.48Å |
| 1112 | D | 58.1 | Low | 69.4 | Low | 109.2 Ų | 109.2 | 69.4 Ų | 69.4 | 58% | 0.584 | 38% | 0.377 | S | S | * | . | H | α-helix | trans | -65.7 | -40 | 179.5 | -64 | -29.8 | 0 | 0 | 0 | 112 | N1110 L1114 G1115 M1116 | N1110-D1112 VanDerWaalsContact C-N 3.28Å; N1110-D1112 PolarHBondContact O-N 3.27Å; N1110-D1112 PolarHBondContact OD1-N 3.26Å; D1112-L1114 VanDerWaalsContact C-N 3.3Å; D1112-L1114 PolarHBondContact O-N 3.09Å; D1112-G1115 PolarHBondContact O-N 3.01Å; D1112-M1116 VanDerWaalsContact O-CG 3.31Å; D1112-M1116 WeakPolarHBondContact O-CG 3.4Å; D1112-M1116 PolarHBondContact O-N 3.15Å; D1112-M1116 VanDerWaalsContact O-N 3.11Å |
| 1113 | T | 63.2 | Low | 69.5 | Low | 49.4 Ų | 49.4 | 73.1 Ų | 73.1 | 30% | 0.303 | 39% | 0.394 | S | S | . | . | H | α-helix | trans | -67.2 | -34.6 | 177.6 | -40 | 0 | 0 | 0 | 0 | 111.1 | T1108 N1110 V1111 M1116 N1117 | T1108-T1113 HydrophobicContact CG2-CG2 4.32Å; N1110-T1113 VanDerWaalsContact CB-OG1 3.3Å; N1110-T1113 WeakPolarHBondContact CB-OG1 3.4Å; N1110-T1113 PolarHBondContact ND2-OG1 3.27Å; N1110-T1113 WeakPolarHBondContact O-CA 3.41Å; N1110-T1113 WeakPolarHBondContact O-CB 3.36Å; N1110-T1113 PolarHBondContact O-N 3.35Å; V1111-T1113 VanDerWaalsContact C-N 3.3Å; V1111-T1113 PolarHBondContact O-N 3.19Å; T1113-M1116 PolarHBondContact O-N 3.15Å; T1113-N1117 VanDerWaalsContact O-CB 3.31Å; T1113-N1117 WeakPolarHBondContact O-CB 3.34Å; T1113-N1117 VanDerWaalsContact O-CG 3.23Å; T1113-N1117 PolarHBondContact O-N 3.14Å; T1113-N1117 PolarHBondContact O-ND2 3.15Å; T1113-N1117 PolarHBondContact O-OD1 3.19Å |
| 1114 | L | 62.9 | Low | 70 | Confident | 41.2 Ų | 41.2 | 76.2 Ų | 76.2 | 22% | 0.216 | 41% | 0.407 | C | S | . | . | H | α-helix | trans | -64.3 | -44.1 | 177 | -156.8 | 83.3 | 0 | 0 | 0 | 111.9 | T1108 N1110 V1111 D1112 M1116 N1117 K1118 | T1108-L1114 WeakPolarHBondContact O-CD1 3.45Å; N1110-L1114 PolarHBondContact O-N 3.22Å; N1110-L1114 VanDerWaalsContact O-N 3.09Å; V1111-L1114 WeakPolarHBondContact O-CB 3.43Å; V1111-L1114 PolarHBondContact O-N 3.19Å; V1111-L1114 VanDerWaalsContact O-N 3.13Å; D1112-L1114 VanDerWaalsContact C-N 3.3Å; D1112-L1114 PolarHBondContact O-N 3.09Å; L1114-M1116 VanDerWaalsContact C-N 3.34Å; L1114-M1116 PolarHBondContact O-N 3.37Å; L1114-N1117 PolarHBondContact O-N 3.05Å; L1114-K1118 WeakPolarHBondContact O-CG 3.41Å; L1114-K1118 PolarHBondContact O-N 3.21Å; L1114-K1118 VanDerWaalsContact O-N 3.11Å |
| 1115 | G | 68.1 | Low | 70.8 | Confident | 34.4 Ų | 34.4 | 75.1 Ų | 75.1 | 36% | 0.355 | 40% | 0.398 | S | S | . | . | H | α-helix | trans | -62.4 | -43.4 | 176.4 | 0 | 0 | 0 | 0 | 0 | 112.4 | V1111 D1112 K1118 S1119 | V1111-G1115 PolarHBondContact O-N 3.07Å; V1111-G1115 VanDerWaalsContact O-N 3.13Å; D1112-G1115 PolarHBondContact O-N 3.01Å; G1115-K1118 PolarHBondContact O-N 3.05Å; G1115-S1119 VanDerWaalsContact O-CB 3.29Å; G1115-S1119 WeakPolarHBondContact O-CB 3.37Å; G1115-S1119 PolarHBondContact O-N 3.29Å; G1115-S1119 VanDerWaalsContact O-N 3.07Å |
| 1116 | M | 72.4 | Confident | 71.9 | Confident | 110.4 Ų | 110.4 | 68.8 Ų | 68.8 | 54% | 0.544 | 37% | 0.369 | S | S | . | . | H | α-helix | trans | -63.9 | -43.4 | 176.2 | -68.1 | -176.8 | 76.8 | 0 | 0 | 112.4 | D1112 T1113 L1114 K1118 S1119 Q1120 | D1112-M1116 VanDerWaalsContact O-CG 3.31Å; D1112-M1116 WeakPolarHBondContact O-CG 3.4Å; D1112-M1116 PolarHBondContact O-N 3.15Å; D1112-M1116 VanDerWaalsContact O-N 3.11Å; T1113-M1116 PolarHBondContact O-N 3.15Å; L1114-M1116 VanDerWaalsContact C-N 3.34Å; L1114-M1116 PolarHBondContact O-N 3.37Å; M1116-K1118 PolarHBondContact O-N 3.21Å; M1116-S1119 WeakPolarHBondContact O-CB 3.38Å; M1116-S1119 PolarHBondContact O-N 2.96Å; M1116-S1119 VanDerWaalsContact O-N 3.16Å; M1116-Q1120 WeakPolarHBondContact O-CG 3.29Å; M1116-Q1120 PolarHBondContact O-N 3.23Å |
| 1117 | N | 76.2 | Confident | 73.3 | Confident | 28 Ų | 28 | 66 Ų | 66 | 15% | 0.15 | 36% | 0.358 | C | S | . | . | H | α-helix | trans | -63.9 | -42.5 | 178.8 | -74 | -7.5 | 0 | 0 | 0 | 111.9 | T1113 L1114 S1119 Q1120 L1121 | T1113-N1117 VanDerWaalsContact O-CB 3.31Å; T1113-N1117 WeakPolarHBondContact O-CB 3.34Å; T1113-N1117 VanDerWaalsContact O-CG 3.23Å; T1113-N1117 PolarHBondContact O-N 3.14Å; T1113-N1117 PolarHBondContact O-ND2 3.15Å; T1113-N1117 PolarHBondContact O-OD1 3.19Å; L1114-N1117 PolarHBondContact O-N 3.05Å; N1117-S1119 VanDerWaalsContact C-N 3.33Å; N1117-S1119 PolarHBondContact O-N 3.12Å; N1117-Q1120 PolarHBondContact O-N 3.26Å; N1117-L1121 WeakPolarHBondContact O-CG 3.33Å; N1117-L1121 PolarHBondContact O-N 3.07Å |
| 1118 | K | 78.3 | Confident | 75 | Confident | 39.8 Ų | 39.8 | 61.6 Ų | 61.6 | 17% | 0.173 | 33% | 0.33 | C | S | . | . | H | α-helix | trans | -60.8 | -42.4 | 173.6 | -72.8 | -179.4 | -178.6 | -179.7 | 0 | 111.7 | L1102 L1114 G1115 M1116 Q1120 L1121 F1122 I1218 Q1580 | L1102-K1118 VanDerWaalsContact O-CE 3.29Å; L1102-K1118 WeakPolarHBondContact O-CE 3.35Å; L1102-K1118 WeakPolarHBondContact O-CG 3.32Å; L1114-K1118 WeakPolarHBondContact O-CG 3.41Å; L1114-K1118 PolarHBondContact O-N 3.21Å; L1114-K1118 VanDerWaalsContact O-N 3.11Å; G1115-K1118 PolarHBondContact O-N 3.05Å; M1116-K1118 PolarHBondContact O-N 3.21Å; K1118-Q1120 PolarHBondContact O-N 2.95Å; K1118-L1121 PolarHBondContact O-N 3.07Å; K1118-F1122 WeakPolarHBondContact O-CB 3.4Å; K1118-F1122 PolarHBondContact O-N 3.18Å; K1118-I1218 HydrophobicContact CB-CD1 3.49Å; K1118-I1218 VanDerWaalsContact CB-CD1 3.48Å; K1118-I1218 HydrophobicContact CD-CD1 4.01Å; K1118-I1218 HydrophobicContact CG-CD1 4.4Å; K1118-Q1580 PolarHBondContact NZ-O 3.23Å |
| 1119 | S | 82 | Confident | 76.8 | Confident | 24 Ų | 24 | 59.4 Ų | 59.4 | 17% | 0.168 | 32% | 0.316 | C | S | . | . | H | α-helix | trans | -59.5 | -45.4 | 176 | 174.8 | 0 | 0 | 0 | 0 | 112.7 | G1115 M1116 N1117 F1122 Q1123 I1218 H1222 | G1115-S1119 VanDerWaalsContact O-CB 3.29Å; G1115-S1119 WeakPolarHBondContact O-CB 3.37Å; G1115-S1119 PolarHBondContact O-N 3.29Å; G1115-S1119 VanDerWaalsContact O-N 3.07Å; M1116-S1119 WeakPolarHBondContact O-CB 3.38Å; M1116-S1119 PolarHBondContact O-N 2.96Å; M1116-S1119 VanDerWaalsContact O-N 3.16Å; N1117-S1119 VanDerWaalsContact C-N 3.33Å; N1117-S1119 PolarHBondContact O-N 3.12Å; S1119-F1122 PolarHBondContact O-N 3.25Å; S1119-Q1123 WeakPolarHBondContact O-CB 3.26Å; S1119-Q1123 PolarHBondContact O-N 3.19Å; S1119-I1218 VanDerWaalsContact CA-CG2 3.46Å; S1119-H1222 PolarHBondContact OG-CE1 3.37Å; S1119-H1222 VanDerWaalsContact OG-CE1 3.31Å; S1119-H1222 PolarHBondContact OG-NE2 3.05Å |
| 1120 | Q | 85.7 | Confident | 78.3 | Confident | 119.4 Ų | 119.4 | 53.3 Ų | 53.3 | 56% | 0.558 | 28% | 0.283 | S | S | * | . | H | α-helix | trans | -65.3 | -41.7 | 176.9 | -69.9 | 178.4 | 7.2 | 0 | 0 | 112.5 | M1116 N1117 K1118 Q1123 K1124 | M1116-Q1120 WeakPolarHBondContact O-CG 3.29Å; M1116-Q1120 PolarHBondContact O-N 3.23Å; N1117-Q1120 PolarHBondContact O-N 3.26Å; K1118-Q1120 PolarHBondContact O-N 2.95Å; Q1120-Q1123 PolarHBondContact O-N 3.12Å; Q1120-K1124 WeakPolarHBondContact O-CB 3.34Å; Q1120-K1124 PolarHBondContact O-N 3Å |
| 1121 | L | 86 | Confident | 79.6 | Confident | 29.4 Ų | 29.4 | 52.2 Ų | 52.2 | 15% | 0.154 | 28% | 0.278 | C | S | . | . | H | α-helix | trans | -62.8 | -44.6 | 176.1 | -76.5 | 169.6 | 0 | 0 | 0 | 111.9 | L1102 N1117 K1118 Q1123 K1124 F1125 | L1102-L1121 HydrophobicContact CD1-CB 4.42Å; N1117-L1121 WeakPolarHBondContact O-CG 3.33Å; N1117-L1121 PolarHBondContact O-N 3.07Å; K1118-L1121 PolarHBondContact O-N 3.07Å; L1121-Q1123 VanDerWaalsContact C-N 3.34Å; L1121-Q1123 PolarHBondContact O-N 3.09Å; L1121-K1124 WeakPolarHBondContact O-CB 3.3Å; L1121-K1124 PolarHBondContact O-N 3.32Å; L1121-F1125 HydrophobicContact CB-CE2 4.44Å; L1121-F1125 HydrophobicContact CD2-CE2 4.35Å; L1121-F1125 HydrophobicContact CD2-CZ 4.5Å; L1121-F1125 WeakPolarHBondContact O-CD2 3.27Å; L1121-F1125 PolarHBondContact O-N 3.01Å; L1121-F1125 VanDerWaalsContact O-N 3.12Å |
| 1122 | F | 89.8 | Confident | 80.9 | Confident | 0.8 Ų | 0.8 | 47.4 Ų | 47.4 | 0% | 0.004 | 25% | 0.248 | C | C | . | . | H | α-helix | trans | -57.2 | -50.1 | 175 | -176.7 | -84.9 | 0 | 0 | 0 | 110.6 | L1102 K1118 S1119 K1124 F1125 F1126 L1211 L1212 N1215 I1218 G1219 H1222 | L1102-F1122 HydrophobicContact CD1-CB 3.88Å; L1102-F1122 HydrophobicContact CD1-CD2 4.22Å; L1102-F1122 HydrophobicContact CD1-CG 4.46Å; K1118-F1122 WeakPolarHBondContact O-CB 3.4Å; K1118-F1122 PolarHBondContact O-N 3.18Å; S1119-F1122 PolarHBondContact O-N 3.25Å; F1122-K1124 VanDerWaalsContact C-N 3.33Å; F1122-K1124 PolarHBondContact O-N 3.22Å; F1122-F1125 PolarHBondContact O-N 3.13Å; F1122-F1126 HydrophobicContact CD1-CB 4.21Å; F1122-F1126 HydrophobicContact CE1-CB 3.91Å; F1122-F1126 AromaticContact CE1-CD2 3.89Å; F1122-F1126 HydrophobicContact CE1-CD2 3.89Å; F1122-F1126 AromaticContact CE1-CG 3.97Å; F1122-F1126 HydrophobicContact CE1-CG 3.99Å; F1122-F1126 HydrophobicContact CZ-CB 4.41Å; F1122-F1126 AromaticContact CZ-CD2 3.96Å; F1122-F1126 HydrophobicContact CZ-CD2 3.99Å; F1122-F1126 HydrophobicContact CZ-CG 4.45Å; F1122-F1126 VanDerWaalsContact O-CB 3.23Å; F1122-F1126 WeakPolarHBondContact O-CB 3.27Å; F1122-F1126 PolarHBondContact O-N 3.04Å; F1122-L1211 HydrophobicContact CD2-CD1 4.46Å; F1122-L1211 HydrophobicContact CD2-CD2 4.15Å; F1122-L1211 HydrophobicContact CD2-CG 3.93Å; F1122-L1211 HydrophobicContact CE2-CB 4.5Å; F1122-L1211 HydrophobicContact CE2-CD2 4Å; F1122-L1211 HydrophobicContact CE2-CG 3.72Å; F1122-L1211 HydrophobicContact CZ-CD2 4.38Å; F1122-L1211 HydrophobicContact CZ-CG 4.48Å; F1122-L1212 HydrophobicContact CE2-CD1 4.4Å; F1122-L1212 HydrophobicContact CZ-CD1 3.96Å; F1122-N1215 HydrophobicContact CD2-CB 4.2Å; F1122-N1215 HydrophobicContact CE2-CB 4.48Å; F1122-I1218 HydrophobicContact CB-CG2 4.15Å; F1122-I1218 HydrophobicContact CG-CG2 4.46Å; F1122-G1219 VanDerWaalsContact CE1-CA 3.43Å; F1122-H1222 HydrophobicContact CD1-CB 4.18Å; F1122-H1222 HydrophobicContact CE1-CB 4.14Å |
| 1123 | Q | 87.3 | Confident | 82.1 | Confident | 79.4 Ų | 79.4 | 42.3 Ų | 42.3 | 37% | 0.371 | 22% | 0.221 | S | C | . | . | H | α-helix | trans | -61.7 | -39.8 | -178.9 | -166.5 | 160.2 | 26.5 | 0 | 0 | 112.2 | S1119 Q1120 L1121 N1127 H1222 | S1119-Q1123 WeakPolarHBondContact O-CB 3.26Å; S1119-Q1123 PolarHBondContact O-N 3.19Å; Q1120-Q1123 PolarHBondContact O-N 3.12Å; L1121-Q1123 VanDerWaalsContact C-N 3.34Å; L1121-Q1123 PolarHBondContact O-N 3.09Å; Q1123-N1127 PolarHBondContact NE2-ND2 2.85Å; Q1123-N1127 PolarHBondContact NE2-OD1 2.95Å; Q1123-N1127 VanDerWaalsContact O-CB 3.28Å; Q1123-N1127 WeakPolarHBondContact O-CB 3.34Å; Q1123-N1127 PolarHBondContact O-N 3.33Å; Q1123-N1127 PolarHBondContact O-ND2 3.21Å; Q1123-H1222 VanDerWaalsContact OE1-CB 3.28Å; Q1123-H1222 PolarHBondContact OE1-ND1 3.38Å |
| 1124 | K | 89.6 | Confident | 82.8 | Confident | 111.8 Ų | 111.8 | 42.3 Ų | 42.3 | 49% | 0.486 | 22% | 0.219 | S | C | . | . | H | α-helix | trans | -56.7 | -53 | 175.2 | 178.4 | -170.4 | 175.6 | -169.6 | 0 | 111.5 | D1049 Q1120 L1121 F1122 L1128 | D1049-K1124 IonicContact OD1-NZ 3.35Å; D1049-K1124 PolarHBondContact OD1-NZ 3.2Å; Q1120-K1124 WeakPolarHBondContact O-CB 3.34Å; Q1120-K1124 PolarHBondContact O-N 3Å; L1121-K1124 WeakPolarHBondContact O-CB 3.3Å; L1121-K1124 PolarHBondContact O-N 3.32Å; F1122-K1124 VanDerWaalsContact C-N 3.33Å; F1122-K1124 PolarHBondContact O-N 3.22Å; K1124-L1128 PolarHBondContact O-N 3.3Å |
| 1125 | F | 90.4 | Very high | 83.5 | Confident | 3.4 Ų | 3.4 | 41.7 Ų | 41.7 | 2% | 0.015 | 22% | 0.216 | C | C | . | . | H | α-helix | trans | -72.1 | -39.5 | -178.3 | -61.6 | -50.8 | 0 | 0 | 0 | 112.5 | I1048 D1049 A1052 L1102 L1121 F1122 N1127 L1128 F1129 L1211 | I1048-F1125 HydrophobicContact CG2-CD1 4.04Å; I1048-F1125 HydrophobicContact CG2-CD2 4.3Å; I1048-F1125 HydrophobicContact CG2-CE1 3.59Å; I1048-F1125 HydrophobicContact CG2-CE2 3.86Å; I1048-F1125 HydrophobicContact CG2-CG 4.39Å; I1048-F1125 HydrophobicContact CG2-CZ 3.49Å; I1048-F1125 VanDerWaalsContact CG2-CZ 3.46Å; D1049-F1125 VanDerWaalsContact OD1-CZ 3.26Å; D1049-F1125 WeakPolarHBondContact OD1-CZ 3.32Å; A1052-F1125 HydrophobicContact CB-CD1 4.06Å; A1052-F1125 HydrophobicContact CB-CE1 3.82Å; L1102-F1125 HydrophobicContact CD2-CD2 4.22Å; L1102-F1125 HydrophobicContact CD2-CE2 4.09Å; L1121-F1125 HydrophobicContact CB-CE2 4.44Å; L1121-F1125 HydrophobicContact CD2-CE2 4.35Å; L1121-F1125 HydrophobicContact CD2-CZ 4.5Å; L1121-F1125 WeakPolarHBondContact O-CD2 3.27Å; L1121-F1125 PolarHBondContact O-N 3.01Å; L1121-F1125 VanDerWaalsContact O-N 3.12Å; F1122-F1125 PolarHBondContact O-N 3.13Å; F1125-N1127 VanDerWaalsContact C-N 3.34Å; F1125-N1127 PolarHBondContact O-N 2.98Å; F1125-L1128 WeakPolarHBondContact O-CB 3.29Å; F1125-L1128 PolarHBondContact O-N 3.27Å; F1125-F1129 HydrophobicContact CB-CE2 4.26Å; F1125-F1129 HydrophobicContact CB-CZ 4.36Å; F1125-F1129 WeakPolarHBondContact O-CD2 3.25Å; F1125-F1129 VanDerWaalsContact O-CG 3.28Å; F1125-F1129 WeakPolarHBondContact O-CG 3.41Å; F1125-F1129 PolarHBondContact O-N 3.24Å; F1125-L1211 HydrophobicContact CB-CD2 3.83Å |
| 1126 | F | 88.5 | Confident | 84.1 | Confident | 6.6 Ų | 6.6 | 40.1 Ų | 40.1 | 3% | 0.029 | 20% | 0.199 | C | C | . | . | H | α-helix | trans | -59.9 | -45.8 | 177.5 | -173 | -95.8 | 0 | 0 | 0 | 111.7 | F1122 L1128 F1129 M1130 M1208 L1211 A1223 M1226 F1238 | F1122-F1126 HydrophobicContact CD1-CB 4.21Å; F1122-F1126 HydrophobicContact CE1-CB 3.91Å; F1122-F1126 AromaticContact CE1-CD2 3.89Å; F1122-F1126 HydrophobicContact CE1-CD2 3.89Å; F1122-F1126 AromaticContact CE1-CG 3.97Å; F1122-F1126 HydrophobicContact CE1-CG 3.99Å; F1122-F1126 HydrophobicContact CZ-CB 4.41Å; F1122-F1126 AromaticContact CZ-CD2 3.96Å; F1122-F1126 HydrophobicContact CZ-CD2 3.99Å; F1122-F1126 HydrophobicContact CZ-CG 4.45Å; F1122-F1126 VanDerWaalsContact O-CB 3.23Å; F1122-F1126 WeakPolarHBondContact O-CB 3.27Å; F1122-F1126 PolarHBondContact O-N 3.04Å; F1126-L1128 VanDerWaalsContact C-N 3.35Å; F1126-L1128 PolarHBondContact O-N 3.26Å; F1126-F1129 PolarHBondContact O-N 3.28Å; F1126-M1130 HydrophobicContact CD1-CG 4.16Å; F1126-M1130 HydrophobicContact CE1-CG 3.83Å; F1126-M1130 HydrophobicContact CE1-SD 4.46Å; F1126-M1130 HydrophobicContact CZ-CG 4.21Å; F1126-M1130 HydrophobicContact CZ-SD 4.43Å; F1126-M1130 WeakPolarHBondContact O-CB 3.4Å; F1126-M1130 WeakPolarHBondContact O-CG 3.27Å; F1126-M1130 PolarHBondContact O-N 3.25Å; F1126-M1208 HydrophobicContact CD2-CE 3.76Å; F1126-M1208 HydrophobicContact CE2-CE 3.31Å; F1126-M1208 HydrophobicContact CZ-CE 3.78Å; F1126-L1211 HydrophobicContact CB-CD2 4.48Å; F1126-A1223 HydrophobicContact CD2-CB 4.43Å; F1126-A1223 HydrophobicContact CE1-CB 4.44Å; F1126-A1223 HydrophobicContact CE2-CB 3.89Å; F1126-A1223 HydrophobicContact CZ-CB 3.82Å; F1126-M1226 HydrophobicContact CE1-CE 4Å; F1126-M1226 HydrophobicContact CE1-CG 4.08Å; F1126-M1226 HydrophobicContact CZ-CG 4.15Å; F1126-F1238 HydrophobicContact CZ-CD2 4.38Å; F1126-F1238 HydrophobicContact CZ-CE2 4.48Å |
| 1127 | N | 87.1 | Confident | 84.1 | Confident | 77.4 Ų | 77.4 | 35.6 Ų | 35.6 | 41% | 0.414 | 18% | 0.178 | S | C | . | . | H | α-helix | trans | -63.3 | -40.5 | 176.8 | -73.7 | -17.4 | 0 | 0 | 0 | 112.2 | Q1123 F1125 F1129 M1130 N1131 | Q1123-N1127 PolarHBondContact NE2-ND2 2.85Å; Q1123-N1127 PolarHBondContact NE2-OD1 2.95Å; Q1123-N1127 VanDerWaalsContact O-CB 3.28Å; Q1123-N1127 WeakPolarHBondContact O-CB 3.34Å; Q1123-N1127 PolarHBondContact O-N 3.33Å; Q1123-N1127 PolarHBondContact O-ND2 3.21Å; F1125-N1127 VanDerWaalsContact C-N 3.34Å; F1125-N1127 PolarHBondContact O-N 2.98Å; N1127-F1129 VanDerWaalsContact C-N 3.34Å; N1127-F1129 PolarHBondContact O-N 3.03Å; N1127-M1130 PolarHBondContact O-N 3.04Å; N1127-N1131 WeakPolarHBondContact O-CB 3.42Å; N1127-N1131 VanDerWaalsContact O-CG 3.24Å; N1127-N1131 PolarHBondContact O-N 2.98Å; N1127-N1131 PolarHBondContact O-ND2 3.17Å |
| 1128 | L | 89.4 | Confident | 83.9 | Confident | 34 Ų | 34 | 37.8 Ų | 37.8 | 18% | 0.178 | 19% | 0.19 | C | C | . | . | H | α-helix | trans | -59.5 | -47.4 | 176.1 | 179.5 | 65.3 | 0 | 0 | 0 | 111.4 | A1052 I1055 K1124 F1125 F1126 M1130 N1131 L1132 | A1052-L1128 HydrophobicContact CB-CD2 3.72Å; I1055-L1128 HydrophobicContact CB-CD1 4.38Å; I1055-L1128 HydrophobicContact CD1-CD2 4.13Å; I1055-L1128 HydrophobicContact CG2-CD1 4.16Å; K1124-L1128 PolarHBondContact O-N 3.3Å; F1125-L1128 WeakPolarHBondContact O-CB 3.29Å; F1125-L1128 PolarHBondContact O-N 3.27Å; F1126-L1128 VanDerWaalsContact C-N 3.35Å; F1126-L1128 PolarHBondContact O-N 3.26Å; L1128-M1130 VanDerWaalsContact C-N 3.34Å; L1128-M1130 PolarHBondContact O-N 3.47Å; L1128-N1131 PolarHBondContact O-N 3.14Å; L1128-L1132 PolarHBondContact O-N 3.28Å; L1128-L1132 VanDerWaalsContact O-N 3.15Å |
| 1129 | F | 90.1 | Very high | 83.5 | Confident | 0.6 Ų | 0.6 | 37.5 Ų | 37.5 | 0% | 0.003 | 19% | 0.188 | C | C | . | . | H | α-helix | trans | -66.7 | -38.7 | 179.9 | -59.5 | -21.7 | 0 | 0 | 0 | 112.3 | M1090 L1093 F1125 F1126 N1127 L1132 L1133 T1204 A1207 M1208 L1211 | M1090-F1129 HydrophobicContact CE-CD1 3.53Å; M1090-F1129 VanDerWaalsContact CE-CD1 3.5Å; M1090-F1129 HydrophobicContact CE-CE1 3.66Å; M1090-F1129 HydrophobicContact CE-CG 4.18Å; M1090-F1129 HydrophobicContact CE-CZ 4.33Å; M1090-F1129 HydrophobicContact SD-CD1 4.02Å; M1090-F1129 HydrophobicContact SD-CE1 4.01Å; L1093-F1129 HydrophobicContact CB-CZ 4.46Å; L1093-F1129 HydrophobicContact CD1-CE1 3.77Å; L1093-F1129 HydrophobicContact CD1-CZ 4.16Å; F1125-F1129 HydrophobicContact CB-CE2 4.26Å; F1125-F1129 HydrophobicContact CB-CZ 4.36Å; F1125-F1129 WeakPolarHBondContact O-CD2 3.25Å; F1125-F1129 VanDerWaalsContact O-CG 3.28Å; F1125-F1129 WeakPolarHBondContact O-CG 3.41Å; F1125-F1129 PolarHBondContact O-N 3.24Å; F1126-F1129 PolarHBondContact O-N 3.28Å; N1127-F1129 VanDerWaalsContact C-N 3.34Å; N1127-F1129 PolarHBondContact O-N 3.03Å; F1129-L1132 PolarHBondContact O-N 3.1Å; F1129-L1133 WeakPolarHBondContact O-CB 3.41Å; F1129-L1133 WeakPolarHBondContact O-CG 3.41Å; F1129-L1133 PolarHBondContact O-N 3.04Å; F1129-T1204 HydrophobicContact CB-CG2 3.95Å; F1129-T1204 WeakPolarHBondContact O-CG2 3.45Å; F1129-A1207 HydrophobicContact CD2-CB 4.46Å; F1129-A1207 HydrophobicContact CE2-CB 4.12Å; F1129-A1207 HydrophobicContact CZ-CB 4.24Å; F1129-M1208 HydrophobicContact CB-CE 4.5Å; F1129-M1208 HydrophobicContact CB-CG 3.43Å; F1129-M1208 VanDerWaalsContact CB-CG 3.45Å; F1129-M1208 HydrophobicContact CB-SD 3.76Å; F1129-M1208 HydrophobicContact CD2-CB 4.48Å; F1129-M1208 HydrophobicContact CD2-CG 3.64Å; F1129-M1208 HydrophobicContact CG-CG 3.94Å; F1129-L1211 HydrophobicContact CD2-CD2 4.3Å; F1129-L1211 HydrophobicContact CE2-CB 4.45Å; F1129-L1211 HydrophobicContact CE2-CD2 4Å |
| 1130 | M | 83.6 | Confident | 82.9 | Confident | 11.6 Ų | 11.6 | 39.1 Ų | 39.1 | 6% | 0.057 | 19% | 0.192 | C | C | . | . | H | α-helix | trans | -62.6 | -43.1 | 174.4 | -78.6 | -58.5 | -51.7 | 0 | 0 | 112.6 | F1126 N1127 L1128 L1132 L1133 N1134 M1208 M1226 A1234 | F1126-M1130 HydrophobicContact CD1-CG 4.16Å; F1126-M1130 HydrophobicContact CE1-CG 3.83Å; F1126-M1130 HydrophobicContact CE1-SD 4.46Å; F1126-M1130 HydrophobicContact CZ-CG 4.21Å; F1126-M1130 HydrophobicContact CZ-SD 4.43Å; F1126-M1130 WeakPolarHBondContact O-CB 3.4Å; F1126-M1130 WeakPolarHBondContact O-CG 3.27Å; F1126-M1130 PolarHBondContact O-N 3.25Å; N1127-M1130 PolarHBondContact O-N 3.04Å; L1128-M1130 VanDerWaalsContact C-N 3.34Å; L1128-M1130 PolarHBondContact O-N 3.47Å; M1130-L1132 VanDerWaalsContact C-N 3.3Å; M1130-L1132 PolarHBondContact O-N 3.08Å; M1130-L1133 PolarHBondContact O-N 3.26Å; M1130-L1133 HydrophobicContact SD-CD1 4.24Å; M1130-N1134 VanDerWaalsContact O-CG 3.27Å; M1130-N1134 PolarHBondContact O-N 3.31Å; M1130-N1134 PolarHBondContact O-ND2 3.05Å; M1130-M1208 HydrophobicContact CG-CE 3.85Å; M1130-M1208 HydrophobicContact SD-CE 3.52Å; M1130-M1208 VanDerWaalsContact SD-CE 3.56Å; M1130-M1208 WeakPolarHBondContact SD-CE 3.39Å; M1130-M1208 HydrophobicContact SD-SD 4.2Å; M1130-M1226 HydrophobicContact CE-CE 3.7Å; M1130-M1226 VanDerWaalsContact CE-CE 3.45Å; M1130-M1226 HydrophobicContact CE-CG 4.2Å; M1130-M1226 HydrophobicContact CE-SD 3.78Å; M1130-M1226 HydrophobicContact CG-CE 4.4Å; M1130-M1226 HydrophobicContact SD-CE 4.21Å; M1130-A1234 HydrophobicContact CE-CB 3.94Å |
| 1131 | N | 84.3 | Confident | 81.9 | Confident | 80.8 Ų | 80.8 | 35.7 Ų | 35.7 | 43% | 0.432 | 18% | 0.178 | S | C | . | . | H | α-helix | trans | -60.6 | -42 | 176.4 | -71.5 | -22.1 | 0 | 0 | 0 | 111.4 | C1057 N1127 L1128 L1133 N1134 D1135 | C1057-N1131 HydrophobicContact CB-CB 4.28Å; N1127-N1131 WeakPolarHBondContact O-CB 3.42Å; N1127-N1131 VanDerWaalsContact O-CG 3.24Å; N1127-N1131 PolarHBondContact O-N 2.98Å; N1127-N1131 PolarHBondContact O-ND2 3.17Å; L1128-N1131 PolarHBondContact O-N 3.14Å; N1131-L1133 VanDerWaalsContact C-N 3.31Å; N1131-L1133 PolarHBondContact O-N 2.91Å; N1131-N1134 WeakPolarHBondContact O-CB 3.35Å; N1131-N1134 PolarHBondContact O-N 3.22Å; N1131-D1135 PolarHBondContact O-N 3.16Å; N1131-D1135 VanDerWaalsContact O-N 3.1Å |
| 1132 | L | 85.9 | Confident | 80.9 | Confident | 3 Ų | 3 | 39.9 Ų | 39.9 | 2% | 0.016 | 20% | 0.198 | C | C | . | . | H | α-helix | trans | -67.8 | -36 | 178.2 | -164.8 | 68.2 | 0 | 0 | 0 | 112.8 | I1055 M1090 L1128 F1129 M1130 N1134 D1135 C1136 L1200 T1204 | I1055-L1132 HydrophobicContact CG2-CD1 4.1Å; I1055-L1132 HydrophobicContact CG2-CD2 4.18Å; M1090-L1132 HydrophobicContact CE-CD2 4.43Å; M1090-L1132 HydrophobicContact CG-CD2 3.31Å; M1090-L1132 HydrophobicContact SD-CD2 3.58Å; M1090-L1132 VanDerWaalsContact SD-CD2 3.54Å; L1128-L1132 PolarHBondContact O-N 3.28Å; L1128-L1132 VanDerWaalsContact O-N 3.15Å; F1129-L1132 PolarHBondContact O-N 3.1Å; M1130-L1132 VanDerWaalsContact C-N 3.3Å; M1130-L1132 PolarHBondContact O-N 3.08Å; L1132-N1134 VanDerWaalsContact C-N 3.34Å; L1132-D1135 PolarHBondContact O-N 3.41Å; L1132-C1136 PolarHBondContact O-N 3.27Å; L1132-C1136 VanDerWaalsContact O-N 3.13Å; L1132-C1136 PolarHBondContact O-SG 3.22Å; L1132-L1200 HydrophobicContact CD1-CD2 4.38Å; L1132-L1200 HydrophobicContact CD2-CD1 4.01Å; L1132-L1200 HydrophobicContact CD2-CD2 4.39Å; L1132-L1200 HydrophobicContact CD2-CG 4.1Å; L1132-L1200 HydrophobicContact CG-CD2 4.49Å; L1132-T1204 HydrophobicContact CB-CG2 4.44Å; L1132-T1204 HydrophobicContact CD2-CG2 4.48Å; L1132-T1204 WeakPolarHBondContact CD2-OG1 3.25Å |
| 1133 | L | 82.9 | Confident | 79.8 | Confident | 3.8 Ų | 3.8 | 40.8 Ų | 40.8 | 2% | 0.02 | 21% | 0.206 | C | C | . | . | H | α-helix | trans | -64 | -43.5 | 172.6 | -90 | 168 | 0 | 0 | 0 | 111.4 | F1129 M1130 N1131 D1135 C1136 T1137 R1201 T1204 I1205 M1208 A1237 | F1129-L1133 WeakPolarHBondContact O-CB 3.41Å; F1129-L1133 WeakPolarHBondContact O-CG 3.41Å; F1129-L1133 PolarHBondContact O-N 3.04Å; M1130-L1133 PolarHBondContact O-N 3.26Å; M1130-L1133 HydrophobicContact SD-CD1 4.24Å; N1131-L1133 VanDerWaalsContact C-N 3.31Å; N1131-L1133 PolarHBondContact O-N 2.91Å; L1133-D1135 VanDerWaalsContact C-N 3.3Å; L1133-D1135 PolarHBondContact O-N 3.17Å; L1133-C1136 WeakPolarHBondContact O-CB 3.38Å; L1133-C1136 PolarHBondContact O-N 3.1Å; L1133-C1136 VanDerWaalsContact O-N 3.12Å; L1133-T1137 HydrophobicContact CD2-CG2 4.31Å; L1133-T1137 WeakPolarHBondContact O-CG2 3.38Å; L1133-T1137 PolarHBondContact O-N 3.1Å; L1133-T1137 VanDerWaalsContact O-N 3.1Å; L1133-R1201 HydrophobicContact CD2-CG 3.97Å; L1133-T1204 HydrophobicContact CB-CG2 4.1Å; L1133-T1204 HydrophobicContact CD1-CG2 4.15Å; L1133-T1204 HydrophobicContact CD2-CG2 3.89Å; L1133-T1204 HydrophobicContact CG-CG2 3.81Å; L1133-I1205 HydrophobicContact CD1-CG1 3.78Å; L1133-I1205 HydrophobicContact CD2-CD1 4.44Å; L1133-I1205 HydrophobicContact CD2-CG1 3.97Å; L1133-M1208 HydrophobicContact CD1-SD 3.6Å; L1133-M1208 WeakPolarHBondContact CD1-SD 3.45Å; L1133-M1208 HydrophobicContact CG-SD 4.41Å; L1133-A1237 HydrophobicContact CD1-CB 3.95Å; L1133-A1237 HydrophobicContact CD2-CB 3.86Å; L1133-A1237 HydrophobicContact CG-CB 4.07Å |
| 1134 | N | 78.9 | Confident | 78.7 | Confident | 47.8 Ų | 47.8 | 40.8 Ų | 40.8 | 26% | 0.256 | 21% | 0.211 | S | C | . | . | H | α-helix | trans | -58.7 | -43.8 | 175.8 | -68.4 | -22.7 | 0 | 0 | 0 | 110.8 | M1130 N1131 L1132 C1136 T1137 L1138 | M1130-N1134 VanDerWaalsContact O-CG 3.27Å; M1130-N1134 PolarHBondContact O-N 3.31Å; M1130-N1134 PolarHBondContact O-ND2 3.05Å; N1131-N1134 WeakPolarHBondContact O-CB 3.35Å; N1131-N1134 PolarHBondContact O-N 3.22Å; L1132-N1134 VanDerWaalsContact C-N 3.34Å; N1134-C1136 VanDerWaalsContact C-N 3.33Å; N1134-C1136 PolarHBondContact O-N 3.14Å; N1134-T1137 PolarHBondContact O-N 3.21Å; N1134-T1137 VanDerWaalsContact O-N 3.15Å; N1134-T1137 PolarHBondContact O-OG1 3.08Å; N1134-L1138 WeakPolarHBondContact O-CG 3.36Å; N1134-L1138 PolarHBondContact O-N 3.2Å |
| 1135 | D | 77.4 | Confident | 77.3 | Confident | 29.6 Ų | 29.6 | 40.5 Ų | 40.5 | 16% | 0.158 | 22% | 0.215 | C | C | . | . | H | α-helix | trans | -59.7 | -40.6 | 175.1 | -74.3 | -11.4 | 0 | 0 | 0 | 112.9 | C1057 N1058 N1131 L1132 L1133 T1137 L1138 Y1139 | C1057-D1135 VanDerWaalsContact CA-OD2 3.26Å; C1057-D1135 WeakPolarHBondContact CA-OD2 3.31Å; C1057-D1135 VanDerWaalsContact CB-OD2 3.31Å; C1057-D1135 WeakPolarHBondContact CB-OD2 3.36Å; N1058-D1135 WeakPolarHBondContact CB-OD1 3.43Å; N1058-D1135 PolarHBondContact N-OD2 3.24Å; N1058-D1135 PolarHBondContact ND2-OD1 3.06Å; N1058-D1135 PolarHBondContact OD1-OD1 2.65Å; N1058-D1135 VanDerWaalsContact OD1-OD1 3.1Å; N1131-D1135 PolarHBondContact O-N 3.16Å; N1131-D1135 VanDerWaalsContact O-N 3.1Å; L1132-D1135 PolarHBondContact O-N 3.41Å; L1133-D1135 VanDerWaalsContact C-N 3.3Å; L1133-D1135 PolarHBondContact O-N 3.17Å; D1135-T1137 VanDerWaalsContact C-N 3.32Å; D1135-T1137 PolarHBondContact O-N 3.01Å; D1135-L1138 PolarHBondContact O-N 3Å; D1135-Y1139 PolarHBondContact O-N 3.17Å; D1135-Y1139 VanDerWaalsContact O-N 3.15Å |
| 1136 | C | 79.6 | Confident | 75.8 | Confident | 0.4 Ų | 0.4 | 42 Ų | 42 | 0% | 0.003 | 23% | 0.228 | C | C | . | . | H | α-helix | trans | -59.9 | -45 | 175.8 | -63.9 | 0 | 0 | 0 | 0 | 111.6 | L1132 L1133 N1134 Y1139 E1140 M1197 L1200 R1201 | L1132-C1136 PolarHBondContact O-N 3.27Å; L1132-C1136 VanDerWaalsContact O-N 3.13Å; L1132-C1136 PolarHBondContact O-SG 3.22Å; L1133-C1136 WeakPolarHBondContact O-CB 3.38Å; L1133-C1136 PolarHBondContact O-N 3.1Å; L1133-C1136 VanDerWaalsContact O-N 3.12Å; N1134-C1136 VanDerWaalsContact C-N 3.33Å; N1134-C1136 PolarHBondContact O-N 3.14Å; C1136-Y1139 PolarHBondContact O-N 3.13Å; C1136-E1140 PolarHBondContact O-N 3.25Å; C1136-E1140 VanDerWaalsContact O-N 3.15Å; C1136-M1197 VanDerWaalsContact CA-CE 3.44Å; C1136-M1197 HydrophobicContact CB-CE 3.89Å; C1136-M1197 HydrophobicContact CB-CG 4.06Å; C1136-M1197 HydrophobicContact CB-SD 3.91Å; C1136-M1197 VanDerWaalsContact SG-CE 3.54Å; C1136-L1200 VanDerWaalsContact SG-CD2 3.55Å; C1136-R1201 HydrophobicContact CB-CB 4.38Å |
| 1137 | T | 73.4 | Confident | 74.3 | Confident | 15 Ų | 15 | 47.3 Ų | 47.3 | 9% | 0.092 | 25% | 0.248 | C | C | . | . | H | α-helix | trans | -69.6 | -34.4 | 179.9 | 68.3 | 0 | 0 | 0 | 0 | 112.9 | L1133 N1134 D1135 Y1139 E1140 N1141 R1233 | L1133-T1137 HydrophobicContact CD2-CG2 4.31Å; L1133-T1137 WeakPolarHBondContact O-CG2 3.38Å; L1133-T1137 PolarHBondContact O-N 3.1Å; L1133-T1137 VanDerWaalsContact O-N 3.1Å; N1134-T1137 PolarHBondContact O-N 3.21Å; N1134-T1137 VanDerWaalsContact O-N 3.15Å; N1134-T1137 PolarHBondContact O-OG1 3.08Å; D1135-T1137 VanDerWaalsContact C-N 3.32Å; D1135-T1137 PolarHBondContact O-N 3.01Å; T1137-Y1139 VanDerWaalsContact C-N 3.29Å; T1137-Y1139 PolarHBondContact O-N 3.09Å; T1137-E1140 PolarHBondContact O-N 3.14Å; T1137-N1141 VanDerWaalsContact O-CG 3.3Å; T1137-N1141 PolarHBondContact O-N 3.21Å; T1137-N1141 PolarHBondContact O-ND2 2.91Å; T1137-R1233 HydrophobicContact CG2-CB 4.19Å; T1137-R1233 PolarHBondContact O-NH1 3.13Å; T1137-R1233 WeakPolarHBondContact OG1-CD 3.31Å |
| 1138 | L | 70.7 | Confident | 72.8 | Confident | 75.6 Ų | 75.6 | 47 Ų | 47 | 40% | 0.396 | 25% | 0.252 | S | S | . | . | H | α-helix | trans | -62.1 | -39.8 | 174.9 | -72.9 | 174.1 | 0 | 0 | 0 | 111.1 | N1134 D1135 N1141 M1142 | N1134-L1138 WeakPolarHBondContact O-CG 3.36Å; N1134-L1138 PolarHBondContact O-N 3.2Å; D1135-L1138 PolarHBondContact O-N 3Å; L1138-N1141 WeakPolarHBondContact O-CB 3.46Å; L1138-N1141 PolarHBondContact O-N 3.03Å; L1138-M1142 WeakPolarHBondContact O-CG 3.34Å; L1138-M1142 PolarHBondContact O-N 3.03Å; L1138-M1142 VanDerWaalsContact O-N 3.11Å |
| 1139 | Y | 70.6 | Confident | 70.9 | Confident | 34 Ų | 34 | 49.3 Ų | 49.3 | 13% | 0.133 | 27% | 0.271 | C | S | . | . | H | α-helix | trans | -66.5 | -43.7 | 176.4 | -174.7 | -100 | 0 | 0 | 0 | 112.8 | R1083 D1135 C1136 T1137 N1141 M1142 A1143 N1193 M1197 | R1083-Y1139 VanDerWaalsContact NH1-CE2 3.32Å; R1083-Y1139 VanDerWaalsContact NH1-CZ 3.29Å; R1083-Y1139 PolarHBondContact NH1-OH 3.01Å; R1083-Y1139 VanDerWaalsContact NH2-CE2 3.26Å; D1135-Y1139 PolarHBondContact O-N 3.17Å; D1135-Y1139 VanDerWaalsContact O-N 3.15Å; C1136-Y1139 PolarHBondContact O-N 3.13Å; T1137-Y1139 VanDerWaalsContact C-N 3.29Å; T1137-Y1139 PolarHBondContact O-N 3.09Å; Y1139-N1141 VanDerWaalsContact C-N 3.27Å; Y1139-N1141 PolarHBondContact O-N 3.11Å; Y1139-M1142 PolarHBondContact O-N 3.01Å; Y1139-M1142 VanDerWaalsContact O-N 3.14Å; Y1139-A1143 HydrophobicContact CE1-CB 4.36Å; Y1139-A1143 WeakPolarHBondContact O-CB 3.36Å; Y1139-A1143 PolarHBondContact O-N 2.97Å; Y1139-N1193 HydrophobicContact CE1-CB 4.35Å; Y1139-N1193 VanDerWaalsContact OH-CB 3.27Å; Y1139-N1193 WeakPolarHBondContact OH-CB 3.34Å; Y1139-M1197 HydrophobicContact CD1-CB 4.25Å; Y1139-M1197 HydrophobicContact CD1-CE 3.68Å; Y1139-M1197 HydrophobicContact CD1-CG 3.64Å; Y1139-M1197 HydrophobicContact CD2-CE 4.49Å; Y1139-M1197 HydrophobicContact CE1-CB 4.49Å; Y1139-M1197 HydrophobicContact CE1-CE 4.3Å; Y1139-M1197 HydrophobicContact CE1-CG 3.9Å; Y1139-M1197 HydrophobicContact CG-CE 3.77Å; Y1139-M1197 HydrophobicContact CG-CG 4.2Å |
| 1140 | E | 69 | Low | 69 | Low | 56.4 Ų | 56.4 | 57.3 Ų | 57.3 | 26% | 0.264 | 31% | 0.306 | S | S | . | . | H | α-helix | trans | -53.5 | -41.9 | 174.7 | -74.8 | 174.6 | -171.1 | 0 | 0 | 111.2 | C1136 T1137 A1143 T1144 R1201 | C1136-E1140 PolarHBondContact O-N 3.25Å; C1136-E1140 VanDerWaalsContact O-N 3.15Å; T1137-E1140 PolarHBondContact O-N 3.14Å; E1140-A1143 PolarHBondContact O-N 2.98Å; E1140-T1144 WeakPolarHBondContact O-CB 3.37Å; E1140-T1144 VanDerWaalsContact O-CG2 3.3Å; E1140-T1144 WeakPolarHBondContact O-CG2 3.36Å; E1140-T1144 PolarHBondContact O-N 3.24Å; E1140-T1144 PolarHBondContact O-OG1 3.2Å; E1140-T1144 VanDerWaalsContact O-OG1 3.08Å; E1140-R1201 IonicContact OE1-NH1 3.84Å |
| 1141 | N | 64.6 | Low | 67 | Low | 48.2 Ų | 48.2 | 65.3 Ų | 65.3 | 26% | 0.258 | 34% | 0.34 | S | S | . | . | H | α-helix | trans | -66.8 | -43.6 | 178 | -68.5 | -48.4 | 0 | 0 | 0 | 113.2 | T1137 L1138 Y1139 A1143 T1144 N1145 R1233 | T1137-N1141 VanDerWaalsContact O-CG 3.3Å; T1137-N1141 PolarHBondContact O-N 3.21Å; T1137-N1141 PolarHBondContact O-ND2 2.91Å; L1138-N1141 WeakPolarHBondContact O-CB 3.46Å; L1138-N1141 PolarHBondContact O-N 3.03Å; Y1139-N1141 VanDerWaalsContact C-N 3.27Å; Y1139-N1141 PolarHBondContact O-N 3.11Å; N1141-A1143 VanDerWaalsContact C-N 3.31Å; N1141-A1143 PolarHBondContact O-N 3.03Å; N1141-T1144 VanDerWaalsContact CA-OG1 3.31Å; N1141-T1144 WeakPolarHBondContact CA-OG1 3.36Å; N1141-T1144 PolarHBondContact O-N 3.16Å; N1141-T1144 PolarHBondContact O-OG1 3.25Å; N1141-N1145 VanDerWaalsContact O-CB 3.28Å; N1141-N1145 WeakPolarHBondContact O-CB 3.31Å; N1141-N1145 VanDerWaalsContact O-CG 3.24Å; N1141-N1145 PolarHBondContact O-N 3.06Å; N1141-N1145 PolarHBondContact O-ND2 3.24Å; N1141-N1145 PolarHBondContact O-OD1 3.17Å; N1141-R1233 PolarHBondContact ND2-NH1 2.99Å; N1141-R1233 VanDerWaalsContact ND2-NH1 3.19Å; N1141-R1233 PolarHBondContact ND2-NH2 3.23Å; N1141-R1233 PolarHBondContact OD1-NH1 3.49Å; N1141-R1233 PolarHBondContact OD1-NH2 3.1Å; N1141-R1233 VanDerWaalsContact OD1-NH2 3.1Å |
| 1142 | M | 66.2 | Low | 65 | Low | 117.8 Ų | 117.8 | 67.3 Ų | 67.3 | 58% | 0.58 | 36% | 0.355 | S | S | * | . | H | α-helix | trans | -62.9 | -39.8 | 176 | -68.7 | -177 | -161.8 | 0 | 0 | 110.8 | P1072 L1138 Y1139 N1145 A1146 | P1072-M1142 HydrophobicContact CB-SD 3.95Å; L1138-M1142 WeakPolarHBondContact O-CG 3.34Å; L1138-M1142 PolarHBondContact O-N 3.03Å; L1138-M1142 VanDerWaalsContact O-N 3.11Å; Y1139-M1142 PolarHBondContact O-N 3.01Å; Y1139-M1142 VanDerWaalsContact O-N 3.14Å; M1142-N1145 PolarHBondContact O-N 3.28Å; M1142-A1146 VanDerWaalsContact O-CB 3.29Å; M1142-A1146 WeakPolarHBondContact O-CB 3.4Å; M1142-A1146 PolarHBondContact O-N 3.19Å |
| 1143 | A | 65.1 | Low | 62.7 | Low | 20 Ų | 20 | 76 Ų | 76 | 17% | 0.165 | 40% | 0.396 | C | S | . | . | H | α-helix | trans | -68.3 | -40.6 | 178 | 0 | 0 | 0 | 0 | 0 | 112.5 | Y1139 E1140 N1141 A1146 R1147 | Y1139-A1143 HydrophobicContact CE1-CB 4.36Å; Y1139-A1143 WeakPolarHBondContact O-CB 3.36Å; Y1139-A1143 PolarHBondContact O-N 2.97Å; E1140-A1143 PolarHBondContact O-N 2.98Å; N1141-A1143 VanDerWaalsContact C-N 3.31Å; N1141-A1143 PolarHBondContact O-N 3.03Å; A1143-A1146 PolarHBondContact O-N 2.64Å; A1143-R1147 WeakPolarHBondContact O-CB 3.47Å; A1143-R1147 WeakPolarHBondContact O-CG 3.37Å; A1143-R1147 PolarHBondContact O-N 3.29Å; A1143-R1147 VanDerWaalsContact O-N 3.11Å |
| 1144 | T | 65.4 | Low | 60.4 | Low | 78.8 Ų | 78.8 | 80.2 Ų | 80.2 | 48% | 0.483 | 43% | 0.431 | S | S | . | . | H | α-helix | trans | -66.8 | -41.4 | 175 | 50.2 | 0 | 0 | 0 | 0 | 111.8 | E1140 N1141 A1146 R1147 S1148 | E1140-T1144 WeakPolarHBondContact O-CB 3.37Å; E1140-T1144 VanDerWaalsContact O-CG2 3.3Å; E1140-T1144 WeakPolarHBondContact O-CG2 3.36Å; E1140-T1144 PolarHBondContact O-N 3.24Å; E1140-T1144 PolarHBondContact O-OG1 3.2Å; E1140-T1144 VanDerWaalsContact O-OG1 3.08Å; N1141-T1144 VanDerWaalsContact CA-OG1 3.31Å; N1141-T1144 WeakPolarHBondContact CA-OG1 3.36Å; N1141-T1144 PolarHBondContact O-N 3.16Å; N1141-T1144 PolarHBondContact O-OG1 3.25Å; T1144-A1146 PolarHBondContact O-N 3.16Å; T1144-R1147 PolarHBondContact O-N 3.24Å; T1144-R1147 VanDerWaalsContact O-N 3.15Å; T1144-S1148 PolarHBondContact O-N 3.24Å; T1144-S1148 PolarHBondContact O-OG 3.1Å |
| 1145 | N | 59.8 | Low | 58.4 | Low | 104.8 Ų | 104.8 | 84.1 Ų | 84.1 | 56% | 0.56 | 46% | 0.456 | S | S | * | . | H | α-helix | trans | -65.7 | -40.4 | 177.2 | -70.5 | -11.4 | 0 | 0 | 0 | 111.6 | N1141 M1142 R1147 S1148 S1149 | N1141-N1145 VanDerWaalsContact O-CB 3.28Å; N1141-N1145 WeakPolarHBondContact O-CB 3.31Å; N1141-N1145 VanDerWaalsContact O-CG 3.24Å; N1141-N1145 PolarHBondContact O-N 3.06Å; N1141-N1145 PolarHBondContact O-ND2 3.24Å; N1141-N1145 PolarHBondContact O-OD1 3.17Å; M1142-N1145 PolarHBondContact O-N 3.28Å; N1145-R1147 VanDerWaalsContact C-N 3.32Å; N1145-R1147 PolarHBondContact O-N 3.05Å; N1145-S1148 VanDerWaalsContact C-OG 3.32Å; N1145-S1148 WeakPolarHBondContact CA-OG 3.28Å; N1145-S1148 PolarHBondContact O-N 3.11Å; N1145-S1148 VanDerWaalsContact O-N 3.11Å; N1145-S1148 PolarHBondContact O-OG 3.21Å; N1145-S1149 PolarHBondContact O-N 3.2Å; N1145-S1149 VanDerWaalsContact O-N 3.09Å; N1145-S1149 PolarHBondContact O-OG 3.2Å |
| 1146 | A | 58.2 | Low | 56.4 | Low | 35.2 Ų | 35.2 | 88.5 Ų | 88.5 | 29% | 0.291 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -66 | -34.2 | 174.2 | 0 | 0 | 0 | 0 | 0 | 112.8 | L1073 M1142 A1143 T1144 S1148 S1149 F1150 | L1073-A1146 HydrophobicContact CD2-CB 3.39Å; M1142-A1146 VanDerWaalsContact O-CB 3.29Å; M1142-A1146 WeakPolarHBondContact O-CB 3.4Å; M1142-A1146 PolarHBondContact O-N 3.19Å; A1143-A1146 PolarHBondContact O-N 2.64Å; T1144-A1146 PolarHBondContact O-N 3.16Å; A1146-S1148 VanDerWaalsContact C-N 3.3Å; A1146-S1148 PolarHBondContact O-N 3.28Å; A1146-S1149 WeakPolarHBondContact CA-OG 3.27Å; A1146-S1149 PolarHBondContact O-N 3.27Å; A1146-S1149 PolarHBondContact O-OG 2.91Å; A1146-F1150 VanDerWaalsContact O-CD2 3.32Å; A1146-F1150 WeakPolarHBondContact O-CD2 3.39Å; A1146-F1150 PolarHBondContact O-N 3.14Å |
| 1147 | R | 57.7 | Low | 54.1 | Low | 118.8 Ų | 118.8 | 96.2 Ų | 96.2 | 45% | 0.448 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -69.3 | -32.9 | 173.2 | -91.7 | 177 | -171.7 | -176.9 | 0.2 | 112.3 | A1143 T1144 N1145 F1150 D1191 | A1143-R1147 WeakPolarHBondContact O-CB 3.47Å; A1143-R1147 WeakPolarHBondContact O-CG 3.37Å; A1143-R1147 PolarHBondContact O-N 3.29Å; A1143-R1147 VanDerWaalsContact O-N 3.11Å; T1144-R1147 PolarHBondContact O-N 3.24Å; T1144-R1147 VanDerWaalsContact O-N 3.15Å; N1145-R1147 VanDerWaalsContact C-N 3.32Å; N1145-R1147 PolarHBondContact O-N 3.05Å; R1147-F1150 PolarHBondContact O-N 3.08Å; R1147-D1191 IonicContact CZ-OD1 2.83Å; R1147-D1191 IonicContact NH1-OD1 3.08Å; R1147-D1191 IonicContact NH2-OD1 3.42Å; R1147-D1191 PolarHBondContact NH2-OD1 3Å |
| 1148 | S | 54.9 | Low | 52.4 | Low | 71.2 Ų | 71.2 | 100.9 Ų | 100.9 | 50% | 0.498 | 56% | 0.558 | S | S | . | * | H | α-helix | trans | -72.2 | -36.5 | 175.7 | 64.5 | 0 | 0 | 0 | 0 | 112.6 | T1144 N1145 A1146 F1150 K1151 V1152 | T1144-S1148 PolarHBondContact O-N 3.24Å; T1144-S1148 PolarHBondContact O-OG 3.1Å; N1145-S1148 VanDerWaalsContact C-OG 3.32Å; N1145-S1148 WeakPolarHBondContact CA-OG 3.28Å; N1145-S1148 PolarHBondContact O-N 3.11Å; N1145-S1148 VanDerWaalsContact O-N 3.11Å; N1145-S1148 PolarHBondContact O-OG 3.21Å; A1146-S1148 VanDerWaalsContact C-N 3.3Å; A1146-S1148 PolarHBondContact O-N 3.28Å; S1148-F1150 VanDerWaalsContact C-N 3.3Å; S1148-F1150 PolarHBondContact O-N 3.13Å; S1148-K1151 PolarHBondContact O-N 3.17Å; S1148-K1151 VanDerWaalsContact O-N 3.12Å; S1148-V1152 WeakPolarHBondContact O-CG2 3.36Å |
| 1149 | S | 50.1 | Low | 50.5 | Low | 81.6 Ų | 81.6 | 107.2 Ų | 107.2 | 57% | 0.571 | 58% | 0.582 | S | S | * | * | H | α-helix | trans | -68.6 | -25.6 | 176.3 | 60.6 | 0 | 0 | 0 | 0 | 113.4 | N1145 A1146 K1151 V1152 | N1145-S1149 PolarHBondContact O-N 3.2Å; N1145-S1149 VanDerWaalsContact O-N 3.09Å; N1145-S1149 PolarHBondContact O-OG 3.2Å; A1146-S1149 WeakPolarHBondContact CA-OG 3.27Å; A1146-S1149 PolarHBondContact O-N 3.27Å; A1146-S1149 PolarHBondContact O-OG 2.91Å; S1149-K1151 VanDerWaalsContact C-N 3.29Å; S1149-K1151 PolarHBondContact O-N 3.18Å; S1149-V1152 PolarHBondContact O-N 3.27Å |
| 1150 | F | 49.8 | Very low | 48.8 | Very low | 168.4 Ų | 168.4 | 112.2 Ų | 112.2 | 74% | 0.739 | 62% | 0.616 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -80.5 | -9.4 | 175.9 | -106.4 | -85.9 | 0 | 0 | 0 | 114.3 | A1146 R1147 S1148 V1152 | A1146-F1150 VanDerWaalsContact O-CD2 3.32Å; A1146-F1150 WeakPolarHBondContact O-CD2 3.39Å; A1146-F1150 PolarHBondContact O-N 3.14Å; R1147-F1150 PolarHBondContact O-N 3.08Å; S1148-F1150 VanDerWaalsContact C-N 3.3Å; S1148-F1150 PolarHBondContact O-N 3.13Å; F1150-V1152 VanDerWaalsContact C-N 3.33Å; F1150-V1152 PolarHBondContact O-N 2.99Å; F1150-V1152 VanDerWaalsContact O-N 3.11Å |
| 1151 | K | 42.2 | Very low | 47 | Very low | 180.8 Ų | 180.8 | 113.8 Ų | 113.8 | 79% | 0.786 | 64% | 0.638 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -92.1 | 30.8 | 176.3 | -83.4 | -172.7 | 174.7 | -176.6 | 0 | 112.7 | S1148 S1149 | S1148-K1151 PolarHBondContact O-N 3.17Å; S1148-K1151 VanDerWaalsContact O-N 3.12Å; S1149-K1151 VanDerWaalsContact C-N 3.29Å; S1149-K1151 PolarHBondContact O-N 3.18Å |
| 1152 | V | 43.2 | Very low | 45.4 | Very low | 122.8 Ų | 122.8 | 117.7 Ų | 117.7 | 74% | 0.744 | 67% | 0.668 | S | S | * | * | trans | -90.3 | 86 | 174.2 | 177.8 | 0 | 0 | 0 | 0 | 109.9 | S1148 S1149 F1150 A1154 | S1148-V1152 WeakPolarHBondContact O-CG2 3.36Å; S1149-V1152 PolarHBondContact O-N 3.27Å; F1150-V1152 VanDerWaalsContact C-N 3.33Å; F1150-V1152 PolarHBondContact O-N 2.99Å; F1150-V1152 VanDerWaalsContact O-N 3.11Å; V1152-A1154 VanDerWaalsContact C-N 3.34Å; V1152-A1154 PolarHBondContact O-N 3.05Å | ||
| 1153 | E | 36.2 | Very low | 43.5 | Very low | 186 Ų | 186 | 119.5 Ų | 119.5 | 87% | 0.869 | 68% | 0.68 | S | S | * | * | trans | -78.2 | 80 | 170.8 | -73.1 | 175.9 | 150.6 | 0 | 0 | 114.1 | ||||
| 1154 | A | 36.2 | Very low | 41.8 | Very low | 91.2 Ų | 91.2 | 123.6 Ų | 123.6 | 75% | 0.754 | 71% | 0.708 | S | S | * | * | trans | -108.3 | 93.1 | 158.4 | 0 | 0 | 0 | 0 | 0 | 108.2 | V1152 P1156 | V1152-A1154 VanDerWaalsContact C-N 3.34Å; V1152-A1154 PolarHBondContact O-N 3.05Å; A1154-P1156 WeakPolarHBondContact O-CD 3.24Å | ||
| 1155 | T | 35.2 | Very low | 40.2 | Very low | 128.8 Ų | 128.8 | 126.2 Ų | 126.2 | 79% | 0.79 | 72% | 0.723 | S | S | * | * | trans | -58.7 | 128.2 | 171.3 | 17.7 | 0 | 0 | 0 | 0 | 109.8 | L1157 | T1155-L1157 PolarHBondContact O-N 3.16Š| ||
| 1156 | P | 35.8 | Very low | 38.6 | Very low | 123.2 Ų | 123.2 | 132.5 Ų | 132.5 | 80% | 0.8 | 74% | 0.739 | S | S | * | * | trans | -82.2 | 113.8 | -177.5 | 30.9 | -29.8 | 0 | 0 | 0 | 109.9 | A1154 | A1154-P1156 WeakPolarHBondContact O-CD 3.24Š| ||
| 1157 | L | 32.2 | Very low | 37.4 | Very low | 162.4 Ų | 162.4 | 137.3 Ų | 137.3 | 85% | 0.85 | 76% | 0.764 | S | S | * | * | P | Polyproline II helix | trans | -71.5 | 137.2 | 162.2 | -85.4 | 155.5 | 0 | 0 | 0 | 109.3 | T1155 K1159 | T1155-L1157 PolarHBondContact O-N 3.16Å; L1157-K1159 PolarHBondContact O-N 3.31Å |
| 1158 | P | 38.1 | Very low | 35.9 | Very low | 113 Ų | 113 | 140.9 Ų | 140.9 | 73% | 0.734 | 79% | 0.786 | S | S | * | * | P | Polyproline II helix | trans | -77.3 | 129.7 | -172.3 | 22.6 | -19.8 | 0 | 0 | 0 | 110.7 | V1160 | P1158-V1160 PolarHBondContact O-N 2.98Š|
| 1159 | K | 30.9 | Very low | 34.7 | Very low | 208.2 Ų | 208.2 | 141.2 Ų | 141.2 | 91% | 0.905 | 80% | 0.8 | S | S | * | * | trans | -76.7 | 113.3 | 171 | -71.2 | -179.8 | 176.4 | 177.2 | 0 | 110.8 | L1157 | L1157-K1159 PolarHBondContact O-N 3.31Š| ||
| 1160 | V | 34.2 | Very low | 33.6 | Very low | 139 Ų | 139 | 144 Ų | 144 | 84% | 0.842 | 81% | 0.809 | S | S | * | * | trans | -89.5 | 123.1 | 149.9 | 179.2 | 0 | 0 | 0 | 0 | 109.5 | P1158 | P1158-V1160 PolarHBondContact O-N 2.98Š| ||
| 1161 | A | 31.7 | Very low | 32.8 | Very low | 89 Ų | 89 | 146.2 Ų | 146.2 | 74% | 0.736 | 81% | 0.814 | S | S | * | * | trans | -66 | 138.3 | 174.6 | 0 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 1162 | C | 30.2 | Very low | 32.6 | Very low | 131.2 Ų | 131.2 | 142.4 Ų | 142.4 | 89% | 0.886 | 81% | 0.808 | S | S | * | * | trans | -158 | 129.7 | 146.2 | -104.5 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 1163 | D | 27 | Very low | 32 | Very low | 154.6 Ų | 154.6 | 143.9 Ų | 143.9 | 83% | 0.827 | 81% | 0.812 | S | S | * | * | trans | -66 | 152.3 | 179.6 | -72.7 | -52.8 | 0 | 0 | 0 | 113.7 | ||||
| 1164 | S | 28.9 | Very low | 31.7 | Very low | 107.6 Ų | 107.6 | 140.7 Ų | 140.7 | 75% | 0.752 | 81% | 0.81 | S | S | * | * | trans | 85 | 123.8 | 137.8 | 69.3 | 0 | 0 | 0 | 0 | 116.8 | ||||
| 1165 | V | 30.9 | Very low | 31.6 | Very low | 132 Ų | 132 | 141 Ų | 141 | 80% | 0.8 | 81% | 0.812 | S | S | * | * | 172.3 | 130.9 | 112 | 174.2 | 0 | 0 | 0 | 0 | 112.7 | V1167 | V1165-V1167 HydrophobicContact CG1-CG2 4.13Š| |||
| 1166 | R | 28 | Very low | 31.6 | Very low | 237.6 Ų | 237.6 | 140.7 Ų | 140.7 | 90% | 0.897 | 81% | 0.812 | S | S | * | * | trans | -83 | 132 | 158.3 | -76.6 | 175.8 | 168.2 | 168.9 | -4.4 | 111.1 | ||||
| 1167 | V | 31.5 | Very low | 31.3 | Very low | 135.4 Ų | 135.4 | 139.9 Ų | 139.9 | 82% | 0.821 | 81% | 0.81 | S | S | * | * | trans | -164.5 | 129.3 | 135.7 | 177 | 0 | 0 | 0 | 0 | 110.4 | V1165 | V1165-V1167 HydrophobicContact CG1-CG2 4.13Š| ||
| 1168 | E | 26.2 | Very low | 31.2 | Very low | 194.6 Ų | 194.6 | 137.8 Ų | 137.8 | 91% | 0.909 | 81% | 0.808 | S | S | * | * | trans | -70.5 | 146.5 | 174.6 | -64.6 | 173.6 | 146.6 | 0 | 0 | 112.5 | ||||
| 1169 | G | 30.2 | Very low | 30.9 | Very low | 77.4 Ų | 77.4 | 139 Ų | 139 | 80% | 0.798 | 81% | 0.812 | S | S | * | * | trans | -176 | 101.1 | 172 | 0 | 0 | 0 | 0 | 0 | 114 | ||||
| 1170 | N | 28.2 | Very low | 31 | Very low | 140.4 Ų | 140.4 | 133.6 Ų | 133.6 | 75% | 0.751 | 80% | 0.801 | S | S | * | * | trans | -32.4 | 139.9 | 165.9 | -95.1 | -15.2 | 0 | 0 | 0 | 117.4 | ||||
| 1171 | Y | 31 | Very low | 31.1 | Very low | 215 Ų | 215 | 132.8 Ų | 132.8 | 84% | 0.843 | 80% | 0.797 | S | S | * | * | trans | 126.5 | 151.3 | 137.6 | -76.8 | -60.5 | 0 | 0 | 0 | 117.2 | ||||
| 1172 | P | 39.9 | Very low | 31.6 | Very low | 100.6 Ų | 100.6 | 133.2 Ų | 133.2 | 65% | 0.653 | 79% | 0.794 | S | S | * | * | trans | -116.7 | 171.3 | -136.3 | 39.2 | -26.1 | 0 | 0 | 0 | 114.6 | ||||
| 1173 | N | 29 | Very low | 32.3 | Very low | 155.4 Ų | 155.4 | 130.9 Ų | 130.9 | 83% | 0.831 | 78% | 0.779 | S | S | * | * | trans | 94.1 | 104.6 | 156.6 | -67.2 | -20.3 | 0 | 0 | 0 | 117.5 | ||||
| 1174 | S | 30.6 | Very low | 33.4 | Very low | 117.6 Ų | 117.6 | 126.3 Ų | 126.3 | 82% | 0.822 | 76% | 0.759 | S | S | * | * | -175.2 | 128.5 | 124.5 | 52.2 | 0 | 0 | 0 | 0 | 110.8 | P1176 | S1174-P1176 WeakPolarHBondContact O-CD 3.31Š| |||
| 1175 | A | 32.9 | Very low | 34.4 | Very low | 97.8 Ų | 97.8 | 123.6 Ų | 123.6 | 81% | 0.808 | 74% | 0.743 | S | S | * | * | trans | -49.8 | 138.5 | 173.7 | 0 | 0 | 0 | 0 | 0 | 114 | ||||
| 1176 | P | 35.9 | Very low | 35.5 | Very low | 122.4 Ų | 122.4 | 120.8 Ų | 120.8 | 80% | 0.795 | 73% | 0.726 | S | S | * | * | trans | -105.1 | 119 | 155 | 26.1 | -10 | 0 | 0 | 0 | 111.2 | S1174 | S1174-P1176 WeakPolarHBondContact O-CD 3.31Š| ||
| 1177 | S | 30 | Very low | 36.8 | Very low | 106.8 Ų | 106.8 | 112 Ų | 112 | 75% | 0.747 | 71% | 0.705 | S | S | * | * | trans | -54.2 | 127.1 | 154 | 49.3 | 0 | 0 | 0 | 0 | 111.8 | V1179 | S1177-V1179 PolarHBondContact O-N 3.32Š| ||
| 1178 | C | 30.7 | Very low | 38.2 | Very low | 119 Ų | 119 | 113.8 Ų | 113.8 | 80% | 0.804 | 70% | 0.697 | S | S | * | * | trans | -48.4 | 114.3 | 142.7 | 5.9 | 0 | 0 | 0 | 0 | 113.5 | ||||
| 1179 | V | 30 | Very low | 39.8 | Very low | 136.4 Ų | 136.4 | 112.8 Ų | 112.8 | 83% | 0.827 | 69% | 0.685 | S | S | * | * | trans | -146.6 | 111.5 | 148.2 | -173.3 | 0 | 0 | 0 | 0 | 108.8 | S1177 | S1177-V1179 PolarHBondContact O-N 3.32Š| ||
| 1180 | S | 33 | Very low | 41.5 | Very low | 96.6 Ų | 96.6 | 111.9 Ų | 111.9 | 68% | 0.676 | 66% | 0.661 | S | S | * | * | trans | 96 | 69.4 | 163.6 | 57.8 | 0 | 0 | 0 | 0 | 117.9 | ||||
| 1181 | T | 37.3 | Very low | 43.5 | Very low | 121.8 Ų | 121.8 | 109.4 Ų | 109.4 | 75% | 0.747 | 65% | 0.648 | S | S | * | * | trans | -102.5 | 5.9 | 176.6 | 40.4 | 0 | 0 | 0 | 0 | 115.7 | S1183 S1184 A1185 | T1181-S1183 VanDerWaalsContact C-N 3.27Å; T1181-S1183 PolarHBondContact O-N 3.46Å; T1181-S1184 PolarHBondContact O-N 3Å; T1181-A1185 PolarHBondContact O-N 3.33Å | ||
| 1182 | S | 41.8 | Very low | 45.4 | Very low | 96.8 Ų | 96.8 | 104.6 Ų | 104.6 | 68% | 0.677 | 63% | 0.633 | S | S | * | * | H | α-helix | trans | -76.3 | -27.3 | -176.6 | 55.5 | 0 | 0 | 0 | 0 | 114.7 | T1186 | S1182-T1186 PolarHBondContact O-OG1 3.16Å |
| 1183 | S | 44.9 | Very low | 46.8 | Very low | 82.6 Ų | 82.6 | 101.1 Ų | 101.1 | 58% | 0.578 | 61% | 0.609 | S | S | * | * | H | α-helix | trans | -74.1 | -32.8 | -179 | 57.7 | 0 | 0 | 0 | 0 | 113.5 | T1181 T1186 A1187 | T1181-S1183 VanDerWaalsContact C-N 3.27Å; T1181-S1183 PolarHBondContact O-N 3.46Å; S1183-T1186 PolarHBondContact O-OG1 3.27Å; S1183-A1187 PolarHBondContact O-N 3.1Å |
| 1184 | S | 49.7 | Very low | 49.1 | Very low | 59.2 Ų | 59.2 | 98.1 Ų | 98.1 | 41% | 0.414 | 59% | 0.588 | S | S | . | * | H | α-helix | trans | -70.6 | -35 | -179.5 | 139.5 | 0 | 0 | 0 | 0 | 113.3 | T1181 T1186 R1188 | T1181-S1184 PolarHBondContact O-N 3Å; S1184-T1186 VanDerWaalsContact C-N 3.32Å; S1184-T1186 PolarHBondContact O-N 3.12Å; S1184-R1188 WeakPolarHBondContact O-CG 3.2Å; S1184-R1188 PolarHBondContact O-N 3.2Å; S1184-R1188 VanDerWaalsContact O-N 3.12Å |
| 1185 | A | 51 | Low | 51.5 | Low | 50 Ų | 50 | 96.1 Ų | 96.1 | 41% | 0.413 | 57% | 0.568 | S | S | . | * | H | α-helix | trans | -70.1 | -36.6 | -179.2 | 0 | 0 | 0 | 0 | 0 | 112.2 | T1181 R1189 | T1181-A1185 PolarHBondContact O-N 3.33Å; A1185-R1189 WeakPolarHBondContact O-CG 3.39Å; A1185-R1189 PolarHBondContact O-N 3.13Å; A1185-R1189 VanDerWaalsContact O-N 3.1Å |
| 1186 | T | 54.1 | Low | 53.8 | Low | 72.6 Ų | 72.6 | 94.8 Ų | 94.8 | 45% | 0.445 | 54% | 0.543 | S | S | . | . | H | α-helix | trans | -70.4 | -40.3 | 178.4 | -19.5 | 0 | 0 | 0 | 0 | 111.7 | F1074 S1182 S1183 S1184 R1189 L1190 | F1074-T1186 HydrophobicContact CE1-CG2 3.96Å; S1182-T1186 PolarHBondContact O-OG1 3.16Å; S1183-T1186 PolarHBondContact O-OG1 3.27Å; S1184-T1186 VanDerWaalsContact C-N 3.32Å; S1184-T1186 PolarHBondContact O-N 3.12Å; T1186-R1189 PolarHBondContact O-N 3.24Å; T1186-L1190 HydrophobicContact CG2-CD1 4.47Å; T1186-L1190 WeakPolarHBondContact O-CG 3.31Å; T1186-L1190 PolarHBondContact O-N 3.19Å; T1186-L1190 VanDerWaalsContact O-N 3.11Å |
| 1187 | A | 54.4 | Low | 55.9 | Low | 52.8 Ų | 52.8 | 89.5 Ų | 89.5 | 44% | 0.436 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -62.2 | -45.1 | 174.5 | 0 | 0 | 0 | 0 | 0 | 112.3 | S1183 R1189 L1190 D1191 | S1183-A1187 PolarHBondContact O-N 3.1Å; A1187-R1189 PolarHBondContact O-N 3.3Å; A1187-L1190 WeakPolarHBondContact O-CB 3.37Å; A1187-L1190 PolarHBondContact O-N 3.13Å; A1187-L1190 VanDerWaalsContact O-N 3.16Å; A1187-D1191 PolarHBondContact O-N 3.3Å; A1187-D1191 VanDerWaalsContact O-N 3.12Å |
| 1188 | R | 60.6 | Low | 58.5 | Low | 174.4 Ų | 174.4 | 87.2 Ų | 87.2 | 66% | 0.658 | 49% | 0.487 | S | S | * | . | H | α-helix | trans | -60.7 | -43.8 | 176 | -74.8 | -176.1 | -175.7 | 177.5 | 2 | 112.7 | S1184 L1190 D1191 E1192 | S1184-R1188 WeakPolarHBondContact O-CG 3.2Å; S1184-R1188 PolarHBondContact O-N 3.2Å; S1184-R1188 VanDerWaalsContact O-N 3.12Å; R1188-L1190 VanDerWaalsContact C-N 3.29Å; R1188-L1190 PolarHBondContact O-N 3.05Å; R1188-D1191 PolarHBondContact O-N 3.37Å; R1188-E1192 WeakPolarHBondContact O-CG 3.37Å; R1188-E1192 PolarHBondContact O-N 3.17Å |
| 1189 | R | 61.6 | Low | 61.3 | Low | 173 Ų | 173 | 87.5 Ų | 87.5 | 65% | 0.653 | 47% | 0.471 | S | S | * | . | H | α-helix | trans | -63.2 | -33.2 | 176.7 | -75.9 | -178.6 | -179.8 | -178.5 | 0.4 | 113.1 | A1185 T1186 A1187 N1193 | A1185-R1189 WeakPolarHBondContact O-CG 3.39Å; A1185-R1189 PolarHBondContact O-N 3.13Å; A1185-R1189 VanDerWaalsContact O-N 3.1Å; T1186-R1189 PolarHBondContact O-N 3.24Å; A1187-R1189 PolarHBondContact O-N 3.3Å; R1189-N1193 WeakPolarHBondContact O-CB 3.36Å; R1189-N1193 PolarHBondContact O-N 3.13Å; R1189-N1193 VanDerWaalsContact O-N 3.16Å; R1189-N1193 PolarHBondContact O-ND2 2.99Å; R1189-N1193 VanDerWaalsContact O-ND2 3.09Å |
| 1190 | L | 65.6 | Low | 64.1 | Low | 59.6 Ų | 59.6 | 81.3 Ų | 81.3 | 31% | 0.312 | 43% | 0.433 | S | S | . | . | H | α-helix | trans | -71 | -38.7 | 175.4 | -74.6 | 166.6 | 0 | 0 | 0 | 111.8 | T1186 A1187 R1188 N1193 K1194 | T1186-L1190 HydrophobicContact CG2-CD1 4.47Å; T1186-L1190 WeakPolarHBondContact O-CG 3.31Å; T1186-L1190 PolarHBondContact O-N 3.19Å; T1186-L1190 VanDerWaalsContact O-N 3.11Å; A1187-L1190 WeakPolarHBondContact O-CB 3.37Å; A1187-L1190 PolarHBondContact O-N 3.13Å; A1187-L1190 VanDerWaalsContact O-N 3.16Å; R1188-L1190 VanDerWaalsContact C-N 3.29Å; R1188-L1190 PolarHBondContact O-N 3.05Å; L1190-N1193 PolarHBondContact O-N 3.29Å; L1190-K1194 WeakPolarHBondContact O-CB 3.37Å; L1190-K1194 PolarHBondContact O-N 3.18Å |
| 1191 | D | 68.7 | Low | 66.7 | Low | 87 Ų | 87 | 78.8 Ų | 78.8 | 47% | 0.465 | 41% | 0.409 | S | S | . | . | H | α-helix | trans | -69.1 | -43 | 176.5 | -89.4 | -11.6 | 0 | 0 | 0 | 112.4 | R1147 A1187 R1188 N1193 K1194 D1195 | R1147-D1191 IonicContact CZ-OD1 2.83Å; R1147-D1191 IonicContact NH1-OD1 3.08Å; R1147-D1191 IonicContact NH2-OD1 3.42Å; R1147-D1191 PolarHBondContact NH2-OD1 3Å; A1187-D1191 PolarHBondContact O-N 3.3Å; A1187-D1191 VanDerWaalsContact O-N 3.12Å; R1188-D1191 PolarHBondContact O-N 3.37Å; D1191-N1193 VanDerWaalsContact C-N 3.33Å; D1191-N1193 PolarHBondContact O-N 3.24Å; D1191-K1194 WeakPolarHBondContact O-CB 3.29Å; D1191-K1194 PolarHBondContact O-N 3.04Å; D1191-K1194 VanDerWaalsContact O-N 3.17Å; D1191-D1195 PolarHBondContact O-N 3.28Å; D1191-D1195 VanDerWaalsContact O-N 3.07Å |
| 1192 | E | 70.8 | Confident | 69.1 | Low | 115 Ų | 115 | 76 Ų | 76 | 54% | 0.537 | 40% | 0.395 | S | S | . | . | H | α-helix | trans | -61.3 | -40.4 | 174.9 | -73.7 | 176.5 | -174.8 | 0 | 0 | 112.2 | R1188 K1194 R1196 | R1188-E1192 WeakPolarHBondContact O-CG 3.37Å; R1188-E1192 PolarHBondContact O-N 3.17Å; E1192-K1194 VanDerWaalsContact C-N 3.34Å; E1192-R1196 WeakPolarHBondContact O-CG 3.34Å; E1192-R1196 PolarHBondContact O-N 3.32Å; E1192-R1196 VanDerWaalsContact O-N 3.14Å |
| 1193 | N | 70.9 | Confident | 71.4 | Confident | 26.2 Ų | 26.2 | 71.9 Ų | 71.9 | 14% | 0.14 | 37% | 0.367 | C | S | . | . | H | α-helix | trans | -69 | -34.3 | 175.9 | -83.6 | -39.5 | 0 | 0 | 0 | 112.3 | Y1139 R1189 L1190 D1191 R1196 M1197 | Y1139-N1193 HydrophobicContact CE1-CB 4.35Å; Y1139-N1193 VanDerWaalsContact OH-CB 3.27Å; Y1139-N1193 WeakPolarHBondContact OH-CB 3.34Å; R1189-N1193 WeakPolarHBondContact O-CB 3.36Å; R1189-N1193 PolarHBondContact O-N 3.13Å; R1189-N1193 VanDerWaalsContact O-N 3.16Å; R1189-N1193 PolarHBondContact O-ND2 2.99Å; R1189-N1193 VanDerWaalsContact O-ND2 3.09Å; L1190-N1193 PolarHBondContact O-N 3.29Å; D1191-N1193 VanDerWaalsContact C-N 3.33Å; D1191-N1193 PolarHBondContact O-N 3.24Å; N1193-R1196 PolarHBondContact O-N 3.33Å; N1193-M1197 VanDerWaalsContact O-CG 3.27Å; N1193-M1197 WeakPolarHBondContact O-CG 3.33Å; N1193-M1197 PolarHBondContact O-N 3.26Å; N1193-M1197 VanDerWaalsContact O-N 3.13Å |
| 1194 | K | 76.1 | Confident | 73.6 | Confident | 92.4 Ų | 92.4 | 68 Ų | 68 | 40% | 0.402 | 34% | 0.339 | S | S | . | . | H | α-helix | trans | -63.1 | -50.3 | 174.6 | -175.4 | -174.9 | 171.9 | -174.5 | 0 | 110.9 | L1190 D1191 E1192 R1196 M1197 D1198 | L1190-K1194 WeakPolarHBondContact O-CB 3.37Å; L1190-K1194 PolarHBondContact O-N 3.18Å; D1191-K1194 WeakPolarHBondContact O-CB 3.29Å; D1191-K1194 PolarHBondContact O-N 3.04Å; D1191-K1194 VanDerWaalsContact O-N 3.17Å; E1192-K1194 VanDerWaalsContact C-N 3.34Å; K1194-R1196 VanDerWaalsContact C-N 3.28Å; K1194-R1196 PolarHBondContact O-N 3.18Å; K1194-M1197 CarbonylContact O-C 3.14Å; K1194-M1197 WeakPolarHBondContact O-CA 3.44Å; K1194-M1197 WeakPolarHBondContact O-CB 3.38Å; K1194-M1197 PolarHBondContact O-N 3.2Å; K1194-D1198 WeakPolarHBondContact CE-OD2 3.47Å; K1194-D1198 PolarHBondContact O-N 3.23Å |
| 1195 | D | 81 | Confident | 75.4 | Confident | 74.8 Ų | 74.8 | 65.5 Ų | 65.5 | 40% | 0.4 | 32% | 0.321 | S | S | . | . | H | α-helix | trans | -58 | -39.5 | 178.5 | 175.9 | 54 | 0 | 0 | 0 | 112.3 | D1191 M1197 D1198 R1199 | D1191-D1195 PolarHBondContact O-N 3.28Å; D1191-D1195 VanDerWaalsContact O-N 3.07Å; D1195-M1197 VanDerWaalsContact C-N 3.34Å; D1195-M1197 PolarHBondContact O-N 3.16Å; D1195-D1198 PolarHBondContact O-N 3.21Å; D1195-R1199 WeakPolarHBondContact O-CB 3.33Å; D1195-R1199 VanDerWaalsContact O-CG 3.25Å; D1195-R1199 WeakPolarHBondContact O-CG 3.34Å; D1195-R1199 PolarHBondContact O-N 3.17Å; D1195-R1199 PolarHBondContact O-NE 3.1Å; D1195-R1199 IonicContact OD1-CZ 2.91Å; D1195-R1199 IonicContact OD1-NE 3.18Å; D1195-R1199 PolarHBondContact OD1-NE 3.37Å; D1195-R1199 IonicContact OD1-NH2 2.9Å; D1195-R1199 PolarHBondContact OD1-NH2 2.89Å; D1195-R1199 IonicContact OD2-CZ 3.01Å; D1195-R1199 IonicContact OD2-NE 3.17Å; D1195-R1199 PolarHBondContact OD2-NE 3.29Å; D1195-R1199 VanDerWaalsContact OD2-NE 3.08Å; D1195-R1199 IonicContact OD2-NH2 3.26Å; D1195-R1199 PolarHBondContact OD2-NH2 3.18Å |
| 1196 | R | 81.2 | Confident | 77.1 | Confident | 71.6 Ų | 71.6 | 66.5 Ų | 66.5 | 27% | 0.27 | 32% | 0.317 | S | S | . | . | H | α-helix | trans | -62.8 | -40.6 | 173.7 | -73.3 | -177.8 | -171.1 | -179.6 | 7.3 | 112.9 | E1084 E1192 N1193 K1194 R1199 L1200 | E1084-R1196 IonicContact OE2-CZ 3.11Å; E1084-R1196 IonicContact OE2-NE 3.4Å; E1084-R1196 PolarHBondContact OE2-NE 3.15Å; E1084-R1196 IonicContact OE2-NH1 3.2Å; E1084-R1196 PolarHBondContact OE2-NH1 3.2Å; E1084-R1196 IonicContact OE2-NH2 3.5Å; E1192-R1196 WeakPolarHBondContact O-CG 3.34Å; E1192-R1196 PolarHBondContact O-N 3.32Å; E1192-R1196 VanDerWaalsContact O-N 3.14Å; N1193-R1196 PolarHBondContact O-N 3.33Å; K1194-R1196 VanDerWaalsContact C-N 3.28Å; K1194-R1196 PolarHBondContact O-N 3.18Å; R1196-R1199 PolarHBondContact O-N 3.35Å; R1196-L1200 WeakPolarHBondContact O-CB 3.33Å; R1196-L1200 PolarHBondContact O-N 3.09Å |
| 1197 | M | 81.6 | Confident | 78.9 | Confident | 11.4 Ų | 11.4 | 63 Ų | 63 | 6% | 0.056 | 30% | 0.296 | C | S | . | . | H | α-helix | trans | -70.5 | -38.2 | 178.6 | -81.3 | -43.3 | -46.1 | 0 | 0 | 111.9 | R1083 C1136 Y1139 N1193 K1194 D1195 R1199 L1200 R1201 | R1083-M1197 HydrophobicContact CG-SD 4.42Å; C1136-M1197 VanDerWaalsContact CA-CE 3.44Å; C1136-M1197 HydrophobicContact CB-CE 3.89Å; C1136-M1197 HydrophobicContact CB-CG 4.06Å; C1136-M1197 HydrophobicContact CB-SD 3.91Å; C1136-M1197 VanDerWaalsContact SG-CE 3.54Å; Y1139-M1197 HydrophobicContact CD1-CB 4.25Å; Y1139-M1197 HydrophobicContact CD1-CE 3.68Å; Y1139-M1197 HydrophobicContact CD1-CG 3.64Å; Y1139-M1197 HydrophobicContact CD2-CE 4.49Å; Y1139-M1197 HydrophobicContact CE1-CB 4.49Å; Y1139-M1197 HydrophobicContact CE1-CE 4.3Å; Y1139-M1197 HydrophobicContact CE1-CG 3.9Å; Y1139-M1197 HydrophobicContact CG-CE 3.77Å; Y1139-M1197 HydrophobicContact CG-CG 4.2Å; N1193-M1197 VanDerWaalsContact O-CG 3.27Å; N1193-M1197 WeakPolarHBondContact O-CG 3.33Å; N1193-M1197 PolarHBondContact O-N 3.26Å; N1193-M1197 VanDerWaalsContact O-N 3.13Å; K1194-M1197 CarbonylContact O-C 3.14Å; K1194-M1197 WeakPolarHBondContact O-CA 3.44Å; K1194-M1197 WeakPolarHBondContact O-CB 3.38Å; K1194-M1197 PolarHBondContact O-N 3.2Å; D1195-M1197 VanDerWaalsContact C-N 3.34Å; D1195-M1197 PolarHBondContact O-N 3.16Å; M1197-R1199 VanDerWaalsContact C-N 3.31Å; M1197-R1199 PolarHBondContact O-N 3.33Å; M1197-L1200 HydrophobicContact CE-CD2 4.04Å; M1197-L1200 WeakPolarHBondContact O-CB 3.4Å; M1197-L1200 PolarHBondContact O-N 2.93Å; M1197-L1200 VanDerWaalsContact O-N 3.14Å; M1197-L1200 HydrophobicContact SD-CD2 4.15Å; M1197-R1201 WeakPolarHBondContact O-CB 3.43Å; M1197-R1201 PolarHBondContact O-N 3.2Å |
| 1198 | D | 84.6 | Confident | 80.6 | Confident | 57.4 Ų | 57.4 | 60.6 Ų | 60.6 | 31% | 0.307 | 28% | 0.276 | S | S | . | . | H | α-helix | trans | -62.3 | -41.4 | 174.5 | -67.7 | -18.5 | 0 | 0 | 0 | 110.7 | K1194 D1195 R1201 S1202 | K1194-D1198 WeakPolarHBondContact CE-OD2 3.47Å; K1194-D1198 PolarHBondContact O-N 3.23Å; D1195-D1198 PolarHBondContact O-N 3.21Å; D1198-R1201 PolarHBondContact O-N 2.89Å; D1198-S1202 WeakPolarHBondContact O-CB 3.42Å; D1198-S1202 PolarHBondContact O-N 3.29Å; D1198-S1202 PolarHBondContact O-OG 3.03Å |
| 1199 | R | 88.8 | Confident | 81.8 | Confident | 125.2 Ų | 125.2 | 52.3 Ų | 52.3 | 47% | 0.472 | 24% | 0.244 | S | C | . | . | H | α-helix | trans | -65.1 | -40.9 | 172.9 | -73 | -178.5 | -114.2 | 179 | -2.8 | 112.7 | L1087 D1195 R1196 M1197 S1202 A1203 | L1087-R1199 HydrophobicContact CD1-CB 3.91Å; L1087-R1199 HydrophobicContact CD2-CB 4.37Å; D1195-R1199 WeakPolarHBondContact O-CB 3.33Å; D1195-R1199 VanDerWaalsContact O-CG 3.25Å; D1195-R1199 WeakPolarHBondContact O-CG 3.34Å; D1195-R1199 PolarHBondContact O-N 3.17Å; D1195-R1199 PolarHBondContact O-NE 3.1Å; D1195-R1199 IonicContact OD1-CZ 2.91Å; D1195-R1199 IonicContact OD1-NE 3.18Å; D1195-R1199 PolarHBondContact OD1-NE 3.37Å; D1195-R1199 IonicContact OD1-NH2 2.9Å; D1195-R1199 PolarHBondContact OD1-NH2 2.89Å; D1195-R1199 IonicContact OD2-CZ 3.01Å; D1195-R1199 IonicContact OD2-NE 3.17Å; D1195-R1199 PolarHBondContact OD2-NE 3.29Å; D1195-R1199 VanDerWaalsContact OD2-NE 3.08Å; D1195-R1199 IonicContact OD2-NH2 3.26Å; D1195-R1199 PolarHBondContact OD2-NH2 3.18Å; R1196-R1199 PolarHBondContact O-N 3.35Å; M1197-R1199 VanDerWaalsContact C-N 3.31Å; M1197-R1199 PolarHBondContact O-N 3.33Å; R1199-S1202 PolarHBondContact O-N 3.28Å; R1199-A1203 WeakPolarHBondContact O-CB 3.28Å; R1199-A1203 PolarHBondContact O-N 3.02Å |
| 1200 | L | 89.3 | Confident | 83 | Confident | 6.2 Ų | 6.2 | 44.2 Ų | 44.2 | 3% | 0.032 | 22% | 0.215 | C | C | . | . | H | α-helix | trans | -62.6 | -47.6 | 177 | 178 | 61.9 | 0 | 0 | 0 | 110.7 | N1086 L1087 M1090 L1132 C1136 R1196 M1197 S1202 A1203 T1204 | N1086-L1200 HydrophobicContact CB-CD1 4.31Å; N1086-L1200 HydrophobicContact CB-CD2 4.44Å; L1087-L1200 HydrophobicContact CB-CD1 4.35Å; L1087-L1200 HydrophobicContact CD1-CB 4.27Å; M1090-L1200 HydrophobicContact CB-CD1 4.11Å; M1090-L1200 HydrophobicContact CG-CD1 3.8Å; L1132-L1200 HydrophobicContact CD1-CD2 4.38Å; L1132-L1200 HydrophobicContact CD2-CD1 4.01Å; L1132-L1200 HydrophobicContact CD2-CD2 4.39Å; L1132-L1200 HydrophobicContact CD2-CG 4.1Å; L1132-L1200 HydrophobicContact CG-CD2 4.49Å; C1136-L1200 VanDerWaalsContact SG-CD2 3.55Å; R1196-L1200 WeakPolarHBondContact O-CB 3.33Å; R1196-L1200 PolarHBondContact O-N 3.09Å; M1197-L1200 HydrophobicContact CE-CD2 4.04Å; M1197-L1200 WeakPolarHBondContact O-CB 3.4Å; M1197-L1200 PolarHBondContact O-N 2.93Å; M1197-L1200 VanDerWaalsContact O-N 3.14Å; M1197-L1200 HydrophobicContact SD-CD2 4.15Å; L1200-S1202 VanDerWaalsContact C-N 3.34Å; L1200-S1202 PolarHBondContact O-N 3.28Å; L1200-A1203 PolarHBondContact O-N 3.12Å; L1200-T1204 WeakPolarHBondContact O-CB 3.31Å; L1200-T1204 PolarHBondContact O-N 3.12Å; L1200-T1204 PolarHBondContact O-OG1 3.07Å |
| 1201 | R | 87.6 | Confident | 84.1 | Confident | 43.8 Ų | 43.8 | 41.4 Ų | 41.4 | 17% | 0.165 | 20% | 0.2 | C | C | . | . | H | α-helix | trans | -56.3 | -50.1 | 174.2 | -179.9 | -174.2 | 170.8 | 129.3 | 2.9 | 110.9 | L1133 C1136 E1140 M1197 D1198 A1203 T1204 I1205 E1240 | L1133-R1201 HydrophobicContact CD2-CG 3.97Å; C1136-R1201 HydrophobicContact CB-CB 4.38Å; E1140-R1201 IonicContact OE1-NH1 3.84Å; M1197-R1201 WeakPolarHBondContact O-CB 3.43Å; M1197-R1201 PolarHBondContact O-N 3.2Å; D1198-R1201 PolarHBondContact O-N 2.89Å; R1201-A1203 VanDerWaalsContact C-N 3.34Å; R1201-A1203 PolarHBondContact O-N 3.06Å; R1201-T1204 WeakPolarHBondContact O-CB 3.41Å; R1201-T1204 PolarHBondContact O-N 3.18Å; R1201-T1204 VanDerWaalsContact O-N 3.11Å; R1201-I1205 HydrophobicContact CG-CD1 3.98Å; R1201-I1205 VanDerWaalsContact NH1-CD1 3.27Å; R1201-I1205 WeakPolarHBondContact O-CG1 3.27Å; R1201-I1205 PolarHBondContact O-N 3.32Å; R1201-E1240 IonicContact CZ-OE2 3.44Å; R1201-E1240 VanDerWaalsContact CZ-OE2 3.26Å; R1201-E1240 IonicContact NE-OE2 3.1Å; R1201-E1240 IonicContact NH1-OE1 3.02Å; R1201-E1240 PolarHBondContact NH1-OE1 3Å; R1201-E1240 VanDerWaalsContact NH1-OE1 3.1Å; R1201-E1240 IonicContact NH1-OE2 2.64Å; R1201-E1240 PolarHBondContact NH1-OE2 3.12Å; R1201-E1240 IonicContact NH2-OE1 3.56Å; R1201-E1240 IonicContact NH2-OE2 3.34Å; R1201-E1240 PolarHBondContact NH2-OE2 3.2Å; R1201-E1240 VanDerWaalsContact NH2-OE2 3.09Å |
| 1202 | S | 87.8 | Confident | 85 | Confident | 64.4 Ų | 64.4 | 37.4 Ų | 37.4 | 45% | 0.45 | 18% | 0.178 | S | C | . | . | H | α-helix | trans | -60.3 | -43.3 | 179.8 | -100.8 | 0 | 0 | 0 | 0 | 112.5 | D1198 R1199 L1200 T1204 I1205 Q1206 | D1198-S1202 WeakPolarHBondContact O-CB 3.42Å; D1198-S1202 PolarHBondContact O-N 3.29Å; D1198-S1202 PolarHBondContact O-OG 3.03Å; R1199-S1202 PolarHBondContact O-N 3.28Å; L1200-S1202 VanDerWaalsContact C-N 3.34Å; L1200-S1202 PolarHBondContact O-N 3.28Å; S1202-T1204 VanDerWaalsContact C-N 3.32Å; S1202-T1204 PolarHBondContact O-N 3.05Å; S1202-I1205 PolarHBondContact O-N 3.01Å; S1202-Q1206 WeakPolarHBondContact O-CB 3.39Å; S1202-Q1206 PolarHBondContact O-N 3.34Å |
| 1203 | A | 90 | Very high | 85.4 | Confident | 11.2 Ų | 11.2 | 32.8 Ų | 32.8 | 9% | 0.093 | 16% | 0.161 | C | C | . | . | H | α-helix | trans | -64.8 | -38.2 | 176.3 | 0 | 0 | 0 | 0 | 0 | 111.9 | L1087 M1090 M1091 R1199 L1200 R1201 Q1206 A1207 | L1087-A1203 HydrophobicContact CD1-CB 4.46Å; M1090-A1203 HydrophobicContact CB-CB 3.95Å; M1091-A1203 HydrophobicContact CG-CB 3.99Å; R1199-A1203 WeakPolarHBondContact O-CB 3.28Å; R1199-A1203 PolarHBondContact O-N 3.02Å; L1200-A1203 PolarHBondContact O-N 3.12Å; R1201-A1203 VanDerWaalsContact C-N 3.34Å; R1201-A1203 PolarHBondContact O-N 3.06Å; A1203-Q1206 PolarHBondContact O-N 3.19Å; A1203-A1207 WeakPolarHBondContact O-CB 3.01Å; A1203-A1207 PolarHBondContact O-N 3.18Å |
| 1204 | T | 90.4 | Very high | 85.8 | Confident | 0 Ų | 0 | 32.9 Ų | 32.9 | 0% | 0 | 17% | 0.165 | C | C | . | . | H | α-helix | trans | -66.9 | -44.1 | 177.4 | -53.5 | 0 | 0 | 0 | 0 | 112.2 | M1090 F1129 L1132 L1133 L1200 R1201 S1202 Q1206 A1207 M1208 | M1090-T1204 HydrophobicContact CE-CG2 3.91Å; F1129-T1204 HydrophobicContact CB-CG2 3.95Å; F1129-T1204 WeakPolarHBondContact O-CG2 3.45Å; L1132-T1204 HydrophobicContact CB-CG2 4.44Å; L1132-T1204 HydrophobicContact CD2-CG2 4.48Å; L1132-T1204 WeakPolarHBondContact CD2-OG1 3.25Å; L1133-T1204 HydrophobicContact CB-CG2 4.1Å; L1133-T1204 HydrophobicContact CD1-CG2 4.15Å; L1133-T1204 HydrophobicContact CD2-CG2 3.89Å; L1133-T1204 HydrophobicContact CG-CG2 3.81Å; L1200-T1204 WeakPolarHBondContact O-CB 3.31Å; L1200-T1204 PolarHBondContact O-N 3.12Å; L1200-T1204 PolarHBondContact O-OG1 3.07Å; R1201-T1204 WeakPolarHBondContact O-CB 3.41Å; R1201-T1204 PolarHBondContact O-N 3.18Å; R1201-T1204 VanDerWaalsContact O-N 3.11Å; S1202-T1204 VanDerWaalsContact C-N 3.32Å; S1202-T1204 PolarHBondContact O-N 3.05Å; T1204-Q1206 VanDerWaalsContact C-N 3.28Å; T1204-Q1206 PolarHBondContact O-N 3.22Å; T1204-A1207 PolarHBondContact O-N 3.09Å; T1204-M1208 HydrophobicContact CG2-SD 4.41Å; T1204-M1208 WeakPolarHBondContact O-CG 3.26Å; T1204-M1208 PolarHBondContact O-N 3.22Å |
| 1205 | I | 87 | Confident | 86.1 | Confident | 5.8 Ų | 5.8 | 29 Ų | 29 | 3% | 0.03 | 15% | 0.148 | C | C | . | . | H | α-helix | trans | -60.8 | -40.9 | 174.3 | -67.6 | 171 | 0 | 0 | 0 | 110.5 | L1133 R1201 S1202 A1207 M1208 S1209 E1240 V1241 K1244 | L1133-I1205 HydrophobicContact CD1-CG1 3.78Å; L1133-I1205 HydrophobicContact CD2-CD1 4.44Å; L1133-I1205 HydrophobicContact CD2-CG1 3.97Å; R1201-I1205 HydrophobicContact CG-CD1 3.98Å; R1201-I1205 VanDerWaalsContact NH1-CD1 3.27Å; R1201-I1205 WeakPolarHBondContact O-CG1 3.27Å; R1201-I1205 PolarHBondContact O-N 3.32Å; S1202-I1205 PolarHBondContact O-N 3.01Å; I1205-A1207 PolarHBondContact O-N 3.21Å; I1205-M1208 PolarHBondContact O-N 3.05Å; I1205-S1209 WeakPolarHBondContact O-CB 3.43Å; I1205-S1209 PolarHBondContact O-N 3.14Å; I1205-S1209 PolarHBondContact O-OG 3.29Å; I1205-E1240 VanDerWaalsContact CD1-CD 3.41Å; I1205-E1240 HydrophobicContact CD1-CG 4.15Å; I1205-E1240 VanDerWaalsContact CD1-OE1 3.25Å; I1205-E1240 WeakPolarHBondContact CD1-OE1 3.46Å; I1205-E1240 VanDerWaalsContact CD1-OE2 3.24Å; I1205-E1240 WeakPolarHBondContact CD1-OE2 3.37Å; I1205-E1240 HydrophobicContact CG2-CB 4.48Å; I1205-E1240 HydrophobicContact CG2-CG 4.22Å; I1205-V1241 HydrophobicContact CB-CG2 4.45Å; I1205-V1241 HydrophobicContact CG1-CG2 4.45Å; I1205-V1241 HydrophobicContact CG2-CG2 3.94Å; I1205-K1244 HydrophobicContact CG2-CD 4.11Å |
| 1206 | Q | 88 | Confident | 85.9 | Confident | 71.6 Ų | 71.6 | 26.3 Ų | 26.3 | 34% | 0.335 | 13% | 0.134 | S | C | . | . | H | α-helix | trans | -65.4 | -39.5 | 176.8 | -166.1 | 85.1 | 24.6 | 0 | 0 | 112.5 | A1094 S1202 A1203 T1204 S1209 G1210 E1248 | A1094-Q1206 HydrophobicContact CB-CB 4.12Å; A1094-Q1206 HydrophobicContact CB-CG 4.16Å; S1202-Q1206 WeakPolarHBondContact O-CB 3.39Å; S1202-Q1206 PolarHBondContact O-N 3.34Å; A1203-Q1206 PolarHBondContact O-N 3.19Å; T1204-Q1206 VanDerWaalsContact C-N 3.28Å; T1204-Q1206 PolarHBondContact O-N 3.22Å; Q1206-S1209 PolarHBondContact O-N 3.29Å; Q1206-S1209 PolarHBondContact O-OG 3.19Å; Q1206-S1209 VanDerWaalsContact O-OG 3.05Å; Q1206-G1210 PolarHBondContact O-N 3.21Å; Q1206-E1248 PolarHBondContact NE2-OE1 3.13Å |
| 1207 | A | 90.8 | Very high | 85.4 | Confident | 0 Ų | 0 | 26.3 Ų | 26.3 | 0% | 0 | 14% | 0.139 | C | C | . | . | H | α-helix | trans | -66.1 | -42.1 | 175.5 | 0 | 0 | 0 | 0 | 0 | 112 | M1090 A1094 V1097 F1129 A1203 T1204 I1205 G1210 L1211 | M1090-A1207 HydrophobicContact CE-CB 3.6Å; A1094-A1207 HydrophobicContact CB-CB 4.02Å; V1097-A1207 HydrophobicContact CG2-CB 4.32Å; V1097-A1207 VanDerWaalsContact CG2-O 3.27Å; V1097-A1207 WeakPolarHBondContact CG2-O 3.33Å; F1129-A1207 HydrophobicContact CD2-CB 4.46Å; F1129-A1207 HydrophobicContact CE2-CB 4.12Å; F1129-A1207 HydrophobicContact CZ-CB 4.24Å; A1203-A1207 WeakPolarHBondContact O-CB 3.01Å; A1203-A1207 PolarHBondContact O-N 3.18Å; T1204-A1207 PolarHBondContact O-N 3.09Å; I1205-A1207 PolarHBondContact O-N 3.21Å; A1207-G1210 PolarHBondContact O-N 3.15Å; A1207-L1211 VanDerWaalsContact O-CB 3.31Å; A1207-L1211 WeakPolarHBondContact O-CB 3.24Å; A1207-L1211 PolarHBondContact O-N 3.28Å |
| 1208 | M | 89.9 | Confident | 85.1 | Confident | 1.6 Ų | 1.6 | 26.7 Ų | 26.7 | 1% | 0.008 | 14% | 0.141 | C | C | . | . | H | α-helix | trans | -65 | -42.2 | 175.4 | -73.5 | -176.2 | 75.9 | 0 | 0 | 112.5 | F1126 F1129 M1130 L1133 T1204 I1205 L1211 L1212 V1241 | F1126-M1208 HydrophobicContact CD2-CE 3.76Å; F1126-M1208 HydrophobicContact CE2-CE 3.31Å; F1126-M1208 HydrophobicContact CZ-CE 3.78Å; F1129-M1208 HydrophobicContact CB-CE 4.5Å; F1129-M1208 HydrophobicContact CB-CG 3.43Å; F1129-M1208 VanDerWaalsContact CB-CG 3.45Å; F1129-M1208 HydrophobicContact CB-SD 3.76Å; F1129-M1208 HydrophobicContact CD2-CB 4.48Å; F1129-M1208 HydrophobicContact CD2-CG 3.64Å; F1129-M1208 HydrophobicContact CG-CG 3.94Å; M1130-M1208 HydrophobicContact CG-CE 3.85Å; M1130-M1208 HydrophobicContact SD-CE 3.52Å; M1130-M1208 VanDerWaalsContact SD-CE 3.56Å; M1130-M1208 WeakPolarHBondContact SD-CE 3.39Å; M1130-M1208 HydrophobicContact SD-SD 4.2Å; L1133-M1208 HydrophobicContact CD1-SD 3.6Å; L1133-M1208 WeakPolarHBondContact CD1-SD 3.45Å; L1133-M1208 HydrophobicContact CG-SD 4.41Å; T1204-M1208 HydrophobicContact CG2-SD 4.41Å; T1204-M1208 WeakPolarHBondContact O-CG 3.26Å; T1204-M1208 PolarHBondContact O-N 3.22Å; I1205-M1208 PolarHBondContact O-N 3.05Å; M1208-L1211 PolarHBondContact O-N 3.11Å; M1208-L1212 WeakPolarHBondContact O-CB 3.27Å; M1208-L1212 PolarHBondContact O-N 3.14Å; M1208-V1241 HydrophobicContact CB-CG1 4.1Å; M1208-V1241 HydrophobicContact CB-CG2 3.73Å; M1208-V1241 HydrophobicContact CE-CG2 4.42Å; M1208-V1241 HydrophobicContact SD-CG2 4.28Å |
| 1209 | S | 86.5 | Confident | 84.8 | Confident | 0 Ų | 0 | 24 Ų | 24 | 0% | 0 | 13% | 0.127 | C | C | . | . | H | α-helix | trans | -60.2 | -50.3 | 175.6 | 147.8 | 0 | 0 | 0 | 0 | 110.7 | I1205 Q1206 L1211 L1212 A1213 K1244 V1245 E1248 | I1205-S1209 WeakPolarHBondContact O-CB 3.43Å; I1205-S1209 PolarHBondContact O-N 3.14Å; I1205-S1209 PolarHBondContact O-OG 3.29Å; Q1206-S1209 PolarHBondContact O-N 3.29Å; Q1206-S1209 PolarHBondContact O-OG 3.19Å; Q1206-S1209 VanDerWaalsContact O-OG 3.05Å; S1209-L1211 VanDerWaalsContact C-N 3.28Å; S1209-L1211 PolarHBondContact O-N 3.23Å; S1209-L1212 PolarHBondContact O-N 3.02Å; S1209-A1213 VanDerWaalsContact O-CB 3.23Å; S1209-A1213 WeakPolarHBondContact O-CB 3.32Å; S1209-A1213 PolarHBondContact O-N 3.22Å; S1209-K1244 VanDerWaalsContact OG-CB 3.26Å; S1209-K1244 WeakPolarHBondContact OG-CB 3.41Å; S1209-V1245 WeakPolarHBondContact O-CG2 3.37Å; S1209-E1248 PolarHBondContact OG-OE1 3.49Å; S1209-E1248 PolarHBondContact OG-OE2 3.21Å; S1209-E1248 VanDerWaalsContact OG-OE2 3.05Å |
| 1210 | G | 86.1 | Confident | 84.3 | Confident | 3.2 Ų | 3.2 | 18.7 Ų | 18.7 | 3% | 0.033 | 11% | 0.108 | C | C | . | . | H | α-helix | trans | -59.8 | -38.8 | 177.2 | 0 | 0 | 0 | 0 | 0 | 113 | Q1206 A1207 A1214 | Q1206-G1210 PolarHBondContact O-N 3.21Å; A1207-G1210 PolarHBondContact O-N 3.15Å; G1210-A1214 VanDerWaalsContact O-CB 3.29Å; G1210-A1214 WeakPolarHBondContact O-CB 3.23Å; G1210-A1214 PolarHBondContact O-N 3.01Å; G1210-A1214 VanDerWaalsContact O-N 3.11Å |
| 1211 | L | 89.7 | Confident | 83.7 | Confident | 1.2 Ų | 1.2 | 22.5 Ų | 22.5 | 1% | 0.006 | 13% | 0.126 | C | C | . | . | H | α-helix | trans | -64.6 | -47.8 | 178.5 | -171.8 | 66.6 | 0 | 0 | 0 | 111.5 | V1097 L1102 F1122 F1125 F1126 F1129 A1207 M1208 S1209 N1215 | V1097-L1211 HydrophobicContact CB-CB 4.38Å; V1097-L1211 HydrophobicContact CG1-CB 3.83Å; V1097-L1211 HydrophobicContact CG1-CD1 3.77Å; V1097-L1211 HydrophobicContact CG1-CG 4.24Å; V1097-L1211 VanDerWaalsContact CG1-N 3.26Å; L1102-L1211 HydrophobicContact CD1-CD1 4.05Å; L1102-L1211 HydrophobicContact CD2-CD1 4.17Å; L1102-L1211 HydrophobicContact CG-CD1 4.32Å; F1122-L1211 HydrophobicContact CD2-CD1 4.46Å; F1122-L1211 HydrophobicContact CD2-CD2 4.15Å; F1122-L1211 HydrophobicContact CD2-CG 3.93Å; F1122-L1211 HydrophobicContact CE2-CB 4.5Å; F1122-L1211 HydrophobicContact CE2-CD2 4Å; F1122-L1211 HydrophobicContact CE2-CG 3.72Å; F1122-L1211 HydrophobicContact CZ-CD2 4.38Å; F1122-L1211 HydrophobicContact CZ-CG 4.48Å; F1125-L1211 HydrophobicContact CB-CD2 3.83Å; F1126-L1211 HydrophobicContact CB-CD2 4.48Å; F1129-L1211 HydrophobicContact CD2-CD2 4.3Å; F1129-L1211 HydrophobicContact CE2-CB 4.45Å; F1129-L1211 HydrophobicContact CE2-CD2 4Å; A1207-L1211 VanDerWaalsContact O-CB 3.31Å; A1207-L1211 WeakPolarHBondContact O-CB 3.24Å; A1207-L1211 PolarHBondContact O-N 3.28Å; M1208-L1211 PolarHBondContact O-N 3.11Å; S1209-L1211 VanDerWaalsContact C-N 3.28Å; S1209-L1211 PolarHBondContact O-N 3.23Å; L1211-N1215 WeakPolarHBondContact O-CB 3.34Å; L1211-N1215 PolarHBondContact O-N 3.07Å; L1211-N1215 PolarHBondContact O-ND2 3.15Å |
| 1212 | L | 86.2 | Confident | 83.2 | Confident | 1.4 Ų | 1.4 | 23 Ų | 23 | 1% | 0.007 | 13% | 0.131 | C | C | . | . | H | α-helix | trans | -70.8 | -42.5 | -178.5 | -175.6 | 62.1 | 0 | 0 | 0 | 111.3 | F1122 M1208 S1209 A1214 N1215 I1216 G1219 L1220 A1223 F1238 V1241 L1242 V1245 | F1122-L1212 HydrophobicContact CE2-CD1 4.4Å; F1122-L1212 HydrophobicContact CZ-CD1 3.96Å; M1208-L1212 WeakPolarHBondContact O-CB 3.27Å; M1208-L1212 PolarHBondContact O-N 3.14Å; S1209-L1212 PolarHBondContact O-N 3.02Å; L1212-A1214 VanDerWaalsContact C-N 3.33Å; L1212-A1214 PolarHBondContact O-N 3.27Å; L1212-N1215 CarbonylContact O-C 3.5Å; L1212-N1215 PolarHBondContact O-N 3.01Å; L1212-I1216 WeakPolarHBondContact O-CA 3.35Å; L1212-I1216 WeakPolarHBondContact O-CB 3.43Å; L1212-I1216 WeakPolarHBondContact O-CG1 3.26Å; L1212-I1216 PolarHBondContact O-N 3.04Å; L1212-I1216 VanDerWaalsContact O-N 3.15Å; L1212-G1219 VanDerWaalsContact CD1-C 3.45Å; L1212-L1220 HydrophobicContact CD1-CD2 4.49Å; L1212-A1223 HydrophobicContact CD1-CB 4.34Å; L1212-A1223 HydrophobicContact CD2-CB 4.43Å; L1212-F1238 HydrophobicContact CD2-CE2 4.47Å; L1212-V1241 HydrophobicContact CD2-CG1 4.16Å; L1212-L1242 HydrophobicContact CD2-CD2 4.06Å; L1212-V1245 HydrophobicContact CB-CG2 4.08Å; L1212-V1245 HydrophobicContact CD2-CG2 4.07Å; L1212-V1245 HydrophobicContact CG-CG2 4.19Å |
| 1213 | A | 80.6 | Confident | 82.9 | Confident | 20.4 Ų | 20.4 | 19.9 Ų | 19.9 | 17% | 0.169 | 11% | 0.109 | C | C | . | . | H | α-helix | trans | -61.7 | -41.4 | 178.5 | 0 | 0 | 0 | 0 | 0 | 112.3 | S1209 N1215 I1216 V1245 T1250 | S1209-A1213 VanDerWaalsContact O-CB 3.23Å; S1209-A1213 WeakPolarHBondContact O-CB 3.32Å; S1209-A1213 PolarHBondContact O-N 3.22Å; A1213-N1215 VanDerWaalsContact C-N 3.31Å; A1213-N1215 PolarHBondContact O-N 3.26Å; A1213-I1216 WeakPolarHBondContact O-CG1 3.44Å; A1213-V1245 HydrophobicContact CB-CG1 4.33Å; A1213-V1245 HydrophobicContact CB-CG2 4.23Å; A1213-T1250 VanDerWaalsContact CA-CG2 3.47Å; A1213-T1250 HydrophobicContact CB-CG2 3.91Å; A1213-T1250 VanDerWaalsContact O-CG2 3.32Å; A1213-T1250 WeakPolarHBondContact O-CG2 3.34Å |
| 1214 | A | 79.7 | Confident | 82.5 | Confident | 28 Ų | 28 | 21.9 Ų | 21.9 | 23% | 0.231 | 12% | 0.118 | C | C | . | . | H | α-helix | trans | -78.6 | -13.7 | -179.4 | 0 | 0 | 0 | 0 | 0 | 114.1 | L1100 G1210 L1212 | L1100-A1214 VanDerWaalsContact O-CB 3.27Å; L1100-A1214 WeakPolarHBondContact O-CB 3.36Å; G1210-A1214 VanDerWaalsContact O-CB 3.29Å; G1210-A1214 WeakPolarHBondContact O-CB 3.23Å; G1210-A1214 PolarHBondContact O-N 3.01Å; G1210-A1214 VanDerWaalsContact O-N 3.11Å; L1212-A1214 VanDerWaalsContact C-N 3.33Å; L1212-A1214 PolarHBondContact O-N 3.27Å |
| 1215 | N | 81.4 | Confident | 82.1 | Confident | 9 Ų | 9 | 24.2 Ų | 24.2 | 5% | 0.048 | 14% | 0.141 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -140 | 45.4 | -173.6 | -54.8 | -89.5 | 0 | 0 | 0 | 111.1 | L1100 L1102 F1122 L1211 L1212 A1213 D1217 I1218 G1219 | L1100-N1215 PolarHBondContact O-ND2 3.03Å; L1100-N1215 VanDerWaalsContact O-ND2 3.13Å; L1102-N1215 PolarHBondContact N-OD1 3.22Å; F1122-N1215 HydrophobicContact CD2-CB 4.2Å; F1122-N1215 HydrophobicContact CE2-CB 4.48Å; L1211-N1215 WeakPolarHBondContact O-CB 3.34Å; L1211-N1215 PolarHBondContact O-N 3.07Å; L1211-N1215 PolarHBondContact O-ND2 3.15Å; L1212-N1215 CarbonylContact O-C 3.5Å; L1212-N1215 PolarHBondContact O-N 3.01Å; A1213-N1215 VanDerWaalsContact C-N 3.31Å; A1213-N1215 PolarHBondContact O-N 3.26Å; N1215-D1217 VanDerWaalsContact C-N 3.32Å; N1215-D1217 VanDerWaalsContact C-OD1 3.29Å; N1215-D1217 PolarHBondContact O-N 3.11Å; N1215-I1218 PolarHBondContact O-N 3.22Å; N1215-G1219 VanDerWaalsContact O-CA 3.27Å; N1215-G1219 WeakPolarHBondContact O-CA 3.18Å; N1215-G1219 PolarHBondContact O-N 3.3Å |
| 1216 | I | 76.9 | Confident | 81.9 | Confident | 18.8 Ų | 18.8 | 25.4 Ų | 25.4 | 10% | 0.096 | 15% | 0.147 | C | C | . | . | H | α-helix | trans | -64 | -38.3 | -168.5 | -123 | 162.6 | 0 | 0 | 0 | 112.7 | L1212 A1213 I1218 G1219 L1220 V1245 T1250 F1252 L1255 A1890 | L1212-I1216 WeakPolarHBondContact O-CA 3.35Å; L1212-I1216 WeakPolarHBondContact O-CB 3.43Å; L1212-I1216 WeakPolarHBondContact O-CG1 3.26Å; L1212-I1216 PolarHBondContact O-N 3.04Å; L1212-I1216 VanDerWaalsContact O-N 3.15Å; A1213-I1216 WeakPolarHBondContact O-CG1 3.44Å; I1216-I1218 VanDerWaalsContact C-N 3.31Å; I1216-I1218 PolarHBondContact O-N 3.28Å; I1216-I1218 VanDerWaalsContact O-N 3.09Å; I1216-G1219 PolarHBondContact O-N 3.13Å; I1216-L1220 HydrophobicContact CD1-CD1 4.04Å; I1216-L1220 HydrophobicContact CG1-CD1 3.72Å; I1216-L1220 VanDerWaalsContact CG1-CD1 3.5Å; I1216-L1220 HydrophobicContact CG1-CG 3.76Å; I1216-L1220 HydrophobicContact CG2-CD1 3.51Å; I1216-L1220 VanDerWaalsContact CG2-CD1 3.47Å; I1216-L1220 HydrophobicContact CG2-CG 3.83Å; I1216-L1220 WeakPolarHBondContact O-CB 3.36Å; I1216-L1220 WeakPolarHBondContact O-CG 3.33Å; I1216-L1220 PolarHBondContact O-N 3.06Å; I1216-L1220 VanDerWaalsContact O-N 3.09Å; I1216-V1245 HydrophobicContact CD1-CG1 3.86Å; I1216-V1245 VanDerWaalsContact CD1-CG1 3.49Å; I1216-V1245 HydrophobicContact CG1-CG1 4.49Å; I1216-T1250 HydrophobicContact CB-CG2 4.36Å; I1216-T1250 HydrophobicContact CD1-CG2 3.53Å; I1216-T1250 HydrophobicContact CG1-CG2 3.85Å; I1216-T1250 HydrophobicContact CG2-CG2 4.45Å; I1216-F1252 HydrophobicContact CD1-CD1 4.48Å; I1216-F1252 HydrophobicContact CD1-CD2 4.49Å; I1216-F1252 HydrophobicContact CD1-CE1 4.33Å; I1216-F1252 HydrophobicContact CD1-CE2 3.64Å; I1216-F1252 HydrophobicContact CD1-CZ 3.91Å; I1216-F1252 HydrophobicContact CG2-CD1 3.73Å; I1216-F1252 HydrophobicContact CG2-CE1 3.75Å; I1216-L1255 HydrophobicContact CG2-CD1 4.31Å; I1216-L1255 HydrophobicContact CG2-CD2 4.36Å; I1216-A1890 HydrophobicContact CD1-CB 3.71Å; I1216-A1890 HydrophobicContact CG1-CB 4.38Å |
| 1217 | D | 69.9 | Low | 81.7 | Confident | 71.2 Ų | 71.2 | 22.5 Ų | 22.5 | 38% | 0.381 | 14% | 0.137 | S | C | . | . | H | α-helix | trans | -57.3 | -37.4 | -178.1 | 46.7 | -35.6 | 0 | 0 | 0 | 112.7 | N1215 K1887 I1888 | N1215-D1217 VanDerWaalsContact C-N 3.32Å; N1215-D1217 VanDerWaalsContact C-OD1 3.29Å; N1215-D1217 PolarHBondContact O-N 3.11Å; D1217-K1887 HydrophobicContact CB-CB 4.44Å; D1217-K1887 HydrophobicContact CB-CD 4.39Å; D1217-K1887 HydrophobicContact CB-CG 4.48Å; D1217-K1887 IonicContact OD2-NZ 3.6Å; D1217-I1888 PolarHBondContact O-N 2.96Å |
| 1218 | I | 76.3 | Confident | 81.5 | Confident | 20 Ų | 20 | 26.8 Ų | 26.8 | 10% | 0.103 | 15% | 0.153 | C | C | . | . | H | α-helix | trans | -97.1 | -39.2 | 178.6 | -61.4 | 171.2 | 0 | 0 | 0 | 110.2 | K1118 S1119 F1122 N1215 I1216 L1220 M1221 H1222 | K1118-I1218 HydrophobicContact CB-CD1 3.49Å; K1118-I1218 VanDerWaalsContact CB-CD1 3.48Å; K1118-I1218 HydrophobicContact CD-CD1 4.01Å; K1118-I1218 HydrophobicContact CG-CD1 4.4Å; S1119-I1218 VanDerWaalsContact CA-CG2 3.46Å; F1122-I1218 HydrophobicContact CB-CG2 4.15Å; F1122-I1218 HydrophobicContact CG-CG2 4.46Å; N1215-I1218 PolarHBondContact O-N 3.22Å; I1216-I1218 VanDerWaalsContact C-N 3.31Å; I1216-I1218 PolarHBondContact O-N 3.28Å; I1216-I1218 VanDerWaalsContact O-N 3.09Å; I1218-L1220 PolarHBondContact O-N 3.17Å; I1218-M1221 WeakPolarHBondContact O-CB 3.36Å; I1218-M1221 PolarHBondContact O-N 2.81Å; I1218-H1222 PolarHBondContact O-CD2 2.95Å; I1218-H1222 VanDerWaalsContact O-CD2 3.3Å; I1218-H1222 PolarHBondContact O-N 3.07Å |
| 1219 | G | 78.1 | Confident | 81.3 | Confident | 0 Ų | 0 | 30.3 Ų | 30.3 | 0% | 0 | 17% | 0.17 | C | C | . | . | H | α-helix | trans | -70.2 | -35.2 | -170.9 | 0 | 0 | 0 | 0 | 0 | 114 | F1122 L1212 N1215 I1216 M1221 H1222 A1223 | F1122-G1219 VanDerWaalsContact CE1-CA 3.43Å; L1212-G1219 VanDerWaalsContact CD1-C 3.45Å; N1215-G1219 VanDerWaalsContact O-CA 3.27Å; N1215-G1219 WeakPolarHBondContact O-CA 3.18Å; N1215-G1219 PolarHBondContact O-N 3.3Å; I1216-G1219 PolarHBondContact O-N 3.13Å; G1219-M1221 VanDerWaalsContact C-N 3.32Å; G1219-M1221 PolarHBondContact O-N 2.98Å; G1219-H1222 PolarHBondContact O-N 3.26Å; G1219-A1223 WeakPolarHBondContact O-CB 3.36Å; G1219-A1223 PolarHBondContact O-N 3.11Å; G1219-A1223 VanDerWaalsContact O-N 3.1Å |
| 1220 | L | 78.9 | Confident | 80.9 | Confident | 14 Ų | 14 | 40.3 Ų | 40.3 | 7% | 0.073 | 21% | 0.213 | C | C | . | . | H | α-helix | trans | -63.5 | -38.7 | 179.7 | -102.6 | 142.4 | 0 | 0 | 0 | 112.1 | L1212 I1216 I1218 H1222 A1223 I1224 L1242 F1252 L1255 I1888 A1890 V1893 | L1212-L1220 HydrophobicContact CD1-CD2 4.49Å; I1216-L1220 HydrophobicContact CD1-CD1 4.04Å; I1216-L1220 HydrophobicContact CG1-CD1 3.72Å; I1216-L1220 VanDerWaalsContact CG1-CD1 3.5Å; I1216-L1220 HydrophobicContact CG1-CG 3.76Å; I1216-L1220 HydrophobicContact CG2-CD1 3.51Å; I1216-L1220 VanDerWaalsContact CG2-CD1 3.47Å; I1216-L1220 HydrophobicContact CG2-CG 3.83Å; I1216-L1220 WeakPolarHBondContact O-CB 3.36Å; I1216-L1220 WeakPolarHBondContact O-CG 3.33Å; I1216-L1220 PolarHBondContact O-N 3.06Å; I1216-L1220 VanDerWaalsContact O-N 3.09Å; I1218-L1220 PolarHBondContact O-N 3.17Å; L1220-H1222 VanDerWaalsContact C-N 3.33Å; L1220-H1222 PolarHBondContact O-N 3.26Å; L1220-A1223 PolarHBondContact O-N 3.36Å; L1220-A1223 VanDerWaalsContact O-N 3.13Å; L1220-I1224 HydrophobicContact CB-CD1 4.39Å; L1220-I1224 HydrophobicContact CD2-CD1 3.9Å; L1220-I1224 HydrophobicContact CD2-CG1 4.26Å; L1220-I1224 HydrophobicContact CG-CD1 3.91Å; L1220-I1224 HydrophobicContact CG-CG1 4.07Å; L1220-I1224 WeakPolarHBondContact O-CB 3.39Å; L1220-I1224 VanDerWaalsContact O-CG1 3.27Å; L1220-I1224 WeakPolarHBondContact O-CG1 3.29Å; L1220-I1224 VanDerWaalsContact O-CG2 3.23Å; L1220-I1224 WeakPolarHBondContact O-CG2 3.35Å; L1220-I1224 PolarHBondContact O-N 3.29Å; L1220-L1242 HydrophobicContact CD1-CD2 4.25Å; L1220-L1242 HydrophobicContact CD2-CD2 4.38Å; L1220-F1252 HydrophobicContact CD1-CD1 4.17Å; L1220-F1252 HydrophobicContact CD1-CE1 4Å; L1220-L1255 HydrophobicContact CD1-CD1 3.79Å; L1220-L1255 HydrophobicContact CD1-CD2 4.47Å; L1220-I1888 HydrophobicContact CB-CG2 4.47Å; L1220-I1888 HydrophobicContact CD2-CG2 3.81Å; L1220-A1890 HydrophobicContact CD2-CB 4.26Å; L1220-V1893 HydrophobicContact CD2-CG2 3.45Å; L1220-V1893 VanDerWaalsContact CD2-CG2 3.45Å |
| 1221 | M | 76.1 | Confident | 80.6 | Confident | 86.8 Ų | 86.8 | 42.8 Ų | 42.8 | 43% | 0.428 | 23% | 0.226 | S | C | . | . | H | α-helix | trans | -56.6 | -44.1 | 177.6 | -142.9 | -164.2 | -65.5 | 0 | 0 | 112.1 | I1218 G1219 A1223 H1885 T1886 I1888 | I1218-M1221 WeakPolarHBondContact O-CB 3.36Å; I1218-M1221 PolarHBondContact O-N 2.81Å; G1219-M1221 VanDerWaalsContact C-N 3.32Å; G1219-M1221 PolarHBondContact O-N 2.98Å; M1221-A1223 VanDerWaalsContact C-N 3.32Å; M1221-H1885 HydrophobicContact CE-CB 3.68Å; M1221-H1885 HydrophobicContact SD-CB 3.96Å; M1221-H1885 PolarHBondContact SD-ND1 3.13Å; M1221-H1885 VanDerWaalsContact SD-ND1 3.42Å; M1221-T1886 WeakPolarHBondContact CE-O 3.26Å; M1221-I1888 HydrophobicContact CB-CD1 4.24Å; M1221-I1888 HydrophobicContact CE-CG1 4.44Å; M1221-I1888 HydrophobicContact CG-CD1 4.39Å |
| 1222 | H | 77.3 | Confident | 80.3 | Confident | 54.4 Ų | 54.4 | 45.6 Ų | 45.6 | 25% | 0.252 | 24% | 0.243 | S | C | . | . | H | α-helix | trans | -80.7 | -26.8 | -179 | -67.2 | -68.3 | 0 | 0 | 0 | 113.2 | S1119 F1122 Q1123 I1218 G1219 L1220 | S1119-H1222 PolarHBondContact OG-CE1 3.37Å; S1119-H1222 VanDerWaalsContact OG-CE1 3.31Å; S1119-H1222 PolarHBondContact OG-NE2 3.05Å; F1122-H1222 HydrophobicContact CD1-CB 4.18Å; F1122-H1222 HydrophobicContact CE1-CB 4.14Å; Q1123-H1222 VanDerWaalsContact OE1-CB 3.28Å; Q1123-H1222 PolarHBondContact OE1-ND1 3.38Å; I1218-H1222 PolarHBondContact O-CD2 2.95Å; I1218-H1222 VanDerWaalsContact O-CD2 3.3Å; I1218-H1222 PolarHBondContact O-N 3.07Å; G1219-H1222 PolarHBondContact O-N 3.26Å; L1220-H1222 VanDerWaalsContact C-N 3.33Å; L1220-H1222 PolarHBondContact O-N 3.26Å |
| 1223 | A | 81.1 | Confident | 79.7 | Confident | 0.2 Ų | 0.2 | 50 Ų | 50 | 0% | 0.002 | 26% | 0.259 | C | S | . | . | H | α-helix | trans | -97.1 | -29.8 | -169 | 0 | 0 | 0 | 0 | 0 | 113.7 | F1126 L1212 G1219 L1220 M1221 G1225 M1226 F1238 | F1126-A1223 HydrophobicContact CD2-CB 4.43Å; F1126-A1223 HydrophobicContact CE1-CB 4.44Å; F1126-A1223 HydrophobicContact CE2-CB 3.89Å; F1126-A1223 HydrophobicContact CZ-CB 3.82Å; L1212-A1223 HydrophobicContact CD1-CB 4.34Å; L1212-A1223 HydrophobicContact CD2-CB 4.43Å; G1219-A1223 WeakPolarHBondContact O-CB 3.36Å; G1219-A1223 PolarHBondContact O-N 3.11Å; G1219-A1223 VanDerWaalsContact O-N 3.1Å; L1220-A1223 PolarHBondContact O-N 3.36Å; L1220-A1223 VanDerWaalsContact O-N 3.13Å; M1221-A1223 VanDerWaalsContact C-N 3.32Å; A1223-G1225 VanDerWaalsContact C-N 3.27Å; A1223-G1225 PolarHBondContact O-N 3.29Å; A1223-G1225 VanDerWaalsContact O-N 3.14Å; A1223-M1226 VanDerWaalsContact O-CB 3.23Å; A1223-M1226 WeakPolarHBondContact O-CB 3.43Å; A1223-M1226 WeakPolarHBondContact O-CG 3.25Å; A1223-M1226 PolarHBondContact O-N 3.13Å; A1223-F1238 VanDerWaalsContact C-CZ 3.42Å; A1223-F1238 HydrophobicContact CB-CD2 4.46Å; A1223-F1238 HydrophobicContact CB-CE2 3.57Å; A1223-F1238 VanDerWaalsContact CB-CE2 3.46Å; A1223-F1238 HydrophobicContact CB-CZ 4.01Å; A1223-F1238 VanDerWaalsContact O-CE1 3.31Å; A1223-F1238 WeakPolarHBondContact O-CE1 3.33Å; A1223-F1238 WeakPolarHBondContact O-CE2 3.38Å; A1223-F1238 VanDerWaalsContact O-CZ 3.23Å; A1223-F1238 WeakPolarHBondContact O-CZ 3.39Å |
| 1224 | I | 81 | Confident | 79.6 | Confident | 52.2 Ų | 52.2 | 49.1 Ų | 49.1 | 27% | 0.268 | 25% | 0.252 | S | S | . | . | G | 310 helix | trans | -56.3 | -38.2 | -173.5 | -110.2 | 162.7 | 0 | 0 | 0 | 113.1 | L1220 M1226 G1227 I1888 V1893 T1896 M1900 | L1220-I1224 HydrophobicContact CB-CD1 4.39Å; L1220-I1224 HydrophobicContact CD2-CD1 3.9Å; L1220-I1224 HydrophobicContact CD2-CG1 4.26Å; L1220-I1224 HydrophobicContact CG-CD1 3.91Å; L1220-I1224 HydrophobicContact CG-CG1 4.07Å; L1220-I1224 WeakPolarHBondContact O-CB 3.39Å; L1220-I1224 VanDerWaalsContact O-CG1 3.27Å; L1220-I1224 WeakPolarHBondContact O-CG1 3.29Å; L1220-I1224 VanDerWaalsContact O-CG2 3.23Å; L1220-I1224 WeakPolarHBondContact O-CG2 3.35Å; L1220-I1224 PolarHBondContact O-N 3.29Å; I1224-M1226 PolarHBondContact O-N 3.09Å; I1224-M1226 VanDerWaalsContact O-N 3.15Å; I1224-G1227 PolarHBondContact O-N 3.33Å; I1224-G1227 VanDerWaalsContact O-N 3.12Å; I1224-I1888 HydrophobicContact CD1-CG2 4.48Å; I1224-V1893 HydrophobicContact CD1-CG2 4.41Å; I1224-T1896 HydrophobicContact CD1-CG2 4.45Å; I1224-T1896 HydrophobicContact CG2-CG2 3.89Å; I1224-M1900 HydrophobicContact CG2-CE 4.29Å; I1224-M1900 VanDerWaalsContact O-CE 3.26Å; I1224-M1900 WeakPolarHBondContact O-CE 3.42Å |
| 1225 | G | 81.6 | Confident | 79.9 | Confident | 48.4 Ų | 48.4 | 50.2 Ų | 50.2 | 50% | 0.499 | 25% | 0.251 | S | S | . | . | G | 310 helix | trans | -59.8 | -22.3 | 177.9 | 0 | 0 | 0 | 0 | 0 | 113.8 | A1223 G1227 Y1228 H1229 | A1223-G1225 VanDerWaalsContact C-N 3.27Å; A1223-G1225 PolarHBondContact O-N 3.29Å; A1223-G1225 VanDerWaalsContact O-N 3.14Å; G1225-G1227 PolarHBondContact O-N 3.18Å; G1225-Y1228 CarbonylContact O-C 3.57Å; G1225-Y1228 PolarHBondContact O-N 3.14Å; G1225-H1229 PolarHBondContact O-N 3.47Å |
| 1226 | M | 83.8 | Confident | 80.1 | Confident | 31.4 Ų | 31.4 | 51.5 Ų | 51.5 | 16% | 0.155 | 26% | 0.258 | C | S | . | . | G | 310 helix | trans | -67.1 | -22.1 | 177.5 | -101.1 | -19.9 | -17 | 0 | 0 | 113 | F1126 M1130 A1223 I1224 Y1228 H1229 A1234 R1235 F1238 | F1126-M1226 HydrophobicContact CE1-CE 4Å; F1126-M1226 HydrophobicContact CE1-CG 4.08Å; F1126-M1226 HydrophobicContact CZ-CG 4.15Å; M1130-M1226 HydrophobicContact CE-CE 3.7Å; M1130-M1226 VanDerWaalsContact CE-CE 3.45Å; M1130-M1226 HydrophobicContact CE-CG 4.2Å; M1130-M1226 HydrophobicContact CE-SD 3.78Å; M1130-M1226 HydrophobicContact CG-CE 4.4Å; M1130-M1226 HydrophobicContact SD-CE 4.21Å; A1223-M1226 VanDerWaalsContact O-CB 3.23Å; A1223-M1226 WeakPolarHBondContact O-CB 3.43Å; A1223-M1226 WeakPolarHBondContact O-CG 3.25Å; A1223-M1226 PolarHBondContact O-N 3.13Å; I1224-M1226 PolarHBondContact O-N 3.09Å; I1224-M1226 VanDerWaalsContact O-N 3.15Å; M1226-Y1228 PolarHBondContact O-N 3.27Å; M1226-Y1228 VanDerWaalsContact O-N 3.16Å; M1226-H1229 HydrophobicContact CE-CB 4.19Å; M1226-H1229 VanDerWaalsContact O-CB 3.27Å; M1226-H1229 WeakPolarHBondContact O-CB 3.29Å; M1226-H1229 PolarHBondContact O-N 3.18Å; M1226-H1229 HydrophobicContact SD-CB 3.75Å; M1226-H1229 VanDerWaalsContact SD-CD2 3.56Å; M1226-A1234 HydrophobicContact CE-CB 3.95Å; M1226-A1234 HydrophobicContact SD-CB 3.91Å; M1226-R1235 WeakPolarHBondContact O-CG 3.31Å; M1226-F1238 HydrophobicContact CB-CB 4.01Å; M1226-F1238 HydrophobicContact CB-CD1 3.85Å; M1226-F1238 HydrophobicContact CB-CD2 3.91Å; M1226-F1238 HydrophobicContact CB-CE1 4.1Å; M1226-F1238 HydrophobicContact CB-CE2 4.42Å; M1226-F1238 HydrophobicContact CB-CG 3.62Å; M1226-F1238 HydrophobicContact CB-CZ 4.42Å; M1226-F1238 HydrophobicContact CG-CB 3.69Å; M1226-F1238 HydrophobicContact CG-CD2 4.31Å; M1226-F1238 HydrophobicContact CG-CG 3.98Å |
| 1227 | G | 83.4 | Confident | 80.2 | Confident | 10.8 Ų | 10.8 | 50.8 Ų | 50.8 | 11% | 0.111 | 26% | 0.255 | C | S | . | . | G | 310 helix | trans | -63.3 | -19.9 | 173.2 | 0 | 0 | 0 | 0 | 0 | 114.1 | I1224 G1225 R1235 F1238 N1904 | I1224-G1227 PolarHBondContact O-N 3.33Å; I1224-G1227 VanDerWaalsContact O-N 3.12Å; G1225-G1227 PolarHBondContact O-N 3.18Å; G1227-R1235 VanDerWaalsContact O-CD 3.26Å; G1227-R1235 WeakPolarHBondContact O-CD 3.38Å; G1227-R1235 WeakPolarHBondContact O-CG 3.33Å; G1227-R1235 PolarHBondContact O-NE 3.27Å; G1227-R1235 VanDerWaalsContact O-NE 3.14Å; G1227-F1238 VanDerWaalsContact N-CD1 3.34Å; G1227-N1904 PolarHBondContact O-ND2 2.92Å |
| 1228 | Y | 86.9 | Confident | 81 | Confident | 89.8 Ų | 89.8 | 47.6 Ų | 47.6 | 35% | 0.352 | 24% | 0.238 | S | C | . | . | G | 310 helix | trans | -113.8 | 12.8 | 179.1 | -52.9 | -76.7 | 0 | 0 | 0 | 113.1 | G1225 M1226 N1899 L1903 E1972 | G1225-Y1228 CarbonylContact O-C 3.57Å; G1225-Y1228 PolarHBondContact O-N 3.14Å; M1226-Y1228 PolarHBondContact O-N 3.27Å; M1226-Y1228 VanDerWaalsContact O-N 3.16Å; Y1228-N1899 PolarHBondContact OH-ND2 3.38Å; Y1228-L1903 HydrophobicContact CD1-CD2 3.5Å; Y1228-L1903 VanDerWaalsContact CD1-CD2 3.48Å; Y1228-L1903 HydrophobicContact CE1-CD2 3.52Å; Y1228-E1972 WeakPolarHBondContact CE2-OE1 3.34Å; Y1228-E1972 WeakPolarHBondContact OH-CG 3.37Å; Y1228-E1972 PolarHBondContact OH-OE1 3.42Å |
| 1229 | H | 84.8 | Confident | 81.5 | Confident | 76 Ų | 76 | 48.1 Ų | 48.1 | 35% | 0.352 | 24% | 0.242 | S | C | . | . | trans | -59.5 | 143 | -176.8 | -168.6 | -94.6 | 0 | 0 | 0 | 112.3 | G1225 M1226 D1231 A1234 R1235 | G1225-H1229 PolarHBondContact O-N 3.47Å; M1226-H1229 HydrophobicContact CE-CB 4.19Å; M1226-H1229 VanDerWaalsContact O-CB 3.27Å; M1226-H1229 WeakPolarHBondContact O-CB 3.29Å; M1226-H1229 PolarHBondContact O-N 3.18Å; M1226-H1229 HydrophobicContact SD-CB 3.75Å; M1226-H1229 VanDerWaalsContact SD-CD2 3.56Å; H1229-D1231 VanDerWaalsContact C-N 3.26Å; H1229-D1231 WeakPolarHBondContact ND1-CB 3.3Å; H1229-D1231 PolarHBondContact ND1-N 3Å; H1229-D1231 VanDerWaalsContact ND1-N 3.13Å; H1229-D1231 PolarHBondContact O-N 3.32Å; H1229-A1234 HydrophobicContact CB-CB 4.35Å; H1229-A1234 WeakPolarHBondContact ND1-CB 3.43Å; H1229-R1235 HydrophobicContact CB-CG 4.08Å; H1229-R1235 WeakPolarHBondContact O-CD 3.41Å; H1229-R1235 VanDerWaalsContact O-CG 3.23Å; H1229-R1235 WeakPolarHBondContact O-CG 3.4Å; H1229-R1235 PolarHBondContact O-NE 3.11Å | ||
| 1230 | K | 79.9 | Confident | 81.9 | Confident | 208.2 Ų | 208.2 | 51.2 Ų | 51.2 | 91% | 0.905 | 26% | 0.257 | S | S | * | . | S | Bend | trans | -60.8 | -34.9 | -177.8 | -67.7 | -176.3 | -179.6 | 179 | 0 | 112.6 | T1232 | K1230-T1232 PolarHBondContact O-N 3.27Š|
| 1231 | D | 78.9 | Confident | 82.2 | Confident | 56 Ų | 56 | 50.6 Ų | 50.6 | 30% | 0.299 | 25% | 0.253 | S | S | . | . | S | Bend | trans | -77.5 | 112.7 | 172.1 | -175 | 1.3 | 0 | 0 | 0 | 110.6 | H1229 R1233 A1234 R1235 | H1229-D1231 VanDerWaalsContact C-N 3.26Å; H1229-D1231 WeakPolarHBondContact ND1-CB 3.3Å; H1229-D1231 PolarHBondContact ND1-N 3Å; H1229-D1231 VanDerWaalsContact ND1-N 3.13Å; H1229-D1231 PolarHBondContact O-N 3.32Å; D1231-R1233 PolarHBondContact O-N 3.05Å; D1231-R1233 VanDerWaalsContact O-N 3.14Å; D1231-R1233 WeakPolarHBondContact OD1-CB 3.35Å; D1231-R1233 WeakPolarHBondContact OD1-CD 3.43Å; D1231-R1233 WeakPolarHBondContact OD1-CG 3.29Å; D1231-R1233 PolarHBondContact OD1-N 3.03Å; D1231-A1234 HydrophobicContact CB-CB 4.18Å; D1231-A1234 WeakPolarHBondContact O-CB 3.16Å; D1231-A1234 PolarHBondContact O-N 3.19Å; D1231-R1235 PolarHBondContact O-N 3.01Å; D1231-R1235 VanDerWaalsContact O-N 3.16Å |
| 1232 | T | 82.8 | Confident | 82.7 | Confident | 61.4 Ų | 61.4 | 47.6 Ų | 47.6 | 38% | 0.377 | 24% | 0.239 | S | C | . | . | H | α-helix | trans | -54.5 | -29.4 | 175.4 | -47.6 | 0 | 0 | 0 | 0 | 112.5 | K1230 R1235 V1236 D1909 L1912 | K1230-T1232 PolarHBondContact O-N 3.27Å; T1232-R1235 WeakPolarHBondContact O-CB 3.29Å; T1232-R1235 PolarHBondContact O-N 3.23Å; T1232-R1235 PolarHBondContact OG1-NH2 3.18Å; T1232-V1236 VanDerWaalsContact O-CG2 3.29Å; T1232-V1236 WeakPolarHBondContact O-CG2 3.41Å; T1232-V1236 PolarHBondContact O-N 3.15Å; T1232-D1909 HydrophobicContact CG2-CB 3.68Å; T1232-L1912 HydrophobicContact CG2-CB 4.2Å; T1232-L1912 HydrophobicContact CG2-CD2 3.47Å; T1232-L1912 VanDerWaalsContact CG2-CD2 3.47Å; T1232-L1912 HydrophobicContact CG2-CG 4.47Å |
| 1233 | R | 74.1 | Confident | 83.1 | Confident | 92 Ų | 92 | 46.4 Ų | 46.4 | 35% | 0.347 | 24% | 0.236 | S | C | . | . | H | α-helix | trans | -75.6 | -42.4 | -178.3 | -61.1 | 168.9 | -179.7 | -170.1 | -3.2 | 112.4 | T1137 N1141 D1231 R1235 V1236 A1237 | T1137-R1233 HydrophobicContact CG2-CB 4.19Å; T1137-R1233 PolarHBondContact O-NH1 3.13Å; T1137-R1233 WeakPolarHBondContact OG1-CD 3.31Å; N1141-R1233 PolarHBondContact ND2-NH1 2.99Å; N1141-R1233 VanDerWaalsContact ND2-NH1 3.19Å; N1141-R1233 PolarHBondContact ND2-NH2 3.23Å; N1141-R1233 PolarHBondContact OD1-NH1 3.49Å; N1141-R1233 PolarHBondContact OD1-NH2 3.1Å; N1141-R1233 VanDerWaalsContact OD1-NH2 3.1Å; D1231-R1233 PolarHBondContact O-N 3.05Å; D1231-R1233 VanDerWaalsContact O-N 3.14Å; D1231-R1233 WeakPolarHBondContact OD1-CB 3.35Å; D1231-R1233 WeakPolarHBondContact OD1-CD 3.43Å; D1231-R1233 WeakPolarHBondContact OD1-CG 3.29Å; D1231-R1233 PolarHBondContact OD1-N 3.03Å; R1233-R1235 PolarHBondContact O-N 3.28Å; R1233-V1236 WeakPolarHBondContact O-CB 3.16Å; R1233-V1236 PolarHBondContact O-N 3.06Å; R1233-V1236 VanDerWaalsContact O-N 3.15Å; R1233-A1237 WeakPolarHBondContact O-CB 3.26Å; R1233-A1237 PolarHBondContact O-N 3.25Å |
| 1234 | A | 77.9 | Confident | 83.1 | Confident | 1.8 Ų | 1.8 | 48.9 Ų | 48.9 | 2% | 0.015 | 25% | 0.246 | C | C | . | . | H | α-helix | trans | -58.2 | -38.9 | 171 | 0 | 0 | 0 | 0 | 0 | 110.6 | M1130 M1226 H1229 D1231 A1237 F1238 | M1130-A1234 HydrophobicContact CE-CB 3.94Å; M1226-A1234 HydrophobicContact CE-CB 3.95Å; M1226-A1234 HydrophobicContact SD-CB 3.91Å; H1229-A1234 HydrophobicContact CB-CB 4.35Å; H1229-A1234 WeakPolarHBondContact ND1-CB 3.43Å; D1231-A1234 HydrophobicContact CB-CB 4.18Å; D1231-A1234 WeakPolarHBondContact O-CB 3.16Å; D1231-A1234 PolarHBondContact O-N 3.19Å; A1234-A1237 PolarHBondContact O-N 3.12Å; A1234-F1238 VanDerWaalsContact O-CB 3.3Å; A1234-F1238 WeakPolarHBondContact O-CB 3.35Å; A1234-F1238 PolarHBondContact O-N 3.2Å |
| 1235 | R | 86.6 | Confident | 83.1 | Confident | 52.8 Ų | 52.8 | 46.5 Ų | 46.5 | 20% | 0.199 | 23% | 0.234 | C | C | . | . | H | α-helix | trans | -61.6 | -48.1 | 172.6 | -69 | 177.9 | 19.6 | 171.4 | 5.8 | 112.3 | M1226 G1227 H1229 D1231 T1232 R1233 A1237 F1238 V1239 N1904 L1912 | M1226-R1235 WeakPolarHBondContact O-CG 3.31Å; G1227-R1235 VanDerWaalsContact O-CD 3.26Å; G1227-R1235 WeakPolarHBondContact O-CD 3.38Å; G1227-R1235 WeakPolarHBondContact O-CG 3.33Å; G1227-R1235 PolarHBondContact O-NE 3.27Å; G1227-R1235 VanDerWaalsContact O-NE 3.14Å; H1229-R1235 HydrophobicContact CB-CG 4.08Å; H1229-R1235 WeakPolarHBondContact O-CD 3.41Å; H1229-R1235 VanDerWaalsContact O-CG 3.23Å; H1229-R1235 WeakPolarHBondContact O-CG 3.4Å; H1229-R1235 PolarHBondContact O-NE 3.11Å; D1231-R1235 PolarHBondContact O-N 3.01Å; D1231-R1235 VanDerWaalsContact O-N 3.16Å; T1232-R1235 WeakPolarHBondContact O-CB 3.29Å; T1232-R1235 PolarHBondContact O-N 3.23Å; T1232-R1235 PolarHBondContact OG1-NH2 3.18Å; R1233-R1235 PolarHBondContact O-N 3.28Å; R1235-A1237 VanDerWaalsContact C-N 3.33Å; R1235-A1237 PolarHBondContact O-N 3.09Å; R1235-F1238 PolarHBondContact O-N 3.1Å; R1235-V1239 WeakPolarHBondContact O-CB 3.32Å; R1235-V1239 VanDerWaalsContact O-CG2 3.24Å; R1235-V1239 WeakPolarHBondContact O-CG2 3.4Å; R1235-V1239 PolarHBondContact O-N 3.17Å; R1235-N1904 PolarHBondContact NE-OD1 3.27Å; R1235-N1904 VanDerWaalsContact NH2-CG 3.3Å; R1235-N1904 PolarHBondContact NH2-OD1 3.29Å; R1235-L1912 HydrophobicContact CB-CD1 4Å; R1235-L1912 HydrophobicContact CB-CD2 4.15Å |
| 1236 | V | 85.8 | Confident | 82.9 | Confident | 34.6 Ų | 34.6 | 46.4 Ų | 46.4 | 21% | 0.21 | 22% | 0.222 | C | C | . | . | H | α-helix | trans | -57.7 | -50 | 178.1 | 173.8 | 0 | 0 | 0 | 0 | 110.7 | T1232 R1233 F1238 V1239 E1240 S1911 L1912 A1915 | T1232-V1236 VanDerWaalsContact O-CG2 3.29Å; T1232-V1236 WeakPolarHBondContact O-CG2 3.41Å; T1232-V1236 PolarHBondContact O-N 3.15Å; R1233-V1236 WeakPolarHBondContact O-CB 3.16Å; R1233-V1236 PolarHBondContact O-N 3.06Å; R1233-V1236 VanDerWaalsContact O-N 3.15Å; V1236-F1238 VanDerWaalsContact C-N 3.32Å; V1236-F1238 PolarHBondContact O-N 3.22Å; V1236-V1239 PolarHBondContact O-N 3.27Å; V1236-E1240 HydrophobicContact CG1-CG 4.39Å; V1236-E1240 WeakPolarHBondContact O-CB 3.39Å; V1236-E1240 VanDerWaalsContact O-CG 3.31Å; V1236-E1240 WeakPolarHBondContact O-CG 3.24Å; V1236-E1240 PolarHBondContact O-N 3.15Å; V1236-S1911 WeakPolarHBondContact CG2-OG 3.35Å; V1236-L1912 HydrophobicContact CB-CD1 4.48Å; V1236-L1912 HydrophobicContact CG2-CB 3.65Å; V1236-L1912 HydrophobicContact CG2-CD1 3.91Å; V1236-L1912 HydrophobicContact CG2-CG 4.32Å; V1236-A1915 HydrophobicContact CG1-CB 4.35Å |
| 1237 | A | 80 | Confident | 82.6 | Confident | 4.6 Ų | 4.6 | 50.3 Ų | 50.3 | 4% | 0.038 | 24% | 0.24 | C | C | . | . | H | α-helix | trans | -62.5 | -42 | -179.1 | 0 | 0 | 0 | 0 | 0 | 111.9 | L1133 R1233 A1234 R1235 E1240 V1241 | L1133-A1237 HydrophobicContact CD1-CB 3.95Å; L1133-A1237 HydrophobicContact CD2-CB 3.86Å; L1133-A1237 HydrophobicContact CG-CB 4.07Å; R1233-A1237 WeakPolarHBondContact O-CB 3.26Å; R1233-A1237 PolarHBondContact O-N 3.25Å; A1234-A1237 PolarHBondContact O-N 3.12Å; R1235-A1237 VanDerWaalsContact C-N 3.33Å; R1235-A1237 PolarHBondContact O-N 3.09Å; A1237-E1240 WeakPolarHBondContact O-CB 3.28Å; A1237-E1240 PolarHBondContact O-N 3.33Å; A1237-V1241 VanDerWaalsContact O-CG2 3.29Å; A1237-V1241 WeakPolarHBondContact O-CG2 3.4Å; A1237-V1241 PolarHBondContact O-N 3.17Å |
| 1238 | F | 85.4 | Confident | 82 | Confident | 3.4 Ų | 3.4 | 54 Ų | 54 | 2% | 0.015 | 25% | 0.254 | C | S | . | . | H | α-helix | trans | -65.6 | -42.3 | 176.7 | 179.3 | -111.1 | 0 | 0 | 0 | 112.7 | F1126 L1212 A1223 M1226 G1227 A1234 R1235 V1236 E1240 V1241 L1242 M1900 | F1126-F1238 HydrophobicContact CZ-CD2 4.38Å; F1126-F1238 HydrophobicContact CZ-CE2 4.48Å; L1212-F1238 HydrophobicContact CD2-CE2 4.47Å; A1223-F1238 VanDerWaalsContact C-CZ 3.42Å; A1223-F1238 HydrophobicContact CB-CD2 4.46Å; A1223-F1238 HydrophobicContact CB-CE2 3.57Å; A1223-F1238 VanDerWaalsContact CB-CE2 3.46Å; A1223-F1238 HydrophobicContact CB-CZ 4.01Å; A1223-F1238 VanDerWaalsContact O-CE1 3.31Å; A1223-F1238 WeakPolarHBondContact O-CE1 3.33Å; A1223-F1238 WeakPolarHBondContact O-CE2 3.38Å; A1223-F1238 VanDerWaalsContact O-CZ 3.23Å; A1223-F1238 WeakPolarHBondContact O-CZ 3.39Å; M1226-F1238 HydrophobicContact CB-CB 4.01Å; M1226-F1238 HydrophobicContact CB-CD1 3.85Å; M1226-F1238 HydrophobicContact CB-CD2 3.91Å; M1226-F1238 HydrophobicContact CB-CE1 4.1Å; M1226-F1238 HydrophobicContact CB-CE2 4.42Å; M1226-F1238 HydrophobicContact CB-CG 3.62Å; M1226-F1238 HydrophobicContact CB-CZ 4.42Å; M1226-F1238 HydrophobicContact CG-CB 3.69Å; M1226-F1238 HydrophobicContact CG-CD2 4.31Å; M1226-F1238 HydrophobicContact CG-CG 3.98Å; G1227-F1238 VanDerWaalsContact N-CD1 3.34Å; A1234-F1238 VanDerWaalsContact O-CB 3.3Å; A1234-F1238 WeakPolarHBondContact O-CB 3.35Å; A1234-F1238 PolarHBondContact O-N 3.2Å; R1235-F1238 PolarHBondContact O-N 3.1Å; V1236-F1238 VanDerWaalsContact C-N 3.32Å; V1236-F1238 PolarHBondContact O-N 3.22Å; F1238-E1240 VanDerWaalsContact C-N 3.3Å; F1238-E1240 PolarHBondContact O-N 3.1Å; F1238-V1241 WeakPolarHBondContact O-CB 3.31Å; F1238-V1241 PolarHBondContact O-N 3.1Å; F1238-L1242 HydrophobicContact CD1-CD1 4.01Å; F1238-L1242 HydrophobicContact CE1-CD1 3.29Å; F1238-L1242 HydrophobicContact CE1-CG 4.01Å; F1238-L1242 HydrophobicContact CE2-CD1 4.21Å; F1238-L1242 HydrophobicContact CE2-CD2 4.45Å; F1238-L1242 HydrophobicContact CE2-CG 4.01Å; F1238-L1242 HydrophobicContact CZ-CD1 3.75Å; F1238-L1242 VanDerWaalsContact CZ-CD1 3.46Å; F1238-L1242 HydrophobicContact CZ-CD2 4.14Å; F1238-L1242 HydrophobicContact CZ-CG 3.66Å; F1238-L1242 WeakPolarHBondContact O-CB 3.4Å; F1238-L1242 PolarHBondContact O-N 3.11Å; F1238-M1900 HydrophobicContact CD1-SD 4.25Å; F1238-M1900 HydrophobicContact CE1-CE 3.99Å; F1238-M1900 HydrophobicContact CE1-SD 3.82Å |
| 1239 | V | 88.1 | Confident | 80.8 | Confident | 31.8 Ų | 31.8 | 51.9 Ų | 51.9 | 19% | 0.193 | 26% | 0.261 | C | S | . | . | H | α-helix | trans | -62.6 | -39.5 | 175.4 | 170.6 | 0 | 0 | 0 | 0 | 110.8 | R1235 V1236 V1241 L1242 T1243 L1912 A1915 L1919 | R1235-V1239 WeakPolarHBondContact O-CB 3.32Å; R1235-V1239 VanDerWaalsContact O-CG2 3.24Å; R1235-V1239 WeakPolarHBondContact O-CG2 3.4Å; R1235-V1239 PolarHBondContact O-N 3.17Å; V1236-V1239 PolarHBondContact O-N 3.27Å; V1239-V1241 VanDerWaalsContact C-N 3.34Å; V1239-V1241 PolarHBondContact O-N 3.18Å; V1239-L1242 PolarHBondContact O-N 3.34Å; V1239-T1243 VanDerWaalsContact O-CB 3.32Å; V1239-T1243 WeakPolarHBondContact O-CB 3.36Å; V1239-T1243 PolarHBondContact O-N 3.15Å; V1239-T1243 PolarHBondContact O-OG1 3.11Å; V1239-L1912 HydrophobicContact CG2-CD1 4.35Å; V1239-A1915 HydrophobicContact CB-CB 4.26Å; V1239-A1915 VanDerWaalsContact CG1-C 3.42Å; V1239-A1915 HydrophobicContact CG1-CB 3.76Å; V1239-A1915 WeakPolarHBondContact CG1-O 3.22Å; V1239-L1919 HydrophobicContact CG1-CB 3.86Å; V1239-L1919 HydrophobicContact CG1-CD2 3.95Å; V1239-L1919 HydrophobicContact CG1-CG 4.49Å |
| 1240 | E | 86.3 | Confident | 79.7 | Confident | 65.4 Ų | 65.4 | 49.5 Ų | 49.5 | 31% | 0.306 | 25% | 0.251 | S | S | . | . | H | α-helix | trans | -63.1 | -41.9 | 173.9 | -108.2 | 177 | 157.9 | 0 | 0 | 111.9 | R1201 I1205 V1236 A1237 F1238 T1243 K1244 A1915 | R1201-E1240 IonicContact CZ-OE2 3.44Å; R1201-E1240 VanDerWaalsContact CZ-OE2 3.26Å; R1201-E1240 IonicContact NE-OE2 3.1Å; R1201-E1240 IonicContact NH1-OE1 3.02Å; R1201-E1240 PolarHBondContact NH1-OE1 3Å; R1201-E1240 VanDerWaalsContact NH1-OE1 3.1Å; R1201-E1240 IonicContact NH1-OE2 2.64Å; R1201-E1240 PolarHBondContact NH1-OE2 3.12Å; R1201-E1240 IonicContact NH2-OE1 3.56Å; R1201-E1240 IonicContact NH2-OE2 3.34Å; R1201-E1240 PolarHBondContact NH2-OE2 3.2Å; R1201-E1240 VanDerWaalsContact NH2-OE2 3.09Å; I1205-E1240 VanDerWaalsContact CD1-CD 3.41Å; I1205-E1240 HydrophobicContact CD1-CG 4.15Å; I1205-E1240 VanDerWaalsContact CD1-OE1 3.25Å; I1205-E1240 WeakPolarHBondContact CD1-OE1 3.46Å; I1205-E1240 VanDerWaalsContact CD1-OE2 3.24Å; I1205-E1240 WeakPolarHBondContact CD1-OE2 3.37Å; I1205-E1240 HydrophobicContact CG2-CB 4.48Å; I1205-E1240 HydrophobicContact CG2-CG 4.22Å; V1236-E1240 HydrophobicContact CG1-CG 4.39Å; V1236-E1240 WeakPolarHBondContact O-CB 3.39Å; V1236-E1240 VanDerWaalsContact O-CG 3.31Å; V1236-E1240 WeakPolarHBondContact O-CG 3.24Å; V1236-E1240 PolarHBondContact O-N 3.15Å; A1237-E1240 WeakPolarHBondContact O-CB 3.28Å; A1237-E1240 PolarHBondContact O-N 3.33Å; F1238-E1240 VanDerWaalsContact C-N 3.3Å; F1238-E1240 PolarHBondContact O-N 3.1Å; E1240-T1243 PolarHBondContact O-N 3.17Å; E1240-K1244 PolarHBondContact O-N 3.07Å; E1240-K1244 VanDerWaalsContact O-N 3.1Å; E1240-A1915 HydrophobicContact CG-CB 4.06Å |
| 1241 | V | 85.2 | Confident | 78.5 | Confident | 0.2 Ų | 0.2 | 45.7 Ų | 45.7 | 0% | 0.001 | 24% | 0.237 | C | C | . | . | H | α-helix | trans | -61.4 | -50.1 | 174 | 169.1 | 0 | 0 | 0 | 0 | 110.9 | I1205 M1208 L1212 A1237 F1238 V1239 T1243 K1244 V1245 | I1205-V1241 HydrophobicContact CB-CG2 4.45Å; I1205-V1241 HydrophobicContact CG1-CG2 4.45Å; I1205-V1241 HydrophobicContact CG2-CG2 3.94Å; M1208-V1241 HydrophobicContact CB-CG1 4.1Å; M1208-V1241 HydrophobicContact CB-CG2 3.73Å; M1208-V1241 HydrophobicContact CE-CG2 4.42Å; M1208-V1241 HydrophobicContact SD-CG2 4.28Å; L1212-V1241 HydrophobicContact CD2-CG1 4.16Å; A1237-V1241 VanDerWaalsContact O-CG2 3.29Å; A1237-V1241 WeakPolarHBondContact O-CG2 3.4Å; A1237-V1241 PolarHBondContact O-N 3.17Å; F1238-V1241 WeakPolarHBondContact O-CB 3.31Å; F1238-V1241 PolarHBondContact O-N 3.1Å; V1239-V1241 VanDerWaalsContact C-N 3.34Å; V1239-V1241 PolarHBondContact O-N 3.18Å; V1241-T1243 VanDerWaalsContact C-N 3.29Å; V1241-T1243 PolarHBondContact O-N 3.22Å; V1241-K1244 WeakPolarHBondContact O-CB 3.37Å; V1241-K1244 PolarHBondContact O-N 3.23Å; V1241-K1244 VanDerWaalsContact O-N 3.14Å; V1241-V1245 HydrophobicContact CG1-CG2 4.43Å; V1241-V1245 WeakPolarHBondContact O-CG2 3.36Å; V1241-V1245 PolarHBondContact O-N 3.04Å |
| 1242 | L | 84.9 | Confident | 77.3 | Confident | 24 Ų | 24 | 45.4 Ų | 45.4 | 13% | 0.126 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -60.5 | -40.2 | 178.3 | -113.7 | 140.1 | 0 | 0 | 0 | 112 | L1212 L1220 F1238 V1239 K1244 V1245 L1246 L1897 M1900 L1919 | L1212-L1242 HydrophobicContact CD2-CD2 4.06Å; L1220-L1242 HydrophobicContact CD1-CD2 4.25Å; L1220-L1242 HydrophobicContact CD2-CD2 4.38Å; F1238-L1242 HydrophobicContact CD1-CD1 4.01Å; F1238-L1242 HydrophobicContact CE1-CD1 3.29Å; F1238-L1242 HydrophobicContact CE1-CG 4.01Å; F1238-L1242 HydrophobicContact CE2-CD1 4.21Å; F1238-L1242 HydrophobicContact CE2-CD2 4.45Å; F1238-L1242 HydrophobicContact CE2-CG 4.01Å; F1238-L1242 HydrophobicContact CZ-CD1 3.75Å; F1238-L1242 VanDerWaalsContact CZ-CD1 3.46Å; F1238-L1242 HydrophobicContact CZ-CD2 4.14Å; F1238-L1242 HydrophobicContact CZ-CG 3.66Å; F1238-L1242 WeakPolarHBondContact O-CB 3.4Å; F1238-L1242 PolarHBondContact O-N 3.11Å; V1239-L1242 PolarHBondContact O-N 3.34Å; L1242-K1244 VanDerWaalsContact C-N 3.32Å; L1242-K1244 PolarHBondContact O-N 3.23Å; L1242-V1245 PolarHBondContact O-N 3.25Å; L1242-L1246 HydrophobicContact CG-CD1 4.42Å; L1242-L1246 WeakPolarHBondContact O-CG 3.32Å; L1242-L1246 PolarHBondContact O-N 3.23Å; L1242-L1897 HydrophobicContact CD1-CD2 4Å; L1242-L1897 HydrophobicContact CD2-CD2 4.4Å; L1242-M1900 HydrophobicContact CD1-CE 4.42Å; L1242-M1900 HydrophobicContact CD1-SD 3.7Å; L1242-L1919 HydrophobicContact CB-CD1 4.1Å |
| 1243 | T | 85.7 | Confident | 75.7 | Confident | 29 Ų | 29 | 48.4 Ų | 48.4 | 18% | 0.178 | 24% | 0.242 | C | C | . | . | H | α-helix | trans | -60 | -45.2 | 176.5 | -56.8 | 0 | 0 | 0 | 0 | 110.5 | V1239 E1240 V1241 V1245 L1246 Q1247 N1918 L1919 A1922 | V1239-T1243 VanDerWaalsContact O-CB 3.32Å; V1239-T1243 WeakPolarHBondContact O-CB 3.36Å; V1239-T1243 PolarHBondContact O-N 3.15Å; V1239-T1243 PolarHBondContact O-OG1 3.11Å; E1240-T1243 PolarHBondContact O-N 3.17Å; V1241-T1243 VanDerWaalsContact C-N 3.29Å; V1241-T1243 PolarHBondContact O-N 3.22Å; T1243-V1245 PolarHBondContact O-N 3.01Å; T1243-L1246 PolarHBondContact O-N 3.19Å; T1243-Q1247 HydrophobicContact CG2-CG 4.49Å; T1243-Q1247 WeakPolarHBondContact O-CB 3.4Å; T1243-Q1247 VanDerWaalsContact O-CG 3.27Å; T1243-Q1247 WeakPolarHBondContact O-CG 3.33Å; T1243-Q1247 PolarHBondContact O-N 3.11Å; T1243-N1918 HydrophobicContact CG2-CB 4.07Å; T1243-L1919 WeakPolarHBondContact OG1-CA 3.46Å; T1243-L1919 WeakPolarHBondContact OG1-CB 3.42Å; T1243-L1919 PolarHBondContact OG1-N 3.49Å; T1243-A1922 HydrophobicContact CG2-CB 4.16Å |
| 1244 | K | 82.3 | Confident | 74.4 | Confident | 53 Ų | 53 | 47 Ų | 47 | 23% | 0.23 | 24% | 0.244 | C | C | . | . | H | α-helix | trans | -64 | -42.1 | 175.5 | -77.9 | -166.6 | 178.1 | -177.1 | 0 | 112.8 | I1205 S1209 E1240 V1241 L1242 L1246 Q1247 E1248 | I1205-K1244 HydrophobicContact CG2-CD 4.11Å; S1209-K1244 VanDerWaalsContact OG-CB 3.26Å; S1209-K1244 WeakPolarHBondContact OG-CB 3.41Å; E1240-K1244 PolarHBondContact O-N 3.07Å; E1240-K1244 VanDerWaalsContact O-N 3.1Å; V1241-K1244 WeakPolarHBondContact O-CB 3.37Å; V1241-K1244 PolarHBondContact O-N 3.23Å; V1241-K1244 VanDerWaalsContact O-N 3.14Å; L1242-K1244 VanDerWaalsContact C-N 3.32Å; L1242-K1244 PolarHBondContact O-N 3.23Å; K1244-L1246 VanDerWaalsContact C-N 3.3Å; K1244-L1246 PolarHBondContact O-N 3.29Å; K1244-Q1247 PolarHBondContact O-N 3.28Å; K1244-Q1247 VanDerWaalsContact O-N 3.11Å; K1244-E1248 VanDerWaalsContact O-CB 3.32Å; K1244-E1248 WeakPolarHBondContact O-CB 3.44Å; K1244-E1248 VanDerWaalsContact O-CG 3.3Å; K1244-E1248 WeakPolarHBondContact O-CG 3.38Å; K1244-E1248 PolarHBondContact O-N 3.12Å |
| 1245 | V | 80.6 | Confident | 72.8 | Confident | 2.4 Ų | 2.4 | 50.5 Ų | 50.5 | 2% | 0.015 | 26% | 0.262 | C | S | . | . | H | α-helix | trans | -60.2 | -40.4 | 177.6 | 171.1 | 0 | 0 | 0 | 0 | 111.5 | S1209 L1212 A1213 I1216 V1241 L1242 T1243 E1248 T1250 F1252 | S1209-V1245 WeakPolarHBondContact O-CG2 3.37Å; L1212-V1245 HydrophobicContact CB-CG2 4.08Å; L1212-V1245 HydrophobicContact CD2-CG2 4.07Å; L1212-V1245 HydrophobicContact CG-CG2 4.19Å; A1213-V1245 HydrophobicContact CB-CG1 4.33Å; A1213-V1245 HydrophobicContact CB-CG2 4.23Å; I1216-V1245 HydrophobicContact CD1-CG1 3.86Å; I1216-V1245 VanDerWaalsContact CD1-CG1 3.49Å; I1216-V1245 HydrophobicContact CG1-CG1 4.49Å; V1241-V1245 HydrophobicContact CG1-CG2 4.43Å; V1241-V1245 WeakPolarHBondContact O-CG2 3.36Å; V1241-V1245 PolarHBondContact O-N 3.04Å; L1242-V1245 PolarHBondContact O-N 3.25Å; T1243-V1245 PolarHBondContact O-N 3.01Å; V1245-E1248 PolarHBondContact O-N 3.22Å; V1245-T1250 HydrophobicContact CG1-CG2 4.06Å; V1245-T1250 WeakPolarHBondContact CG1-OG1 3.41Å; V1245-T1250 WeakPolarHBondContact O-CB 3.17Å; V1245-T1250 PolarHBondContact O-N 3.21Å; V1245-T1250 PolarHBondContact O-OG1 3.37Å; V1245-F1252 HydrophobicContact CG1-CZ 4.45Å |
| 1246 | L | 78.4 | Confident | 70.7 | Confident | 45.6 Ų | 45.6 | 53.9 Ų | 53.9 | 24% | 0.239 | 28% | 0.284 | C | S | . | . | H | α-helix | trans | -67.8 | -38.9 | 175.4 | -70.8 | 167 | 0 | 0 | 0 | 112.2 | L1242 T1243 K1244 E1248 G1249 F1252 L1919 A1922 L1923 T1926 F1927 | L1242-L1246 HydrophobicContact CG-CD1 4.42Å; L1242-L1246 WeakPolarHBondContact O-CG 3.32Å; L1242-L1246 PolarHBondContact O-N 3.23Å; T1243-L1246 PolarHBondContact O-N 3.19Å; K1244-L1246 VanDerWaalsContact C-N 3.3Å; K1244-L1246 PolarHBondContact O-N 3.29Å; L1246-E1248 VanDerWaalsContact C-N 3.32Å; L1246-E1248 PolarHBondContact O-N 2.83Å; L1246-G1249 PolarHBondContact O-N 3.11Å; L1246-F1252 HydrophobicContact CD2-CE1 4.45Å; L1246-F1252 HydrophobicContact CD2-CE2 3.75Å; L1246-F1252 HydrophobicContact CD2-CZ 4.03Å; L1246-L1919 HydrophobicContact CD1-CD1 3.58Å; L1246-A1922 HydrophobicContact CB-CB 4.1Å; L1246-A1922 HydrophobicContact CD1-CB 4.3Å; L1246-L1923 HydrophobicContact CD1-CD2 3.61Å; L1246-L1923 HydrophobicContact CD1-CG 3.99Å; L1246-L1923 HydrophobicContact CD2-CD2 4.35Å; L1246-T1926 HydrophobicContact CD2-CG2 4.15Å; L1246-F1927 HydrophobicContact CD2-CE2 4.44Å |
| 1247 | Q | 77.4 | Confident | 68.5 | Low | 114.4 Ų | 114.4 | 57.8 Ų | 57.8 | 54% | 0.535 | 30% | 0.3 | S | S | . | . | H | α-helix | trans | -69.9 | -34.5 | 177 | -74.1 | 172 | -8.4 | 0 | 0 | 113.4 | T1243 K1244 G1249 A1922 E1937 | T1243-Q1247 HydrophobicContact CG2-CG 4.49Å; T1243-Q1247 WeakPolarHBondContact O-CB 3.4Å; T1243-Q1247 VanDerWaalsContact O-CG 3.27Å; T1243-Q1247 WeakPolarHBondContact O-CG 3.33Å; T1243-Q1247 PolarHBondContact O-N 3.11Å; K1244-Q1247 PolarHBondContact O-N 3.28Å; K1244-Q1247 VanDerWaalsContact O-N 3.11Å; Q1247-G1249 PolarHBondContact O-N 2.91Å; Q1247-G1249 VanDerWaalsContact O-N 3.13Å; Q1247-A1922 HydrophobicContact CG-CB 4.44Å; Q1247-E1937 PolarHBondContact NE2-OE1 3.17Å; Q1247-E1937 PolarHBondContact NE2-OE2 3.19Å |
| 1248 | E | 70 | Confident | 67 | Low | 87.2 Ų | 87.2 | 61.7 Ų | 61.7 | 41% | 0.407 | 32% | 0.324 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -69.2 | -6.9 | 177.8 | -75.7 | 175.9 | 176.3 | 0 | 0 | 112.3 | Q1206 S1209 K1244 V1245 L1246 T1250 | Q1206-E1248 PolarHBondContact NE2-OE1 3.13Å; S1209-E1248 PolarHBondContact OG-OE1 3.49Å; S1209-E1248 PolarHBondContact OG-OE2 3.21Å; S1209-E1248 VanDerWaalsContact OG-OE2 3.05Å; K1244-E1248 VanDerWaalsContact O-CB 3.32Å; K1244-E1248 WeakPolarHBondContact O-CB 3.44Å; K1244-E1248 VanDerWaalsContact O-CG 3.3Å; K1244-E1248 WeakPolarHBondContact O-CG 3.38Å; K1244-E1248 PolarHBondContact O-N 3.12Å; V1245-E1248 PolarHBondContact O-N 3.22Å; L1246-E1248 VanDerWaalsContact C-N 3.32Å; L1246-E1248 PolarHBondContact O-N 2.83Å; E1248-T1250 VanDerWaalsContact C-N 3.31Å; E1248-T1250 PolarHBondContact O-N 3.34Å |
| 1249 | G | 62.4 | Low | 65.1 | Low | 47 Ų | 47 | 64.9 Ų | 64.9 | 49% | 0.485 | 34% | 0.344 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 69.8 | 44.9 | 174.5 | 0 | 0 | 0 | 0 | 0 | 112.2 | L1246 Q1247 E1251 | L1246-G1249 PolarHBondContact O-N 3.11Å; Q1247-G1249 PolarHBondContact O-N 2.91Å; Q1247-G1249 VanDerWaalsContact O-N 3.13Å; G1249-E1251 VanDerWaalsContact C-N 3.32Å; G1249-E1251 PolarHBondContact O-N 3.13Å |
| 1250 | T | 60.1 | Low | 63 | Low | 24.4 Ų | 24.4 | 68.5 Ų | 68.5 | 15% | 0.15 | 36% | 0.359 | C | S | . | . | trans | -58.1 | 119.5 | 175.5 | 14.2 | 0 | 0 | 0 | 0 | 110 | A1213 I1216 V1245 E1248 F1252 | A1213-T1250 VanDerWaalsContact CA-CG2 3.47Å; A1213-T1250 HydrophobicContact CB-CG2 3.91Å; A1213-T1250 VanDerWaalsContact O-CG2 3.32Å; A1213-T1250 WeakPolarHBondContact O-CG2 3.34Å; I1216-T1250 HydrophobicContact CB-CG2 4.36Å; I1216-T1250 HydrophobicContact CD1-CG2 3.53Å; I1216-T1250 HydrophobicContact CG1-CG2 3.85Å; I1216-T1250 HydrophobicContact CG2-CG2 4.45Å; V1245-T1250 HydrophobicContact CG1-CG2 4.06Å; V1245-T1250 WeakPolarHBondContact CG1-OG1 3.41Å; V1245-T1250 WeakPolarHBondContact O-CB 3.17Å; V1245-T1250 PolarHBondContact O-N 3.21Å; V1245-T1250 PolarHBondContact O-OG1 3.37Å; E1248-T1250 VanDerWaalsContact C-N 3.31Å; E1248-T1250 PolarHBondContact O-N 3.34Å; T1250-F1252 WeakPolarHBondContact O-CD2 3.25Å; T1250-F1252 WeakPolarHBondContact O-CE2 3.42Å; T1250-F1252 VanDerWaalsContact O-CG 3.27Å; T1250-F1252 WeakPolarHBondContact O-CG 3.41Å; T1250-F1252 PolarHBondContact O-N 3.15Å; T1250-F1252 WeakPolarHBondContact OG1-CD2 3.42Å; T1250-F1252 WeakPolarHBondContact OG1-CE2 3.38Å; T1250-F1252 WeakPolarHBondContact OG1-CZ 3.45Å | ||
| 1251 | E | 56.4 | Low | 61.4 | Low | 129.4 Ų | 129.4 | 67.3 Ų | 67.3 | 61% | 0.605 | 36% | 0.361 | S | S | * | . | trans | -52.7 | 77 | -175.8 | -63.2 | -175.4 | 158.4 | 0 | 0 | 113.6 | G1249 E1253 L1255 R1687 | G1249-E1251 VanDerWaalsContact C-N 3.32Å; G1249-E1251 PolarHBondContact O-N 3.13Å; E1251-E1253 PolarHBondContact O-N 3.31Å; E1251-L1255 HydrophobicContact CB-CD1 4.42Å; E1251-L1255 HydrophobicContact CG-CD1 3.93Å; E1251-R1687 IonicContact OE1-CZ 2.99Å; E1251-R1687 IonicContact OE1-NH1 3.79Å; E1251-R1687 PolarHBondContact OE1-NH1 3.22Å; E1251-R1687 VanDerWaalsContact OE1-NH1 3.15Å; E1251-R1687 IonicContact OE1-NH2 3.3Å; E1251-R1687 PolarHBondContact OE1-NH2 3Å; E1251-R1687 IonicContact OE2-CZ 2.9Å; E1251-R1687 IonicContact OE2-NH1 2.79Å; E1251-R1687 PolarHBondContact OE2-NH1 2.84Å; E1251-R1687 IonicContact OE2-NH2 3.87Å; E1251-R1687 PolarHBondContact OE2-NH2 3.3Å | ||
| 1252 | F | 53.7 | Low | 60.1 | Low | 49.6 Ų | 49.6 | 70.6 Ų | 70.6 | 22% | 0.218 | 38% | 0.379 | C | S | . | . | trans | -77.1 | 82.9 | 170.1 | -66.7 | -78.3 | 0 | 0 | 0 | 108.7 | I1216 L1220 V1245 L1246 T1250 T1254 L1255 A1890 K1891 T1926 | I1216-F1252 HydrophobicContact CD1-CD1 4.48Å; I1216-F1252 HydrophobicContact CD1-CD2 4.49Å; I1216-F1252 HydrophobicContact CD1-CE1 4.33Å; I1216-F1252 HydrophobicContact CD1-CE2 3.64Å; I1216-F1252 HydrophobicContact CD1-CZ 3.91Å; I1216-F1252 HydrophobicContact CG2-CD1 3.73Å; I1216-F1252 HydrophobicContact CG2-CE1 3.75Å; L1220-F1252 HydrophobicContact CD1-CD1 4.17Å; L1220-F1252 HydrophobicContact CD1-CE1 4Å; V1245-F1252 HydrophobicContact CG1-CZ 4.45Å; L1246-F1252 HydrophobicContact CD2-CE1 4.45Å; L1246-F1252 HydrophobicContact CD2-CE2 3.75Å; L1246-F1252 HydrophobicContact CD2-CZ 4.03Å; T1250-F1252 WeakPolarHBondContact O-CD2 3.25Å; T1250-F1252 WeakPolarHBondContact O-CE2 3.42Å; T1250-F1252 VanDerWaalsContact O-CG 3.27Å; T1250-F1252 WeakPolarHBondContact O-CG 3.41Å; T1250-F1252 PolarHBondContact O-N 3.15Å; T1250-F1252 WeakPolarHBondContact OG1-CD2 3.42Å; T1250-F1252 WeakPolarHBondContact OG1-CE2 3.38Å; T1250-F1252 WeakPolarHBondContact OG1-CZ 3.45Å; F1252-T1254 VanDerWaalsContact CB-OG1 3.27Å; F1252-T1254 WeakPolarHBondContact CB-OG1 3.35Å; F1252-T1254 PolarHBondContact O-N 3.25Å; F1252-T1254 VanDerWaalsContact O-N 3.12Å; F1252-T1254 PolarHBondContact O-OG1 3.15Å; F1252-L1255 HydrophobicContact CB-CD1 4.13Å; F1252-L1255 HydrophobicContact CD1-CD1 3.84Å; F1252-L1255 HydrophobicContact CG-CD1 4.47Å; F1252-L1255 WeakPolarHBondContact O-CB 3.47Å; F1252-L1255 PolarHBondContact O-N 3.06Å; F1252-L1255 VanDerWaalsContact O-N 3.09Å; F1252-A1890 HydrophobicContact CE1-CB 4.23Å; F1252-A1890 HydrophobicContact CZ-CB 3.76Å; F1252-K1891 HydrophobicContact CE1-CB 3.66Å; F1252-K1891 HydrophobicContact CE1-CD 4.03Å; F1252-K1891 HydrophobicContact CE1-CG 4.05Å; F1252-K1891 HydrophobicContact CZ-CB 3.75Å; F1252-K1891 HydrophobicContact CZ-CG 4.2Å; F1252-T1926 HydrophobicContact CD2-CG2 4.14Å; F1252-T1926 HydrophobicContact CE2-CG2 4.23Å | ||
| 1253 | E | 49.1 | Very low | 59 | Low | 123.6 Ų | 123.6 | 74.7 Ų | 74.7 | 58% | 0.578 | 39% | 0.392 | S | S | * | . | G | 310 helix | trans | -61.7 | 0.1 | -175.2 | -64.5 | -177.6 | 152.4 | 0 | 0 | 113.2 | E1251 L1255 N1256 T1684 | E1251-E1253 PolarHBondContact O-N 3.31Å; E1253-L1255 VanDerWaalsContact C-N 3.29Å; E1253-L1255 PolarHBondContact O-N 3.21Å; E1253-L1255 VanDerWaalsContact O-N 3.14Å; E1253-N1256 WeakPolarHBondContact O-CB 3.46Å; E1253-N1256 PolarHBondContact O-N 2.98Å; E1253-T1684 VanDerWaalsContact OE1-CG2 3.27Å; E1253-T1684 WeakPolarHBondContact OE1-CG2 3.34Å; E1253-T1684 PolarHBondContact OE1-OG1 3.08Å |
| 1254 | T | 45.1 | Very low | 58.1 | Low | 63.8 Ų | 63.8 | 79.8 Ų | 79.8 | 39% | 0.391 | 41% | 0.414 | S | S | . | . | G | 310 helix | trans | -72.1 | -0.8 | 169.6 | 54.4 | 0 | 0 | 0 | 0 | 113.8 | F1252 N1256 E1257 T1258 | F1252-T1254 VanDerWaalsContact CB-OG1 3.27Å; F1252-T1254 WeakPolarHBondContact CB-OG1 3.35Å; F1252-T1254 PolarHBondContact O-N 3.25Å; F1252-T1254 VanDerWaalsContact O-N 3.12Å; F1252-T1254 PolarHBondContact O-OG1 3.15Å; T1254-N1256 PolarHBondContact O-N 3.47Å; T1254-N1256 VanDerWaalsContact O-N 3.09Å; T1254-E1257 CarbonylContact O-C 3.6Å; T1254-E1257 WeakPolarHBondContact O-CA 3.33Å; T1254-E1257 PolarHBondContact O-N 3.17Å; T1254-T1258 PolarHBondContact O-N 3.02Å; T1254-T1258 PolarHBondContact O-OG1 3.3Å; T1254-T1258 VanDerWaalsContact O-OG1 3.13Å |
| 1255 | L | 45.2 | Very low | 57.5 | Low | 75.2 Ų | 75.2 | 78.9 Ų | 78.9 | 39% | 0.394 | 41% | 0.411 | S | S | . | . | G | 310 helix | trans | -59.5 | -24.7 | 171.6 | -85.9 | 156.6 | 0 | 0 | 0 | 113 | I1216 L1220 E1251 F1252 E1253 E1257 T1258 V1259 F1726 | I1216-L1255 HydrophobicContact CG2-CD1 4.31Å; I1216-L1255 HydrophobicContact CG2-CD2 4.36Å; L1220-L1255 HydrophobicContact CD1-CD1 3.79Å; L1220-L1255 HydrophobicContact CD1-CD2 4.47Å; E1251-L1255 HydrophobicContact CB-CD1 4.42Å; E1251-L1255 HydrophobicContact CG-CD1 3.93Å; F1252-L1255 HydrophobicContact CB-CD1 4.13Å; F1252-L1255 HydrophobicContact CD1-CD1 3.84Å; F1252-L1255 HydrophobicContact CG-CD1 4.47Å; F1252-L1255 WeakPolarHBondContact O-CB 3.47Å; F1252-L1255 PolarHBondContact O-N 3.06Å; F1252-L1255 VanDerWaalsContact O-N 3.09Å; E1253-L1255 VanDerWaalsContact C-N 3.29Å; E1253-L1255 PolarHBondContact O-N 3.21Å; E1253-L1255 VanDerWaalsContact O-N 3.14Å; L1255-E1257 VanDerWaalsContact C-N 3.32Å; L1255-E1257 PolarHBondContact O-N 3.24Å; L1255-T1258 WeakPolarHBondContact CA-OG1 3.44Å; L1255-V1259 HydrophobicContact CB-CG2 4Å; L1255-V1259 HydrophobicContact CD2-CG2 3.67Å; L1255-V1259 HydrophobicContact CG-CG2 4.28Å; L1255-V1259 VanDerWaalsContact O-CA 3.3Å; L1255-V1259 WeakPolarHBondContact O-CA 3.41Å; L1255-V1259 WeakPolarHBondContact O-CB 3.44Å; L1255-V1259 WeakPolarHBondContact O-CG2 3.4Å; L1255-V1259 PolarHBondContact O-N 3.44Å; L1255-F1726 HydrophobicContact CD2-CE2 3.91Å; L1255-F1726 HydrophobicContact CD2-CZ 4.21Å |
| 1256 | N | 41.5 | Very low | 57.2 | Low | 123.2 Ų | 123.2 | 79.5 Ų | 79.5 | 66% | 0.659 | 41% | 0.413 | S | S | * | . | H | α-helix | trans | -76.1 | -12.8 | 177.2 | -92.6 | -14.8 | 0 | 0 | 0 | 112.9 | E1253 T1254 M1260 | E1253-N1256 WeakPolarHBondContact O-CB 3.46Å; E1253-N1256 PolarHBondContact O-N 2.98Å; T1254-N1256 PolarHBondContact O-N 3.47Å; T1254-N1256 VanDerWaalsContact O-N 3.09Å; N1256-M1260 WeakPolarHBondContact O-CB 3.4Å; N1256-M1260 WeakPolarHBondContact O-CG 3.33Å; N1256-M1260 PolarHBondContact O-N 2.99Å; N1256-M1260 VanDerWaalsContact O-N 3.08Å |
| 1257 | E | 40.3 | Very low | 57.1 | Low | 115.8 Ų | 115.8 | 80.4 Ų | 80.4 | 54% | 0.541 | 42% | 0.419 | S | S | . | . | trans | -99.6 | -5.8 | -177.9 | -76 | -175.2 | 174.3 | 0 | 0 | 113.2 | T1254 L1255 V1259 M1260 A1261 Q1264 | T1254-E1257 CarbonylContact O-C 3.6Å; T1254-E1257 WeakPolarHBondContact O-CA 3.33Å; T1254-E1257 PolarHBondContact O-N 3.17Å; L1255-E1257 VanDerWaalsContact C-N 3.32Å; L1255-E1257 PolarHBondContact O-N 3.24Å; E1257-V1259 PolarHBondContact O-N 3.17Å; E1257-M1260 HydrophobicContact CB-CB 3.84Å; E1257-M1260 HydrophobicContact CB-CG 4.35Å; E1257-M1260 HydrophobicContact CG-CB 3.75Å; E1257-M1260 HydrophobicContact CG-CG 3.86Å; E1257-M1260 HydrophobicContact CG-SD 3.81Å; E1257-M1260 CarbonylContact O-C 3.56Å; E1257-M1260 WeakPolarHBondContact O-CA 3.38Å; E1257-M1260 WeakPolarHBondContact O-CB 3.12Å; E1257-M1260 PolarHBondContact O-N 3.29Å; E1257-M1260 VanDerWaalsContact OE2-CB 3.25Å; E1257-M1260 WeakPolarHBondContact OE2-CB 3.42Å; E1257-M1260 VanDerWaalsContact OE2-SD 3.34Å; E1257-A1261 WeakPolarHBondContact O-CB 3.44Å; E1257-A1261 PolarHBondContact O-N 3.24Å; E1257-Q1264 PolarHBondContact OE2-NE2 2.87Å | ||
| 1258 | T | 48.2 | Very low | 57.4 | Low | 86.6 Ų | 86.6 | 77.3 Ų | 77.3 | 53% | 0.531 | 40% | 0.404 | S | S | . | . | H | α-helix | trans | -63.3 | -35 | 177.4 | 49.4 | 0 | 0 | 0 | 0 | 113 | T1254 L1255 M1260 A1261 D1262 | T1254-T1258 PolarHBondContact O-N 3.02Å; T1254-T1258 PolarHBondContact O-OG1 3.3Å; T1254-T1258 VanDerWaalsContact O-OG1 3.13Å; L1255-T1258 WeakPolarHBondContact CA-OG1 3.44Å; T1258-M1260 VanDerWaalsContact C-N 3.27Å; T1258-M1260 PolarHBondContact O-N 3.05Å; T1258-A1261 PolarHBondContact O-N 3.33Å; T1258-A1261 VanDerWaalsContact O-N 3.15Å; T1258-D1262 WeakPolarHBondContact O-CB 3.38Å; T1258-D1262 PolarHBondContact O-N 3.15Å |
| 1259 | V | 45.5 | Very low | 58.1 | Low | 72 Ų | 72 | 73.1 Ų | 73.1 | 44% | 0.436 | 39% | 0.385 | S | S | . | . | H | α-helix | trans | -72.6 | -27.1 | 174.5 | -179 | 0 | 0 | 0 | 0 | 111.9 | L1255 E1257 R1263 | L1255-V1259 HydrophobicContact CB-CG2 4Å; L1255-V1259 HydrophobicContact CD2-CG2 3.67Å; L1255-V1259 HydrophobicContact CG-CG2 4.28Å; L1255-V1259 VanDerWaalsContact O-CA 3.3Å; L1255-V1259 WeakPolarHBondContact O-CA 3.41Å; L1255-V1259 WeakPolarHBondContact O-CB 3.44Å; L1255-V1259 WeakPolarHBondContact O-CG2 3.4Å; L1255-V1259 PolarHBondContact O-N 3.44Å; E1257-V1259 PolarHBondContact O-N 3.17Å; V1259-R1263 HydrophobicContact CG1-CG 4.46Å; V1259-R1263 WeakPolarHBondContact O-CA 3.23Å; V1259-R1263 WeakPolarHBondContact O-CB 3.32Å; V1259-R1263 WeakPolarHBondContact O-CG 3.34Å; V1259-R1263 PolarHBondContact O-N 3.05Å |
| 1260 | M | 44.5 | Very low | 59.3 | Low | 105.8 Ų | 105.8 | 71 Ų | 71 | 52% | 0.521 | 36% | 0.362 | S | S | . | . | H | α-helix | trans | -73.5 | -35.7 | 172 | -74.1 | -110.3 | 99.6 | 0 | 0 | 111.6 | N1256 E1257 T1258 R1263 Q1264 | N1256-M1260 WeakPolarHBondContact O-CB 3.4Å; N1256-M1260 WeakPolarHBondContact O-CG 3.33Å; N1256-M1260 PolarHBondContact O-N 2.99Å; N1256-M1260 VanDerWaalsContact O-N 3.08Å; E1257-M1260 HydrophobicContact CB-CB 3.84Å; E1257-M1260 HydrophobicContact CB-CG 4.35Å; E1257-M1260 HydrophobicContact CG-CB 3.75Å; E1257-M1260 HydrophobicContact CG-CG 3.86Å; E1257-M1260 HydrophobicContact CG-SD 3.81Å; E1257-M1260 CarbonylContact O-C 3.56Å; E1257-M1260 WeakPolarHBondContact O-CA 3.38Å; E1257-M1260 WeakPolarHBondContact O-CB 3.12Å; E1257-M1260 PolarHBondContact O-N 3.29Å; E1257-M1260 VanDerWaalsContact OE2-CB 3.25Å; E1257-M1260 WeakPolarHBondContact OE2-CB 3.42Å; E1257-M1260 VanDerWaalsContact OE2-SD 3.34Å; T1258-M1260 VanDerWaalsContact C-N 3.27Å; T1258-M1260 PolarHBondContact O-N 3.05Å; M1260-R1263 CarbonylContact O-C 3.08Å; M1260-R1263 PolarHBondContact O-N 3.11Å; M1260-R1263 VanDerWaalsContact O-N 3.17Å; M1260-Q1264 WeakPolarHBondContact O-CB 3.16Å; M1260-Q1264 WeakPolarHBondContact O-CG 3.34Å; M1260-Q1264 PolarHBondContact O-N 3.23Å |
| 1261 | A | 52.2 | Low | 60.5 | Low | 40.2 Ų | 40.2 | 75.1 Ų | 75.1 | 33% | 0.332 | 38% | 0.378 | S | S | . | . | H | α-helix | trans | -63.2 | -49.6 | 176.7 | 0 | 0 | 0 | 0 | 0 | 111.4 | E1257 T1258 R1263 Q1264 M1265 | E1257-A1261 WeakPolarHBondContact O-CB 3.44Å; E1257-A1261 PolarHBondContact O-N 3.24Å; T1258-A1261 PolarHBondContact O-N 3.33Å; T1258-A1261 VanDerWaalsContact O-N 3.15Å; A1261-R1263 VanDerWaalsContact C-N 3.31Å; A1261-R1263 PolarHBondContact O-N 3.28Å; A1261-Q1264 WeakPolarHBondContact O-CB 3.43Å; A1261-Q1264 PolarHBondContact O-N 3.23Å; A1261-Q1264 VanDerWaalsContact O-N 3.12Å; A1261-M1265 WeakPolarHBondContact O-CB 3.38Å; A1261-M1265 VanDerWaalsContact O-CG 3.25Å; A1261-M1265 WeakPolarHBondContact O-CG 3.41Å; A1261-M1265 PolarHBondContact O-N 3.15Å |
| 1262 | D | 58.1 | Low | 62 | Low | 71.4 Ų | 71.4 | 69.2 Ų | 69.2 | 38% | 0.382 | 35% | 0.351 | S | S | . | . | H | α-helix | trans | -59.2 | -43.5 | 174.9 | -75.7 | -13.6 | 0 | 0 | 0 | 111.1 | T1258 Q1264 M1265 F1266 | T1258-D1262 WeakPolarHBondContact O-CB 3.38Å; T1258-D1262 PolarHBondContact O-N 3.15Å; D1262-Q1264 VanDerWaalsContact C-N 3.31Å; D1262-Q1264 PolarHBondContact O-N 3Å; D1262-M1265 CarbonylContact O-C 3.53Å; D1262-M1265 WeakPolarHBondContact O-CB 3.4Å; D1262-M1265 PolarHBondContact O-N 3.24Å; D1262-M1265 VanDerWaalsContact O-N 3.12Å; D1262-F1266 HydrophobicContact CB-CD2 4.26Å; D1262-F1266 HydrophobicContact CB-CE2 4.13Å; D1262-F1266 WeakPolarHBondContact O-CB 3.36Å; D1262-F1266 WeakPolarHBondContact O-CD2 3.41Å; D1262-F1266 WeakPolarHBondContact O-CG 3.47Å; D1262-F1266 PolarHBondContact O-N 3.19Å |
| 1263 | R | 62.4 | Low | 63.7 | Low | 108.6 Ų | 108.6 | 66.9 Ų | 66.9 | 41% | 0.41 | 34% | 0.341 | S | S | . | . | H | α-helix | trans | -60.8 | -43.2 | 175.7 | -127.5 | -177.7 | 173.5 | 148.5 | 4.9 | 112.1 | V1259 M1260 A1261 M1265 F1266 D1267 D1540 | V1259-R1263 HydrophobicContact CG1-CG 4.46Å; V1259-R1263 WeakPolarHBondContact O-CA 3.23Å; V1259-R1263 WeakPolarHBondContact O-CB 3.32Å; V1259-R1263 WeakPolarHBondContact O-CG 3.34Å; V1259-R1263 PolarHBondContact O-N 3.05Å; M1260-R1263 CarbonylContact O-C 3.08Å; M1260-R1263 PolarHBondContact O-N 3.11Å; M1260-R1263 VanDerWaalsContact O-N 3.17Å; A1261-R1263 VanDerWaalsContact C-N 3.31Å; A1261-R1263 PolarHBondContact O-N 3.28Å; R1263-M1265 VanDerWaalsContact C-N 3.29Å; R1263-M1265 PolarHBondContact O-N 3.05Å; R1263-F1266 PolarHBondContact O-N 3.15Å; R1263-D1267 VanDerWaalsContact O-CB 3.27Å; R1263-D1267 WeakPolarHBondContact O-CB 3.32Å; R1263-D1267 PolarHBondContact O-N 3.05Å; R1263-D1540 IonicContact CZ-OD1 3.03Å; R1263-D1540 IonicContact CZ-OD2 3.72Å; R1263-D1540 IonicContact NE-OD1 3.59Å; R1263-D1540 PolarHBondContact NE-OD1 3.27Å; R1263-D1540 VanDerWaalsContact NE-OD1 3.13Å; R1263-D1540 IonicContact NE-OD2 3.42Å; R1263-D1540 PolarHBondContact NE-OD2 2.83Å; R1263-D1540 IonicContact NH2-OD1 3.29Å; R1263-D1540 IonicContact NH2-OD2 3.36Å; R1263-D1540 PolarHBondContact NH2-OD2 2.94Å |
| 1264 | Q | 66 | Low | 65.5 | Low | 136 Ų | 136 | 61.9 Ų | 61.9 | 64% | 0.636 | 32% | 0.318 | S | S | * | . | H | α-helix | trans | -62 | -40.4 | 175.8 | -88.5 | -175 | -7.9 | 0 | 0 | 111.2 | E1257 M1260 A1261 D1262 D1267 E1268 | E1257-Q1264 PolarHBondContact OE2-NE2 2.87Å; M1260-Q1264 WeakPolarHBondContact O-CB 3.16Å; M1260-Q1264 WeakPolarHBondContact O-CG 3.34Å; M1260-Q1264 PolarHBondContact O-N 3.23Å; A1261-Q1264 WeakPolarHBondContact O-CB 3.43Å; A1261-Q1264 PolarHBondContact O-N 3.23Å; A1261-Q1264 VanDerWaalsContact O-N 3.12Å; D1262-Q1264 VanDerWaalsContact C-N 3.31Å; D1262-Q1264 PolarHBondContact O-N 3Å; Q1264-D1267 PolarHBondContact O-N 3.01Å; Q1264-E1268 WeakPolarHBondContact O-CB 3.36Å; Q1264-E1268 PolarHBondContact O-N 3.22Å |
| 1265 | M | 69.3 | Low | 67.5 | Low | 33.8 Ų | 33.8 | 62.1 Ų | 62.1 | 17% | 0.167 | 32% | 0.316 | C | S | . | . | H | α-helix | trans | -68.8 | -40.5 | 177.6 | -68.3 | -175.5 | 81.6 | 0 | 0 | 112.4 | A1261 D1262 R1263 D1267 E1268 L1269 L1577 Q1580 L1581 | A1261-M1265 WeakPolarHBondContact O-CB 3.38Å; A1261-M1265 VanDerWaalsContact O-CG 3.25Å; A1261-M1265 WeakPolarHBondContact O-CG 3.41Å; A1261-M1265 PolarHBondContact O-N 3.15Å; D1262-M1265 CarbonylContact O-C 3.53Å; D1262-M1265 WeakPolarHBondContact O-CB 3.4Å; D1262-M1265 PolarHBondContact O-N 3.24Å; D1262-M1265 VanDerWaalsContact O-N 3.12Å; R1263-M1265 VanDerWaalsContact C-N 3.29Å; R1263-M1265 PolarHBondContact O-N 3.05Å; M1265-D1267 VanDerWaalsContact C-N 3.34Å; M1265-E1268 CarbonylContact O-C 3.55Å; M1265-E1268 PolarHBondContact O-N 3.12Å; M1265-L1269 WeakPolarHBondContact O-CB 3.31Å; M1265-L1269 WeakPolarHBondContact O-CG 3.46Å; M1265-L1269 PolarHBondContact O-N 3.13Å; M1265-L1577 HydrophobicContact CE-CB 4.4Å; M1265-L1577 HydrophobicContact CE-CD2 4.25Å; M1265-L1577 WeakPolarHBondContact CE-O 3.11Å; M1265-L1577 HydrophobicContact CG-CD2 4.46Å; M1265-Q1580 HydrophobicContact CE-CB 3.24Å; M1265-Q1580 HydrophobicContact CE-CG 4.23Å; M1265-Q1580 HydrophobicContact SD-CB 4.06Å; M1265-L1581 HydrophobicContact CB-CD1 4.35Å; M1265-L1581 HydrophobicContact CB-CD2 3.89Å; M1265-L1581 HydrophobicContact CB-CG 4.25Å; M1265-L1581 HydrophobicContact CE-CB 4.43Å; M1265-L1581 HydrophobicContact CE-CD1 4.31Å; M1265-L1581 HydrophobicContact CE-CD2 4.38Å; M1265-L1581 HydrophobicContact CE-CG 4.09Å; M1265-L1581 HydrophobicContact SD-CD2 4.35Å; M1265-L1581 HydrophobicContact SD-CG 4.12Å |
| 1266 | F | 75.9 | Confident | 69.3 | Low | 15.6 Ų | 15.6 | 62 Ų | 62 | 7% | 0.068 | 32% | 0.316 | C | S | . | . | H | α-helix | trans | -62.4 | -43 | 171.3 | -77.7 | -60.7 | 0 | 0 | 0 | 111.4 | D1262 R1263 E1268 L1269 V1270 A1543 Y1544 H1547 L1581 | D1262-F1266 HydrophobicContact CB-CD2 4.26Å; D1262-F1266 HydrophobicContact CB-CE2 4.13Å; D1262-F1266 WeakPolarHBondContact O-CB 3.36Å; D1262-F1266 WeakPolarHBondContact O-CD2 3.41Å; D1262-F1266 WeakPolarHBondContact O-CG 3.47Å; D1262-F1266 PolarHBondContact O-N 3.19Å; R1263-F1266 PolarHBondContact O-N 3.15Å; F1266-E1268 VanDerWaalsContact C-N 3.28Å; F1266-E1268 PolarHBondContact O-N 3.2Å; F1266-L1269 HydrophobicContact CD1-CD1 4.37Å; F1266-L1269 HydrophobicContact CD1-CD2 4.44Å; F1266-L1269 WeakPolarHBondContact O-CB 3.39Å; F1266-L1269 PolarHBondContact O-N 3.21Å; F1266-V1270 WeakPolarHBondContact O-CB 3.47Å; F1266-V1270 VanDerWaalsContact O-CG2 3.27Å; F1266-V1270 WeakPolarHBondContact O-CG2 3.36Å; F1266-V1270 PolarHBondContact O-N 2.87Å; F1266-A1543 HydrophobicContact CB-CB 3.98Å; F1266-A1543 HydrophobicContact CD1-CB 4.02Å; F1266-A1543 HydrophobicContact CG-CB 4.23Å; F1266-Y1544 HydrophobicContact CD2-CD2 4.43Å; F1266-Y1544 AromaticContact CD2-CE2 3.96Å; F1266-Y1544 HydrophobicContact CD2-CE2 4.23Å; F1266-Y1544 AromaticContact CE1-CD1 3.93Å; F1266-Y1544 HydrophobicContact CE1-CD1 4.07Å; F1266-Y1544 HydrophobicContact CE1-CD2 4.11Å; F1266-Y1544 HydrophobicContact CE1-CE1 4.21Å; F1266-Y1544 HydrophobicContact CE1-CE2 4.25Å; F1266-Y1544 HydrophobicContact CE1-CG 4.33Å; F1266-Y1544 HydrophobicContact CE2-CD1 4.28Å; F1266-Y1544 AromaticContact CE2-CD2 3.98Å; F1266-Y1544 HydrophobicContact CE2-CD2 3.98Å; F1266-Y1544 AromaticContact CE2-CE1 3.72Å; F1266-Y1544 HydrophobicContact CE2-CE1 3.72Å; F1266-Y1544 AromaticContact CE2-CE2 3.33Å; F1266-Y1544 HydrophobicContact CE2-CE2 3.99Å; F1266-Y1544 AromaticContact CE2-CZ 3.5Å; F1266-Y1544 VanDerWaalsContact CE2-CZ 3.44Å; F1266-Y1544 WeakPolarHBondContact CE2-OH 3.35Å; F1266-Y1544 AromaticContact CZ-CD1 3.65Å; F1266-Y1544 HydrophobicContact CZ-CD1 3.65Å; F1266-Y1544 AromaticContact CZ-CD2 3.82Å; F1266-Y1544 HydrophobicContact CZ-CD2 3.82Å; F1266-Y1544 AromaticContact CZ-CE1 3.35Å; F1266-Y1544 HydrophobicContact CZ-CE1 3.35Å; F1266-Y1544 VanDerWaalsContact CZ-CE1 3.45Å; F1266-Y1544 AromaticContact CZ-CE2 3.51Å; F1266-Y1544 HydrophobicContact CZ-CE2 4.07Å; F1266-Y1544 AromaticContact CZ-CG 3.95Å; F1266-Y1544 HydrophobicContact CZ-CG 4.21Å; F1266-Y1544 AromaticContact CZ-CZ 3.65Å; F1266-H1547 HydrophobicContact CD1-CB 4.42Å; F1266-H1547 HydrophobicContact CE1-CB 3.73Å; F1266-H1547 AromaticContact CE1-CG 3.9Å; F1266-H1547 AromaticContact CE1-ND1 3.93Å; F1266-L1581 HydrophobicContact CE1-CD2 4.31Å; F1266-L1581 HydrophobicContact CE2-CD2 4.31Å; F1266-L1581 HydrophobicContact CZ-CD2 4.12Å |
| 1267 | D | 76.6 | Confident | 71.3 | Confident | 65.4 Ų | 65.4 | 57.2 Ų | 57.2 | 35% | 0.35 | 29% | 0.291 | S | S | . | . | H | α-helix | trans | -65.3 | -34.5 | 176.7 | -127 | 11.1 | 0 | 0 | 0 | 111.3 | R1263 Q1264 M1265 V1270 K1271 K1311 | R1263-D1267 VanDerWaalsContact O-CB 3.27Å; R1263-D1267 WeakPolarHBondContact O-CB 3.32Å; R1263-D1267 PolarHBondContact O-N 3.05Å; Q1264-D1267 PolarHBondContact O-N 3.01Å; M1265-D1267 VanDerWaalsContact C-N 3.34Å; D1267-V1270 PolarHBondContact O-N 3.16Å; D1267-K1271 VanDerWaalsContact O-CB 3.3Å; D1267-K1271 WeakPolarHBondContact O-CB 3.24Å; D1267-K1271 VanDerWaalsContact O-CG 3.22Å; D1267-K1271 WeakPolarHBondContact O-CG 3.39Å; D1267-K1271 PolarHBondContact O-N 3.01Å; D1267-K1271 IonicContact OD2-NZ 2.67Å; D1267-K1311 IonicContact OD1-NZ 3.54Å; D1267-K1311 PolarHBondContact OD1-NZ 3.17Å; D1267-K1311 VanDerWaalsContact OD1-NZ 3.12Å |
| 1268 | E | 82.4 | Confident | 73.1 | Confident | 48 Ų | 48 | 57.8 Ų | 57.8 | 22% | 0.224 | 31% | 0.307 | C | S | . | . | H | α-helix | trans | -69.9 | -38.6 | 172.5 | -167.8 | 70.5 | 175.2 | 0 | 0 | 112.3 | Q1264 M1265 F1266 V1270 K1271 L1272 R1573 L1577 | Q1264-E1268 WeakPolarHBondContact O-CB 3.36Å; Q1264-E1268 PolarHBondContact O-N 3.22Å; M1265-E1268 CarbonylContact O-C 3.55Å; M1265-E1268 PolarHBondContact O-N 3.12Å; F1266-E1268 VanDerWaalsContact C-N 3.28Å; F1266-E1268 PolarHBondContact O-N 3.2Å; E1268-V1270 VanDerWaalsContact C-N 3.34Å; E1268-V1270 PolarHBondContact O-N 3.32Å; E1268-K1271 WeakPolarHBondContact O-CB 3.4Å; E1268-K1271 PolarHBondContact O-N 3.02Å; E1268-K1271 WeakPolarHBondContact OE2-CD 3.39Å; E1268-K1271 IonicContact OE2-NZ 3.24Å; E1268-L1272 HydrophobicContact CG-CD1 4.38Å; E1268-L1272 VanDerWaalsContact O-CB 3.24Å; E1268-L1272 WeakPolarHBondContact O-CB 3.4Å; E1268-L1272 WeakPolarHBondContact O-CG 3.32Å; E1268-L1272 PolarHBondContact O-N 3.08Å; E1268-R1573 IonicContact OE1-CZ 3.67Å; E1268-R1573 IonicContact OE1-NE 3.68Å; E1268-R1573 PolarHBondContact OE1-NE 3.14Å; E1268-R1573 VanDerWaalsContact OE1-NE 3.09Å; E1268-R1573 IonicContact OE1-NH2 3.66Å; E1268-R1573 PolarHBondContact OE1-NH2 3.32Å; E1268-L1577 HydrophobicContact CB-CD1 4.23Å; E1268-L1577 HydrophobicContact CB-CD2 4.34Å; E1268-L1577 HydrophobicContact CG-CD1 4.02Å; E1268-L1577 HydrophobicContact CG-CD2 4.22Å; E1268-L1577 HydrophobicContact CG-CG 4.46Å |
| 1269 | L | 86.1 | Confident | 74.4 | Confident | 0.6 Ų | 0.6 | 58.6 Ų | 58.6 | 0% | 0.003 | 31% | 0.308 | C | S | . | . | H | α-helix | trans | -60.9 | -44.1 | 172.2 | -134 | 120.1 | 0 | 0 | 0 | 111.3 | M1265 F1266 L1272 T1273 L1546 H1547 L1550 L1574 L1577 L1578 L1581 | M1265-L1269 WeakPolarHBondContact O-CB 3.31Å; M1265-L1269 WeakPolarHBondContact O-CG 3.46Å; M1265-L1269 PolarHBondContact O-N 3.13Å; F1266-L1269 HydrophobicContact CD1-CD1 4.37Å; F1266-L1269 HydrophobicContact CD1-CD2 4.44Å; F1266-L1269 WeakPolarHBondContact O-CB 3.39Å; F1266-L1269 PolarHBondContact O-N 3.21Å; L1269-L1272 PolarHBondContact O-N 3.11Å; L1269-T1273 WeakPolarHBondContact O-CB 3.4Å; L1269-T1273 PolarHBondContact O-N 3.21Å; L1269-T1273 VanDerWaalsContact O-N 3.08Å; L1269-T1273 PolarHBondContact O-OG1 3.11Å; L1269-T1273 VanDerWaalsContact O-OG1 3.06Å; L1269-L1546 HydrophobicContact CB-CD2 4.31Å; L1269-L1546 HydrophobicContact CD2-CB 4.5Å; L1269-L1546 HydrophobicContact CD2-CD2 4.08Å; L1269-L1546 HydrophobicContact CD2-CG 4.09Å; L1269-L1546 HydrophobicContact CG-CD2 4.27Å; L1269-H1547 HydrophobicContact CD1-CB 4.05Å; L1269-H1547 HydrophobicContact CD2-CB 3.87Å; L1269-L1550 HydrophobicContact CD1-CD1 3.9Å; L1269-L1550 HydrophobicContact CD2-CD1 4.05Å; L1269-L1550 HydrophobicContact CG-CD1 4.03Å; L1269-L1574 HydrophobicContact CD1-CD1 4.04Å; L1269-L1574 HydrophobicContact CD2-CD1 3.81Å; L1269-L1577 HydrophobicContact CD1-CB 4.45Å; L1269-L1577 HydrophobicContact CD2-CB 3.95Å; L1269-L1577 HydrophobicContact CD2-CD1 4.09Å; L1269-L1578 HydrophobicContact CD1-CD2 4.48Å; L1269-L1578 HydrophobicContact CD2-CD2 4.49Å; L1269-L1581 HydrophobicContact CD1-CD1 4.06Å; L1269-L1581 HydrophobicContact CD2-CD1 4.48Å; L1269-L1581 HydrophobicContact CG-CD1 4.01Å |
| 1270 | V | 85.7 | Confident | 76 | Confident | 1.6 Ų | 1.6 | 56.2 Ų | 56.2 | 1% | 0.01 | 30% | 0.299 | C | S | . | . | H | α-helix | trans | -63.6 | -45.7 | 175.6 | 172.7 | 0 | 0 | 0 | 0 | 110.3 | F1266 D1267 E1268 L1272 T1273 T1274 L1307 K1311 V1539 A1543 L1546 | F1266-V1270 WeakPolarHBondContact O-CB 3.47Å; F1266-V1270 VanDerWaalsContact O-CG2 3.27Å; F1266-V1270 WeakPolarHBondContact O-CG2 3.36Å; F1266-V1270 PolarHBondContact O-N 2.87Å; D1267-V1270 PolarHBondContact O-N 3.16Å; E1268-V1270 VanDerWaalsContact C-N 3.34Å; E1268-V1270 PolarHBondContact O-N 3.32Å; V1270-L1272 VanDerWaalsContact C-N 3.34Å; V1270-L1272 PolarHBondContact O-N 3.28Å; V1270-T1273 PolarHBondContact O-N 3.08Å; V1270-T1273 VanDerWaalsContact O-N 3.13Å; V1270-T1274 HydrophobicContact CG1-CG2 4.44Å; V1270-T1274 WeakPolarHBondContact O-CB 3.4Å; V1270-T1274 WeakPolarHBondContact O-CG2 3.39Å; V1270-T1274 PolarHBondContact O-N 3.31Å; V1270-T1274 PolarHBondContact O-OG1 3.07Å; V1270-T1274 VanDerWaalsContact O-OG1 3.05Å; V1270-L1307 HydrophobicContact CB-CD1 4.42Å; V1270-L1307 HydrophobicContact CG1-CD1 3.98Å; V1270-L1307 HydrophobicContact CG1-CD2 4.31Å; V1270-L1307 HydrophobicContact CG1-CG 4.14Å; V1270-L1307 HydrophobicContact CG2-CD1 3.89Å; V1270-K1311 HydrophobicContact CG1-CD 4.44Å; V1270-K1311 VanDerWaalsContact CG1-CE 3.44Å; V1270-K1311 HydrophobicContact CG1-CG 4.4Å; V1270-V1539 HydrophobicContact CG2-CG1 4.16Å; V1270-A1543 HydrophobicContact CG2-CB 3.86Å; V1270-L1546 HydrophobicContact CG2-CD2 4.29Å |
| 1271 | K | 86.5 | Confident | 77.9 | Confident | 110 Ų | 110 | 54.6 Ų | 54.6 | 48% | 0.478 | 29% | 0.29 | S | S | . | . | H | α-helix | trans | -57.6 | -48.6 | 175.3 | -114.7 | 176.6 | -176 | 174.8 | 0 | 111.2 | D1267 E1268 T1273 T1274 I1275 | D1267-K1271 VanDerWaalsContact O-CB 3.3Å; D1267-K1271 WeakPolarHBondContact O-CB 3.24Å; D1267-K1271 VanDerWaalsContact O-CG 3.22Å; D1267-K1271 WeakPolarHBondContact O-CG 3.39Å; D1267-K1271 PolarHBondContact O-N 3.01Å; D1267-K1271 IonicContact OD2-NZ 2.67Å; E1268-K1271 WeakPolarHBondContact O-CB 3.4Å; E1268-K1271 PolarHBondContact O-N 3.02Å; E1268-K1271 WeakPolarHBondContact OE2-CD 3.39Å; E1268-K1271 IonicContact OE2-NZ 3.24Å; K1271-T1273 VanDerWaalsContact C-N 3.28Å; K1271-T1273 PolarHBondContact O-N 3.23Å; K1271-T1274 WeakPolarHBondContact CA-OG1 3.39Å; K1271-T1274 CarbonylContact O-C 3.57Å; K1271-T1274 PolarHBondContact O-N 3.13Å; K1271-T1274 PolarHBondContact O-OG1 3.04Å; K1271-T1274 VanDerWaalsContact O-OG1 3.07Å; K1271-I1275 WeakPolarHBondContact O-CG1 3.43Å; K1271-I1275 PolarHBondContact O-N 3.25Å; K1271-I1275 VanDerWaalsContact O-N 3.1Å |
| 1272 | L | 88.2 | Confident | 79.6 | Confident | 7.4 Ų | 7.4 | 53 Ų | 53 | 4% | 0.039 | 28% | 0.276 | C | S | . | . | H | α-helix | trans | -59.6 | -39.6 | 179.8 | -137 | 106.2 | 0 | 0 | 0 | 112 | E1268 L1269 V1270 T1274 I1275 I1284 V1570 R1573 L1574 L1577 | E1268-L1272 HydrophobicContact CG-CD1 4.38Å; E1268-L1272 VanDerWaalsContact O-CB 3.24Å; E1268-L1272 WeakPolarHBondContact O-CB 3.4Å; E1268-L1272 WeakPolarHBondContact O-CG 3.32Å; E1268-L1272 PolarHBondContact O-N 3.08Å; L1269-L1272 PolarHBondContact O-N 3.11Å; V1270-L1272 VanDerWaalsContact C-N 3.34Å; V1270-L1272 PolarHBondContact O-N 3.28Å; L1272-T1274 VanDerWaalsContact C-N 3.31Å; L1272-T1274 PolarHBondContact O-N 3.28Å; L1272-I1275 HydrophobicContact CD1-CD1 4.34Å; L1272-I1275 HydrophobicContact CD2-CD1 4.26Å; L1272-I1275 PolarHBondContact O-N 2.82Å; L1272-I1284 HydrophobicContact CB-CD1 4.18Å; L1272-I1284 HydrophobicContact CD2-CD1 3.68Å; L1272-I1284 VanDerWaalsContact CD2-CD1 3.41Å; L1272-I1284 HydrophobicContact CG-CD1 3.88Å; L1272-V1570 HydrophobicContact CD1-CG1 4.23Å; L1272-V1570 HydrophobicContact CD2-CG1 4.07Å; L1272-V1570 HydrophobicContact CG-CG1 4.14Å; L1272-R1573 HydrophobicContact CD1-CB 4.12Å; L1272-R1573 HydrophobicContact CD1-CG 3.87Å; L1272-R1573 HydrophobicContact CD2-CB 4.4Å; L1272-L1574 HydrophobicContact CD2-CB 3.72Å; L1272-L1574 HydrophobicContact CD2-CD1 4.27Å; L1272-L1574 HydrophobicContact CD2-CG 4.45Å; L1272-L1577 HydrophobicContact CD1-CD1 3.84Å; L1272-L1577 HydrophobicContact CD2-CD1 4.36Å |
| 1273 | T | 88.8 | Confident | 81.1 | Confident | 1 Ų | 1 | 49.7 Ų | 49.7 | 1% | 0.006 | 26% | 0.259 | C | S | . | . | H | α-helix | trans | -71.2 | -29.3 | 179 | -57.2 | 0 | 0 | 0 | 0 | 112.6 | L1269 V1270 K1271 I1284 V1285 L1307 L1546 | L1269-T1273 WeakPolarHBondContact O-CB 3.4Å; L1269-T1273 PolarHBondContact O-N 3.21Å; L1269-T1273 VanDerWaalsContact O-N 3.08Å; L1269-T1273 PolarHBondContact O-OG1 3.11Å; L1269-T1273 VanDerWaalsContact O-OG1 3.06Å; V1270-T1273 PolarHBondContact O-N 3.08Å; V1270-T1273 VanDerWaalsContact O-N 3.13Å; K1271-T1273 VanDerWaalsContact C-N 3.28Å; K1271-T1273 PolarHBondContact O-N 3.23Å; T1273-I1284 HydrophobicContact CG2-CB 4.41Å; T1273-I1284 HydrophobicContact CG2-CG2 4.01Å; T1273-V1285 HydrophobicContact CG2-CG2 4.31Å; T1273-L1307 HydrophobicContact CG2-CD2 4.23Å; T1273-L1546 HydrophobicContact CG2-CD1 3.98Å; T1273-L1546 HydrophobicContact CG2-CD2 4.23Å; T1273-L1546 WeakPolarHBondContact OG1-CD2 3.45Å |
| 1274 | T | 87.1 | Confident | 82.4 | Confident | 17.2 Ų | 17.2 | 44.6 Ų | 44.6 | 11% | 0.106 | 24% | 0.239 | C | C | . | . | H | α-helix | trans | -93.3 | 1.2 | 179.2 | 54.4 | 0 | 0 | 0 | 0 | 114.1 | V1270 K1271 L1272 I1276 L1307 F1308 K1311 L1313 | V1270-T1274 HydrophobicContact CG1-CG2 4.44Å; V1270-T1274 WeakPolarHBondContact O-CB 3.4Å; V1270-T1274 WeakPolarHBondContact O-CG2 3.39Å; V1270-T1274 PolarHBondContact O-N 3.31Å; V1270-T1274 PolarHBondContact O-OG1 3.07Å; V1270-T1274 VanDerWaalsContact O-OG1 3.05Å; K1271-T1274 WeakPolarHBondContact CA-OG1 3.39Å; K1271-T1274 CarbonylContact O-C 3.57Å; K1271-T1274 PolarHBondContact O-N 3.13Å; K1271-T1274 PolarHBondContact O-OG1 3.04Å; K1271-T1274 VanDerWaalsContact O-OG1 3.07Å; L1272-T1274 VanDerWaalsContact C-N 3.31Å; L1272-T1274 PolarHBondContact O-N 3.28Å; T1274-I1276 PolarHBondContact O-N 3.17Å; T1274-L1307 HydrophobicContact CG2-CD2 3.72Å; T1274-L1307 VanDerWaalsContact CG2-CD2 3.45Å; T1274-F1308 HydrophobicContact CG2-CD1 4.43Å; T1274-F1308 HydrophobicContact CG2-CD2 4.41Å; T1274-F1308 HydrophobicContact CG2-CE1 4.19Å; T1274-F1308 HydrophobicContact CG2-CE2 4.18Å; T1274-F1308 HydrophobicContact CG2-CG 4.5Å; T1274-F1308 HydrophobicContact CG2-CZ 4.02Å; T1274-K1311 HydrophobicContact CG2-CG 4.36Å; T1274-L1313 HydrophobicContact CG2-CD1 4.43Å |
| 1275 | I | 86.9 | Confident | 83.6 | Confident | 68 Ų | 68 | 38.2 Ų | 38.2 | 35% | 0.349 | 21% | 0.209 | S | C | . | . | P | Polyproline II helix | trans | -65.4 | 119.4 | 175.2 | -84.2 | 170 | 0 | 0 | 0 | 109.7 | K1271 L1272 T1277 | K1271-I1275 WeakPolarHBondContact O-CG1 3.43Å; K1271-I1275 PolarHBondContact O-N 3.25Å; K1271-I1275 VanDerWaalsContact O-N 3.1Å; L1272-I1275 HydrophobicContact CD1-CD1 4.34Å; L1272-I1275 HydrophobicContact CD2-CD1 4.26Å; L1272-I1275 PolarHBondContact O-N 2.82Å; I1275-T1277 HydrophobicContact CG2-CG2 4.2Å |
| 1276 | I | 84.1 | Confident | 84.5 | Confident | 74.8 Ų | 74.8 | 37.7 Ų | 37.7 | 38% | 0.384 | 21% | 0.207 | S | C | . | . | P | Polyproline II helix | trans | -89.8 | 120.7 | 165.4 | -57.5 | 170.7 | 0 | 0 | 0 | 106.9 | T1274 E1281 L1282 L1313 E1316 | T1274-I1276 PolarHBondContact O-N 3.17Å; I1276-E1281 WeakPolarHBondContact CA-O 3.33Å; I1276-L1282 HydrophobicContact CB-CD2 4.49Å; I1276-L1282 HydrophobicContact CG1-CD2 3.71Å; I1276-L1282 HydrophobicContact CG1-CG 4.44Å; I1276-L1313 HydrophobicContact CD1-CD2 4.41Å; I1276-E1316 HydrophobicContact CD1-CB 4.07Å; I1276-E1316 HydrophobicContact CD1-CG 4.1Å |
| 1277 | T | 83.1 | Confident | 85.1 | Confident | 21.8 Ų | 21.8 | 36.9 Ų | 36.9 | 13% | 0.134 | 20% | 0.204 | C | C | . | . | P | Polyproline II helix | trans | -75.5 | 169.9 | -178.8 | 54.8 | 0 | 0 | 0 | 0 | 111.3 | I1275 D1279 G1280 E1281 P1283 H1567 | I1275-T1277 HydrophobicContact CG2-CG2 4.2Å; T1277-D1279 WeakPolarHBondContact CB-OD1 3.42Å; T1277-D1279 PolarHBondContact O-N 3.14Å; T1277-D1279 VanDerWaalsContact O-N 3.13Å; T1277-D1279 PolarHBondContact OG1-OD1 3.12Å; T1277-G1280 WeakPolarHBondContact O-CA 3.34Å; T1277-G1280 PolarHBondContact O-N 3.25Å; T1277-E1281 PolarHBondContact N-O 3.14Å; T1277-E1281 WeakPolarHBondContact OG1-CA 3.26Å; T1277-E1281 WeakPolarHBondContact OG1-CB 3.38Å; T1277-E1281 PolarHBondContact OG1-N 2.96Å; T1277-E1281 VanDerWaalsContact OG1-N 3.1Å; T1277-E1281 PolarHBondContact OG1-O 3.11Å; T1277-E1281 VanDerWaalsContact OG1-O 3.11Å; T1277-P1283 HydrophobicContact CG2-CG 3.72Å; T1277-H1567 VanDerWaalsContact CG2-CE1 3.46Å; T1277-H1567 WeakPolarHBondContact CG2-CE1 3.41Å; T1277-H1567 WeakPolarHBondContact CG2-ND1 3.27Å; T1277-H1567 PolarHBondContact OG1-CE1 3.08Å |
| 1278 | S | 77 | Confident | 85.8 | Confident | 127.4 Ų | 127.4 | 33.8 Ų | 33.8 | 89% | 0.891 | 19% | 0.187 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -56.5 | -27.5 | 179.3 | 47.3 | 0 | 0 | 0 | 0 | 113.7 | G1280 | S1278-G1280 VanDerWaalsContact C-N 3.31Å; S1278-G1280 PolarHBondContact O-N 3.17Å |
| 1279 | D | 75.7 | Confident | 86.1 | Confident | 103.2 Ų | 103.2 | 33.3 Ų | 33.3 | 55% | 0.552 | 19% | 0.191 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -86.8 | 1.6 | 179.3 | -4.3 | -26.5 | 0 | 0 | 0 | 111.8 | T1277 E1281 H1567 | T1277-D1279 WeakPolarHBondContact CB-OD1 3.42Å; T1277-D1279 PolarHBondContact O-N 3.14Å; T1277-D1279 VanDerWaalsContact O-N 3.13Å; T1277-D1279 PolarHBondContact OG1-OD1 3.12Å; D1279-E1281 VanDerWaalsContact C-N 3.33Å; D1279-E1281 WeakPolarHBondContact OD2-CG 3.39Å; D1279-H1567 IonicContact OD1-CE1 2.7Å; D1279-H1567 IonicContact OD2-CE1 3.47Å; D1279-H1567 PolarHBondContact OD2-CE1 3.3Å; D1279-H1567 IonicContact OD2-NE2 2.99Å |
| 1280 | G | 79.4 | Confident | 86.1 | Confident | 23.4 Ų | 23.4 | 39.7 Ų | 39.7 | 24% | 0.241 | 22% | 0.221 | C | C | . | . | S | Bend | trans | 75 | 20.1 | -178.7 | 0 | 0 | 0 | 0 | 0 | 113.6 | T1277 S1278 K1320 | T1277-G1280 WeakPolarHBondContact O-CA 3.34Å; T1277-G1280 PolarHBondContact O-N 3.25Å; S1278-G1280 VanDerWaalsContact C-N 3.31Å; S1278-G1280 PolarHBondContact O-N 3.17Å; G1280-K1320 WeakPolarHBondContact O-CD 3.24Å; G1280-K1320 WeakPolarHBondContact O-CE 3.35Å; G1280-K1320 PolarHBondContact O-NZ 3.18Å |
| 1281 | E | 83.7 | Confident | 86.2 | Confident | 71 Ų | 71 | 40.3 Ų | 40.3 | 33% | 0.332 | 23% | 0.225 | S | C | . | . | trans | -92 | 154.3 | 178.1 | -65.3 | -121.5 | 162.3 | 0 | 0 | 112.4 | I1276 T1277 D1279 P1283 N1286 K1320 H1567 | I1276-E1281 WeakPolarHBondContact CA-O 3.33Å; T1277-E1281 PolarHBondContact N-O 3.14Å; T1277-E1281 WeakPolarHBondContact OG1-CA 3.26Å; T1277-E1281 WeakPolarHBondContact OG1-CB 3.38Å; T1277-E1281 PolarHBondContact OG1-N 2.96Å; T1277-E1281 VanDerWaalsContact OG1-N 3.1Å; T1277-E1281 PolarHBondContact OG1-O 3.11Å; T1277-E1281 VanDerWaalsContact OG1-O 3.11Å; D1279-E1281 VanDerWaalsContact C-N 3.33Å; D1279-E1281 WeakPolarHBondContact OD2-CG 3.39Å; E1281-P1283 VanDerWaalsContact O-CD 3.26Å; E1281-P1283 WeakPolarHBondContact O-CD 3.36Å; E1281-N1286 PolarHBondContact OE2-ND2 3.18Å; E1281-K1320 VanDerWaalsContact CD-CE 3.41Å; E1281-K1320 VanDerWaalsContact OE1-CE 3.3Å; E1281-K1320 WeakPolarHBondContact OE1-CE 3.41Å; E1281-K1320 IonicContact OE1-NZ 3.19Å; E1281-K1320 PolarHBondContact OE1-NZ 3.22Å; E1281-K1320 WeakPolarHBondContact OE2-CE 3.48Å; E1281-K1320 IonicContact OE2-NZ 3.04Å; E1281-K1320 PolarHBondContact OE2-NZ 3.17Å; E1281-H1567 IonicContact OE2-NE2 3.52Å | ||
| 1282 | L | 89.5 | Confident | 86.2 | Confident | 6.2 Ų | 6.2 | 35.6 Ų | 35.6 | 3% | 0.032 | 21% | 0.205 | C | C | . | . | trans | -110.8 | 85.5 | 171.1 | -72.5 | 166.5 | 0 | 0 | 0 | 108.2 | I1276 I1284 V1285 N1286 F1308 L1317 K1320 | I1276-L1282 HydrophobicContact CB-CD2 4.49Å; I1276-L1282 HydrophobicContact CG1-CD2 3.71Å; I1276-L1282 HydrophobicContact CG1-CG 4.44Å; L1282-I1284 PolarHBondContact O-N 3.3Å; L1282-V1285 HydrophobicContact CB-CB 3.87Å; L1282-V1285 HydrophobicContact CB-CG2 4.03Å; L1282-V1285 HydrophobicContact CD1-CG2 4.46Å; L1282-V1285 PolarHBondContact O-N 3.14Å; L1282-N1286 WeakPolarHBondContact O-CB 3.33Å; L1282-N1286 PolarHBondContact O-N 3.13Å; L1282-N1286 PolarHBondContact O-ND2 3.25Å; L1282-F1308 HydrophobicContact CD1-CE1 4.02Å; L1282-F1308 HydrophobicContact CD1-CZ 4.2Å; L1282-F1308 HydrophobicContact CD2-CE1 3.9Å; L1282-F1308 HydrophobicContact CD2-CZ 4Å; L1282-L1317 HydrophobicContact CD1-CD1 4.03Å; L1282-K1320 HydrophobicContact CD1-CB 4.46Å; L1282-K1320 HydrophobicContact CD1-CG 4.5Å | ||
| 1283 | P | 87.7 | Confident | 86.1 | Confident | 3 Ų | 3 | 39 Ų | 39 | 2% | 0.019 | 22% | 0.221 | C | C | . | . | H | α-helix | trans | -61 | -44.3 | -165.1 | 1.2 | -5.3 | 0 | 0 | 0 | 113.5 | T1277 E1281 N1286 A1287 F1561 H1567 V1570 | T1277-P1283 HydrophobicContact CG2-CG 3.72Å; E1281-P1283 VanDerWaalsContact O-CD 3.26Å; E1281-P1283 WeakPolarHBondContact O-CD 3.36Å; P1283-N1286 PolarHBondContact O-N 3.18Å; P1283-A1287 WeakPolarHBondContact O-CB 3.36Å; P1283-A1287 PolarHBondContact O-N 3.11Å; P1283-F1561 HydrophobicContact CB-CE1 3.9Å; P1283-F1561 HydrophobicContact CB-CZ 4.24Å; P1283-H1567 HydrophobicContact CB-CB 4Å; P1283-H1567 HydrophobicContact CG-CB 4.34Å; P1283-V1570 HydrophobicContact CG-CG1 4.39Å; P1283-V1570 HydrophobicContact CG-CG2 4.46Å |
| 1284 | I | 89.8 | Confident | 85.7 | Confident | 0.6 Ų | 0.6 | 43.4 Ų | 43.4 | 0% | 0.003 | 25% | 0.248 | C | C | . | . | H | α-helix | trans | -70.6 | -39.4 | -179.1 | -63.6 | -177.6 | 0 | 0 | 0 | 111 | L1272 T1273 L1282 N1286 A1287 L1288 L1550 F1561 V1570 L1574 | L1272-I1284 HydrophobicContact CB-CD1 4.18Å; L1272-I1284 HydrophobicContact CD2-CD1 3.68Å; L1272-I1284 VanDerWaalsContact CD2-CD1 3.41Å; L1272-I1284 HydrophobicContact CG-CD1 3.88Å; T1273-I1284 HydrophobicContact CG2-CB 4.41Å; T1273-I1284 HydrophobicContact CG2-CG2 4.01Å; L1282-I1284 PolarHBondContact O-N 3.3Å; I1284-N1286 VanDerWaalsContact C-N 3.34Å; I1284-N1286 PolarHBondContact O-N 3.07Å; I1284-A1287 PolarHBondContact O-N 3.28Å; I1284-L1288 HydrophobicContact CG2-CD1 3.99Å; I1284-L1288 HydrophobicContact CG2-CG 4.41Å; I1284-L1288 WeakPolarHBondContact O-CB 3.36Å; I1284-L1288 WeakPolarHBondContact O-CG 3.35Å; I1284-L1288 PolarHBondContact O-N 3.23Å; I1284-L1550 HydrophobicContact CG2-CD2 3.78Å; I1284-F1561 HydrophobicContact CG1-CZ 4.37Å; I1284-V1570 HydrophobicContact CD1-CG1 3.85Å; I1284-V1570 HydrophobicContact CG1-CG1 3.92Å; I1284-L1574 HydrophobicContact CD1-CD1 4.48Å; I1284-L1574 HydrophobicContact CD1-CD2 4.31Å |
| 1285 | V | 91.1 | Very high | 85.2 | Confident | 1.6 Ų | 1.6 | 47.5 Ų | 47.5 | 1% | 0.01 | 27% | 0.266 | C | S | . | . | H | α-helix | trans | -64.4 | -42.7 | 175.9 | 180 | 0 | 0 | 0 | 0 | 110.5 | T1273 L1282 A1287 L1288 A1289 L1304 F1308 L1317 L1321 L1341 | T1273-V1285 HydrophobicContact CG2-CG2 4.31Å; L1282-V1285 HydrophobicContact CB-CB 3.87Å; L1282-V1285 HydrophobicContact CB-CG2 4.03Å; L1282-V1285 HydrophobicContact CD1-CG2 4.46Å; L1282-V1285 PolarHBondContact O-N 3.14Å; V1285-A1287 VanDerWaalsContact C-N 3.35Å; V1285-A1287 PolarHBondContact O-N 2.86Å; V1285-L1288 PolarHBondContact O-N 3.26Å; V1285-A1289 VanDerWaalsContact O-CB 3.25Å; V1285-A1289 WeakPolarHBondContact O-CB 3.28Å; V1285-A1289 PolarHBondContact O-N 3.13Å; V1285-L1304 HydrophobicContact CG1-CD1 3.87Å; V1285-L1304 HydrophobicContact CG1-CD2 4.31Å; V1285-L1304 HydrophobicContact CG2-CD2 3.93Å; V1285-F1308 HydrophobicContact CG2-CE2 3.87Å; V1285-F1308 HydrophobicContact CG2-CZ 3.72Å; V1285-L1317 HydrophobicContact CG1-CD1 3.98Å; V1285-L1321 HydrophobicContact CG1-CD2 4.48Å; V1285-L1341 HydrophobicContact CG1-CD2 4.43Å |
| 1286 | N | 88.7 | Confident | 85 | Confident | 23 Ų | 23 | 45.2 Ų | 45.2 | 12% | 0.123 | 25% | 0.254 | C | S | . | . | H | α-helix | trans | -61.2 | -43.6 | 175.6 | -80.1 | -22.7 | 0 | 0 | 0 | 111.8 | E1281 L1282 P1283 I1284 A1289 H1290 K1324 F1560 | E1281-N1286 PolarHBondContact OE2-ND2 3.18Å; L1282-N1286 WeakPolarHBondContact O-CB 3.33Å; L1282-N1286 PolarHBondContact O-N 3.13Å; L1282-N1286 PolarHBondContact O-ND2 3.25Å; P1283-N1286 PolarHBondContact O-N 3.18Å; I1284-N1286 VanDerWaalsContact C-N 3.34Å; I1284-N1286 PolarHBondContact O-N 3.07Å; N1286-A1289 PolarHBondContact O-N 3.07Å; N1286-H1290 PolarHBondContact O-N 3.25Å; N1286-K1324 PolarHBondContact OD1-NZ 3.01Å; N1286-F1560 HydrophobicContact CB-CE1 4.38Å; N1286-F1560 HydrophobicContact CB-CZ 4.39Å |
| 1287 | A | 89 | Confident | 85 | Confident | 0.2 Ų | 0.2 | 42.7 Ų | 42.7 | 0% | 0.002 | 24% | 0.24 | C | C | . | . | H | α-helix | trans | -61.9 | -51.5 | 175.7 | 0 | 0 | 0 | 0 | 0 | 110.9 | P1283 I1284 V1285 A1289 H1290 V1291 I1557 F1560 F1561 | P1283-A1287 WeakPolarHBondContact O-CB 3.36Å; P1283-A1287 PolarHBondContact O-N 3.11Å; I1284-A1287 PolarHBondContact O-N 3.28Å; V1285-A1287 VanDerWaalsContact C-N 3.35Å; V1285-A1287 PolarHBondContact O-N 2.86Å; A1287-A1289 VanDerWaalsContact C-N 3.33Å; A1287-A1289 PolarHBondContact O-N 3.09Å; A1287-H1290 PolarHBondContact O-N 3.16Å; A1287-H1290 VanDerWaalsContact O-N 3.11Å; A1287-V1291 VanDerWaalsContact O-CB 3.29Å; A1287-V1291 WeakPolarHBondContact O-CB 3.22Å; A1287-V1291 WeakPolarHBondContact O-CG1 3.39Å; A1287-V1291 VanDerWaalsContact O-CG2 3.24Å; A1287-V1291 WeakPolarHBondContact O-CG2 3.33Å; A1287-V1291 PolarHBondContact O-N 2.98Å; A1287-I1557 HydrophobicContact CB-CG1 4.48Å; A1287-I1557 HydrophobicContact CB-CG2 4.17Å; A1287-F1560 HydrophobicContact CB-CB 4.47Å; A1287-F1560 HydrophobicContact CB-CD1 3.51Å; A1287-F1560 VanDerWaalsContact CB-CD1 3.48Å; A1287-F1560 HydrophobicContact CB-CE1 3.84Å; A1287-F1560 HydrophobicContact CB-CG 4.08Å; A1287-F1561 HydrophobicContact CB-CE2 4.26Å; A1287-F1561 HydrophobicContact CB-CZ 4.22Å |
| 1288 | L | 90.5 | Very high | 85 | Confident | 0 Ų | 0 | 45.3 Ų | 45.3 | 0% | 0 | 25% | 0.254 | C | S | . | . | H | α-helix | trans | -58.8 | -42.5 | 178.2 | -74.5 | 170.9 | 0 | 0 | 0 | 112.1 | I1284 V1285 H1290 V1291 V1292 L1300 L1546 L1549 L1550 I1557 | I1284-L1288 HydrophobicContact CG2-CD1 3.99Å; I1284-L1288 HydrophobicContact CG2-CG 4.41Å; I1284-L1288 WeakPolarHBondContact O-CB 3.36Å; I1284-L1288 WeakPolarHBondContact O-CG 3.35Å; I1284-L1288 PolarHBondContact O-N 3.23Å; V1285-L1288 PolarHBondContact O-N 3.26Å; L1288-H1290 PolarHBondContact O-N 2.97Å; L1288-V1291 PolarHBondContact O-N 3.24Å; L1288-V1292 HydrophobicContact CB-CG2 4.28Å; L1288-V1292 HydrophobicContact CD2-CG2 3.85Å; L1288-V1292 VanDerWaalsContact O-CB 3.23Å; L1288-V1292 WeakPolarHBondContact O-CB 3.36Å; L1288-V1292 WeakPolarHBondContact O-CG2 3.29Å; L1288-V1292 PolarHBondContact O-N 3.07Å; L1288-V1292 VanDerWaalsContact O-N 3.09Å; L1288-L1300 HydrophobicContact CB-CD1 4.11Å; L1288-L1300 HydrophobicContact CB-CD2 4.09Å; L1288-L1300 HydrophobicContact CD1-CD1 4.04Å; L1288-L1300 HydrophobicContact CG-CD1 4.48Å; L1288-L1546 HydrophobicContact CD1-CD1 4.18Å; L1288-L1549 HydrophobicContact CD2-CB 4.32Å; L1288-L1550 HydrophobicContact CD1-CD2 4.16Å; L1288-L1550 HydrophobicContact CD2-CD2 4.17Å; L1288-L1550 HydrophobicContact CG-CD2 4.32Å; L1288-I1557 HydrophobicContact CD2-CD1 3.94Å |
| 1289 | A | 88.7 | Confident | 85.1 | Confident | 36.6 Ų | 36.6 | 40.1 Ų | 40.1 | 30% | 0.302 | 22% | 0.22 | S | C | . | . | H | α-helix | trans | -60.6 | -28.2 | 177.5 | 0 | 0 | 0 | 0 | 0 | 113.3 | V1285 N1286 A1287 L1341 | V1285-A1289 VanDerWaalsContact O-CB 3.25Å; V1285-A1289 WeakPolarHBondContact O-CB 3.28Å; V1285-A1289 PolarHBondContact O-N 3.13Å; N1286-A1289 PolarHBondContact O-N 3.07Å; A1287-A1289 VanDerWaalsContact C-N 3.33Å; A1287-A1289 PolarHBondContact O-N 3.09Å; A1289-L1341 HydrophobicContact CB-CB 4.33Å; A1289-L1341 HydrophobicContact CB-CD2 3.44Å; A1289-L1341 VanDerWaalsContact CB-CD2 3.44Å; A1289-L1341 HydrophobicContact CB-CG 4.49Å |
| 1290 | H | 86.4 | Confident | 85.7 | Confident | 136.6 Ų | 136.6 | 35.2 Ų | 35.2 | 63% | 0.632 | 19% | 0.194 | S | C | * | . | H | α-helix | trans | -91.1 | -35.9 | -178.6 | -152.5 | 74.4 | 0 | 0 | 0 | 113 | N1286 A1287 L1288 F1560 | N1286-H1290 PolarHBondContact O-N 3.25Å; A1287-H1290 PolarHBondContact O-N 3.16Å; A1287-H1290 VanDerWaalsContact O-N 3.11Å; L1288-H1290 PolarHBondContact O-N 2.97Å; H1290-F1560 HydrophobicContact CB-CD2 3.99Å; H1290-F1560 HydrophobicContact CB-CE2 3.81Å; H1290-F1560 AromaticContact CD2-CD2 3.79Å; H1290-F1560 AromaticContact CG-CD2 3.9Å; H1290-F1560 AromaticContact CG-CE2 3.94Å |
| 1291 | V | 88.8 | Confident | 86.2 | Confident | 13.6 Ų | 13.6 | 34.1 Ų | 34.1 | 8% | 0.082 | 18% | 0.183 | C | C | . | . | H | α-helix | trans | -95.1 | -28.5 | -169.9 | -103 | 0 | 0 | 0 | 0 | 113.9 | A1287 L1288 Y1553 R1556 I1557 F1560 | A1287-V1291 VanDerWaalsContact O-CB 3.29Å; A1287-V1291 WeakPolarHBondContact O-CB 3.22Å; A1287-V1291 WeakPolarHBondContact O-CG1 3.39Å; A1287-V1291 VanDerWaalsContact O-CG2 3.24Å; A1287-V1291 WeakPolarHBondContact O-CG2 3.33Å; A1287-V1291 PolarHBondContact O-N 2.98Å; L1288-V1291 PolarHBondContact O-N 3.24Å; V1291-Y1553 HydrophobicContact CG1-CD1 3.86Å; V1291-Y1553 HydrophobicContact CG1-CG 4.04Å; V1291-Y1553 HydrophobicContact CG2-CD1 4.48Å; V1291-Y1553 HydrophobicContact CG2-CG 4.2Å; V1291-Y1553 WeakPolarHBondContact O-CE1 3.49Å; V1291-R1556 HydrophobicContact CB-CB 4.16Å; V1291-R1556 HydrophobicContact CG1-CB 3.49Å; V1291-R1556 HydrophobicContact CG1-CG 4.22Å; V1291-R1556 WeakPolarHBondContact CG1-O 3.31Å; V1291-R1556 HydrophobicContact CG2-CB 4.32Å; V1291-I1557 HydrophobicContact CB-CG1 4.45Å; V1291-I1557 HydrophobicContact CG1-CG1 4.32Å; V1291-I1557 HydrophobicContact CG2-CG1 4.02Å; V1291-F1560 HydrophobicContact CG1-CB 4.34Å; V1291-F1560 HydrophobicContact CG2-CB 4.23Å |
| 1292 | V | 87.1 | Confident | 86.2 | Confident | 11.2 Ų | 11.2 | 34.5 Ų | 34.5 | 7% | 0.068 | 18% | 0.181 | C | C | . | . | S | Bend | trans | -72.1 | 132.3 | -175.7 | 174.7 | 0 | 0 | 0 | 0 | 110.2 | L1288 H1296 M1297 L1300 Y1553 | L1288-V1292 HydrophobicContact CB-CG2 4.28Å; L1288-V1292 HydrophobicContact CD2-CG2 3.85Å; L1288-V1292 VanDerWaalsContact O-CB 3.23Å; L1288-V1292 WeakPolarHBondContact O-CB 3.36Å; L1288-V1292 WeakPolarHBondContact O-CG2 3.29Å; L1288-V1292 PolarHBondContact O-N 3.07Å; L1288-V1292 VanDerWaalsContact O-N 3.09Å; V1292-H1296 HydrophobicContact CG1-CB 3.73Å; V1292-M1297 HydrophobicContact CB-SD 4.07Å; V1292-M1297 HydrophobicContact CG1-CG 4.35Å; V1292-M1297 HydrophobicContact CG1-SD 4Å; V1292-L1300 HydrophobicContact CB-CD2 4.08Å; V1292-L1300 HydrophobicContact CG1-CD2 4.28Å; V1292-L1300 HydrophobicContact CG2-CD2 4.07Å; V1292-Y1553 HydrophobicContact CB-CE2 4.25Å; V1292-Y1553 HydrophobicContact CG1-CE2 4.11Å; V1292-Y1553 HydrophobicContact CG2-CD2 3.8Å; V1292-Y1553 HydrophobicContact CG2-CE2 3.86Å; V1292-Y1553 HydrophobicContact CG2-CG 4.44Å |
| 1293 | Q | 84.4 | Confident | 86.1 | Confident | 78.4 Ų | 78.4 | 34.5 Ų | 34.5 | 37% | 0.366 | 18% | 0.181 | S | C | . | . | trans | -77.2 | 160.6 | -178.8 | -64.2 | 178.6 | -0.4 | 0 | 0 | 111.8 | E1295 H1296 M1297 Y1553 | Q1293-E1295 HydrophobicContact CB-CG 3.99Å; Q1293-E1295 PolarHBondContact O-N 3.14Å; Q1293-E1295 VanDerWaalsContact O-N 3.15Å; Q1293-E1295 PolarHBondContact OE1-OE1 3.32Å; Q1293-H1296 PolarHBondContact O-N 3.16Å; Q1293-H1296 VanDerWaalsContact O-N 3.12Å; Q1293-M1297 WeakPolarHBondContact O-CG 3.45Å; Q1293-M1297 PolarHBondContact O-N 3.1Å; Q1293-Y1553 WeakPolarHBondContact CB-OH 3.48Å; Q1293-Y1553 HydrophobicContact CG-CE1 4.26Å; Q1293-Y1553 PolarHBondContact N-OH 3.22Å; Q1293-Y1553 VanDerWaalsContact N-OH 3.1Å | ||
| 1294 | T | 81 | Confident | 86.2 | Confident | 94.6 Ų | 94.6 | 34.4 Ų | 34.4 | 58% | 0.58 | 18% | 0.18 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -55.6 | -31.1 | -176.4 | 39.6 | 0 | 0 | 0 | 0 | 114.3 | H1296 M1297 N1339 | T1294-H1296 VanDerWaalsContact C-N 3.31Å; T1294-H1296 PolarHBondContact O-N 3.05Å; T1294-M1297 HydrophobicContact CG2-CE 3.86Å; T1294-M1297 PolarHBondContact O-N 3.22Å; T1294-N1339 WeakPolarHBondContact CG2-ND2 3.32Å |
| 1295 | E | 77.3 | Confident | 86.1 | Confident | 101.4 Ų | 101.4 | 34.3 Ų | 34.3 | 47% | 0.474 | 18% | 0.18 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -61 | -38.2 | 176.3 | 52.8 | -179.2 | -164.5 | 0 | 0 | 113.5 | Q1293 | Q1293-E1295 HydrophobicContact CB-CG 3.99Å; Q1293-E1295 PolarHBondContact O-N 3.14Å; Q1293-E1295 VanDerWaalsContact O-N 3.15Å; Q1293-E1295 PolarHBondContact OE1-OE1 3.32Å |
| 1296 | H | 82.2 | Confident | 85.6 | Confident | 21 Ų | 21 | 35.4 Ų | 35.4 | 10% | 0.097 | 19% | 0.187 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -99.1 | -1.2 | -177.5 | -63.5 | -66.5 | 0 | 0 | 0 | 113.1 | V1292 Q1293 T1294 D1298 G1299 L1300 L1549 R1552 Y1553 E1589 | V1292-H1296 HydrophobicContact CG1-CB 3.73Å; Q1293-H1296 PolarHBondContact O-N 3.16Å; Q1293-H1296 VanDerWaalsContact O-N 3.12Å; T1294-H1296 VanDerWaalsContact C-N 3.31Å; T1294-H1296 PolarHBondContact O-N 3.05Å; H1296-D1298 VanDerWaalsContact C-N 3.33Å; H1296-D1298 PolarHBondContact O-N 2.99Å; H1296-G1299 PolarHBondContact O-N 3.02Å; H1296-G1299 VanDerWaalsContact O-N 3.15Å; H1296-L1300 PolarHBondContact O-N 3.26Å; H1296-L1549 HydrophobicContact CB-CD2 4.11Å; H1296-R1552 PolarHBondContact NE2-NE 3.02Å; H1296-Y1553 AromaticContact CD2-CE2 3.84Å; H1296-Y1553 AromaticContact CD2-CZ 3.87Å; H1296-Y1553 PolarHBondContact CD2-OH 3.13Å; H1296-Y1553 VanDerWaalsContact CD2-OH 3.26Å; H1296-E1589 VanDerWaalsContact CE1-CD 3.43Å; H1296-E1589 IonicContact CE1-OE1 3.45Å; H1296-E1589 PolarHBondContact CE1-OE1 3.21Å; H1296-E1589 IonicContact CE1-OE2 3.31Å; H1296-E1589 PolarHBondContact CE1-OE2 3.21Å; H1296-E1589 IonicContact CG-OE1 2.93Å; H1296-E1589 VanDerWaalsContact ND1-CD 3.34Å; H1296-E1589 IonicContact ND1-OE1 2.78Å; H1296-E1589 PolarHBondContact ND1-OE1 2.95Å; H1296-E1589 IonicContact ND1-OE2 3.26Å; H1296-E1589 PolarHBondContact ND1-OE2 3.34Å |
| 1297 | M | 84.8 | Confident | 85.4 | Confident | 21.2 Ų | 21.2 | 34.4 Ų | 34.4 | 10% | 0.104 | 18% | 0.181 | C | C | . | . | H | α-helix | trans | -66.1 | -34.1 | -173.8 | -106.9 | -122.2 | -88.2 | 0 | 0 | 113.3 | V1292 Q1293 T1294 G1299 L1300 A1301 N1339 L1341 K1344 | V1292-M1297 HydrophobicContact CB-SD 4.07Å; V1292-M1297 HydrophobicContact CG1-CG 4.35Å; V1292-M1297 HydrophobicContact CG1-SD 4Å; Q1293-M1297 WeakPolarHBondContact O-CG 3.45Å; Q1293-M1297 PolarHBondContact O-N 3.1Å; T1294-M1297 HydrophobicContact CG2-CE 3.86Å; T1294-M1297 PolarHBondContact O-N 3.22Å; M1297-G1299 VanDerWaalsContact C-N 3.34Å; M1297-L1300 PolarHBondContact O-N 3.02Å; M1297-L1300 HydrophobicContact SD-CD2 4.13Å; M1297-A1301 VanDerWaalsContact O-CB 3.31Å; M1297-A1301 WeakPolarHBondContact O-CB 3.3Å; M1297-A1301 PolarHBondContact O-N 3.09Å; M1297-N1339 WeakPolarHBondContact CE-O 3.38Å; M1297-L1341 HydrophobicContact CE-CB 3.8Å; M1297-L1341 HydrophobicContact CE-CD1 4.34Å; M1297-L1341 HydrophobicContact SD-CB 4.41Å; M1297-K1344 HydrophobicContact CB-CD 3.74Å; M1297-K1344 VanDerWaalsContact CB-CE 3.5Å; M1297-K1344 HydrophobicContact CG-CD 4.12Å; M1297-K1344 HydrophobicContact SD-CD 3.96Å; M1297-K1344 HydrophobicContact SD-CG 4.42Å |
| 1298 | D | 81.8 | Confident | 85.4 | Confident | 77.6 Ų | 77.6 | 34.4 Ų | 34.4 | 42% | 0.415 | 18% | 0.181 | S | C | . | . | H | α-helix | trans | -68.2 | -38.1 | 174.4 | -74.1 | -59.1 | 0 | 0 | 0 | 111.9 | H1296 A1301 R1302 K1344 W1593 | H1296-D1298 VanDerWaalsContact C-N 3.33Å; H1296-D1298 PolarHBondContact O-N 2.99Å; D1298-A1301 PolarHBondContact O-N 3.07Å; D1298-R1302 WeakPolarHBondContact O-CB 3.23Å; D1298-R1302 PolarHBondContact O-N 3.24Å; D1298-R1302 VanDerWaalsContact O-N 3.09Å; D1298-K1344 VanDerWaalsContact OD1-CD 3.31Å; D1298-K1344 WeakPolarHBondContact OD1-CD 3.3Å; D1298-K1344 WeakPolarHBondContact OD1-CE 3.37Å; D1298-K1344 IonicContact OD1-NZ 2.95Å; D1298-K1344 PolarHBondContact OD1-NZ 3.21Å; D1298-K1344 IonicContact OD2-NZ 3.41Å; D1298-K1344 PolarHBondContact OD2-NZ 3.17Å; D1298-W1593 HydrophobicContact CB-CH2 4.02Å |
| 1299 | G | 79.5 | Confident | 85.1 | Confident | 17.8 Ų | 17.8 | 35.1 Ų | 35.1 | 18% | 0.184 | 19% | 0.187 | C | C | . | . | H | α-helix | trans | -63.4 | -46.5 | 173.3 | 0 | 0 | 0 | 0 | 0 | 111.6 | H1296 M1297 A1301 R1302 L1303 | H1296-G1299 PolarHBondContact O-N 3.02Å; H1296-G1299 VanDerWaalsContact O-N 3.15Å; M1297-G1299 VanDerWaalsContact C-N 3.34Å; G1299-A1301 VanDerWaalsContact C-N 3.35Å; G1299-A1301 PolarHBondContact O-N 2.97Å; G1299-R1302 PolarHBondContact O-N 3.07Å; G1299-L1303 VanDerWaalsContact O-CB 3.28Å; G1299-L1303 WeakPolarHBondContact O-CB 3.33Å; G1299-L1303 PolarHBondContact O-N 3.06Å |
| 1300 | L | 89.3 | Confident | 84.5 | Confident | 0.2 Ų | 0.2 | 35.3 Ų | 35.3 | 0% | 0.001 | 19% | 0.186 | C | C | . | . | H | α-helix | trans | -60.7 | -44.7 | 175.1 | 178.1 | 64.2 | 0 | 0 | 0 | 112 | L1288 V1292 H1296 M1297 R1302 L1303 L1304 L1341 L1549 | L1288-L1300 HydrophobicContact CB-CD1 4.11Å; L1288-L1300 HydrophobicContact CB-CD2 4.09Å; L1288-L1300 HydrophobicContact CD1-CD1 4.04Å; L1288-L1300 HydrophobicContact CG-CD1 4.48Å; V1292-L1300 HydrophobicContact CB-CD2 4.08Å; V1292-L1300 HydrophobicContact CG1-CD2 4.28Å; V1292-L1300 HydrophobicContact CG2-CD2 4.07Å; H1296-L1300 PolarHBondContact O-N 3.26Å; M1297-L1300 PolarHBondContact O-N 3.02Å; M1297-L1300 HydrophobicContact SD-CD2 4.13Å; L1300-R1302 VanDerWaalsContact C-N 3.33Å; L1300-R1302 PolarHBondContact O-N 3.12Å; L1300-L1303 HydrophobicContact CD1-CD2 4.12Å; L1300-L1303 WeakPolarHBondContact O-CB 3.37Å; L1300-L1303 PolarHBondContact O-N 3.23Å; L1300-L1304 HydrophobicContact CD1-CD1 3.87Å; L1300-L1304 HydrophobicContact CD1-CD2 4.38Å; L1300-L1304 HydrophobicContact CD1-CG 3.87Å; L1300-L1304 HydrophobicContact CD2-CD1 4.5Å; L1300-L1304 HydrophobicContact CG-CD1 3.91Å; L1300-L1304 HydrophobicContact CG-CG 4.3Å; L1300-L1304 WeakPolarHBondContact O-CB 3.27Å; L1300-L1304 VanDerWaalsContact O-CG 3.32Å; L1300-L1304 WeakPolarHBondContact O-CG 3.36Å; L1300-L1304 PolarHBondContact O-N 3.24Å; L1300-L1341 HydrophobicContact CD2-CD1 3.9Å; L1300-L1341 HydrophobicContact CD2-CD2 4.19Å; L1300-L1341 HydrophobicContact CG-CD1 3.98Å; L1300-L1549 HydrophobicContact CB-CD1 4.21Å; L1300-L1549 HydrophobicContact CD1-CD1 4.04Å |
| 1301 | A | 89.1 | Confident | 84.2 | Confident | 0.8 Ų | 0.8 | 32.3 Ų | 32.3 | 1% | 0.007 | 17% | 0.171 | C | C | . | . | H | α-helix | trans | -60.6 | -45 | 178.8 | 0 | 0 | 0 | 0 | 0 | 111.7 | M1297 D1298 G1299 L1303 L1304 T1305 L1341 K1344 V1345 | M1297-A1301 VanDerWaalsContact O-CB 3.31Å; M1297-A1301 WeakPolarHBondContact O-CB 3.3Å; M1297-A1301 PolarHBondContact O-N 3.09Å; D1298-A1301 PolarHBondContact O-N 3.07Å; G1299-A1301 VanDerWaalsContact C-N 3.35Å; G1299-A1301 PolarHBondContact O-N 2.97Å; A1301-L1303 PolarHBondContact O-N 3.29Å; A1301-L1304 PolarHBondContact O-N 2.85Å; A1301-T1305 WeakPolarHBondContact O-CB 3.3Å; A1301-T1305 PolarHBondContact O-N 2.97Å; A1301-T1305 VanDerWaalsContact O-N 3.08Å; A1301-T1305 PolarHBondContact O-OG1 3.19Å; A1301-L1341 HydrophobicContact CB-CD1 4.16Å; A1301-K1344 HydrophobicContact CB-CB 3.55Å; A1301-K1344 VanDerWaalsContact CB-CB 3.49Å; A1301-V1345 HydrophobicContact CB-CG2 3.84Å |
| 1302 | R | 83.8 | Confident | 83.9 | Confident | 78.4 Ų | 78.4 | 35.8 Ų | 35.8 | 30% | 0.296 | 19% | 0.19 | S | C | . | . | H | α-helix | trans | -63 | -45.8 | 175.3 | -173.3 | 177.9 | -63.7 | -156.1 | 2.2 | 111.8 | D1298 G1299 L1300 L1304 T1305 T1306 C1348 V1596 | D1298-R1302 WeakPolarHBondContact O-CB 3.23Å; D1298-R1302 PolarHBondContact O-N 3.24Å; D1298-R1302 VanDerWaalsContact O-N 3.09Å; G1299-R1302 PolarHBondContact O-N 3.07Å; L1300-R1302 VanDerWaalsContact C-N 3.33Å; L1300-R1302 PolarHBondContact O-N 3.12Å; R1302-L1304 PolarHBondContact O-N 3.22Å; R1302-T1305 PolarHBondContact O-N 3.26Å; R1302-T1306 WeakPolarHBondContact O-CB 3.33Å; R1302-T1306 PolarHBondContact O-N 3.23Å; R1302-T1306 PolarHBondContact O-OG1 3.16Å; R1302-C1348 VanDerWaalsContact CA-SG 3.54Å; R1302-C1348 VanDerWaalsContact CB-SG 3.59Å; R1302-V1596 VanDerWaalsContact NH1-CG2 3.33Å |
| 1303 | L | 86.5 | Confident | 83.9 | Confident | 6.8 Ų | 6.8 | 37.2 Ų | 37.2 | 4% | 0.036 | 20% | 0.196 | C | C | . | . | H | α-helix | trans | -53.7 | -57.1 | 176.6 | 172.8 | 77.5 | 0 | 0 | 0 | 110.9 | G1299 L1300 A1301 T1305 T1306 L1307 P1542 A1545 L1546 L1549 | G1299-L1303 VanDerWaalsContact O-CB 3.28Å; G1299-L1303 WeakPolarHBondContact O-CB 3.33Å; G1299-L1303 PolarHBondContact O-N 3.06Å; L1300-L1303 HydrophobicContact CD1-CD2 4.12Å; L1300-L1303 WeakPolarHBondContact O-CB 3.37Å; L1300-L1303 PolarHBondContact O-N 3.23Å; A1301-L1303 PolarHBondContact O-N 3.29Å; L1303-T1305 VanDerWaalsContact C-N 3.32Å; L1303-T1305 PolarHBondContact O-N 3.18Å; L1303-T1306 PolarHBondContact O-N 3.15Å; L1303-T1306 PolarHBondContact O-OG1 3.13Å; L1303-L1307 HydrophobicContact CD1-CB 4.49Å; L1303-L1307 HydrophobicContact CD1-CD1 4.22Å; L1303-L1307 WeakPolarHBondContact O-CB 3.36Å; L1303-L1307 PolarHBondContact O-N 3.16Å; L1303-P1542 HydrophobicContact CD1-CB 3.84Å; L1303-P1542 WeakPolarHBondContact CD1-O 3.24Å; L1303-A1545 HydrophobicContact CD1-CB 3.87Å; L1303-A1545 VanDerWaalsContact CD1-CB 3.48Å; L1303-L1546 HydrophobicContact CD1-CB 4.02Å; L1303-L1546 VanDerWaalsContact CD1-N 3.34Å; L1303-L1546 HydrophobicContact CD2-CB 3.98Å; L1303-L1546 HydrophobicContact CD2-CD1 3.99Å; L1303-L1549 HydrophobicContact CD2-CD1 4.01Å |
| 1304 | L | 90.3 | Very high | 84.1 | Confident | 0 Ų | 0 | 34.7 Ų | 34.7 | 0% | 0 | 19% | 0.185 | C | C | . | . | H | α-helix | trans | -62.8 | -42.3 | -176.4 | -67.9 | 174.8 | 0 | 0 | 0 | 111.5 | V1285 L1300 A1301 R1302 T1306 L1307 F1308 L1317 L1341 | V1285-L1304 HydrophobicContact CG1-CD1 3.87Å; V1285-L1304 HydrophobicContact CG1-CD2 4.31Å; V1285-L1304 HydrophobicContact CG2-CD2 3.93Å; L1300-L1304 HydrophobicContact CD1-CD1 3.87Å; L1300-L1304 HydrophobicContact CD1-CD2 4.38Å; L1300-L1304 HydrophobicContact CD1-CG 3.87Å; L1300-L1304 HydrophobicContact CD2-CD1 4.5Å; L1300-L1304 HydrophobicContact CG-CD1 3.91Å; L1300-L1304 HydrophobicContact CG-CG 4.3Å; L1300-L1304 WeakPolarHBondContact O-CB 3.27Å; L1300-L1304 VanDerWaalsContact O-CG 3.32Å; L1300-L1304 WeakPolarHBondContact O-CG 3.36Å; L1300-L1304 PolarHBondContact O-N 3.24Å; A1301-L1304 PolarHBondContact O-N 2.85Å; R1302-L1304 PolarHBondContact O-N 3.22Å; L1304-T1306 VanDerWaalsContact C-N 3.32Å; L1304-T1306 PolarHBondContact O-N 3.15Å; L1304-L1307 PolarHBondContact O-N 3.21Å; L1304-F1308 HydrophobicContact CD2-CD2 4.37Å; L1304-F1308 HydrophobicContact CD2-CE2 3.93Å; L1304-F1308 WeakPolarHBondContact O-CB 3.37Å; L1304-F1308 VanDerWaalsContact O-CD2 3.31Å; L1304-F1308 WeakPolarHBondContact O-CD2 3.38Å; L1304-F1308 PolarHBondContact O-N 3.08Å; L1304-L1317 HydrophobicContact CB-CD2 3.95Å; L1304-L1341 HydrophobicContact CD1-CD1 4.24Å; L1304-L1341 HydrophobicContact CD1-CD2 3.84Å; L1304-L1341 HydrophobicContact CD1-CG 4.4Å |
| 1305 | T | 87.4 | Confident | 84.4 | Confident | 0 Ų | 0 | 33.4 Ų | 33.4 | 0% | 0 | 17% | 0.173 | C | C | . | . | H | α-helix | trans | -59.6 | -48.1 | 177.9 | -53.2 | 0 | 0 | 0 | 0 | 111.1 | A1301 R1302 L1303 A1309 L1314 C1348 C1349 L1352 Y1353 | A1301-T1305 WeakPolarHBondContact O-CB 3.3Å; A1301-T1305 PolarHBondContact O-N 2.97Å; A1301-T1305 VanDerWaalsContact O-N 3.08Å; A1301-T1305 PolarHBondContact O-OG1 3.19Å; R1302-T1305 PolarHBondContact O-N 3.26Å; L1303-T1305 VanDerWaalsContact C-N 3.32Å; L1303-T1305 PolarHBondContact O-N 3.18Å; T1305-A1309 WeakPolarHBondContact O-CB 3.42Å; T1305-A1309 PolarHBondContact O-N 3.14Å; T1305-A1309 VanDerWaalsContact O-N 3.11Å; T1305-L1314 HydrophobicContact CG2-CD1 4.14Å; T1305-C1348 HydrophobicContact CG2-CB 4.5Å; T1305-C1349 VanDerWaalsContact CG2-SG 3.54Å; T1305-C1349 WeakPolarHBondContact CG2-SG 3.16Å; T1305-L1352 HydrophobicContact CG2-CD1 3.8Å; T1305-Y1353 HydrophobicContact CG2-CE2 4.41Å |
| 1306 | T | 81.7 | Confident | 85 | Confident | 25 Ų | 25 | 32.1 Ų | 32.1 | 15% | 0.153 | 17% | 0.166 | C | C | . | . | H | α-helix | trans | -71.7 | -41 | -178.3 | -14 | 0 | 0 | 0 | 0 | 112.1 | R1302 L1303 L1304 A1309 S1310 L1352 Y1537 P1542 | R1302-T1306 WeakPolarHBondContact O-CB 3.33Å; R1302-T1306 PolarHBondContact O-N 3.23Å; R1302-T1306 PolarHBondContact O-OG1 3.16Å; L1303-T1306 PolarHBondContact O-N 3.15Å; L1303-T1306 PolarHBondContact O-OG1 3.13Å; L1304-T1306 VanDerWaalsContact C-N 3.32Å; L1304-T1306 PolarHBondContact O-N 3.15Å; T1306-A1309 PolarHBondContact O-N 3.02Å; T1306-S1310 WeakPolarHBondContact O-CB 3.3Å; T1306-S1310 PolarHBondContact O-N 2.96Å; T1306-L1352 HydrophobicContact CG2-CD1 4.43Å; T1306-Y1537 HydrophobicContact CG2-CD2 4.09Å; T1306-Y1537 HydrophobicContact CG2-CE2 4.5Å; T1306-Y1537 HydrophobicContact CG2-CG 4.28Å; T1306-P1542 HydrophobicContact CG2-CG 4.21Å |
| 1307 | L | 84.9 | Confident | 85.5 | Confident | 0.8 Ų | 0.8 | 31.1 Ų | 31.1 | 0% | 0.004 | 16% | 0.162 | C | C | . | . | H | α-helix | trans | -64.7 | -49.5 | -179.3 | -171.7 | 116 | 0 | 0 | 0 | 111.3 | V1270 T1273 T1274 L1303 L1304 A1309 S1310 K1311 P1542 L1546 | V1270-L1307 HydrophobicContact CB-CD1 4.42Å; V1270-L1307 HydrophobicContact CG1-CD1 3.98Å; V1270-L1307 HydrophobicContact CG1-CD2 4.31Å; V1270-L1307 HydrophobicContact CG1-CG 4.14Å; V1270-L1307 HydrophobicContact CG2-CD1 3.89Å; T1273-L1307 HydrophobicContact CG2-CD2 4.23Å; T1274-L1307 HydrophobicContact CG2-CD2 3.72Å; T1274-L1307 VanDerWaalsContact CG2-CD2 3.45Å; L1303-L1307 HydrophobicContact CD1-CB 4.49Å; L1303-L1307 HydrophobicContact CD1-CD1 4.22Å; L1303-L1307 WeakPolarHBondContact O-CB 3.36Å; L1303-L1307 PolarHBondContact O-N 3.16Å; L1304-L1307 PolarHBondContact O-N 3.21Å; L1307-A1309 VanDerWaalsContact C-N 3.34Å; L1307-A1309 PolarHBondContact O-N 3.15Å; L1307-S1310 PolarHBondContact O-N 3.29Å; L1307-S1310 PolarHBondContact O-OG 3.13Å; L1307-K1311 PolarHBondContact O-N 3.07Å; L1307-P1542 HydrophobicContact CB-CB 4.37Å; L1307-P1542 HydrophobicContact CD1-CB 3.94Å; L1307-P1542 HydrophobicContact CD1-CG 4.38Å; L1307-L1546 HydrophobicContact CD1-CD2 4.06Å; L1307-L1546 HydrophobicContact CD2-CD2 4.38Å |
| 1308 | F | 88.9 | Confident | 85.8 | Confident | 0.2 Ų | 0.2 | 30.3 Ų | 30.3 | 0% | 0.001 | 16% | 0.158 | C | C | . | . | H | α-helix | trans | -72 | -31.5 | 179.8 | -80.3 | -104.5 | 0 | 0 | 0 | 112 | T1274 L1282 V1285 L1304 S1310 K1311 N1312 L1313 L1314 L1317 | T1274-F1308 HydrophobicContact CG2-CD1 4.43Å; T1274-F1308 HydrophobicContact CG2-CD2 4.41Å; T1274-F1308 HydrophobicContact CG2-CE1 4.19Å; T1274-F1308 HydrophobicContact CG2-CE2 4.18Å; T1274-F1308 HydrophobicContact CG2-CG 4.5Å; T1274-F1308 HydrophobicContact CG2-CZ 4.02Å; L1282-F1308 HydrophobicContact CD1-CE1 4.02Å; L1282-F1308 HydrophobicContact CD1-CZ 4.2Å; L1282-F1308 HydrophobicContact CD2-CE1 3.9Å; L1282-F1308 HydrophobicContact CD2-CZ 4Å; V1285-F1308 HydrophobicContact CG2-CE2 3.87Å; V1285-F1308 HydrophobicContact CG2-CZ 3.72Å; L1304-F1308 HydrophobicContact CD2-CD2 4.37Å; L1304-F1308 HydrophobicContact CD2-CE2 3.93Å; L1304-F1308 WeakPolarHBondContact O-CB 3.37Å; L1304-F1308 VanDerWaalsContact O-CD2 3.31Å; L1304-F1308 WeakPolarHBondContact O-CD2 3.38Å; L1304-F1308 PolarHBondContact O-N 3.08Å; F1308-S1310 VanDerWaalsContact C-N 3.33Å; F1308-S1310 PolarHBondContact O-N 3.4Å; F1308-K1311 CarbonylContact O-C 3.56Å; F1308-K1311 PolarHBondContact O-N 3.21Å; F1308-N1312 PolarHBondContact O-N 3.08Å; F1308-N1312 VanDerWaalsContact O-N 3.16Å; F1308-L1313 HydrophobicContact CB-CB 4.49Å; F1308-L1313 HydrophobicContact CD1-CB 3.68Å; F1308-L1313 WeakPolarHBondContact CD1-O 3.42Å; F1308-L1313 HydrophobicContact CE1-CB 4.41Å; F1308-L1313 HydrophobicContact CG-CB 4.47Å; F1308-L1313 PolarHBondContact O-N 3.22Å; F1308-L1314 PolarHBondContact O-N 3.18Å; F1308-L1317 HydrophobicContact CB-CB 4.19Å; F1308-L1317 HydrophobicContact CB-CD2 3.87Å; F1308-L1317 HydrophobicContact CD1-CB 3.69Å; F1308-L1317 HydrophobicContact CD1-CD1 4.46Å; F1308-L1317 HydrophobicContact CD1-CD2 4.38Å; F1308-L1317 HydrophobicContact CD1-CG 4.39Å; F1308-L1317 HydrophobicContact CD2-CD1 4.37Å; F1308-L1317 HydrophobicContact CD2-CD2 3.83Å; F1308-L1317 HydrophobicContact CD2-CG 4.47Å; F1308-L1317 HydrophobicContact CE1-CB 4.2Å; F1308-L1317 HydrophobicContact CE1-CD1 4.36Å; F1308-L1317 HydrophobicContact CE2-CD1 4.25Å; F1308-L1317 HydrophobicContact CE2-CD2 4.48Å; F1308-L1317 HydrophobicContact CG-CB 3.91Å; F1308-L1317 HydrophobicContact CG-CD1 4.46Å; F1308-L1317 HydrophobicContact CG-CD2 3.76Å; F1308-L1317 HydrophobicContact CG-CG 4.25Å; F1308-L1317 HydrophobicContact CZ-CD1 4.25Å |
| 1309 | A | 82.3 | Confident | 86.3 | Confident | 15.8 Ų | 15.8 | 31.5 Ų | 31.5 | 13% | 0.131 | 16% | 0.157 | C | C | . | . | H | α-helix | trans | -60.4 | -45 | 169.7 | 0 | 0 | 0 | 0 | 0 | 111.6 | T1305 T1306 L1307 K1311 N1312 L1314 Y1353 S1534 | T1305-A1309 WeakPolarHBondContact O-CB 3.42Å; T1305-A1309 PolarHBondContact O-N 3.14Å; T1305-A1309 VanDerWaalsContact O-N 3.11Å; T1306-A1309 PolarHBondContact O-N 3.02Å; L1307-A1309 VanDerWaalsContact C-N 3.34Å; L1307-A1309 PolarHBondContact O-N 3.15Å; A1309-K1311 VanDerWaalsContact C-N 3.26Å; A1309-K1311 PolarHBondContact O-N 3.16Å; A1309-K1311 VanDerWaalsContact O-N 3.15Å; A1309-N1312 PolarHBondContact O-N 3.3Å; A1309-L1314 HydrophobicContact CB-CB 4.45Å; A1309-L1314 HydrophobicContact CB-CD2 4.28Å; A1309-Y1353 VanDerWaalsContact CB-OH 3.28Å; A1309-Y1353 WeakPolarHBondContact CB-OH 3.37Å; A1309-S1534 VanDerWaalsContact C-OG 3.3Å; A1309-S1534 PolarHBondContact O-OG 3.23Å |
| 1310 | S | 76.7 | Confident | 86.8 | Confident | 39.6 Ų | 39.6 | 34.2 Ų | 34.2 | 28% | 0.277 | 16% | 0.164 | S | C | . | . | H | α-helix | trans | -64.5 | -23.9 | -179.6 | 77.3 | 0 | 0 | 0 | 0 | 114.1 | T1306 L1307 F1308 | T1306-S1310 WeakPolarHBondContact O-CB 3.3Å; T1306-S1310 PolarHBondContact O-N 2.96Å; L1307-S1310 PolarHBondContact O-N 3.29Å; L1307-S1310 PolarHBondContact O-OG 3.13Å; F1308-S1310 VanDerWaalsContact C-N 3.33Å; F1308-S1310 PolarHBondContact O-N 3.4Å |
| 1311 | K | 80.8 | Confident | 87 | Confident | 74.6 Ų | 74.6 | 34.9 Ų | 34.9 | 32% | 0.324 | 17% | 0.167 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -99.4 | 7.3 | 176.5 | -61.7 | -63.4 | -172.9 | 179.9 | 0 | 113.1 | D1267 V1270 T1274 L1307 F1308 A1309 L1313 | D1267-K1311 IonicContact OD1-NZ 3.54Å; D1267-K1311 PolarHBondContact OD1-NZ 3.17Å; D1267-K1311 VanDerWaalsContact OD1-NZ 3.12Å; V1270-K1311 HydrophobicContact CG1-CD 4.44Å; V1270-K1311 VanDerWaalsContact CG1-CE 3.44Å; V1270-K1311 HydrophobicContact CG1-CG 4.4Å; T1274-K1311 HydrophobicContact CG2-CG 4.36Å; L1307-K1311 PolarHBondContact O-N 3.07Å; F1308-K1311 CarbonylContact O-C 3.56Å; F1308-K1311 PolarHBondContact O-N 3.21Å; A1309-K1311 VanDerWaalsContact C-N 3.26Å; A1309-K1311 PolarHBondContact O-N 3.16Å; A1309-K1311 VanDerWaalsContact O-N 3.15Å; K1311-L1313 HydrophobicContact CB-CD1 4.19Å; K1311-L1313 HydrophobicContact CB-CG 4.35Å; K1311-L1313 PolarHBondContact O-N 3.27Å |
| 1312 | N | 81.5 | Confident | 87.2 | Confident | 86.6 Ų | 86.6 | 34.9 Ų | 34.9 | 46% | 0.463 | 17% | 0.167 | S | C | . | . | T | Hydrogen-bonded Turn | trans | 56.1 | 31.3 | -174.9 | -56.8 | -42 | 0 | 0 | 0 | 114 | F1308 A1309 N1531 | F1308-N1312 PolarHBondContact O-N 3.08Å; F1308-N1312 VanDerWaalsContact O-N 3.16Å; A1309-N1312 PolarHBondContact O-N 3.3Å; N1312-N1531 PolarHBondContact OD1-OD1 3.09Å; N1312-N1531 VanDerWaalsContact OD1-OD1 3.13Å |
| 1313 | L | 87.6 | Confident | 87.6 | Confident | 40.6 Ų | 40.6 | 33 Ų | 33 | 21% | 0.213 | 16% | 0.164 | C | C | . | . | trans | -113.5 | 12.8 | 179.8 | -67.4 | 170.9 | 0 | 0 | 0 | 112.7 | T1274 I1276 F1308 K1311 H1315 E1316 L1317 | T1274-L1313 HydrophobicContact CG2-CD1 4.43Å; I1276-L1313 HydrophobicContact CD1-CD2 4.41Å; F1308-L1313 HydrophobicContact CB-CB 4.49Å; F1308-L1313 HydrophobicContact CD1-CB 3.68Å; F1308-L1313 WeakPolarHBondContact CD1-O 3.42Å; F1308-L1313 HydrophobicContact CE1-CB 4.41Å; F1308-L1313 HydrophobicContact CG-CB 4.47Å; F1308-L1313 PolarHBondContact O-N 3.22Å; K1311-L1313 HydrophobicContact CB-CD1 4.19Å; K1311-L1313 HydrophobicContact CB-CG 4.35Å; K1311-L1313 PolarHBondContact O-N 3.27Å; L1313-H1315 VanDerWaalsContact C-N 3.27Å; L1313-H1315 PolarHBondContact O-N 3.22Å; L1313-E1316 VanDerWaalsContact C-OE2 3.27Å; L1313-E1316 VanDerWaalsContact CA-OE2 3.25Å; L1313-E1316 WeakPolarHBondContact CA-OE2 3.37Å; L1313-E1316 HydrophobicContact CD2-CG 4.42Å; L1313-E1316 PolarHBondContact O-N 3.34Å; L1313-L1317 PolarHBondContact O-N 3.17Å; L1313-L1317 VanDerWaalsContact O-N 3.09Å | ||
| 1314 | L | 88 | Confident | 87.7 | Confident | 24.8 Ų | 24.8 | 37.2 Ų | 37.2 | 13% | 0.13 | 18% | 0.182 | C | C | . | . | H | α-helix | trans | -61.8 | -36.1 | -177.3 | -179.6 | 62 | 0 | 0 | 0 | 111.8 | T1305 F1308 A1309 L1317 L1318 Y1353 | T1305-L1314 HydrophobicContact CG2-CD1 4.14Å; F1308-L1314 PolarHBondContact O-N 3.18Å; A1309-L1314 HydrophobicContact CB-CB 4.45Å; A1309-L1314 HydrophobicContact CB-CD2 4.28Å; L1314-L1317 HydrophobicContact CD1-CD2 4.37Å; L1314-L1317 PolarHBondContact O-N 3.09Å; L1314-L1318 HydrophobicContact CD1-CD1 4.23Å; L1314-L1318 HydrophobicContact CD1-CG 4.17Å; L1314-L1318 HydrophobicContact CD2-CD1 4.49Å; L1314-L1318 HydrophobicContact CG-CD1 3.91Å; L1314-L1318 HydrophobicContact CG-CG 4.31Å; L1314-L1318 WeakPolarHBondContact O-CB 3.28Å; L1314-L1318 VanDerWaalsContact O-CG 3.23Å; L1314-L1318 WeakPolarHBondContact O-CG 3.41Å; L1314-L1318 PolarHBondContact O-N 3.18Å; L1314-Y1353 HydrophobicContact CD2-CE2 3.96Å; L1314-Y1353 WeakPolarHBondContact CD2-OH 3.46Å |
| 1315 | H | 88 | Confident | 87.6 | Confident | 68.8 Ų | 68.8 | 38.6 Ų | 38.6 | 32% | 0.319 | 19% | 0.189 | S | C | . | . | H | α-helix | trans | -63.3 | -46 | 179.2 | -176.2 | 90.4 | 0 | 0 | 0 | 111.3 | L1313 L1317 L1318 W1319 S1421 V1425 | L1313-H1315 VanDerWaalsContact C-N 3.27Å; L1313-H1315 PolarHBondContact O-N 3.22Å; H1315-L1317 PolarHBondContact O-N 2.77Å; H1315-L1318 PolarHBondContact O-N 3.06Å; H1315-W1319 AromaticContact NE2-CE3 3.92Å; H1315-W1319 WeakPolarHBondContact O-CB 3.35Å; H1315-W1319 PolarHBondContact O-N 3.31Å; H1315-S1421 PolarHBondContact ND1-OG 3.33Å; H1315-V1425 WeakPolarHBondContact CE1-CG2 3.37Å; H1315-V1425 VanDerWaalsContact ND1-CG2 3.3Å; H1315-V1425 WeakPolarHBondContact ND1-CG2 3.35Å |
| 1316 | E | 89.7 | Confident | 87.8 | Confident | 73 Ų | 73 | 38.7 Ų | 38.7 | 34% | 0.341 | 19% | 0.189 | S | C | . | . | H | α-helix | trans | -63.1 | -42.4 | 178 | -67.7 | 80.2 | 175.6 | 0 | 0 | 111.5 | I1276 L1313 W1319 K1320 | I1276-E1316 HydrophobicContact CD1-CB 4.07Å; I1276-E1316 HydrophobicContact CD1-CG 4.1Å; L1313-E1316 VanDerWaalsContact C-OE2 3.27Å; L1313-E1316 VanDerWaalsContact CA-OE2 3.25Å; L1313-E1316 WeakPolarHBondContact CA-OE2 3.37Å; L1313-E1316 HydrophobicContact CD2-CG 4.42Å; L1313-E1316 PolarHBondContact O-N 3.34Å; E1316-W1319 PolarHBondContact O-N 3.19Å; E1316-K1320 WeakPolarHBondContact O-CB 3.39Å; E1316-K1320 VanDerWaalsContact O-CG 3.29Å; E1316-K1320 WeakPolarHBondContact O-CG 3.31Å; E1316-K1320 PolarHBondContact O-N 3.25Å; E1316-K1320 VanDerWaalsContact O-N 3.13Å |
| 1317 | L | 92 | Very high | 88.2 | Confident | 0.4 Ų | 0.4 | 42.8 Ų | 42.8 | 0% | 0.002 | 21% | 0.207 | C | C | . | . | H | α-helix | trans | -59.9 | -50.3 | 174.3 | 176.8 | 68.9 | 0 | 0 | 0 | 111.5 | L1282 V1285 L1304 F1308 L1313 L1314 H1315 W1319 K1320 L1321 | L1282-L1317 HydrophobicContact CD1-CD1 4.03Å; V1285-L1317 HydrophobicContact CG1-CD1 3.98Å; L1304-L1317 HydrophobicContact CB-CD2 3.95Å; F1308-L1317 HydrophobicContact CB-CB 4.19Å; F1308-L1317 HydrophobicContact CB-CD2 3.87Å; F1308-L1317 HydrophobicContact CD1-CB 3.69Å; F1308-L1317 HydrophobicContact CD1-CD1 4.46Å; F1308-L1317 HydrophobicContact CD1-CD2 4.38Å; F1308-L1317 HydrophobicContact CD1-CG 4.39Å; F1308-L1317 HydrophobicContact CD2-CD1 4.37Å; F1308-L1317 HydrophobicContact CD2-CD2 3.83Å; F1308-L1317 HydrophobicContact CD2-CG 4.47Å; F1308-L1317 HydrophobicContact CE1-CB 4.2Å; F1308-L1317 HydrophobicContact CE1-CD1 4.36Å; F1308-L1317 HydrophobicContact CE2-CD1 4.25Å; F1308-L1317 HydrophobicContact CE2-CD2 4.48Å; F1308-L1317 HydrophobicContact CG-CB 3.91Å; F1308-L1317 HydrophobicContact CG-CD1 4.46Å; F1308-L1317 HydrophobicContact CG-CD2 3.76Å; F1308-L1317 HydrophobicContact CG-CG 4.25Å; F1308-L1317 HydrophobicContact CZ-CD1 4.25Å; L1313-L1317 PolarHBondContact O-N 3.17Å; L1313-L1317 VanDerWaalsContact O-N 3.09Å; L1314-L1317 HydrophobicContact CD1-CD2 4.37Å; L1314-L1317 PolarHBondContact O-N 3.09Å; H1315-L1317 PolarHBondContact O-N 2.77Å; L1317-W1319 VanDerWaalsContact C-N 3.33Å; L1317-W1319 PolarHBondContact O-N 3.22Å; L1317-K1320 PolarHBondContact O-N 3.35Å; L1317-L1321 HydrophobicContact CD1-CD1 3.83Å; L1317-L1321 HydrophobicContact CD1-CG 4.12Å; L1317-L1321 HydrophobicContact CD2-CD1 4.46Å; L1317-L1321 HydrophobicContact CG-CD1 3.91Å; L1317-L1321 HydrophobicContact CG-CG 4.39Å; L1317-L1321 WeakPolarHBondContact O-CB 3.34Å; L1317-L1321 WeakPolarHBondContact O-CG 3.44Å; L1317-L1321 PolarHBondContact O-N 3.15Å |
| 1318 | L | 92.9 | Very high | 88.2 | Confident | 4.4 Ų | 4.4 | 49.3 Ų | 49.3 | 2% | 0.023 | 24% | 0.241 | C | C | . | . | H | α-helix | trans | -61.7 | -43.7 | -179.3 | -71.3 | 169.4 | 0 | 0 | 0 | 111 | L1314 H1315 K1320 L1321 F1322 V1345 M1422 V1425 | L1314-L1318 HydrophobicContact CD1-CD1 4.23Å; L1314-L1318 HydrophobicContact CD1-CG 4.17Å; L1314-L1318 HydrophobicContact CD2-CD1 4.49Å; L1314-L1318 HydrophobicContact CG-CD1 3.91Å; L1314-L1318 HydrophobicContact CG-CG 4.31Å; L1314-L1318 WeakPolarHBondContact O-CB 3.28Å; L1314-L1318 VanDerWaalsContact O-CG 3.23Å; L1314-L1318 WeakPolarHBondContact O-CG 3.41Å; L1314-L1318 PolarHBondContact O-N 3.18Å; H1315-L1318 PolarHBondContact O-N 3.06Å; L1318-K1320 VanDerWaalsContact C-N 3.31Å; L1318-K1320 PolarHBondContact O-N 3.22Å; L1318-L1321 PolarHBondContact O-N 3.15Å; L1318-F1322 HydrophobicContact CB-CE2 4.36Å; L1318-F1322 HydrophobicContact CB-CZ 4.49Å; L1318-F1322 HydrophobicContact CD2-CE1 4.06Å; L1318-F1322 HydrophobicContact CD2-CE2 4.22Å; L1318-F1322 HydrophobicContact CD2-CZ 3.67Å; L1318-F1322 VanDerWaalsContact O-CB 3.24Å; L1318-F1322 WeakPolarHBondContact O-CB 3.36Å; L1318-F1322 WeakPolarHBondContact O-CG 3.36Å; L1318-F1322 PolarHBondContact O-N 3.08Å; L1318-V1345 HydrophobicContact CD2-CG1 3.82Å; L1318-M1422 HydrophobicContact CD1-CB 3.96Å; L1318-M1422 HydrophobicContact CD1-CG 3.93Å; L1318-M1422 HydrophobicContact CD2-CG 4.3Å; L1318-M1422 HydrophobicContact CD2-SD 4.46Å; L1318-V1425 HydrophobicContact CB-CG1 4.36Å |
| 1319 | W | 92.1 | Very high | 88.1 | Confident | 103 Ų | 103 | 50 Ų | 50 | 39% | 0.39 | 25% | 0.247 | S | C | . | . | H | α-helix | trans | -56.1 | -48.7 | 177.3 | -167.3 | -74.3 | 0 | 0 | 0 | 110.9 | H1315 E1316 L1317 F1322 T1323 V1425 H1428 V1429 | H1315-W1319 AromaticContact NE2-CE3 3.92Å; H1315-W1319 WeakPolarHBondContact O-CB 3.35Å; H1315-W1319 PolarHBondContact O-N 3.31Å; E1316-W1319 PolarHBondContact O-N 3.19Å; L1317-W1319 VanDerWaalsContact C-N 3.33Å; L1317-W1319 PolarHBondContact O-N 3.22Å; W1319-F1322 PolarHBondContact O-N 3.46Å; W1319-T1323 VanDerWaalsContact O-CB 3.32Å; W1319-T1323 WeakPolarHBondContact O-CB 3.39Å; W1319-T1323 PolarHBondContact O-N 3.2Å; W1319-T1323 PolarHBondContact O-OG1 3.2Å; W1319-V1425 VanDerWaalsContact CA-CG1 3.48Å; W1319-V1425 HydrophobicContact CB-CG1 4.04Å; W1319-V1425 HydrophobicContact CD2-CG1 4.3Å; W1319-V1425 HydrophobicContact CE3-CB 4.39Å; W1319-V1425 HydrophobicContact CE3-CG1 3.84Å; W1319-V1425 HydrophobicContact CE3-CG2 4.13Å; W1319-V1425 HydrophobicContact CG-CG1 4.45Å; W1319-V1425 HydrophobicContact CZ3-CG1 4.48Å; W1319-H1428 HydrophobicContact CH2-CB 3.92Å; W1319-H1428 HydrophobicContact CZ3-CB 4.23Å; W1319-V1429 HydrophobicContact CD2-CG2 4.22Å; W1319-V1429 HydrophobicContact CE3-CG2 4.5Å; W1319-V1429 HydrophobicContact CG-CG2 4.43Å; W1319-V1429 HydrophobicContact CZ2-CG2 4.42Å |
| 1320 | K | 90 | Very high | 88.2 | Confident | 75.2 Ų | 75.2 | 58 Ų | 58 | 33% | 0.327 | 28% | 0.282 | S | S | . | . | H | α-helix | trans | -68.2 | -46.8 | -177.9 | -104.2 | -32.9 | 172.1 | 178.2 | 0 | 112.7 | G1280 E1281 L1282 E1316 L1317 L1318 F1322 T1323 K1324 | G1280-K1320 WeakPolarHBondContact O-CD 3.24Å; G1280-K1320 WeakPolarHBondContact O-CE 3.35Å; G1280-K1320 PolarHBondContact O-NZ 3.18Å; E1281-K1320 VanDerWaalsContact CD-CE 3.41Å; E1281-K1320 VanDerWaalsContact OE1-CE 3.3Å; E1281-K1320 WeakPolarHBondContact OE1-CE 3.41Å; E1281-K1320 IonicContact OE1-NZ 3.19Å; E1281-K1320 PolarHBondContact OE1-NZ 3.22Å; E1281-K1320 WeakPolarHBondContact OE2-CE 3.48Å; E1281-K1320 IonicContact OE2-NZ 3.04Å; E1281-K1320 PolarHBondContact OE2-NZ 3.17Å; L1282-K1320 HydrophobicContact CD1-CB 4.46Å; L1282-K1320 HydrophobicContact CD1-CG 4.5Å; E1316-K1320 WeakPolarHBondContact O-CB 3.39Å; E1316-K1320 VanDerWaalsContact O-CG 3.29Å; E1316-K1320 WeakPolarHBondContact O-CG 3.31Å; E1316-K1320 PolarHBondContact O-N 3.25Å; E1316-K1320 VanDerWaalsContact O-N 3.13Å; L1317-K1320 PolarHBondContact O-N 3.35Å; L1318-K1320 VanDerWaalsContact C-N 3.31Å; L1318-K1320 PolarHBondContact O-N 3.22Å; K1320-F1322 VanDerWaalsContact C-N 3.33Å; K1320-F1322 PolarHBondContact O-N 3.04Å; K1320-T1323 PolarHBondContact O-N 3.1Å; K1320-K1324 PolarHBondContact O-N 3.08Å; K1320-K1324 VanDerWaalsContact O-N 3.1Å |
| 1321 | L | 92.3 | Very high | 88.6 | Confident | 14.8 Ų | 14.8 | 57.6 Ų | 57.6 | 8% | 0.077 | 28% | 0.28 | C | S | . | . | H | α-helix | trans | -63.2 | -42.7 | 179 | -74.2 | 177.2 | 0 | 0 | 0 | 111.7 | V1285 L1317 L1318 K1324 E1325 L1341 A1342 V1345 | V1285-L1321 HydrophobicContact CG1-CD2 4.48Å; L1317-L1321 HydrophobicContact CD1-CD1 3.83Å; L1317-L1321 HydrophobicContact CD1-CG 4.12Å; L1317-L1321 HydrophobicContact CD2-CD1 4.46Å; L1317-L1321 HydrophobicContact CG-CD1 3.91Å; L1317-L1321 HydrophobicContact CG-CG 4.39Å; L1317-L1321 WeakPolarHBondContact O-CB 3.34Å; L1317-L1321 WeakPolarHBondContact O-CG 3.44Å; L1317-L1321 PolarHBondContact O-N 3.15Å; L1318-L1321 PolarHBondContact O-N 3.15Å; L1321-K1324 PolarHBondContact O-N 3.03Å; L1321-E1325 WeakPolarHBondContact O-CB 3.34Å; L1321-E1325 PolarHBondContact O-N 3.14Å; L1321-E1325 VanDerWaalsContact O-N 3.09Å; L1321-L1341 HydrophobicContact CD1-CD2 4.47Å; L1321-L1341 HydrophobicContact CD1-CG 4.36Å; L1321-L1341 HydrophobicContact CD2-CD2 3.96Å; L1321-L1341 HydrophobicContact CD2-CG 4.35Å; L1321-A1342 HydrophobicContact CB-CB 4.12Å; L1321-V1345 HydrophobicContact CD1-CB 4.18Å; L1321-V1345 HydrophobicContact CD1-CG1 4.15Å; L1321-V1345 HydrophobicContact CD1-CG2 3.88Å |
| 1322 | F | 94 | Very high | 88.5 | Confident | 0 Ų | 0 | 55.4 Ų | 55.4 | 0% | 0 | 27% | 0.274 | C | S | . | . | H | α-helix | trans | -70.4 | -37.9 | -179.9 | -66.5 | -4.8 | 0 | 0 | 0 | 111.6 | L1318 W1319 K1320 K1324 E1325 V1326 F1336 A1342 M1346 M1422 V1425 L1426 V1429 | L1318-F1322 HydrophobicContact CB-CE2 4.36Å; L1318-F1322 HydrophobicContact CB-CZ 4.49Å; L1318-F1322 HydrophobicContact CD2-CE1 4.06Å; L1318-F1322 HydrophobicContact CD2-CE2 4.22Å; L1318-F1322 HydrophobicContact CD2-CZ 3.67Å; L1318-F1322 VanDerWaalsContact O-CB 3.24Å; L1318-F1322 WeakPolarHBondContact O-CB 3.36Å; L1318-F1322 WeakPolarHBondContact O-CG 3.36Å; L1318-F1322 PolarHBondContact O-N 3.08Å; W1319-F1322 PolarHBondContact O-N 3.46Å; K1320-F1322 VanDerWaalsContact C-N 3.33Å; K1320-F1322 PolarHBondContact O-N 3.04Å; F1322-K1324 VanDerWaalsContact C-N 3.32Å; F1322-K1324 PolarHBondContact O-N 3.03Å; F1322-E1325 PolarHBondContact O-N 3.26Å; F1322-V1326 VanDerWaalsContact O-CB 3.28Å; F1322-V1326 WeakPolarHBondContact O-CB 3.31Å; F1322-V1326 VanDerWaalsContact O-CG2 3.22Å; F1322-V1326 WeakPolarHBondContact O-CG2 3.41Å; F1322-V1326 PolarHBondContact O-N 3.03Å; F1322-F1336 HydrophobicContact CB-CZ 4.09Å; F1322-F1336 AromaticContact CD1-CE1 3.53Å; F1322-F1336 HydrophobicContact CD1-CE1 3.53Å; F1322-F1336 VanDerWaalsContact CD1-CE1 3.42Å; F1322-F1336 AromaticContact CD1-CZ 3.58Å; F1322-F1336 HydrophobicContact CD1-CZ 3.58Å; F1322-F1336 HydrophobicContact CD2-CZ 4.42Å; F1322-F1336 AromaticContact CE1-CE1 3.77Å; F1322-F1336 HydrophobicContact CE1-CE1 3.77Å; F1322-F1336 AromaticContact CE1-CZ 3.98Å; F1322-F1336 HydrophobicContact CE1-CZ 4.09Å; F1322-F1336 HydrophobicContact CG-CE1 4.24Å; F1322-F1336 AromaticContact CG-CZ 3.8Å; F1322-F1336 HydrophobicContact CG-CZ 3.8Å; F1322-A1342 HydrophobicContact CD1-CB 4.28Å; F1322-M1346 HydrophobicContact CD1-CE 4.41Å; F1322-M1346 HydrophobicContact CE1-CB 4.16Å; F1322-M1346 HydrophobicContact CE1-CE 3.69Å; F1322-M1346 HydrophobicContact CE2-CE 3.92Å; F1322-M1346 HydrophobicContact CZ-CB 4.09Å; F1322-M1346 HydrophobicContact CZ-CE 3.39Å; F1322-M1346 VanDerWaalsContact CZ-CE 3.4Å; F1322-M1346 HydrophobicContact CZ-CG 4.25Å; F1322-M1422 HydrophobicContact CE2-CG 3.89Å; F1322-M1422 HydrophobicContact CZ-CG 4Å; F1322-M1422 HydrophobicContact CZ-SD 4.36Å; F1322-V1425 HydrophobicContact CD2-CG1 3.97Å; F1322-L1426 HydrophobicContact CD2-CB 4.17Å; F1322-L1426 HydrophobicContact CD2-CD1 4.26Å; F1322-L1426 HydrophobicContact CE2-CB 4.16Å; F1322-L1426 HydrophobicContact CE2-CD1 4.48Å; F1322-V1429 HydrophobicContact CB-CB 4.47Å; F1322-V1429 HydrophobicContact CB-CG1 4.23Å; F1322-V1429 HydrophobicContact CB-CG2 4.46Å |
| 1323 | T | 91.8 | Very high | 88.3 | Confident | 39.2 Ų | 39.2 | 54.8 Ų | 54.8 | 24% | 0.24 | 27% | 0.273 | C | S | . | . | H | α-helix | trans | -58.3 | -48.3 | 176.3 | -58.9 | 0 | 0 | 0 | 0 | 110.4 | W1319 K1320 E1325 V1326 E1327 V1429 | W1319-T1323 VanDerWaalsContact O-CB 3.32Å; W1319-T1323 WeakPolarHBondContact O-CB 3.39Å; W1319-T1323 PolarHBondContact O-N 3.2Å; W1319-T1323 PolarHBondContact O-OG1 3.2Å; K1320-T1323 PolarHBondContact O-N 3.1Å; T1323-E1325 PolarHBondContact O-N 3.07Å; T1323-V1326 PolarHBondContact O-N 2.91Å; T1323-E1327 HydrophobicContact CG2-CG 4.49Å; T1323-E1327 WeakPolarHBondContact CG2-OE1 3.21Å; T1323-E1327 WeakPolarHBondContact O-CB 3.37Å; T1323-E1327 VanDerWaalsContact O-CG 3.29Å; T1323-E1327 WeakPolarHBondContact O-CG 3.4Å; T1323-E1327 PolarHBondContact O-N 3.1Å; T1323-V1429 VanDerWaalsContact CA-CG1 3.46Å |
| 1324 | K | 87.8 | Confident | 88.1 | Confident | 94.2 Ų | 94.2 | 56.1 Ų | 56.1 | 41% | 0.41 | 28% | 0.283 | S | S | . | . | H | α-helix | trans | -64.7 | -39.6 | 179.7 | -158.3 | 169.9 | -173.4 | 172 | 0 | 112.9 | N1286 K1320 L1321 F1322 E1327 L1328 | N1286-K1324 PolarHBondContact OD1-NZ 3.01Å; K1320-K1324 PolarHBondContact O-N 3.08Å; K1320-K1324 VanDerWaalsContact O-N 3.1Å; L1321-K1324 PolarHBondContact O-N 3.03Å; F1322-K1324 VanDerWaalsContact C-N 3.32Å; F1322-K1324 PolarHBondContact O-N 3.03Å; K1324-E1327 PolarHBondContact O-N 2.9Å; K1324-L1328 VanDerWaalsContact O-CG 3.31Å; K1324-L1328 WeakPolarHBondContact O-CG 3.25Å; K1324-L1328 PolarHBondContact O-N 3.27Å |
| 1325 | E | 89.7 | Confident | 87.9 | Confident | 28.8 Ų | 28.8 | 55.3 Ų | 55.3 | 14% | 0.135 | 28% | 0.279 | C | S | . | . | H | α-helix | trans | -65.1 | -44 | 176.2 | -170.7 | 80.7 | 177.4 | 0 | 0 | 111.7 | L1321 F1322 T1323 E1327 L1328 A1329 F1336 T1340 A1342 | L1321-E1325 WeakPolarHBondContact O-CB 3.34Å; L1321-E1325 PolarHBondContact O-N 3.14Å; L1321-E1325 VanDerWaalsContact O-N 3.09Å; F1322-E1325 PolarHBondContact O-N 3.26Å; T1323-E1325 PolarHBondContact O-N 3.07Å; E1325-E1327 VanDerWaalsContact C-N 3.31Å; E1325-E1327 PolarHBondContact O-N 3.14Å; E1325-L1328 PolarHBondContact O-N 3.12Å; E1325-A1329 PolarHBondContact O-N 3.26Å; E1325-A1329 VanDerWaalsContact O-N 3.15Å; E1325-F1336 HydrophobicContact CB-CE1 4.12Å; E1325-F1336 HydrophobicContact CB-CZ 4.21Å; E1325-F1336 HydrophobicContact CG-CD1 4.02Å; E1325-F1336 HydrophobicContact CG-CE1 3.8Å; E1325-F1336 HydrophobicContact CG-CG 4.46Å; E1325-F1336 HydrophobicContact CG-CZ 4.1Å; E1325-T1340 WeakPolarHBondContact OE1-CB 3.35Å; E1325-T1340 VanDerWaalsContact OE1-CG2 3.25Å; E1325-T1340 WeakPolarHBondContact OE1-CG2 3.37Å; E1325-T1340 PolarHBondContact OE1-OG1 3.27Å; E1325-T1340 VanDerWaalsContact OE2-CB 3.26Å; E1325-T1340 WeakPolarHBondContact OE2-CB 3.39Å; E1325-T1340 VanDerWaalsContact OE2-CG2 3.27Å; E1325-T1340 WeakPolarHBondContact OE2-CG2 3.42Å; E1325-T1340 PolarHBondContact OE2-OG1 3.24Å; E1325-T1340 VanDerWaalsContact OE2-OG1 3.05Å; E1325-A1342 HydrophobicContact CB-CB 3.89Å; E1325-A1342 HydrophobicContact CG-CB 4.15Å; E1325-A1342 WeakPolarHBondContact OE2-CB 3.41Å |
| 1326 | V | 91.5 | Very high | 87.6 | Confident | 2.6 Ų | 2.6 | 52.1 Ų | 52.1 | 2% | 0.016 | 26% | 0.264 | C | S | . | . | H | α-helix | trans | -68.1 | -34.2 | -179.9 | 171.2 | 0 | 0 | 0 | 0 | 110.9 | F1322 T1323 L1328 A1329 L1335 F1336 V1429 V1430 R1433 F1434 | F1322-V1326 VanDerWaalsContact O-CB 3.28Å; F1322-V1326 WeakPolarHBondContact O-CB 3.31Å; F1322-V1326 VanDerWaalsContact O-CG2 3.22Å; F1322-V1326 WeakPolarHBondContact O-CG2 3.41Å; F1322-V1326 PolarHBondContact O-N 3.03Å; T1323-V1326 PolarHBondContact O-N 2.91Å; V1326-L1328 VanDerWaalsContact C-N 3.28Å; V1326-L1328 PolarHBondContact O-N 3.31Å; V1326-A1329 PolarHBondContact O-N 3.08Å; V1326-A1329 VanDerWaalsContact O-N 3.12Å; V1326-L1335 HydrophobicContact CB-CD2 4.26Å; V1326-L1335 HydrophobicContact CG1-CD2 4.45Å; V1326-L1335 HydrophobicContact CG2-CD1 4.48Å; V1326-L1335 HydrophobicContact CG2-CD2 3.59Å; V1326-L1335 VanDerWaalsContact CG2-CD2 3.48Å; V1326-L1335 HydrophobicContact CG2-CG 4.48Å; V1326-F1336 HydrophobicContact CG2-CE2 4.29Å; V1326-F1336 HydrophobicContact CG2-CZ 4.45Å; V1326-V1429 HydrophobicContact CB-CG1 4.05Å; V1326-V1429 HydrophobicContact CG1-CG1 4.42Å; V1326-V1429 HydrophobicContact CG2-CG1 3.87Å; V1326-V1430 HydrophobicContact CG2-CG2 3.94Å; V1326-R1433 HydrophobicContact CG1-CB 3.42Å; V1326-R1433 VanDerWaalsContact CG1-CB 3.41Å; V1326-R1433 HydrophobicContact CG1-CG 3.77Å; V1326-R1433 VanDerWaalsContact O-CD 3.28Å; V1326-R1433 WeakPolarHBondContact O-CD 3.48Å; V1326-R1433 PolarHBondContact O-NE 3.43Å; V1326-F1434 HydrophobicContact CG1-CD2 4.41Å; V1326-F1434 HydrophobicContact CG1-CE2 4.28Å |
| 1327 | E | 88.7 | Confident | 87.2 | Confident | 110.4 Ų | 110.4 | 55.2 Ų | 55.2 | 52% | 0.516 | 27% | 0.273 | S | S | . | . | H | α-helix | trans | -62.6 | -30.3 | 173.4 | -79.4 | 172.7 | 177.9 | 0 | 0 | 113.6 | T1323 K1324 E1325 R1433 | T1323-E1327 HydrophobicContact CG2-CG 4.49Å; T1323-E1327 WeakPolarHBondContact CG2-OE1 3.21Å; T1323-E1327 WeakPolarHBondContact O-CB 3.37Å; T1323-E1327 VanDerWaalsContact O-CG 3.29Å; T1323-E1327 WeakPolarHBondContact O-CG 3.4Å; T1323-E1327 PolarHBondContact O-N 3.1Å; K1324-E1327 PolarHBondContact O-N 2.9Å; E1325-E1327 VanDerWaalsContact C-N 3.31Å; E1325-E1327 PolarHBondContact O-N 3.14Å; E1327-R1433 VanDerWaalsContact C-CZ 3.48Å; E1327-R1433 VanDerWaalsContact CA-NH1 3.27Å; E1327-R1433 VanDerWaalsContact O-CZ 3.31Å; E1327-R1433 PolarHBondContact O-NH1 3.22Å; E1327-R1433 PolarHBondContact O-NH2 3.23Å |
| 1328 | L | 86.2 | Confident | 86.5 | Confident | 139 Ų | 139 | 57 Ų | 57 | 73% | 0.728 | 29% | 0.291 | S | S | * | . | H | α-helix | trans | -88.5 | -15.2 | 178.9 | -66 | 171 | 0 | 0 | 0 | 113.2 | K1324 E1325 V1326 | K1324-L1328 VanDerWaalsContact O-CG 3.31Å; K1324-L1328 WeakPolarHBondContact O-CG 3.25Å; K1324-L1328 PolarHBondContact O-N 3.27Å; E1325-L1328 PolarHBondContact O-N 3.12Å; V1326-L1328 VanDerWaalsContact C-N 3.28Å; V1326-L1328 PolarHBondContact O-N 3.31Å |
| 1329 | A | 86.1 | Confident | 85.9 | Confident | 14.4 Ų | 14.4 | 61.6 Ų | 61.6 | 12% | 0.119 | 32% | 0.315 | C | S | . | . | trans | -81.1 | 134.3 | -178.2 | 0 | 0 | 0 | 0 | 0 | 112.2 | E1325 V1326 L1335 R1433 F1434 | E1325-A1329 PolarHBondContact O-N 3.26Å; E1325-A1329 VanDerWaalsContact O-N 3.15Å; V1326-A1329 PolarHBondContact O-N 3.08Å; V1326-A1329 VanDerWaalsContact O-N 3.12Å; A1329-L1335 HydrophobicContact CB-CD1 4.22Å; A1329-L1335 HydrophobicContact CB-CD2 3.72Å; A1329-L1335 HydrophobicContact CB-CG 4.1Å; A1329-R1433 PolarHBondContact O-NH2 3.31Å; A1329-F1434 WeakPolarHBondContact O-CZ 3.35Å | ||
| 1330 | E | 85.7 | Confident | 85.7 | Confident | 184.6 Ų | 184.6 | 58.6 Ų | 58.6 | 86% | 0.863 | 31% | 0.309 | S | S | * | . | S | Bend | trans | -77.9 | -33.4 | 176.2 | -65.9 | -179.7 | 173.6 | 0 | 0 | 112.8 | ||
| 1331 | A | 83.5 | Confident | 85.7 | Confident | 30.2 Ų | 30.2 | 55.6 Ų | 55.6 | 25% | 0.25 | 30% | 0.296 | C | S | . | . | S | Bend | trans | -143.6 | 153.7 | -175.5 | 0 | 0 | 0 | 0 | 0 | 112.7 | T1333 T1334 | A1331-T1333 PolarHBondContact O-N 3.23Å; A1331-T1333 VanDerWaalsContact O-N 3.12Å; A1331-T1334 PolarHBondContact N-OG1 3.16Å; A1331-T1334 PolarHBondContact O-N 2.98Å; A1331-T1334 VanDerWaalsContact O-N 3.15Å; A1331-T1334 PolarHBondContact O-OG1 3.07Å |
| 1332 | P | 79.2 | Confident | 85.7 | Confident | 28.6 Ų | 28.6 | 55 Ų | 55 | 19% | 0.186 | 29% | 0.294 | C | S | . | . | G | 310 helix | trans | -58.6 | -28 | 176.6 | -23 | 31.8 | 0 | 0 | 0 | 113.9 | T1334 L1335 F1434 T1437 M1444 | P1332-T1334 VanDerWaalsContact C-N 3.34Å; P1332-L1335 HydrophobicContact CB-CD1 4.42Å; P1332-L1335 WeakPolarHBondContact O-CB 3.24Å; P1332-L1335 WeakPolarHBondContact O-CD1 3.39Å; P1332-L1335 WeakPolarHBondContact O-CG 3.33Å; P1332-F1434 HydrophobicContact CG-CB 4.08Å; P1332-F1434 HydrophobicContact CG-CD1 4.13Å; P1332-F1434 HydrophobicContact CG-CD2 4.26Å; P1332-F1434 HydrophobicContact CG-CG 3.92Å; P1332-T1437 HydrophobicContact CG-CG2 4.13Å; P1332-M1444 WeakPolarHBondContact O-CE 3.44Å |
| 1333 | T | 78.3 | Confident | 85.6 | Confident | 73.6 Ų | 73.6 | 55.1 Ų | 55.1 | 45% | 0.452 | 29% | 0.294 | S | S | . | . | G | 310 helix | trans | -79.8 | -17.8 | -178.3 | 52.9 | 0 | 0 | 0 | 0 | 113.6 | A1331 R1337 M1444 | A1331-T1333 PolarHBondContact O-N 3.23Å; A1331-T1333 VanDerWaalsContact O-N 3.12Å; T1333-R1337 WeakPolarHBondContact O-CD 3.43Å; T1333-R1337 PolarHBondContact O-NE 3.31Å; T1333-R1337 VanDerWaalsContact O-NE 3.08Å; T1333-R1337 PolarHBondContact O-NH1 2.69Å; T1333-R1337 PolarHBondContact O-NH2 3.2Å; T1333-R1337 VanDerWaalsContact O-NH2 3.09Å; T1333-M1444 HydrophobicContact CG2-CE 4.33Å; T1333-M1444 HydrophobicContact CG2-SD 4.11Å |
| 1334 | T | 82 | Confident | 85.5 | Confident | 68.6 Ų | 68.6 | 54.9 Ų | 54.9 | 42% | 0.421 | 29% | 0.29 | S | S | . | . | G | 310 helix | trans | -94.9 | -7 | 178.2 | 57.4 | 0 | 0 | 0 | 0 | 112.9 | A1331 P1332 F1336 R1337 | A1331-T1334 PolarHBondContact N-OG1 3.16Å; A1331-T1334 PolarHBondContact O-N 2.98Å; A1331-T1334 VanDerWaalsContact O-N 3.15Å; A1331-T1334 PolarHBondContact O-OG1 3.07Å; P1332-T1334 VanDerWaalsContact C-N 3.34Å; T1334-F1336 PolarHBondContact O-N 3.06Å; T1334-R1337 PolarHBondContact O-N 3.14Å |
| 1335 | L | 84.1 | Confident | 85.7 | Confident | 7.2 Ų | 7.2 | 50.4 Ų | 50.4 | 4% | 0.038 | 27% | 0.27 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -56.6 | 132.6 | -179.2 | -90.8 | 157.1 | 0 | 0 | 0 | 112.6 | V1326 A1329 P1332 R1337 V1430 F1434 A1441 I1445 | V1326-L1335 HydrophobicContact CB-CD2 4.26Å; V1326-L1335 HydrophobicContact CG1-CD2 4.45Å; V1326-L1335 HydrophobicContact CG2-CD1 4.48Å; V1326-L1335 HydrophobicContact CG2-CD2 3.59Å; V1326-L1335 VanDerWaalsContact CG2-CD2 3.48Å; V1326-L1335 HydrophobicContact CG2-CG 4.48Å; A1329-L1335 HydrophobicContact CB-CD1 4.22Å; A1329-L1335 HydrophobicContact CB-CD2 3.72Å; A1329-L1335 HydrophobicContact CB-CG 4.1Å; P1332-L1335 HydrophobicContact CB-CD1 4.42Å; P1332-L1335 WeakPolarHBondContact O-CB 3.24Å; P1332-L1335 WeakPolarHBondContact O-CD1 3.39Å; P1332-L1335 WeakPolarHBondContact O-CG 3.33Å; L1335-R1337 VanDerWaalsContact C-N 3.26Å; L1335-R1337 PolarHBondContact O-N 3.13Å; L1335-R1337 VanDerWaalsContact O-N 3.13Å; L1335-V1430 HydrophobicContact CD1-CB 4.38Å; L1335-V1430 HydrophobicContact CD1-CG1 3.99Å; L1335-V1430 HydrophobicContact CD1-CG2 3.89Å; L1335-V1430 HydrophobicContact CD2-CG2 4.16Å; L1335-F1434 HydrophobicContact CD1-CD2 4.14Å; L1335-F1434 HydrophobicContact CD1-CE2 3.9Å; L1335-A1441 HydrophobicContact CD1-CB 4.2Å; L1335-I1445 HydrophobicContact CB-CD1 4.37Å |
| 1336 | F | 82.1 | Confident | 85.8 | Confident | 2 Ų | 2 | 49 Ų | 49 | 1% | 0.009 | 26% | 0.264 | C | S | . | . | T | Hydrogen-bonded Turn | trans | 49.6 | 40.7 | 178.8 | -56.7 | -87.9 | 0 | 0 | 0 | 112.9 | F1322 E1325 V1326 T1334 A1342 S1343 M1346 L1426 I1445 R1449 | F1322-F1336 HydrophobicContact CB-CZ 4.09Å; F1322-F1336 AromaticContact CD1-CE1 3.53Å; F1322-F1336 HydrophobicContact CD1-CE1 3.53Å; F1322-F1336 VanDerWaalsContact CD1-CE1 3.42Å; F1322-F1336 AromaticContact CD1-CZ 3.58Å; F1322-F1336 HydrophobicContact CD1-CZ 3.58Å; F1322-F1336 HydrophobicContact CD2-CZ 4.42Å; F1322-F1336 AromaticContact CE1-CE1 3.77Å; F1322-F1336 HydrophobicContact CE1-CE1 3.77Å; F1322-F1336 AromaticContact CE1-CZ 3.98Å; F1322-F1336 HydrophobicContact CE1-CZ 4.09Å; F1322-F1336 HydrophobicContact CG-CE1 4.24Å; F1322-F1336 AromaticContact CG-CZ 3.8Å; F1322-F1336 HydrophobicContact CG-CZ 3.8Å; E1325-F1336 HydrophobicContact CB-CE1 4.12Å; E1325-F1336 HydrophobicContact CB-CZ 4.21Å; E1325-F1336 HydrophobicContact CG-CD1 4.02Å; E1325-F1336 HydrophobicContact CG-CE1 3.8Å; E1325-F1336 HydrophobicContact CG-CG 4.46Å; E1325-F1336 HydrophobicContact CG-CZ 4.1Å; V1326-F1336 HydrophobicContact CG2-CE2 4.29Å; V1326-F1336 HydrophobicContact CG2-CZ 4.45Å; T1334-F1336 PolarHBondContact O-N 3.06Å; F1336-A1342 HydrophobicContact CD1-CB 4.41Å; F1336-A1342 HydrophobicContact CE1-CB 3.87Å; F1336-S1343 VanDerWaalsContact CA-OG 3.32Å; F1336-S1343 WeakPolarHBondContact CA-OG 3.33Å; F1336-M1346 HydrophobicContact CB-CE 4.47Å; F1336-M1346 HydrophobicContact CD1-CE 3.64Å; F1336-M1346 HydrophobicContact CD1-SD 4.32Å; F1336-M1346 HydrophobicContact CD2-CE 3.95Å; F1336-M1346 HydrophobicContact CE1-CE 3.56Å; F1336-M1346 HydrophobicContact CE2-CE 3.91Å; F1336-M1346 HydrophobicContact CG-CE 3.83Å; F1336-M1346 HydrophobicContact CG-SD 4.39Å; F1336-M1346 HydrophobicContact CZ-CE 3.71Å; F1336-L1426 HydrophobicContact CD2-CD1 4.16Å; F1336-L1426 HydrophobicContact CE2-CD1 3.33Å; F1336-L1426 HydrophobicContact CZ-CD1 3.85Å; F1336-I1445 HydrophobicContact CB-CD1 4.33Å; F1336-I1445 HydrophobicContact CD2-CD1 3.58Å; F1336-I1445 VanDerWaalsContact CD2-CD1 3.5Å; F1336-I1445 HydrophobicContact CD2-CG1 4.5Å; F1336-I1445 HydrophobicContact CE2-CD1 4.28Å; F1336-I1445 HydrophobicContact CG-CD1 4.32Å; F1336-R1449 PolarHBondContact O-NE 3.14Å; F1336-R1449 PolarHBondContact O-NH2 3.37Å |
| 1337 | R | 80.3 | Confident | 85.7 | Confident | 138.8 Ų | 138.8 | 50.1 Ų | 50.1 | 52% | 0.524 | 28% | 0.276 | S | S | . | . | trans | -99.9 | -18.9 | 168.7 | -69 | -170.2 | 177.1 | -178.8 | 1.2 | 113 | T1333 T1334 L1335 L1448 | T1333-R1337 WeakPolarHBondContact O-CD 3.43Å; T1333-R1337 PolarHBondContact O-NE 3.31Å; T1333-R1337 VanDerWaalsContact O-NE 3.08Å; T1333-R1337 PolarHBondContact O-NH1 2.69Å; T1333-R1337 PolarHBondContact O-NH2 3.2Å; T1333-R1337 VanDerWaalsContact O-NH2 3.09Å; T1334-R1337 PolarHBondContact O-N 3.14Å; L1335-R1337 VanDerWaalsContact C-N 3.26Å; L1335-R1337 PolarHBondContact O-N 3.13Å; L1335-R1337 VanDerWaalsContact O-N 3.13Å; R1337-L1448 HydrophobicContact CG-CD2 4.49Å | ||
| 1338 | G | 78 | Confident | 85.7 | Confident | 38.2 Ų | 38.2 | 45.5 Ų | 45.5 | 39% | 0.394 | 26% | 0.255 | S | S | . | . | S | Bend | trans | -76.1 | 170.7 | 179.6 | 0 | 0 | 0 | 0 | 0 | 114.2 | T1340 S1343 R1449 | G1338-T1340 VanDerWaalsContact C-N 3.29Å; G1338-T1340 PolarHBondContact O-N 3.08Å; G1338-T1340 VanDerWaalsContact O-N 3.13Å; G1338-S1343 WeakPolarHBondContact O-CB 3.29Å; G1338-S1343 PolarHBondContact O-OG 3.14Å; G1338-S1343 VanDerWaalsContact O-OG 3.13Å; G1338-R1449 PolarHBondContact O-NH2 3.49Å |
| 1339 | N | 80.8 | Confident | 85.9 | Confident | 99.4 Ų | 99.4 | 39 Ų | 39 | 53% | 0.532 | 22% | 0.221 | S | C | . | . | S | Bend | trans | -89.3 | 58.7 | 173.4 | -157.7 | 24 | 0 | 0 | 0 | 110.4 | T1294 M1297 K1344 | T1294-N1339 WeakPolarHBondContact CG2-ND2 3.32Å; M1297-N1339 WeakPolarHBondContact CE-O 3.38Å; N1339-K1344 WeakPolarHBondContact OD1-CE 3.36Å; N1339-K1344 PolarHBondContact OD1-NZ 3.22Å; N1339-K1344 VanDerWaalsContact OD1-NZ 3.11Å |
| 1340 | T | 88 | Confident | 86.1 | Confident | 41 Ų | 41 | 38.5 Ų | 38.5 | 25% | 0.252 | 22% | 0.217 | S | C | . | . | trans | -100.2 | 159.1 | -175.5 | 60.6 | 0 | 0 | 0 | 0 | 111.7 | E1325 G1338 A1342 S1343 K1344 | E1325-T1340 WeakPolarHBondContact OE1-CB 3.35Å; E1325-T1340 VanDerWaalsContact OE1-CG2 3.25Å; E1325-T1340 WeakPolarHBondContact OE1-CG2 3.37Å; E1325-T1340 PolarHBondContact OE1-OG1 3.27Å; E1325-T1340 VanDerWaalsContact OE2-CB 3.26Å; E1325-T1340 WeakPolarHBondContact OE2-CB 3.39Å; E1325-T1340 VanDerWaalsContact OE2-CG2 3.27Å; E1325-T1340 WeakPolarHBondContact OE2-CG2 3.42Å; E1325-T1340 PolarHBondContact OE2-OG1 3.24Å; E1325-T1340 VanDerWaalsContact OE2-OG1 3.05Å; G1338-T1340 VanDerWaalsContact C-N 3.29Å; G1338-T1340 PolarHBondContact O-N 3.08Å; G1338-T1340 VanDerWaalsContact O-N 3.13Å; T1340-A1342 VanDerWaalsContact C-N 3.27Å; T1340-A1342 PolarHBondContact O-N 3.03Å; T1340-S1343 WeakPolarHBondContact O-CB 3.3Å; T1340-S1343 PolarHBondContact O-N 3.16Å; T1340-S1343 WeakPolarHBondContact OG1-CB 3.34Å; T1340-S1343 PolarHBondContact OG1-N 3.19Å; T1340-S1343 PolarHBondContact OG1-OG 3.16Å; T1340-K1344 VanDerWaalsContact O-CG 3.23Å; T1340-K1344 WeakPolarHBondContact O-CG 3.29Å; T1340-K1344 PolarHBondContact O-N 3.13Å | ||
| 1341 | L | 90.5 | Very high | 86 | Confident | 12 Ų | 12 | 35.2 Ų | 35.2 | 6% | 0.063 | 20% | 0.199 | C | C | . | . | H | α-helix | trans | -58 | -41.7 | 176.5 | -178.9 | 61.7 | 0 | 0 | 0 | 111.4 | V1285 A1289 M1297 L1300 A1301 L1304 L1321 S1343 K1344 V1345 | V1285-L1341 HydrophobicContact CG1-CD2 4.43Å; A1289-L1341 HydrophobicContact CB-CB 4.33Å; A1289-L1341 HydrophobicContact CB-CD2 3.44Å; A1289-L1341 VanDerWaalsContact CB-CD2 3.44Å; A1289-L1341 HydrophobicContact CB-CG 4.49Å; M1297-L1341 HydrophobicContact CE-CB 3.8Å; M1297-L1341 HydrophobicContact CE-CD1 4.34Å; M1297-L1341 HydrophobicContact SD-CB 4.41Å; L1300-L1341 HydrophobicContact CD2-CD1 3.9Å; L1300-L1341 HydrophobicContact CD2-CD2 4.19Å; L1300-L1341 HydrophobicContact CG-CD1 3.98Å; A1301-L1341 HydrophobicContact CB-CD1 4.16Å; L1304-L1341 HydrophobicContact CD1-CD1 4.24Å; L1304-L1341 HydrophobicContact CD1-CD2 3.84Å; L1304-L1341 HydrophobicContact CD1-CG 4.4Å; L1321-L1341 HydrophobicContact CD1-CD2 4.47Å; L1321-L1341 HydrophobicContact CD1-CG 4.36Å; L1321-L1341 HydrophobicContact CD2-CD2 3.96Å; L1321-L1341 HydrophobicContact CD2-CG 4.35Å; L1341-S1343 PolarHBondContact O-N 3.29Å; L1341-K1344 PolarHBondContact O-N 3.28Å; L1341-V1345 HydrophobicContact CD1-CG2 4.02Å; L1341-V1345 HydrophobicContact CG-CG2 4.2Å; L1341-V1345 WeakPolarHBondContact O-CB 3.36Å; L1341-V1345 VanDerWaalsContact O-CG2 3.31Å; L1341-V1345 WeakPolarHBondContact O-CG2 3.34Å; L1341-V1345 PolarHBondContact O-N 3.21Å |
| 1342 | A | 91.9 | Very high | 85.9 | Confident | 2.6 Ų | 2.6 | 35.8 Ų | 35.8 | 2% | 0.021 | 20% | 0.198 | C | C | . | . | H | α-helix | trans | -62 | -44.2 | 179.1 | 0 | 0 | 0 | 0 | 0 | 111.7 | L1321 F1322 E1325 F1336 T1340 K1344 V1345 M1346 | L1321-A1342 HydrophobicContact CB-CB 4.12Å; F1322-A1342 HydrophobicContact CD1-CB 4.28Å; E1325-A1342 HydrophobicContact CB-CB 3.89Å; E1325-A1342 HydrophobicContact CG-CB 4.15Å; E1325-A1342 WeakPolarHBondContact OE2-CB 3.41Å; F1336-A1342 HydrophobicContact CD1-CB 4.41Å; F1336-A1342 HydrophobicContact CE1-CB 3.87Å; T1340-A1342 VanDerWaalsContact C-N 3.27Å; T1340-A1342 PolarHBondContact O-N 3.03Å; A1342-K1344 VanDerWaalsContact C-N 3.32Å; A1342-K1344 PolarHBondContact O-N 3.24Å; A1342-V1345 PolarHBondContact O-N 3.16Å; A1342-M1346 WeakPolarHBondContact O-CB 3.4Å; A1342-M1346 PolarHBondContact O-N 3.29Å |
| 1343 | S | 90.7 | Very high | 86.2 | Confident | 2.4 Ų | 2.4 | 36.3 Ų | 36.3 | 2% | 0.017 | 20% | 0.197 | C | C | . | . | H | α-helix | trans | -62.3 | -39.8 | 175.4 | -62 | 0 | 0 | 0 | 0 | 112.5 | F1336 G1338 T1340 L1341 G1347 R1449 | F1336-S1343 VanDerWaalsContact CA-OG 3.32Å; F1336-S1343 WeakPolarHBondContact CA-OG 3.33Å; G1338-S1343 WeakPolarHBondContact O-CB 3.29Å; G1338-S1343 PolarHBondContact O-OG 3.14Å; G1338-S1343 VanDerWaalsContact O-OG 3.13Å; T1340-S1343 WeakPolarHBondContact O-CB 3.3Å; T1340-S1343 PolarHBondContact O-N 3.16Å; T1340-S1343 WeakPolarHBondContact OG1-CB 3.34Å; T1340-S1343 PolarHBondContact OG1-N 3.19Å; T1340-S1343 PolarHBondContact OG1-OG 3.16Å; L1341-S1343 PolarHBondContact O-N 3.29Å; S1343-G1347 PolarHBondContact O-N 3.04Å; S1343-R1449 PolarHBondContact O-NH1 3.11Å |
| 1344 | K | 90.2 | Very high | 86.6 | Confident | 34.2 Ų | 34.2 | 32.8 Ų | 32.8 | 15% | 0.149 | 18% | 0.175 | C | C | . | . | H | α-helix | trans | -70.7 | -42.9 | 177.8 | -70.5 | -145 | 177 | -107.3 | 0 | 112.3 | M1297 D1298 A1301 N1339 T1340 L1341 A1342 M1346 G1347 C1348 | M1297-K1344 HydrophobicContact CB-CD 3.74Å; M1297-K1344 VanDerWaalsContact CB-CE 3.5Å; M1297-K1344 HydrophobicContact CG-CD 4.12Å; M1297-K1344 HydrophobicContact SD-CD 3.96Å; M1297-K1344 HydrophobicContact SD-CG 4.42Å; D1298-K1344 VanDerWaalsContact OD1-CD 3.31Å; D1298-K1344 WeakPolarHBondContact OD1-CD 3.3Å; D1298-K1344 WeakPolarHBondContact OD1-CE 3.37Å; D1298-K1344 IonicContact OD1-NZ 2.95Å; D1298-K1344 PolarHBondContact OD1-NZ 3.21Å; D1298-K1344 IonicContact OD2-NZ 3.41Å; D1298-K1344 PolarHBondContact OD2-NZ 3.17Å; A1301-K1344 HydrophobicContact CB-CB 3.55Å; A1301-K1344 VanDerWaalsContact CB-CB 3.49Å; N1339-K1344 WeakPolarHBondContact OD1-CE 3.36Å; N1339-K1344 PolarHBondContact OD1-NZ 3.22Å; N1339-K1344 VanDerWaalsContact OD1-NZ 3.11Å; T1340-K1344 VanDerWaalsContact O-CG 3.23Å; T1340-K1344 WeakPolarHBondContact O-CG 3.29Å; T1340-K1344 PolarHBondContact O-N 3.13Å; L1341-K1344 PolarHBondContact O-N 3.28Å; A1342-K1344 VanDerWaalsContact C-N 3.32Å; A1342-K1344 PolarHBondContact O-N 3.24Å; K1344-M1346 VanDerWaalsContact C-N 3.33Å; K1344-M1346 PolarHBondContact O-N 3.08Å; K1344-G1347 CarbonylContact O-C 3.12Å; K1344-G1347 WeakPolarHBondContact O-CA 3.42Å; K1344-G1347 PolarHBondContact O-N 3.14Å; K1344-G1347 VanDerWaalsContact O-N 3.14Å; K1344-C1348 WeakPolarHBondContact O-CB 3.36Å; K1344-C1348 PolarHBondContact O-N 3.16Å; K1344-C1348 PolarHBondContact O-SG 3.43Å |
| 1345 | V | 92.2 | Very high | 86.7 | Confident | 0 Ų | 0 | 33.6 Ų | 33.6 | 0% | 0 | 17% | 0.171 | C | C | . | . | H | α-helix | trans | -61.3 | -44.5 | 175.8 | 166.4 | 0 | 0 | 0 | 0 | 110.5 | A1301 L1318 L1321 L1341 A1342 G1347 C1348 C1349 | A1301-V1345 HydrophobicContact CB-CG2 3.84Å; L1318-V1345 HydrophobicContact CD2-CG1 3.82Å; L1321-V1345 HydrophobicContact CD1-CB 4.18Å; L1321-V1345 HydrophobicContact CD1-CG1 4.15Å; L1321-V1345 HydrophobicContact CD1-CG2 3.88Å; L1341-V1345 HydrophobicContact CD1-CG2 4.02Å; L1341-V1345 HydrophobicContact CG-CG2 4.2Å; L1341-V1345 WeakPolarHBondContact O-CB 3.36Å; L1341-V1345 VanDerWaalsContact O-CG2 3.31Å; L1341-V1345 WeakPolarHBondContact O-CG2 3.34Å; L1341-V1345 PolarHBondContact O-N 3.21Å; A1342-V1345 PolarHBondContact O-N 3.16Å; V1345-G1347 VanDerWaalsContact C-N 3.35Å; V1345-G1347 PolarHBondContact O-N 3.36Å; V1345-C1348 WeakPolarHBondContact O-CA 3.47Å; V1345-C1348 VanDerWaalsContact O-CB 3.3Å; V1345-C1348 WeakPolarHBondContact O-CB 3.36Å; V1345-C1348 PolarHBondContact O-N 3.17Å; V1345-C1348 VanDerWaalsContact O-N 3.11Å; V1345-C1349 PolarHBondContact O-N 3.01Å; V1345-C1349 PolarHBondContact O-SG 2.93Å; V1345-C1349 VanDerWaalsContact O-SG 3.41Å |
| 1346 | M | 92.4 | Very high | 86.7 | Confident | 0 Ų | 0 | 35.6 Ų | 35.6 | 0% | 0 | 19% | 0.193 | C | C | . | . | H | α-helix | trans | -59.8 | -46.8 | 174.1 | -175.7 | -172 | -71.7 | 0 | 0 | 111.8 | F1322 F1336 A1342 K1344 C1348 C1349 F1350 M1422 L1426 I1445 | F1322-M1346 HydrophobicContact CD1-CE 4.41Å; F1322-M1346 HydrophobicContact CE1-CB 4.16Å; F1322-M1346 HydrophobicContact CE1-CE 3.69Å; F1322-M1346 HydrophobicContact CE2-CE 3.92Å; F1322-M1346 HydrophobicContact CZ-CB 4.09Å; F1322-M1346 HydrophobicContact CZ-CE 3.39Å; F1322-M1346 VanDerWaalsContact CZ-CE 3.4Å; F1322-M1346 HydrophobicContact CZ-CG 4.25Å; F1336-M1346 HydrophobicContact CB-CE 4.47Å; F1336-M1346 HydrophobicContact CD1-CE 3.64Å; F1336-M1346 HydrophobicContact CD1-SD 4.32Å; F1336-M1346 HydrophobicContact CD2-CE 3.95Å; F1336-M1346 HydrophobicContact CE1-CE 3.56Å; F1336-M1346 HydrophobicContact CE2-CE 3.91Å; F1336-M1346 HydrophobicContact CG-CE 3.83Å; F1336-M1346 HydrophobicContact CG-SD 4.39Å; F1336-M1346 HydrophobicContact CZ-CE 3.71Å; A1342-M1346 WeakPolarHBondContact O-CB 3.4Å; A1342-M1346 PolarHBondContact O-N 3.29Å; K1344-M1346 VanDerWaalsContact C-N 3.33Å; K1344-M1346 PolarHBondContact O-N 3.08Å; M1346-C1348 VanDerWaalsContact C-N 3.28Å; M1346-C1348 PolarHBondContact O-N 2.94Å; M1346-C1349 WeakPolarHBondContact O-CB 3.32Å; M1346-C1349 PolarHBondContact O-N 3.14Å; M1346-F1350 HydrophobicContact CG-CD2 4.05Å; M1346-F1350 HydrophobicContact CG-CE2 3.64Å; M1346-F1350 HydrophobicContact CG-CZ 4.38Å; M1346-F1350 WeakPolarHBondContact O-CD2 3.38Å; M1346-F1350 PolarHBondContact O-N 3.23Å; M1346-F1350 HydrophobicContact SD-CE2 3.97Å; M1346-M1422 HydrophobicContact CB-SD 4.46Å; M1346-M1422 HydrophobicContact CG-CE 4.03Å; M1346-M1422 HydrophobicContact CG-SD 3.9Å; M1346-L1426 HydrophobicContact CE-CD1 4Å; M1346-L1426 HydrophobicContact CE-CD2 4.02Å; M1346-L1426 HydrophobicContact CE-CG 4.5Å; M1346-I1445 HydrophobicContact CE-CG2 4.37Å; M1346-I1445 HydrophobicContact SD-CG2 3.46Å; M1346-I1445 VanDerWaalsContact SD-CG2 3.52Å; M1346-I1445 WeakPolarHBondContact SD-CG2 3.29Å |
| 1347 | G | 89.5 | Confident | 87.1 | Confident | 24.8 Ų | 24.8 | 36.1 Ų | 36.1 | 26% | 0.256 | 20% | 0.196 | S | C | . | . | H | α-helix | trans | -59.5 | -37.8 | 174.7 | 0 | 0 | 0 | 0 | 0 | 112.9 | S1343 K1344 V1345 F1350 K1351 | S1343-G1347 PolarHBondContact O-N 3.04Å; K1344-G1347 CarbonylContact O-C 3.12Å; K1344-G1347 WeakPolarHBondContact O-CA 3.42Å; K1344-G1347 PolarHBondContact O-N 3.14Å; K1344-G1347 VanDerWaalsContact O-N 3.14Å; V1345-G1347 VanDerWaalsContact C-N 3.35Å; V1345-G1347 PolarHBondContact O-N 3.36Å; G1347-F1350 PolarHBondContact O-N 2.85Å; G1347-K1351 WeakPolarHBondContact O-CB 3.27Å; G1347-K1351 WeakPolarHBondContact O-CG 3.38Å; G1347-K1351 PolarHBondContact O-N 3.19Å; G1347-K1351 VanDerWaalsContact O-N 3.1Å |
| 1348 | C | 86.9 | Confident | 87.6 | Confident | 14 Ų | 14 | 29.8 Ų | 29.8 | 10% | 0.095 | 17% | 0.172 | C | C | . | . | H | α-helix | trans | -65.2 | -44.6 | 174.9 | -131.2 | 0 | 0 | 0 | 0 | 111.7 | R1302 T1305 K1344 V1345 M1346 F1350 K1351 L1352 | R1302-C1348 VanDerWaalsContact CA-SG 3.54Å; R1302-C1348 VanDerWaalsContact CB-SG 3.59Å; T1305-C1348 HydrophobicContact CG2-CB 4.5Å; K1344-C1348 WeakPolarHBondContact O-CB 3.36Å; K1344-C1348 PolarHBondContact O-N 3.16Å; K1344-C1348 PolarHBondContact O-SG 3.43Å; V1345-C1348 WeakPolarHBondContact O-CA 3.47Å; V1345-C1348 VanDerWaalsContact O-CB 3.3Å; V1345-C1348 WeakPolarHBondContact O-CB 3.36Å; V1345-C1348 PolarHBondContact O-N 3.17Å; V1345-C1348 VanDerWaalsContact O-N 3.11Å; M1346-C1348 VanDerWaalsContact C-N 3.28Å; M1346-C1348 PolarHBondContact O-N 2.94Å; C1348-F1350 VanDerWaalsContact C-N 3.34Å; C1348-F1350 PolarHBondContact O-N 3.28Å; C1348-K1351 PolarHBondContact O-N 3.14Å; C1348-L1352 HydrophobicContact CB-CD1 4.44Å; C1348-L1352 VanDerWaalsContact O-CB 3.3Å; C1348-L1352 WeakPolarHBondContact O-CB 3.33Å; C1348-L1352 WeakPolarHBondContact O-CD1 3.5Å; C1348-L1352 VanDerWaalsContact O-CG 3.31Å; C1348-L1352 WeakPolarHBondContact O-CG 3.29Å; C1348-L1352 PolarHBondContact O-N 3.23Å; C1348-L1352 VanDerWaalsContact SG-CD1 3.5Å |
| 1349 | C | 90.4 | Very high | 88 | Confident | 1.6 Ų | 1.6 | 31.9 Ų | 31.9 | 1% | 0.011 | 17% | 0.168 | C | C | . | . | H | α-helix | trans | -58.5 | -47.3 | 175.2 | -68.4 | 0 | 0 | 0 | 0 | 111.7 | T1305 V1345 M1346 K1351 L1352 Y1353 L1419 M1422 | T1305-C1349 VanDerWaalsContact CG2-SG 3.54Å; T1305-C1349 WeakPolarHBondContact CG2-SG 3.16Å; V1345-C1349 PolarHBondContact O-N 3.01Å; V1345-C1349 PolarHBondContact O-SG 2.93Å; V1345-C1349 VanDerWaalsContact O-SG 3.41Å; M1346-C1349 WeakPolarHBondContact O-CB 3.32Å; M1346-C1349 PolarHBondContact O-N 3.14Å; C1349-K1351 VanDerWaalsContact C-N 3.3Å; C1349-K1351 PolarHBondContact O-N 3.15Å; C1349-L1352 PolarHBondContact O-N 3.06Å; C1349-Y1353 HydrophobicContact CB-CD2 4.24Å; C1349-Y1353 HydrophobicContact CB-CE2 4.44Å; C1349-Y1353 VanDerWaalsContact O-CD2 3.31Å; C1349-Y1353 WeakPolarHBondContact O-CD2 3.33Å; C1349-Y1353 PolarHBondContact O-N 3Å; C1349-L1419 HydrophobicContact CB-CD2 4.39Å; C1349-M1422 HydrophobicContact CB-CE 4.36Å; C1349-M1422 HydrophobicContact CB-SD 3.46Å; C1349-M1422 VanDerWaalsContact CB-SD 3.52Å; C1349-M1422 WeakPolarHBondContact CB-SD 3.38Å |
| 1350 | F | 91.3 | Very high | 88.4 | Confident | 4.6 Ų | 4.6 | 30.9 Ų | 30.9 | 2% | 0.02 | 17% | 0.169 | C | C | . | . | H | α-helix | trans | -57.3 | -43 | 176 | -78.8 | -46.3 | 0 | 0 | 0 | 112.4 | M1346 G1347 C1348 G1354 L1419 M1422 L1423 I1445 V1446 R1449 F1450 | M1346-F1350 HydrophobicContact CG-CD2 4.05Å; M1346-F1350 HydrophobicContact CG-CE2 3.64Å; M1346-F1350 HydrophobicContact CG-CZ 4.38Å; M1346-F1350 WeakPolarHBondContact O-CD2 3.38Å; M1346-F1350 PolarHBondContact O-N 3.23Å; M1346-F1350 HydrophobicContact SD-CE2 3.97Å; G1347-F1350 PolarHBondContact O-N 2.85Å; C1348-F1350 VanDerWaalsContact C-N 3.34Å; C1348-F1350 PolarHBondContact O-N 3.28Å; F1350-G1354 WeakPolarHBondContact O-CA 3.39Å; F1350-G1354 PolarHBondContact O-N 3.04Å; F1350-L1419 HydrophobicContact CD1-CD1 4.16Å; F1350-L1419 HydrophobicContact CD1-CD2 3.86Å; F1350-L1419 HydrophobicContact CE1-CD2 4.38Å; F1350-M1422 HydrophobicContact CD1-CE 3.86Å; F1350-M1422 HydrophobicContact CD2-CE 4.35Å; F1350-M1422 HydrophobicContact CE1-CE 3.44Å; F1350-M1422 VanDerWaalsContact CE1-CE 3.44Å; F1350-M1422 HydrophobicContact CE2-CE 3.99Å; F1350-M1422 HydrophobicContact CG-CE 4.29Å; F1350-M1422 HydrophobicContact CZ-CE 3.51Å; F1350-L1423 HydrophobicContact CE1-CD2 4.46Å; F1350-L1423 HydrophobicContact CZ-CD2 4.21Å; F1350-I1445 HydrophobicContact CE2-CG2 4.3Å; F1350-I1445 HydrophobicContact CZ-CG2 4.41Å; F1350-V1446 HydrophobicContact CE1-CG2 4.38Å; F1350-V1446 HydrophobicContact CZ-CG2 4.26Å; F1350-R1449 HydrophobicContact CD2-CB 4.3Å; F1350-R1449 HydrophobicContact CE2-CB 4.11Å; F1350-F1450 HydrophobicContact CB-CD2 3.74Å; F1350-F1450 HydrophobicContact CB-CE2 4.27Å; F1350-F1450 HydrophobicContact CB-CG 4.46Å; F1350-F1450 HydrophobicContact CD1-CB 3.78Å; F1350-F1450 HydrophobicContact CD1-CD1 4.24Å; F1350-F1450 AromaticContact CD1-CD2 3.6Å; F1350-F1450 HydrophobicContact CD1-CD2 3.6Å; F1350-F1450 HydrophobicContact CD1-CE2 4.19Å; F1350-F1450 AromaticContact CD1-CG 3.62Å; F1350-F1450 HydrophobicContact CD1-CG 3.62Å; F1350-F1450 HydrophobicContact CD2-CB 4.36Å; F1350-F1450 HydrophobicContact CE1-CB 3.9Å; F1350-F1450 HydrophobicContact CE1-CD1 4.39Å; F1350-F1450 HydrophobicContact CE1-CD2 4.4Å; F1350-F1450 AromaticContact CE1-CG 3.96Å; F1350-F1450 HydrophobicContact CE1-CG 4.02Å; F1350-F1450 HydrophobicContact CE2-CB 4.41Å; F1350-F1450 HydrophobicContact CG-CB 4.04Å; F1350-F1450 AromaticContact CG-CD2 3.86Å; F1350-F1450 HydrophobicContact CG-CD2 3.86Å; F1350-F1450 HydrophobicContact CG-CG 4.14Å; F1350-F1450 HydrophobicContact CZ-CB 4.24Å; F1350-F1450 WeakPolarHBondContact O-CE2 3.23Å |
| 1351 | K | 84.3 | Confident | 88.6 | Confident | 114.4 Ų | 114.4 | 29.5 Ų | 29.5 | 50% | 0.497 | 16% | 0.16 | S | C | . | . | H | α-helix | trans | -70 | -45 | 178.8 | -120.6 | 175.3 | -176 | 176.8 | 0 | 112.3 | G1347 C1348 C1349 Y1355 | G1347-K1351 WeakPolarHBondContact O-CB 3.27Å; G1347-K1351 WeakPolarHBondContact O-CG 3.38Å; G1347-K1351 PolarHBondContact O-N 3.19Å; G1347-K1351 VanDerWaalsContact O-N 3.1Å; C1348-K1351 PolarHBondContact O-N 3.14Å; C1349-K1351 VanDerWaalsContact C-N 3.3Å; C1349-K1351 PolarHBondContact O-N 3.15Å; K1351-Y1355 VanDerWaalsContact O-CB 3.28Å; K1351-Y1355 WeakPolarHBondContact O-CB 3.28Å; K1351-Y1355 PolarHBondContact O-N 3.32Å |
| 1352 | L | 79.8 | Confident | 88.7 | Confident | 44.2 Ų | 44.2 | 29 Ų | 29 | 23% | 0.231 | 16% | 0.157 | C | C | . | . | H | α-helix | trans | -66.6 | -50.4 | -176.7 | -81.2 | 163.5 | 0 | 0 | 0 | 112.5 | T1305 T1306 C1348 C1349 | T1305-L1352 HydrophobicContact CG2-CD1 3.8Å; T1306-L1352 HydrophobicContact CG2-CD1 4.43Å; C1348-L1352 HydrophobicContact CB-CD1 4.44Å; C1348-L1352 VanDerWaalsContact O-CB 3.3Å; C1348-L1352 WeakPolarHBondContact O-CB 3.33Å; C1348-L1352 WeakPolarHBondContact O-CD1 3.5Å; C1348-L1352 VanDerWaalsContact O-CG 3.31Å; C1348-L1352 WeakPolarHBondContact O-CG 3.29Å; C1348-L1352 PolarHBondContact O-N 3.23Å; C1348-L1352 VanDerWaalsContact SG-CD1 3.5Å; C1349-L1352 PolarHBondContact O-N 3.06Å |
| 1353 | Y | 86 | Confident | 88.5 | Confident | 39.6 Ų | 39.6 | 34.4 Ų | 34.4 | 16% | 0.155 | 18% | 0.177 | C | C | . | . | H | α-helix | trans | -95.7 | -21.6 | -173.2 | -55.8 | -63 | 0 | 0 | 0 | 113 | T1305 A1309 L1314 C1349 P1416 Q1418 L1419 L1535 | T1305-Y1353 HydrophobicContact CG2-CE2 4.41Å; A1309-Y1353 VanDerWaalsContact CB-OH 3.28Å; A1309-Y1353 WeakPolarHBondContact CB-OH 3.37Å; L1314-Y1353 HydrophobicContact CD2-CE2 3.96Å; L1314-Y1353 WeakPolarHBondContact CD2-OH 3.46Å; C1349-Y1353 HydrophobicContact CB-CD2 4.24Å; C1349-Y1353 HydrophobicContact CB-CE2 4.44Å; C1349-Y1353 VanDerWaalsContact O-CD2 3.31Å; C1349-Y1353 WeakPolarHBondContact O-CD2 3.33Å; C1349-Y1353 PolarHBondContact O-N 3Å; Y1353-P1416 WeakPolarHBondContact O-CG 3.29Å; Y1353-Q1418 HydrophobicContact CD1-CB 4.02Å; Y1353-Q1418 HydrophobicContact CD1-CG 3.89Å; Y1353-Q1418 HydrophobicContact CD2-CB 3.97Å; Y1353-Q1418 HydrophobicContact CE1-CB 4.41Å; Y1353-Q1418 HydrophobicContact CE1-CG 4.08Å; Y1353-Q1418 HydrophobicContact CE2-CB 4.31Å; Y1353-Q1418 HydrophobicContact CG-CB 3.79Å; Y1353-Q1418 HydrophobicContact CG-CG 4.2Å; Y1353-L1419 HydrophobicContact CD2-CD2 4.4Å; Y1353-L1535 HydrophobicContact CD1-CD1 4.2Å; Y1353-L1535 HydrophobicContact CE1-CD1 3.9Å |
| 1354 | G | 87.1 | Confident | 88.4 | Confident | 0 Ų | 0 | 41.6 Ų | 41.6 | 0% | 0 | 21% | 0.21 | C | C | . | . | H | α-helix | trans | -98.8 | -13.3 | -173.7 | 0 | 0 | 0 | 0 | 0 | 115.7 | F1350 G1356 Y1357 L1358 | F1350-G1354 WeakPolarHBondContact O-CA 3.39Å; F1350-G1354 PolarHBondContact O-N 3.04Å; G1354-G1356 PolarHBondContact O-N 3.26Å; G1354-Y1357 PolarHBondContact O-N 3.09Å; G1354-L1358 WeakPolarHBondContact O-CB 3.36Å; G1354-L1358 WeakPolarHBondContact O-CG 3.3Å; G1354-L1358 PolarHBondContact O-N 3.1Å |
| 1355 | Y | 84.3 | Confident | 88.4 | Confident | 84.2 Ų | 84.2 | 40.6 Ų | 40.6 | 33% | 0.33 | 21% | 0.206 | S | C | . | . | H | α-helix | trans | -57.1 | -49.2 | -177 | 170.4 | -106 | 0 | 0 | 0 | 113 | K1351 Y1357 L1358 R1359 Y1461 G1462 | K1351-Y1355 VanDerWaalsContact O-CB 3.28Å; K1351-Y1355 WeakPolarHBondContact O-CB 3.28Å; K1351-Y1355 PolarHBondContact O-N 3.32Å; Y1355-Y1357 VanDerWaalsContact C-N 3.33Å; Y1355-Y1357 PolarHBondContact O-N 3.29Å; Y1355-L1358 PolarHBondContact O-N 3Å; Y1355-R1359 WeakPolarHBondContact O-CB 3.24Å; Y1355-R1359 PolarHBondContact O-N 3.1Å; Y1355-R1359 WeakPolarHBondContact OH-CD 3.43Å; Y1355-R1359 PolarHBondContact OH-NH1 3.22Å; Y1355-R1359 VanDerWaalsContact OH-NH1 3.1Å; Y1355-Y1461 VanDerWaalsContact CE2-O 3.3Å; Y1355-Y1461 WeakPolarHBondContact CE2-O 3.38Å; Y1355-G1462 PolarHBondContact OH-O 3.21Å; Y1355-G1462 VanDerWaalsContact OH-O 3.11Å |
| 1356 | G | 83.1 | Confident | 88.2 | Confident | 49 Ų | 49 | 40.7 Ų | 40.7 | 51% | 0.505 | 21% | 0.206 | S | C | . | . | H | α-helix | trans | -60.5 | -42.8 | 179.9 | 0 | 0 | 0 | 0 | 0 | 112.5 | G1354 R1359 S1360 | G1354-G1356 PolarHBondContact O-N 3.26Å; G1356-R1359 PolarHBondContact O-N 3.41Å; G1356-S1360 WeakPolarHBondContact O-CB 3.28Å; G1356-S1360 PolarHBondContact O-N 3.28Å; G1356-S1360 VanDerWaalsContact O-N 3.1Å; G1356-S1360 PolarHBondContact O-OG 3.22Å |
| 1357 | Y | 91.3 | Very high | 87.9 | Confident | 14 Ų | 14 | 42.6 Ų | 42.6 | 6% | 0.055 | 22% | 0.22 | C | C | . | . | H | α-helix | trans | -63.5 | -49.9 | 175.9 | 167.4 | -97.8 | 0 | 0 | 0 | 112.1 | G1354 Y1355 R1359 S1360 L1361 S1411 Q1414 F1415 P1416 F1450 F1451 | G1354-Y1357 PolarHBondContact O-N 3.09Å; Y1355-Y1357 VanDerWaalsContact C-N 3.33Å; Y1355-Y1357 PolarHBondContact O-N 3.29Å; Y1357-R1359 VanDerWaalsContact C-N 3.31Å; Y1357-R1359 PolarHBondContact O-N 3.01Å; Y1357-S1360 PolarHBondContact O-N 3.06Å; Y1357-S1360 VanDerWaalsContact O-N 3.16Å; Y1357-S1360 PolarHBondContact O-OG 3.16Å; Y1357-S1360 VanDerWaalsContact O-OG 3.04Å; Y1357-L1361 HydrophobicContact CE1-CD2 4.07Å; Y1357-L1361 VanDerWaalsContact O-CB 3.26Å; Y1357-L1361 WeakPolarHBondContact O-CB 3.39Å; Y1357-L1361 PolarHBondContact O-N 3.16Å; Y1357-S1411 PolarHBondContact OH-OG 3Å; Y1357-Q1414 HydrophobicContact CD2-CB 4.35Å; Y1357-Q1414 WeakPolarHBondContact CD2-O 3.41Å; Y1357-Q1414 HydrophobicContact CE2-CB 4.3Å; Y1357-F1415 AromaticContact CE1-CD2 3.82Å; Y1357-F1415 HydrophobicContact CE1-CD2 3.82Å; Y1357-F1415 AromaticContact CE1-CE2 3.98Å; Y1357-F1415 HydrophobicContact CE1-CE2 4.03Å; Y1357-F1415 HydrophobicContact CE2-CB 4.43Å; Y1357-F1415 HydrophobicContact CE2-CD2 4.26Å; Y1357-F1415 AromaticContact CZ-CD2 3.65Å; Y1357-P1416 HydrophobicContact CG-CG 4.3Å; Y1357-F1450 AromaticContact CD1-CE1 3.86Å; Y1357-F1450 HydrophobicContact CD1-CE1 3.86Å; Y1357-F1450 AromaticContact CD1-CZ 3.83Å; Y1357-F1450 HydrophobicContact CD1-CZ 3.83Å; Y1357-F1450 AromaticContact CE1-CE1 3.87Å; Y1357-F1450 HydrophobicContact CE1-CE1 3.87Å; Y1357-F1450 HydrophobicContact CE1-CZ 4.31Å; Y1357-F1451 AromaticContact CE1-CE1 3.73Å; Y1357-F1451 HydrophobicContact CE1-CE1 3.73Å; Y1357-F1451 AromaticContact CE1-CZ 3.95Å; Y1357-F1451 HydrophobicContact CE1-CZ 3.95Å |
| 1358 | L | 91.5 | Very high | 87.8 | Confident | 5 Ų | 5 | 43.8 Ų | 43.8 | 3% | 0.026 | 23% | 0.227 | C | C | . | . | H | α-helix | trans | -59.8 | -42.5 | 178.2 | -77.1 | 173.8 | 0 | 0 | 0 | 111.7 | G1354 Y1355 L1361 L1362 F1450 F1451 A1454 Y1461 | G1354-L1358 WeakPolarHBondContact O-CB 3.36Å; G1354-L1358 WeakPolarHBondContact O-CG 3.3Å; G1354-L1358 PolarHBondContact O-N 3.1Å; Y1355-L1358 PolarHBondContact O-N 3Å; L1358-L1361 PolarHBondContact O-N 3.24Å; L1358-L1362 HydrophobicContact CB-CD1 4.44Å; L1358-L1362 HydrophobicContact CD2-CD1 3.85Å; L1358-L1362 HydrophobicContact CD2-CG 4.44Å; L1358-L1362 VanDerWaalsContact O-CB 3.28Å; L1358-L1362 WeakPolarHBondContact O-CB 3.32Å; L1358-L1362 WeakPolarHBondContact O-CG 3.48Å; L1358-L1362 PolarHBondContact O-N 3.13Å; L1358-F1450 HydrophobicContact CD1-CD2 3.69Å; L1358-F1450 HydrophobicContact CD1-CE2 3.29Å; L1358-F1450 HydrophobicContact CD1-CZ 3.9Å; L1358-F1450 HydrophobicContact CD2-CD1 4.41Å; L1358-F1450 HydrophobicContact CD2-CD2 4.4Å; L1358-F1450 HydrophobicContact CD2-CE1 4.24Å; L1358-F1450 HydrophobicContact CD2-CE2 4.18Å; L1358-F1450 HydrophobicContact CD2-CZ 4.05Å; L1358-F1450 HydrophobicContact CG-CD2 4.25Å; L1358-F1450 HydrophobicContact CG-CE1 4.3Å; L1358-F1450 HydrophobicContact CG-CE2 3.58Å; L1358-F1450 HydrophobicContact CG-CZ 3.61Å; L1358-F1451 HydrophobicContact CD2-CD1 3.84Å; L1358-F1451 HydrophobicContact CD2-CE1 4.13Å; L1358-A1454 HydrophobicContact CD1-CB 3.96Å; L1358-A1454 HydrophobicContact CD2-CB 4.15Å; L1358-Y1461 HydrophobicContact CD1-CD1 4.31Å |
| 1359 | R | 86.6 | Confident | 87.7 | Confident | 82.6 Ų | 82.6 | 43.4 Ų | 43.4 | 31% | 0.312 | 22% | 0.224 | S | C | . | . | H | α-helix | trans | -64.3 | -43.2 | 178.8 | -173.2 | 173.9 | 178.8 | -173.3 | -1.3 | 111.5 | Y1355 G1356 Y1357 L1361 R1363 | Y1355-R1359 WeakPolarHBondContact O-CB 3.24Å; Y1355-R1359 PolarHBondContact O-N 3.1Å; Y1355-R1359 WeakPolarHBondContact OH-CD 3.43Å; Y1355-R1359 PolarHBondContact OH-NH1 3.22Å; Y1355-R1359 VanDerWaalsContact OH-NH1 3.1Å; G1356-R1359 PolarHBondContact O-N 3.41Å; Y1357-R1359 VanDerWaalsContact C-N 3.31Å; Y1357-R1359 PolarHBondContact O-N 3.01Å; R1359-L1361 VanDerWaalsContact C-N 3.33Å; R1359-L1361 PolarHBondContact O-N 3.08Å; R1359-R1363 WeakPolarHBondContact O-CB 3.42Å; R1359-R1363 PolarHBondContact O-N 3.11Å |
| 1360 | S | 88.9 | Confident | 87.4 | Confident | 77.8 Ų | 77.8 | 44.4 Ų | 44.4 | 54% | 0.544 | 23% | 0.23 | S | C | . | . | H | α-helix | trans | -65.8 | -37 | 176.8 | 82.1 | 0 | 0 | 0 | 0 | 112.5 | G1356 Y1357 | G1356-S1360 WeakPolarHBondContact O-CB 3.28Å; G1356-S1360 PolarHBondContact O-N 3.28Å; G1356-S1360 VanDerWaalsContact O-N 3.1Å; G1356-S1360 PolarHBondContact O-OG 3.22Å; Y1357-S1360 PolarHBondContact O-N 3.06Å; Y1357-S1360 VanDerWaalsContact O-N 3.16Å; Y1357-S1360 PolarHBondContact O-OG 3.16Å; Y1357-S1360 VanDerWaalsContact O-OG 3.04Å |
| 1361 | L | 91.9 | Very high | 86.9 | Confident | 13.4 Ų | 13.4 | 51.4 Ų | 51.4 | 7% | 0.07 | 26% | 0.263 | C | S | . | . | H | α-helix | trans | -76.5 | -47.3 | -176.4 | -175.7 | 71.5 | 0 | 0 | 0 | 113 | Y1357 L1358 R1359 L1407 I1408 S1411 F1451 | Y1357-L1361 HydrophobicContact CE1-CD2 4.07Å; Y1357-L1361 VanDerWaalsContact O-CB 3.26Å; Y1357-L1361 WeakPolarHBondContact O-CB 3.39Å; Y1357-L1361 PolarHBondContact O-N 3.16Å; L1358-L1361 PolarHBondContact O-N 3.24Å; R1359-L1361 VanDerWaalsContact C-N 3.33Å; R1359-L1361 PolarHBondContact O-N 3.08Å; L1361-L1407 HydrophobicContact CD1-CB 4.29Å; L1361-L1407 HydrophobicContact CD1-CD2 3.94Å; L1361-L1407 HydrophobicContact CG-CD2 4.43Å; L1361-I1408 HydrophobicContact CD2-CG1 4.02Å; L1361-S1411 VanDerWaalsContact CD1-CB 3.48Å; L1361-S1411 WeakPolarHBondContact CD1-OG 3.43Å; L1361-F1451 HydrophobicContact CD2-CD1 4.45Å; L1361-F1451 HydrophobicContact CD2-CE1 3.82Å |
| 1362 | L | 91.8 | Very high | 86.8 | Confident | 0.2 Ų | 0.2 | 49.8 Ų | 49.8 | 0% | 0.001 | 26% | 0.26 | C | S | . | . | H | α-helix | trans | -94.8 | -20.3 | -166.9 | -62.9 | 178.3 | 0 | 0 | 0 | 113.4 | L1358 E1364 F1365 V1366 I1404 A1454 I1455 I1463 | L1358-L1362 HydrophobicContact CB-CD1 4.44Å; L1358-L1362 HydrophobicContact CD2-CD1 3.85Å; L1358-L1362 HydrophobicContact CD2-CG 4.44Å; L1358-L1362 VanDerWaalsContact O-CB 3.28Å; L1358-L1362 WeakPolarHBondContact O-CB 3.32Å; L1358-L1362 WeakPolarHBondContact O-CG 3.48Å; L1358-L1362 PolarHBondContact O-N 3.13Å; L1362-E1364 PolarHBondContact O-N 2.95Å; L1362-F1365 PolarHBondContact O-N 3.22Å; L1362-V1366 HydrophobicContact CB-CG2 4.45Å; L1362-V1366 WeakPolarHBondContact O-CB 3.34Å; L1362-V1366 VanDerWaalsContact O-CG2 3.27Å; L1362-V1366 WeakPolarHBondContact O-CG2 3.39Å; L1362-V1366 PolarHBondContact O-N 3.35Å; L1362-I1404 HydrophobicContact CD2-CD1 3.58Å; L1362-I1404 VanDerWaalsContact CD2-CD1 3.46Å; L1362-I1404 HydrophobicContact CD2-CG1 4.31Å; L1362-A1454 HydrophobicContact CD1-CB 3.71Å; L1362-I1455 HydrophobicContact CD1-CG1 4.24Å; L1362-I1455 HydrophobicContact CD2-CG1 4.14Å; L1362-I1463 HydrophobicContact CB-CD1 4.04Å; L1362-I1463 HydrophobicContact CB-CG2 4.02Å; L1362-I1463 HydrophobicContact CD1-CD1 3.65Å; L1362-I1463 HydrophobicContact CG-CD1 4.43Å |
| 1363 | R | 88.6 | Confident | 86.5 | Confident | 115.4 Ų | 115.4 | 53.6 Ų | 53.6 | 44% | 0.435 | 28% | 0.279 | S | S | . | . | H | α-helix | trans | -61.5 | -51 | -171.6 | -177.7 | 172.6 | -169.3 | -127.6 | 0.7 | 112.9 | R1359 F1365 V1366 C1367 I1463 | R1359-R1363 WeakPolarHBondContact O-CB 3.42Å; R1359-R1363 PolarHBondContact O-N 3.11Å; R1363-F1365 VanDerWaalsContact C-N 3.33Å; R1363-F1365 PolarHBondContact O-N 3.16Å; R1363-V1366 PolarHBondContact O-N 3.07Å; R1363-C1367 WeakPolarHBondContact O-CB 3.33Å; R1363-C1367 PolarHBondContact O-N 3.24Å; R1363-C1367 PolarHBondContact O-SG 3.2Å; R1363-C1367 VanDerWaalsContact O-SG 3.36Å; R1363-I1463 HydrophobicContact CB-CG2 4.07Å |
| 1364 | E | 87.8 | Confident | 85.9 | Confident | 155.6 Ų | 155.6 | 59.7 Ų | 59.7 | 73% | 0.727 | 31% | 0.314 | S | S | * | . | H | α-helix | trans | -62.4 | -42.3 | 178.5 | -70.5 | -133.3 | 157.5 | 0 | 0 | 111.6 | L1362 C1367 A1368 | L1362-E1364 PolarHBondContact O-N 2.95Å; E1364-C1367 PolarHBondContact O-N 3.22Å; E1364-A1368 VanDerWaalsContact O-CB 3.29Å; E1364-A1368 WeakPolarHBondContact O-CB 3.43Å; E1364-A1368 PolarHBondContact O-N 3.37Å |
| 1365 | F | 90.7 | Very high | 85.5 | Confident | 13 Ų | 13 | 63.3 Ų | 63.3 | 6% | 0.057 | 33% | 0.33 | C | S | . | . | H | α-helix | trans | -60.7 | -49.1 | 177 | 174.3 | -93.6 | 0 | 0 | 0 | 112.4 | L1362 R1363 A1368 T1369 L1400 N1403 I1404 L1407 L1476 | L1362-F1365 PolarHBondContact O-N 3.22Å; R1363-F1365 VanDerWaalsContact C-N 3.33Å; R1363-F1365 PolarHBondContact O-N 3.16Å; F1365-A1368 PolarHBondContact O-N 3.13Å; F1365-T1369 VanDerWaalsContact O-CB 3.3Å; F1365-T1369 WeakPolarHBondContact O-CB 3.31Å; F1365-T1369 PolarHBondContact O-N 3.2Å; F1365-T1369 PolarHBondContact O-OG1 3.04Å; F1365-L1400 HydrophobicContact CE1-CD2 4.44Å; F1365-L1400 HydrophobicContact CE2-CD1 4.21Å; F1365-L1400 HydrophobicContact CE2-CG 4.35Å; F1365-L1400 HydrophobicContact CZ-CD1 3.91Å; F1365-L1400 VanDerWaalsContact CZ-CD1 3.49Å; F1365-L1400 HydrophobicContact CZ-CD2 3.76Å; F1365-L1400 HydrophobicContact CZ-CG 3.99Å; F1365-N1403 HydrophobicContact CE2-CB 4.18Å; F1365-I1404 HydrophobicContact CB-CD1 4.29Å; F1365-I1404 HydrophobicContact CD1-CD1 3.56Å; F1365-I1404 VanDerWaalsContact CD1-CD1 3.43Å; F1365-I1404 HydrophobicContact CD1-CG1 4.39Å; F1365-I1404 HydrophobicContact CD2-CB 4.32Å; F1365-I1404 HydrophobicContact CD2-CD1 3.97Å; F1365-I1404 HydrophobicContact CE1-CB 4.19Å; F1365-I1404 HydrophobicContact CE1-CD1 3.65Å; F1365-I1404 HydrophobicContact CE1-CG1 4.21Å; F1365-I1404 HydrophobicContact CE2-CB 3.79Å; F1365-I1404 HydrophobicContact CE2-CD1 4.15Å; F1365-I1404 HydrophobicContact CE2-CG1 4.45Å; F1365-I1404 HydrophobicContact CG-CD1 3.62Å; F1365-I1404 HydrophobicContact CZ-CB 3.72Å; F1365-I1404 HydrophobicContact CZ-CD1 4.01Å; F1365-I1404 HydrophobicContact CZ-CG1 4.24Å; F1365-I1404 HydrophobicContact CZ-CG2 4.41Å; F1365-L1407 HydrophobicContact CB-CD1 3.99Å; F1365-L1407 HydrophobicContact CD2-CD1 4.11Å; F1365-L1407 HydrophobicContact CG-CD1 4.35Å; F1365-L1476 HydrophobicContact CE1-CD2 4.07Å |
| 1366 | V | 87.8 | Confident | 85.5 | Confident | 1.2 Ų | 1.2 | 61.6 Ų | 61.6 | 1% | 0.007 | 33% | 0.33 | C | S | . | . | H | α-helix | trans | -65.6 | -44.3 | -179.6 | 172.9 | 0 | 0 | 0 | 0 | 110.2 | L1362 R1363 A1368 T1369 T1370 P1458 I1463 T1464 | L1362-V1366 HydrophobicContact CB-CG2 4.45Å; L1362-V1366 WeakPolarHBondContact O-CB 3.34Å; L1362-V1366 VanDerWaalsContact O-CG2 3.27Å; L1362-V1366 WeakPolarHBondContact O-CG2 3.39Å; L1362-V1366 PolarHBondContact O-N 3.35Å; R1363-V1366 PolarHBondContact O-N 3.07Å; V1366-A1368 PolarHBondContact O-N 3.24Å; V1366-T1369 PolarHBondContact O-N 3.09Å; V1366-T1370 VanDerWaalsContact O-CB 3.3Å; V1366-T1370 WeakPolarHBondContact O-CB 3.33Å; V1366-T1370 PolarHBondContact O-N 2.96Å; V1366-T1370 PolarHBondContact O-OG1 3.21Å; V1366-P1458 HydrophobicContact CG1-CB 3.9Å; V1366-P1458 HydrophobicContact CG1-CG 3.85Å; V1366-P1458 HydrophobicContact CG2-CB 4.04Å; V1366-P1458 HydrophobicContact CG2-CG 4.47Å; V1366-I1463 HydrophobicContact CG2-CG2 4.47Å; V1366-T1464 HydrophobicContact CG1-CG2 3.81Å |
| 1367 | C | 86.7 | Confident | 85.7 | Confident | 40.6 Ų | 40.6 | 59.5 Ų | 59.5 | 27% | 0.274 | 31% | 0.307 | S | S | . | . | H | α-helix | trans | -60.5 | -48.1 | 177.3 | -74.1 | 0 | 0 | 0 | 0 | 111.9 | R1363 E1364 T1369 T1370 Q1371 | R1363-C1367 WeakPolarHBondContact O-CB 3.33Å; R1363-C1367 PolarHBondContact O-N 3.24Å; R1363-C1367 PolarHBondContact O-SG 3.2Å; R1363-C1367 VanDerWaalsContact O-SG 3.36Å; E1364-C1367 PolarHBondContact O-N 3.22Å; C1367-T1369 VanDerWaalsContact C-N 3.34Å; C1367-T1369 PolarHBondContact O-N 3.03Å; C1367-T1370 PolarHBondContact O-N 3.13Å; C1367-Q1371 WeakPolarHBondContact O-CG 3.42Å; C1367-Q1371 PolarHBondContact O-N 3.16Å; C1367-Q1371 VanDerWaalsContact O-N 3.13Å |
| 1368 | A | 86.7 | Confident | 85.6 | Confident | 49.2 Ų | 49.2 | 59.9 Ų | 59.9 | 41% | 0.407 | 31% | 0.309 | S | S | . | . | H | α-helix | trans | -62.2 | -41 | 177.8 | 0 | 0 | 0 | 0 | 0 | 112.1 | E1364 F1365 V1366 T1370 Q1371 N1372 | E1364-A1368 VanDerWaalsContact O-CB 3.29Å; E1364-A1368 WeakPolarHBondContact O-CB 3.43Å; E1364-A1368 PolarHBondContact O-N 3.37Å; F1365-A1368 PolarHBondContact O-N 3.13Å; V1366-A1368 PolarHBondContact O-N 3.24Å; A1368-T1370 VanDerWaalsContact C-N 3.34Å; A1368-T1370 PolarHBondContact O-N 3.2Å; A1368-Q1371 PolarHBondContact O-N 3.19Å; A1368-N1372 PolarHBondContact O-N 2.86Å; A1368-N1372 PolarHBondContact O-ND2 2.81Å |
| 1369 | T | 86.1 | Confident | 85.4 | Confident | 6.2 Ų | 6.2 | 60 Ų | 60 | 4% | 0.038 | 31% | 0.31 | C | S | . | . | H | α-helix | trans | -65.4 | -40.2 | 177 | -53 | 0 | 0 | 0 | 0 | 111.2 | F1365 V1366 C1367 Q1371 N1372 L1400 I1472 L1476 | F1365-T1369 VanDerWaalsContact O-CB 3.3Å; F1365-T1369 WeakPolarHBondContact O-CB 3.31Å; F1365-T1369 PolarHBondContact O-N 3.2Å; F1365-T1369 PolarHBondContact O-OG1 3.04Å; V1366-T1369 PolarHBondContact O-N 3.09Å; C1367-T1369 VanDerWaalsContact C-N 3.34Å; C1367-T1369 PolarHBondContact O-N 3.03Å; T1369-Q1371 VanDerWaalsContact C-N 3.26Å; T1369-Q1371 PolarHBondContact O-N 3.2Å; T1369-N1372 PolarHBondContact O-N 3.13Å; T1369-N1372 VanDerWaalsContact O-N 3.13Å; T1369-L1400 HydrophobicContact CG2-CD1 3.83Å; T1369-L1400 HydrophobicContact CG2-CD2 4.29Å; T1369-I1472 HydrophobicContact CG2-CG2 3.95Å; T1369-I1472 WeakPolarHBondContact O-CD1 3.23Å; T1369-L1476 HydrophobicContact CG2-CD2 4.46Å |
| 1370 | T | 82.8 | Confident | 85.2 | Confident | 22.6 Ų | 22.6 | 58 Ų | 58 | 14% | 0.139 | 31% | 0.305 | C | S | . | . | H | α-helix | trans | -67.4 | -26.3 | -179.3 | -49.7 | 0 | 0 | 0 | 0 | 112.5 | V1366 C1367 A1368 V1466 P1468 I1472 | V1366-T1370 VanDerWaalsContact O-CB 3.3Å; V1366-T1370 WeakPolarHBondContact O-CB 3.33Å; V1366-T1370 PolarHBondContact O-N 2.96Å; V1366-T1370 PolarHBondContact O-OG1 3.21Å; C1367-T1370 PolarHBondContact O-N 3.13Å; A1368-T1370 VanDerWaalsContact C-N 3.34Å; A1368-T1370 PolarHBondContact O-N 3.2Å; T1370-V1466 HydrophobicContact CG2-CG1 4.24Å; T1370-P1468 HydrophobicContact CG2-CB 4.5Å; T1370-I1472 HydrophobicContact CG2-CD1 4.49Å; T1370-I1472 WeakPolarHBondContact O-CD1 3.38Å |
| 1371 | Q | 82 | Confident | 84.8 | Confident | 150.8 Ų | 150.8 | 61.7 Ų | 61.7 | 71% | 0.705 | 31% | 0.314 | S | S | * | . | H | α-helix | trans | -77.8 | -21.6 | 176.4 | -71.8 | 173.1 | -1.9 | 0 | 0 | 113.4 | C1367 A1368 T1369 I1373 | C1367-Q1371 WeakPolarHBondContact O-CG 3.42Å; C1367-Q1371 PolarHBondContact O-N 3.16Å; C1367-Q1371 VanDerWaalsContact O-N 3.13Å; A1368-Q1371 PolarHBondContact O-N 3.19Å; T1369-Q1371 VanDerWaalsContact C-N 3.26Å; T1369-Q1371 PolarHBondContact O-N 3.2Å; Q1371-I1373 VanDerWaalsContact C-N 3.28Å; Q1371-I1373 PolarHBondContact O-N 3.16Å |
| 1372 | N | 80.9 | Confident | 84.2 | Confident | 80.6 Ų | 80.6 | 65.8 Ų | 65.8 | 43% | 0.431 | 34% | 0.344 | S | S | . | . | trans | -83.2 | 66.7 | 179.1 | -73.3 | -30.4 | 0 | 0 | 0 | 111.7 | A1368 T1369 D1374 K1375 | A1368-N1372 PolarHBondContact O-N 2.86Å; A1368-N1372 PolarHBondContact O-ND2 2.81Å; T1369-N1372 PolarHBondContact O-N 3.13Å; T1369-N1372 VanDerWaalsContact O-N 3.13Å; N1372-D1374 PolarHBondContact O-N 3.1Å; N1372-K1375 HydrophobicContact CB-CG 4.48Å; N1372-K1375 PolarHBondContact O-N 3.27Å | ||
| 1373 | I | 73.1 | Confident | 83.7 | Confident | 125.4 Ų | 125.4 | 72.6 Ų | 72.6 | 64% | 0.643 | 37% | 0.369 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -65.1 | -27.8 | -175.3 | -59.9 | 166.8 | 0 | 0 | 0 | 112 | Q1371 K1375 | Q1371-I1373 VanDerWaalsContact C-N 3.28Å; Q1371-I1373 PolarHBondContact O-N 3.16Å; I1373-K1375 VanDerWaalsContact C-N 3.29Å; I1373-K1375 PolarHBondContact O-N 3.27Å |
| 1374 | D | 75.2 | Confident | 83.2 | Confident | 166.4 Ų | 166.4 | 69.2 Ų | 69.2 | 89% | 0.89 | 36% | 0.36 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -78.8 | -11.4 | -175.1 | -57.9 | -31.3 | 0 | 0 | 0 | 114.2 | N1372 | N1372-D1374 PolarHBondContact O-N 3.1Š|
| 1375 | K | 78.4 | Confident | 82.7 | Confident | 75.8 Ų | 75.8 | 69.7 Ų | 69.7 | 33% | 0.33 | 36% | 0.362 | S | S | . | . | trans | -89 | 130.5 | -178.2 | -71.6 | -163.9 | 172.6 | -150.4 | 0 | 112.1 | N1372 I1373 Y1377 N1396 S1471 | N1372-K1375 HydrophobicContact CB-CG 4.48Å; N1372-K1375 PolarHBondContact O-N 3.27Å; I1373-K1375 VanDerWaalsContact C-N 3.29Å; I1373-K1375 PolarHBondContact O-N 3.27Å; K1375-Y1377 HydrophobicContact CB-CE1 4.41Å; K1375-Y1377 HydrophobicContact CB-CE2 4.15Å; K1375-N1396 WeakPolarHBondContact CE-OD1 3.38Å; K1375-N1396 PolarHBondContact NZ-OD1 3.17Å; K1375-S1471 PolarHBondContact O-OG 2.84Å | ||
| 1376 | C | 82.7 | Confident | 81.5 | Confident | 49.2 Ų | 49.2 | 79 Ų | 79 | 33% | 0.332 | 41% | 0.406 | S | S | . | . | trans | -100.8 | 144.4 | 170.1 | -166.3 | 0 | 0 | 0 | 0 | 110.9 | N1393 | C1376-N1393 WeakPolarHBondContact CB-OD1 3.44Å; C1376-N1393 PolarHBondContact O-OD1 3.3Å | ||
| 1377 | Y | 88.5 | Confident | 80.8 | Confident | 4.2 Ų | 4.2 | 83 Ų | 83 | 2% | 0.016 | 45% | 0.447 | C | S | . | . | trans | -124.8 | 7.9 | -176.5 | -57.9 | -76 | 0 | 0 | 0 | 112.9 | K1375 V1379 N1396 L1397 L1400 L1478 | K1375-Y1377 HydrophobicContact CB-CE1 4.41Å; K1375-Y1377 HydrophobicContact CB-CE2 4.15Å; Y1377-V1379 PolarHBondContact O-N 3.26Å; Y1377-N1396 HydrophobicContact CD1-CB 4.1Å; Y1377-N1396 HydrophobicContact CE1-CB 4Å; Y1377-L1397 HydrophobicContact CD1-CB 4.48Å; Y1377-L1397 HydrophobicContact CD1-CD1 4.22Å; Y1377-L1397 HydrophobicContact CG-CD1 4.43Å; Y1377-L1400 HydrophobicContact CD1-CD2 4.15Å; Y1377-L1400 HydrophobicContact CE1-CB 4.29Å; Y1377-L1400 HydrophobicContact CE1-CD1 3.94Å; Y1377-L1400 HydrophobicContact CE1-CD2 3.8Å; Y1377-L1400 HydrophobicContact CE1-CG 4.41Å; Y1377-L1400 HydrophobicContact CE2-CD2 4.49Å; Y1377-L1400 WeakPolarHBondContact OH-CD1 3.37Å; Y1377-L1478 VanDerWaalsContact O-CD1 3.28Å; Y1377-L1478 WeakPolarHBondContact O-CD1 3.32Å | ||
| 1378 | E | 88.6 | Confident | 80.2 | Confident | 22.2 Ų | 22.2 | 83 Ų | 83 | 10% | 0.104 | 45% | 0.45 | C | S | . | . | trans | -75.6 | 129 | -178.8 | -171 | 59.1 | -99.3 | 0 | 0 | 110.6 | D1380 R1383 L1384 N1393 R1474 | E1378-D1380 VanDerWaalsContact OE1-CB 3.3Å; E1378-D1380 WeakPolarHBondContact OE1-CB 3.41Å; E1378-D1380 PolarHBondContact OE1-N 3.07Å; E1378-D1380 VanDerWaalsContact OE1-N 3.13Å; E1378-R1383 HydrophobicContact CG-CB 3.86Å; E1378-R1383 IonicContact OE2-CZ 3.02Å; E1378-R1383 IonicContact OE2-NE 3.75Å; E1378-R1383 PolarHBondContact OE2-NE 3Å; E1378-R1383 VanDerWaalsContact OE2-NE 3.14Å; E1378-R1383 IonicContact OE2-NH2 3.02Å; E1378-L1384 HydrophobicContact CB-CD2 4.34Å; E1378-L1384 HydrophobicContact CG-CD1 4.39Å; E1378-L1384 HydrophobicContact CG-CD2 4.37Å; E1378-L1384 WeakPolarHBondContact O-CD2 3.32Å; E1378-N1393 VanDerWaalsContact O-CB 3.29Å; E1378-N1393 WeakPolarHBondContact O-CB 3.37Å; E1378-N1393 PolarHBondContact O-ND2 3.1Å; E1378-R1474 IonicContact OE1-CZ 3.29Å; E1378-R1474 IonicContact OE1-NE 3.66Å; E1378-R1474 IonicContact OE1-NH2 3.18Å; E1378-R1474 PolarHBondContact OE1-NH2 3.06Å; E1378-R1474 VanDerWaalsContact OE1-NH2 3.12Å; E1378-R1474 WeakPolarHBondContact OE2-CG 3.22Å; E1378-R1474 IonicContact OE2-CZ 3.52Å; E1378-R1474 IonicContact OE2-NE 2.75Å; E1378-R1474 PolarHBondContact OE2-NE 3.04Å; E1378-R1474 IonicContact OE2-NH2 3.36Å; E1378-R1474 PolarHBondContact OE2-NH2 3.17Å | ||
| 1379 | V | 86.8 | Confident | 80 | Confident | 6.6 Ų | 6.6 | 84.6 Ų | 84.6 | 4% | 0.04 | 45% | 0.452 | C | S | . | . | trans | -124.5 | -6.2 | -176.1 | -64 | 0 | 0 | 0 | 0 | 112.4 | Y1377 Q1381 L1390 N1393 L1397 L1478 C1497 F1501 | Y1377-V1379 PolarHBondContact O-N 3.26Å; V1379-Q1381 PolarHBondContact O-N 3.25Å; V1379-L1390 HydrophobicContact CB-CD1 4.21Å; V1379-L1390 HydrophobicContact CG1-CD1 4.41Å; V1379-L1390 WeakPolarHBondContact O-CD1 3.38Å; V1379-N1393 HydrophobicContact CG1-CB 4.46Å; V1379-L1397 HydrophobicContact CG1-CD2 4.12Å; V1379-L1397 HydrophobicContact CG2-CD2 4.34Å; V1379-L1478 HydrophobicContact CG2-CD1 4.11Å; V1379-L1478 HydrophobicContact CG2-CD2 4.41Å; V1379-C1497 HydrophobicContact CG2-CB 4.49Å; V1379-F1501 HydrophobicContact CB-CE2 4.48Å; V1379-F1501 HydrophobicContact CG1-CE2 4.43Å; V1379-F1501 HydrophobicContact CG1-CZ 4.08Å; V1379-F1501 HydrophobicContact CG2-CE2 4.34Å | ||
| 1380 | D | 83.5 | Confident | 80 | Confident | 41 Ų | 41 | 86.8 Ų | 86.8 | 22% | 0.219 | 46% | 0.463 | C | S | . | . | trans | -77.7 | 112.8 | 171.6 | -170 | -18.6 | 0 | 0 | 0 | 109.7 | E1378 S1382 R1383 L1384 C1497 | E1378-D1380 VanDerWaalsContact OE1-CB 3.3Å; E1378-D1380 WeakPolarHBondContact OE1-CB 3.41Å; E1378-D1380 PolarHBondContact OE1-N 3.07Å; E1378-D1380 VanDerWaalsContact OE1-N 3.13Å; D1380-S1382 PolarHBondContact O-N 3.11Å; D1380-S1382 VanDerWaalsContact O-N 3.08Å; D1380-S1382 WeakPolarHBondContact OD1-CB 3.2Å; D1380-S1382 PolarHBondContact OD1-N 3.22Å; D1380-S1382 PolarHBondContact OD1-OG 3.11Å; D1380-S1382 PolarHBondContact OD2-OG 3.21Å; D1380-R1383 HydrophobicContact CB-CB 4.3Å; D1380-R1383 HydrophobicContact CB-CG 4.27Å; D1380-R1383 PolarHBondContact O-N 3.16Å; D1380-R1383 IonicContact OD2-NE 3.68Å; D1380-R1383 PolarHBondContact OD2-NE 3.14Å; D1380-L1384 VanDerWaalsContact O-CD1 3.28Å; D1380-L1384 WeakPolarHBondContact O-CD1 3.31Å; D1380-L1384 PolarHBondContact O-N 3.22Å; D1380-C1497 HydrophobicContact CB-CB 4.3Å | ||
| 1381 | Q | 79.5 | Confident | 80.1 | Confident | 156 Ų | 156 | 89.1 Ų | 89.1 | 73% | 0.729 | 48% | 0.484 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -54.3 | -28.5 | 179.5 | -74.7 | 179.2 | -3.7 | 0 | 0 | 113 | V1379 R1383 L1390 | V1379-Q1381 PolarHBondContact O-N 3.25Å; Q1381-R1383 VanDerWaalsContact C-N 3.25Å; Q1381-R1383 PolarHBondContact O-N 3.19Å; Q1381-L1390 HydrophobicContact CG-CD1 4.44Å; Q1381-L1390 HydrophobicContact CG-CD2 4.05Å |
| 1382 | S | 80.1 | Confident | 80.4 | Confident | 99.2 Ų | 99.2 | 87.2 Ų | 87.2 | 69% | 0.694 | 48% | 0.475 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -74.2 | -11.8 | 178.4 | 68.1 | 0 | 0 | 0 | 0 | 114.1 | D1380 | D1380-S1382 PolarHBondContact O-N 3.11Å; D1380-S1382 VanDerWaalsContact O-N 3.08Å; D1380-S1382 WeakPolarHBondContact OD1-CB 3.2Å; D1380-S1382 PolarHBondContact OD1-N 3.22Å; D1380-S1382 PolarHBondContact OD1-OG 3.11Å; D1380-S1382 PolarHBondContact OD2-OG 3.21Å |
| 1383 | R | 80.4 | Confident | 80.8 | Confident | 142.4 Ų | 142.4 | 83.6 Ų | 83.6 | 54% | 0.537 | 46% | 0.456 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -121.1 | 0.6 | -174.4 | -61 | -178.4 | 140.4 | -168.3 | -3.9 | 113.8 | E1378 D1380 Q1381 | E1378-R1383 HydrophobicContact CG-CB 3.86Å; E1378-R1383 IonicContact OE2-CZ 3.02Å; E1378-R1383 IonicContact OE2-NE 3.75Å; E1378-R1383 PolarHBondContact OE2-NE 3Å; E1378-R1383 VanDerWaalsContact OE2-NE 3.14Å; E1378-R1383 IonicContact OE2-NH2 3.02Å; D1380-R1383 HydrophobicContact CB-CB 4.3Å; D1380-R1383 HydrophobicContact CB-CG 4.27Å; D1380-R1383 PolarHBondContact O-N 3.16Å; D1380-R1383 IonicContact OD2-NE 3.68Å; D1380-R1383 PolarHBondContact OD2-NE 3.14Å; Q1381-R1383 VanDerWaalsContact C-N 3.25Å; Q1381-R1383 PolarHBondContact O-N 3.19Å |
| 1384 | L | 79.7 | Confident | 81.5 | Confident | 45.6 Ų | 45.6 | 78.7 Ų | 78.7 | 24% | 0.239 | 43% | 0.432 | C | S | . | . | trans | -69.4 | 131.8 | 176.6 | -90.8 | 119.1 | 0 | 0 | 0 | 110.2 | E1378 D1380 A1388 L1390 | E1378-L1384 HydrophobicContact CB-CD2 4.34Å; E1378-L1384 HydrophobicContact CG-CD1 4.39Å; E1378-L1384 HydrophobicContact CG-CD2 4.37Å; E1378-L1384 WeakPolarHBondContact O-CD2 3.32Å; D1380-L1384 VanDerWaalsContact O-CD1 3.28Å; D1380-L1384 WeakPolarHBondContact O-CD1 3.31Å; D1380-L1384 PolarHBondContact O-N 3.22Å; L1384-A1388 HydrophobicContact CB-CB 4.36Å; L1384-A1388 HydrophobicContact CD2-CB 3.87Å; L1384-A1388 WeakPolarHBondContact CD2-O 3.41Å; L1384-A1388 HydrophobicContact CG-CB 4.09Å; L1384-L1390 HydrophobicContact CD1-CB 3.97Å; L1384-L1390 HydrophobicContact CD1-CD1 3.89Å; L1384-L1390 HydrophobicContact CD1-CG 4.47Å; L1384-L1390 HydrophobicContact CD2-CB 4.11Å; L1384-L1390 HydrophobicContact CD2-CD1 4.27Å | ||
| 1385 | E | 75.6 | Confident | 82.3 | Confident | 166 Ų | 166 | 73.2 Ų | 73.2 | 78% | 0.776 | 41% | 0.41 | S | S | * | . | trans | -70.4 | 151.2 | 170.1 | -65.1 | -177.9 | 174.1 | 0 | 0 | 110.7 | G1387 A1388 | E1385-G1387 PolarHBondContact O-N 3.17Å; E1385-G1387 VanDerWaalsContact O-N 3.11Å; E1385-A1388 VanDerWaalsContact O-CB 3.24Å; E1385-A1388 WeakPolarHBondContact O-CB 3.42Å; E1385-A1388 PolarHBondContact O-N 3.02Å | ||
| 1386 | E | 67.3 | Low | 82.9 | Confident | 208.6 Ų | 208.6 | 70.4 Ų | 70.4 | 98% | 0.975 | 40% | 0.398 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -59.8 | 115.5 | 179.2 | -70.9 | -175.4 | 166.1 | 0 | 0 | 110.6 | ||
| 1387 | G | 72.8 | Confident | 83.3 | Confident | 85 Ų | 85 | 68.1 Ų | 68.1 | 88% | 0.876 | 38% | 0.382 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 103.6 | -7.9 | -176.6 | 0 | 0 | 0 | 0 | 0 | 115.1 | E1385 | E1385-G1387 PolarHBondContact O-N 3.17Å; E1385-G1387 VanDerWaalsContact O-N 3.11Å |
| 1388 | A | 74.2 | Confident | 83.5 | Confident | 39.6 Ų | 39.6 | 70 Ų | 70 | 33% | 0.327 | 39% | 0.393 | S | S | . | . | trans | -70.7 | 134.9 | 176.3 | 0 | 0 | 0 | 0 | 0 | 111.9 | L1384 E1385 L1390 | L1384-A1388 HydrophobicContact CB-CB 4.36Å; L1384-A1388 HydrophobicContact CD2-CB 3.87Å; L1384-A1388 WeakPolarHBondContact CD2-O 3.41Å; L1384-A1388 HydrophobicContact CG-CB 4.09Å; E1385-A1388 VanDerWaalsContact O-CB 3.24Å; E1385-A1388 WeakPolarHBondContact O-CB 3.42Å; E1385-A1388 PolarHBondContact O-N 3.02Å; A1388-L1390 PolarHBondContact O-N 3.32Å | ||
| 1389 | N | 82.6 | Confident | 83.6 | Confident | 83.8 Ų | 83.8 | 73.4 Ų | 73.4 | 45% | 0.448 | 41% | 0.412 | S | S | . | . | trans | -92.9 | 106 | -178.5 | -174.7 | -13 | 0 | 0 | 0 | 111.1 | A1391 E1392 N1393 | N1389-A1391 VanDerWaalsContact C-N 3.27Å; N1389-A1391 PolarHBondContact O-N 3.21Å; N1389-A1391 WeakPolarHBondContact OD1-CB 3.4Å; N1389-A1391 PolarHBondContact OD1-N 3.06Å; N1389-A1391 VanDerWaalsContact OD1-N 3.08Å; N1389-E1392 HydrophobicContact CB-CB 3.86Å; N1389-E1392 PolarHBondContact O-N 3.26Å; N1389-E1392 PolarHBondContact OD1-N 3.23Å; N1389-N1393 PolarHBondContact O-N 3.03Å; N1389-N1393 PolarHBondContact O-OD1 3.11Å | ||
| 1390 | L | 84.6 | Confident | 83.8 | Confident | 52.6 Ų | 52.6 | 73.8 Ų | 73.8 | 28% | 0.275 | 41% | 0.413 | S | S | . | . | H | α-helix | trans | -57.2 | -38.3 | 179.6 | -175.7 | 67.5 | 0 | 0 | 0 | 112.6 | V1379 Q1381 L1384 A1388 T1394 | V1379-L1390 HydrophobicContact CB-CD1 4.21Å; V1379-L1390 HydrophobicContact CG1-CD1 4.41Å; V1379-L1390 WeakPolarHBondContact O-CD1 3.38Å; Q1381-L1390 HydrophobicContact CG-CD1 4.44Å; Q1381-L1390 HydrophobicContact CG-CD2 4.05Å; L1384-L1390 HydrophobicContact CD1-CB 3.97Å; L1384-L1390 HydrophobicContact CD1-CD1 3.89Å; L1384-L1390 HydrophobicContact CD1-CG 4.47Å; L1384-L1390 HydrophobicContact CD2-CB 4.11Å; L1384-L1390 HydrophobicContact CD2-CD1 4.27Å; A1388-L1390 PolarHBondContact O-N 3.32Å; L1390-T1394 VanDerWaalsContact O-CB 3.3Å; L1390-T1394 WeakPolarHBondContact O-CB 3.42Å; L1390-T1394 PolarHBondContact O-N 3.16Å; L1390-T1394 PolarHBondContact O-OG1 2.98Å |
| 1391 | A | 85.4 | Confident | 84.3 | Confident | 69.8 Ų | 69.8 | 71.9 Ų | 71.9 | 58% | 0.577 | 40% | 0.403 | S | S | * | . | H | α-helix | trans | -68.9 | -40.3 | -179 | 0 | 0 | 0 | 0 | 0 | 111.5 | N1389 T1394 A1395 | N1389-A1391 VanDerWaalsContact C-N 3.27Å; N1389-A1391 PolarHBondContact O-N 3.21Å; N1389-A1391 WeakPolarHBondContact OD1-CB 3.4Å; N1389-A1391 PolarHBondContact OD1-N 3.06Å; N1389-A1391 VanDerWaalsContact OD1-N 3.08Å; A1391-T1394 PolarHBondContact O-N 3.05Å; A1391-A1395 PolarHBondContact O-N 3.04Å |
| 1392 | E | 88.5 | Confident | 85 | Confident | 110.4 Ų | 110.4 | 67.4 Ų | 67.4 | 52% | 0.516 | 38% | 0.382 | S | S | . | . | H | α-helix | trans | -66.5 | -45.7 | 175.6 | -172.4 | -177.9 | 169.1 | 0 | 0 | 111.6 | N1389 T1394 A1395 N1396 | N1389-E1392 HydrophobicContact CB-CB 3.86Å; N1389-E1392 PolarHBondContact O-N 3.26Å; N1389-E1392 PolarHBondContact OD1-N 3.23Å; E1392-T1394 VanDerWaalsContact C-N 3.27Å; E1392-T1394 PolarHBondContact O-N 3.21Å; E1392-A1395 PolarHBondContact O-N 3.18Å; E1392-N1396 WeakPolarHBondContact O-CB 3.41Å; E1392-N1396 PolarHBondContact O-N 3.24Å; E1392-N1396 PolarHBondContact O-ND2 3.11Å |
| 1393 | N | 89.2 | Confident | 85.6 | Confident | 6.4 Ų | 6.4 | 67.3 Ų | 67.3 | 3% | 0.034 | 37% | 0.374 | C | S | . | . | H | α-helix | trans | -61 | -38.8 | 176.1 | -69.4 | -0.7 | 0 | 0 | 0 | 111.7 | C1376 E1378 V1379 N1389 N1396 L1397 | C1376-N1393 WeakPolarHBondContact CB-OD1 3.44Å; C1376-N1393 PolarHBondContact O-OD1 3.3Å; E1378-N1393 VanDerWaalsContact O-CB 3.29Å; E1378-N1393 WeakPolarHBondContact O-CB 3.37Å; E1378-N1393 PolarHBondContact O-ND2 3.1Å; V1379-N1393 HydrophobicContact CG1-CB 4.46Å; N1389-N1393 PolarHBondContact O-N 3.03Å; N1389-N1393 PolarHBondContact O-OD1 3.11Å; N1393-N1396 PolarHBondContact O-N 3.08Å; N1393-L1397 WeakPolarHBondContact O-CB 3.37Å; N1393-L1397 PolarHBondContact O-N 3.24Å |
| 1394 | T | 89.1 | Confident | 86.2 | Confident | 22.8 Ų | 22.8 | 60.5 Ų | 60.5 | 14% | 0.14 | 35% | 0.348 | C | S | . | . | H | α-helix | trans | -62.8 | -47.1 | 175.5 | -57.7 | 0 | 0 | 0 | 0 | 110.7 | L1390 A1391 E1392 L1397 I1398 P1500 F1501 | L1390-T1394 VanDerWaalsContact O-CB 3.3Å; L1390-T1394 WeakPolarHBondContact O-CB 3.42Å; L1390-T1394 PolarHBondContact O-N 3.16Å; L1390-T1394 PolarHBondContact O-OG1 2.98Å; A1391-T1394 PolarHBondContact O-N 3.05Å; E1392-T1394 VanDerWaalsContact C-N 3.27Å; E1392-T1394 PolarHBondContact O-N 3.21Å; T1394-L1397 PolarHBondContact O-N 2.96Å; T1394-I1398 HydrophobicContact CG2-CD1 4.25Å; T1394-I1398 WeakPolarHBondContact O-CG1 3.27Å; T1394-I1398 PolarHBondContact O-N 3.18Å; T1394-P1500 HydrophobicContact CG2-CB 4.49Å; T1394-F1501 HydrophobicContact CG2-CE1 3.93Å; T1394-F1501 HydrophobicContact CG2-CE2 4.36Å; T1394-F1501 HydrophobicContact CG2-CZ 3.7Å |
| 1395 | A | 90.5 | Very high | 86.9 | Confident | 50.8 Ų | 50.8 | 58.4 Ų | 58.4 | 42% | 0.42 | 34% | 0.337 | S | S | . | . | H | α-helix | trans | -62.5 | -45.8 | 176.8 | 0 | 0 | 0 | 0 | 0 | 112 | A1391 E1392 L1397 I1398 D1399 | A1391-A1395 PolarHBondContact O-N 3.04Å; E1392-A1395 PolarHBondContact O-N 3.18Å; A1395-L1397 VanDerWaalsContact C-N 3.28Å; A1395-L1397 PolarHBondContact O-N 3.22Å; A1395-I1398 PolarHBondContact O-N 3.25Å; A1395-D1399 PolarHBondContact O-N 3.22Å |
| 1396 | N | 90.8 | Very high | 87.7 | Confident | 16.4 Ų | 16.4 | 53.6 Ų | 53.6 | 9% | 0.088 | 32% | 0.317 | C | S | . | . | H | α-helix | trans | -57.6 | -39.8 | 175.6 | -78.1 | -35.7 | 0 | 0 | 0 | 112.1 | K1375 Y1377 E1392 N1393 L1400 | K1375-N1396 WeakPolarHBondContact CE-OD1 3.38Å; K1375-N1396 PolarHBondContact NZ-OD1 3.17Å; Y1377-N1396 HydrophobicContact CD1-CB 4.1Å; Y1377-N1396 HydrophobicContact CE1-CB 4Å; E1392-N1396 WeakPolarHBondContact O-CB 3.41Å; E1392-N1396 PolarHBondContact O-N 3.24Å; E1392-N1396 PolarHBondContact O-ND2 3.11Å; N1393-N1396 PolarHBondContact O-N 3.08Å; N1396-L1400 WeakPolarHBondContact O-CB 3.4Å; N1396-L1400 PolarHBondContact O-N 3.11Å; N1396-L1400 VanDerWaalsContact O-N 3.12Å |
| 1397 | L | 91.7 | Very high | 88.9 | Confident | 0 Ų | 0 | 46.6 Ų | 46.6 | 0% | 0 | 29% | 0.286 | C | S | . | . | H | α-helix | trans | -72.1 | -39.1 | 178.5 | -169.8 | 67.2 | 0 | 0 | 0 | 112.1 | Y1377 V1379 N1393 T1394 A1395 L1400 V1401 L1478 V1479 I1482 F1501 | Y1377-L1397 HydrophobicContact CD1-CB 4.48Å; Y1377-L1397 HydrophobicContact CD1-CD1 4.22Å; Y1377-L1397 HydrophobicContact CG-CD1 4.43Å; V1379-L1397 HydrophobicContact CG1-CD2 4.12Å; V1379-L1397 HydrophobicContact CG2-CD2 4.34Å; N1393-L1397 WeakPolarHBondContact O-CB 3.37Å; N1393-L1397 PolarHBondContact O-N 3.24Å; T1394-L1397 PolarHBondContact O-N 2.96Å; A1395-L1397 VanDerWaalsContact C-N 3.28Å; A1395-L1397 PolarHBondContact O-N 3.22Å; L1397-L1400 PolarHBondContact O-N 3.27Å; L1397-V1401 HydrophobicContact CD1-CG2 4.37Å; L1397-V1401 VanDerWaalsContact O-CG2 3.31Å; L1397-V1401 WeakPolarHBondContact O-CG2 3.29Å; L1397-V1401 PolarHBondContact O-N 3.34Å; L1397-L1478 HydrophobicContact CD1-CB 3.99Å; L1397-L1478 HydrophobicContact CD1-CD1 4.43Å; L1397-L1478 HydrophobicContact CD2-CB 3.98Å; L1397-L1478 HydrophobicContact CD2-CD1 4.3Å; L1397-V1479 HydrophobicContact CD1-CG2 4.05Å; L1397-I1482 HydrophobicContact CD1-CD1 4.4Å; L1397-I1482 HydrophobicContact CD2-CD1 3.65Å; L1397-I1482 HydrophobicContact CG-CD1 4.07Å; L1397-F1501 HydrophobicContact CB-CE1 4.27Å; L1397-F1501 HydrophobicContact CB-CZ 4.37Å; L1397-F1501 HydrophobicContact CD2-CE1 3.92Å; L1397-F1501 HydrophobicContact CD2-CE2 4.38Å; L1397-F1501 HydrophobicContact CD2-CZ 3.62Å; L1397-F1501 HydrophobicContact CG-CE1 4.31Å; L1397-F1501 HydrophobicContact CG-CZ 4.41Å |
| 1398 | I | 92.2 | Very high | 90 | Very high | 45.4 Ų | 45.4 | 42.6 Ų | 42.6 | 23% | 0.233 | 24% | 0.244 | C | C | . | . | H | α-helix | trans | -59.3 | -50.3 | 173.6 | -70.3 | 173.3 | 0 | 0 | 0 | 110.2 | T1394 A1395 L1400 V1401 E1402 F1501 F1504 | T1394-I1398 HydrophobicContact CG2-CD1 4.25Å; T1394-I1398 WeakPolarHBondContact O-CG1 3.27Å; T1394-I1398 PolarHBondContact O-N 3.18Å; A1395-I1398 PolarHBondContact O-N 3.25Å; I1398-L1400 PolarHBondContact O-N 3.14Å; I1398-V1401 PolarHBondContact O-N 3.17Å; I1398-V1401 VanDerWaalsContact O-N 3.17Å; I1398-E1402 WeakPolarHBondContact O-CB 3.37Å; I1398-E1402 PolarHBondContact O-N 3.13Å; I1398-F1501 HydrophobicContact CD1-CD1 4.38Å; I1398-F1501 HydrophobicContact CD1-CE1 4.36Å; I1398-F1501 HydrophobicContact CG1-CD1 3.81Å; I1398-F1501 HydrophobicContact CG1-CE1 3.68Å; I1398-F1504 HydrophobicContact CG2-CD2 4Å; I1398-F1504 HydrophobicContact CG2-CE2 3.8Å; I1398-F1504 HydrophobicContact CG2-CZ 4.3Å |
| 1399 | D | 91.6 | Very high | 90.8 | Very high | 94 Ų | 94 | 42.3 Ų | 42.3 | 50% | 0.503 | 24% | 0.237 | S | C | . | . | H | α-helix | trans | -56.3 | -41.8 | 177.7 | -85.7 | -5.5 | 0 | 0 | 0 | 111.5 | A1395 E1402 N1403 | A1395-D1399 PolarHBondContact O-N 3.22Å; D1399-E1402 PolarHBondContact O-N 2.96Å; D1399-N1403 VanDerWaalsContact O-CB 3.3Å; D1399-N1403 WeakPolarHBondContact O-CB 3.41Å; D1399-N1403 PolarHBondContact O-N 3.23Å; D1399-N1403 PolarHBondContact O-ND2 2.95Å |
| 1400 | L | 91.7 | Very high | 91.3 | Very high | 14.6 Ų | 14.6 | 46.4 Ų | 46.4 | 8% | 0.076 | 25% | 0.251 | C | S | . | . | H | α-helix | trans | -67.1 | -43.8 | -179.6 | -155.3 | 88.4 | 0 | 0 | 0 | 112 | F1365 T1369 Y1377 N1396 L1397 I1398 E1402 N1403 I1404 L1476 V1479 | F1365-L1400 HydrophobicContact CE1-CD2 4.44Å; F1365-L1400 HydrophobicContact CE2-CD1 4.21Å; F1365-L1400 HydrophobicContact CE2-CG 4.35Å; F1365-L1400 HydrophobicContact CZ-CD1 3.91Å; F1365-L1400 VanDerWaalsContact CZ-CD1 3.49Å; F1365-L1400 HydrophobicContact CZ-CD2 3.76Å; F1365-L1400 HydrophobicContact CZ-CG 3.99Å; T1369-L1400 HydrophobicContact CG2-CD1 3.83Å; T1369-L1400 HydrophobicContact CG2-CD2 4.29Å; Y1377-L1400 HydrophobicContact CD1-CD2 4.15Å; Y1377-L1400 HydrophobicContact CE1-CB 4.29Å; Y1377-L1400 HydrophobicContact CE1-CD1 3.94Å; Y1377-L1400 HydrophobicContact CE1-CD2 3.8Å; Y1377-L1400 HydrophobicContact CE1-CG 4.41Å; Y1377-L1400 HydrophobicContact CE2-CD2 4.49Å; Y1377-L1400 WeakPolarHBondContact OH-CD1 3.37Å; N1396-L1400 WeakPolarHBondContact O-CB 3.4Å; N1396-L1400 PolarHBondContact O-N 3.11Å; N1396-L1400 VanDerWaalsContact O-N 3.12Å; L1397-L1400 PolarHBondContact O-N 3.27Å; I1398-L1400 PolarHBondContact O-N 3.14Å; L1400-E1402 VanDerWaalsContact C-N 3.35Å; L1400-N1403 PolarHBondContact O-N 3.01Å; L1400-I1404 WeakPolarHBondContact O-CG2 3.27Å; L1400-I1404 PolarHBondContact O-N 3.28Å; L1400-L1476 HydrophobicContact CD2-CD2 4.47Å; L1400-V1479 HydrophobicContact CB-CG2 4.33Å; L1400-V1479 HydrophobicContact CD2-CB 4.38Å; L1400-V1479 HydrophobicContact CD2-CG2 3.48Å; L1400-V1479 HydrophobicContact CG-CG2 4.26Å |
| 1401 | V | 93.4 | Very high | 91.6 | Very high | 0.2 Ų | 0.2 | 44.1 Ų | 44.1 | 0% | 0.001 | 24% | 0.239 | C | C | . | . | H | α-helix | trans | -66 | -41.3 | 176.6 | 176.3 | 0 | 0 | 0 | 0 | 111 | L1397 I1398 I1404 L1405 V1479 I1482 L1483 I1486 F1504 | L1397-V1401 HydrophobicContact CD1-CG2 4.37Å; L1397-V1401 VanDerWaalsContact O-CG2 3.31Å; L1397-V1401 WeakPolarHBondContact O-CG2 3.29Å; L1397-V1401 PolarHBondContact O-N 3.34Å; I1398-V1401 PolarHBondContact O-N 3.17Å; I1398-V1401 VanDerWaalsContact O-N 3.17Å; V1401-I1404 VanDerWaalsContact O-CG2 3.28Å; V1401-I1404 WeakPolarHBondContact O-CG2 3.35Å; V1401-L1405 WeakPolarHBondContact O-CB 3.44Å; V1401-L1405 PolarHBondContact O-N 3.13Å; V1401-V1479 HydrophobicContact CG2-CB 4.22Å; V1401-V1479 HydrophobicContact CG2-CG1 4.22Å; V1401-V1479 HydrophobicContact CG2-CG2 3.88Å; V1401-I1482 HydrophobicContact CG1-CB 4.49Å; V1401-I1482 HydrophobicContact CG1-CG2 3.92Å; V1401-I1482 HydrophobicContact CG2-CB 4.16Å; V1401-I1482 HydrophobicContact CG2-CD1 3.92Å; V1401-I1482 HydrophobicContact CG2-CG2 4.16Å; V1401-L1483 HydrophobicContact CG1-CD2 4.11Å; V1401-L1483 HydrophobicContact CG1-CG 4.49Å; V1401-I1486 HydrophobicContact CG1-CD1 4.44Å; V1401-F1504 HydrophobicContact CB-CE1 4.21Å; V1401-F1504 HydrophobicContact CB-CZ 4.38Å; V1401-F1504 HydrophobicContact CG1-CE1 3.69Å; V1401-F1504 HydrophobicContact CG1-CZ 4.06Å |
| 1402 | E | 94 | Very high | 91.8 | Very high | 62 Ų | 62 | 41.7 Ų | 41.7 | 29% | 0.29 | 22% | 0.217 | S | C | . | . | H | α-helix | trans | -67.3 | -40 | -179.7 | -171.3 | 143.5 | -138.6 | 0 | 0 | 111.8 | I1398 D1399 L1400 L1405 N1406 F1504 K1508 | I1398-E1402 WeakPolarHBondContact O-CB 3.37Å; I1398-E1402 PolarHBondContact O-N 3.13Å; D1399-E1402 PolarHBondContact O-N 2.96Å; L1400-E1402 VanDerWaalsContact C-N 3.35Å; E1402-L1405 PolarHBondContact O-N 3.19Å; E1402-N1406 WeakPolarHBondContact CG-ND2 3.36Å; E1402-N1406 VanDerWaalsContact O-CB 3.28Å; E1402-N1406 WeakPolarHBondContact O-CB 3.42Å; E1402-N1406 VanDerWaalsContact O-CG 3.27Å; E1402-N1406 PolarHBondContact O-N 3.16Å; E1402-N1406 PolarHBondContact O-ND2 3.15Å; E1402-N1406 VanDerWaalsContact O-ND2 3.12Å; E1402-F1504 HydrophobicContact CB-CE2 4.4Å; E1402-F1504 HydrophobicContact CB-CZ 4.32Å; E1402-F1504 WeakPolarHBondContact OE2-CE2 3.39Å; E1402-K1508 IonicContact OE1-NZ 3.68Å; E1402-K1508 PolarHBondContact OE1-NZ 3.1Å; E1402-K1508 IonicContact OE2-NZ 3.81Å |
| 1403 | N | 92.4 | Very high | 91.7 | Very high | 96.4 Ų | 96.4 | 43.5 Ų | 43.5 | 52% | 0.516 | 23% | 0.23 | S | C | . | . | H | α-helix | trans | -60.9 | -51.4 | 175.2 | -106.4 | -21.1 | 0 | 0 | 0 | 112.2 | F1365 D1399 L1400 L1405 N1406 L1407 | F1365-N1403 HydrophobicContact CE2-CB 4.18Å; D1399-N1403 VanDerWaalsContact O-CB 3.3Å; D1399-N1403 WeakPolarHBondContact O-CB 3.41Å; D1399-N1403 PolarHBondContact O-N 3.23Å; D1399-N1403 PolarHBondContact O-ND2 2.95Å; L1400-N1403 PolarHBondContact O-N 3.01Å; N1403-L1405 VanDerWaalsContact C-N 3.34Å; N1403-L1405 PolarHBondContact O-N 3.33Å; N1403-N1406 PolarHBondContact O-N 3.31Å; N1403-L1407 WeakPolarHBondContact O-CB 3.19Å; N1403-L1407 WeakPolarHBondContact O-CG 3.3Å; N1403-L1407 PolarHBondContact O-N 3.33Å; N1403-L1407 VanDerWaalsContact O-N 3.08Å |
| 1404 | I | 93.4 | Very high | 91.7 | Very high | 0.2 Ų | 0.2 | 49.5 Ų | 49.5 | 0% | 0.001 | 26% | 0.258 | C | S | . | . | H | α-helix | trans | -67.4 | -38.5 | -179.1 | -167.6 | 102.8 | 0 | 0 | 0 | 112 | L1362 F1365 L1400 V1401 N1406 L1407 I1408 I1455 V1479 L1483 | L1362-I1404 HydrophobicContact CD2-CD1 3.58Å; L1362-I1404 VanDerWaalsContact CD2-CD1 3.46Å; L1362-I1404 HydrophobicContact CD2-CG1 4.31Å; F1365-I1404 HydrophobicContact CB-CD1 4.29Å; F1365-I1404 HydrophobicContact CD1-CD1 3.56Å; F1365-I1404 VanDerWaalsContact CD1-CD1 3.43Å; F1365-I1404 HydrophobicContact CD1-CG1 4.39Å; F1365-I1404 HydrophobicContact CD2-CB 4.32Å; F1365-I1404 HydrophobicContact CD2-CD1 3.97Å; F1365-I1404 HydrophobicContact CE1-CB 4.19Å; F1365-I1404 HydrophobicContact CE1-CD1 3.65Å; F1365-I1404 HydrophobicContact CE1-CG1 4.21Å; F1365-I1404 HydrophobicContact CE2-CB 3.79Å; F1365-I1404 HydrophobicContact CE2-CD1 4.15Å; F1365-I1404 HydrophobicContact CE2-CG1 4.45Å; F1365-I1404 HydrophobicContact CG-CD1 3.62Å; F1365-I1404 HydrophobicContact CZ-CB 3.72Å; F1365-I1404 HydrophobicContact CZ-CD1 4.01Å; F1365-I1404 HydrophobicContact CZ-CG1 4.24Å; F1365-I1404 HydrophobicContact CZ-CG2 4.41Å; L1400-I1404 WeakPolarHBondContact O-CG2 3.27Å; L1400-I1404 PolarHBondContact O-N 3.28Å; V1401-I1404 VanDerWaalsContact O-CG2 3.28Å; V1401-I1404 WeakPolarHBondContact O-CG2 3.35Å; I1404-N1406 VanDerWaalsContact C-N 3.33Å; I1404-N1406 PolarHBondContact O-N 3.34Å; I1404-L1407 WeakPolarHBondContact O-CB 3.29Å; I1404-L1407 PolarHBondContact O-N 3.29Å; I1404-I1408 HydrophobicContact CG1-CD1 4.24Å; I1404-I1408 WeakPolarHBondContact O-CG1 3.41Å; I1404-I1408 PolarHBondContact O-N 3.24Å; I1404-I1455 HydrophobicContact CD1-CB 4.49Å; I1404-I1455 HydrophobicContact CD1-CD1 3.75Å; I1404-I1455 VanDerWaalsContact CD1-CD1 3.42Å; I1404-I1455 HydrophobicContact CD1-CG1 3.55Å; I1404-I1455 HydrophobicContact CD1-CG2 4.22Å; I1404-I1455 HydrophobicContact CG1-CD1 4.19Å; I1404-V1479 HydrophobicContact CG2-CG1 3.76Å; I1404-L1483 HydrophobicContact CG2-CD1 4.03Å; I1404-L1483 HydrophobicContact CG2-CD2 4.5Å |
| 1405 | L | 93.5 | Very high | 91.8 | Very high | 2.2 Ų | 2.2 | 48.6 Ų | 48.6 | 1% | 0.012 | 25% | 0.253 | C | S | . | . | H | α-helix | trans | -64.5 | -45.2 | 178.6 | -174.8 | 65 | 0 | 0 | 0 | 110.4 | V1401 E1402 N1403 L1407 I1408 L1409 F1447 L1483 I1486 K1508 V1512 | V1401-L1405 WeakPolarHBondContact O-CB 3.44Å; V1401-L1405 PolarHBondContact O-N 3.13Å; E1402-L1405 PolarHBondContact O-N 3.19Å; N1403-L1405 VanDerWaalsContact C-N 3.34Å; N1403-L1405 PolarHBondContact O-N 3.33Å; L1405-L1407 VanDerWaalsContact C-N 3.32Å; L1405-L1407 PolarHBondContact O-N 3.01Å; L1405-I1408 PolarHBondContact O-N 3.24Å; L1405-L1409 HydrophobicContact CD1-CD1 4.35Å; L1405-L1409 HydrophobicContact CD1-CD2 4.49Å; L1405-L1409 HydrophobicContact CD1-CG 4.33Å; L1405-L1409 HydrophobicContact CD2-CD1 4.49Å; L1405-L1409 HydrophobicContact CG-CD1 3.94Å; L1405-L1409 HydrophobicContact CG-CG 4.35Å; L1405-L1409 WeakPolarHBondContact O-CB 3.25Å; L1405-L1409 WeakPolarHBondContact O-CG 3.45Å; L1405-L1409 PolarHBondContact O-N 3Å; L1405-F1447 HydrophobicContact CD1-CZ 4.4Å; L1405-L1483 HydrophobicContact CB-CD2 4.22Å; L1405-L1483 HydrophobicContact CD1-CD2 3.9Å; L1405-L1483 HydrophobicContact CG-CD2 4.5Å; L1405-I1486 HydrophobicContact CD2-CD1 4.39Å; L1405-K1508 HydrophobicContact CD2-CB 3.97Å; L1405-K1508 HydrophobicContact CD2-CD 4.08Å; L1405-K1508 HydrophobicContact CD2-CG 3.81Å; L1405-V1512 HydrophobicContact CD1-CG2 3.84Å |
| 1406 | N | 93.5 | Very high | 91.7 | Very high | 64.8 Ų | 64.8 | 47.1 Ų | 47.1 | 35% | 0.347 | 24% | 0.238 | S | C | . | . | H | α-helix | trans | -62.3 | -36.7 | 176.3 | -78 | -36.5 | 0 | 0 | 0 | 112.7 | E1402 N1403 I1404 L1409 K1410 | E1402-N1406 WeakPolarHBondContact CG-ND2 3.36Å; E1402-N1406 VanDerWaalsContact O-CB 3.28Å; E1402-N1406 WeakPolarHBondContact O-CB 3.42Å; E1402-N1406 VanDerWaalsContact O-CG 3.27Å; E1402-N1406 PolarHBondContact O-N 3.16Å; E1402-N1406 PolarHBondContact O-ND2 3.15Å; E1402-N1406 VanDerWaalsContact O-ND2 3.12Å; N1403-N1406 PolarHBondContact O-N 3.31Å; I1404-N1406 VanDerWaalsContact C-N 3.33Å; I1404-N1406 PolarHBondContact O-N 3.34Å; N1406-L1409 PolarHBondContact O-N 3.29Å; N1406-K1410 WeakPolarHBondContact O-CB 3.39Å; N1406-K1410 VanDerWaalsContact O-CG 3.27Å; N1406-K1410 WeakPolarHBondContact O-CG 3.3Å; N1406-K1410 PolarHBondContact O-N 3.21Å |
| 1407 | L | 93.1 | Very high | 91.4 | Very high | 62.2 Ų | 62.2 | 48.3 Ų | 48.3 | 33% | 0.326 | 25% | 0.246 | S | C | . | . | H | α-helix | trans | -60.3 | -49.3 | 173 | -109.4 | 141.7 | 0 | 0 | 0 | 111.2 | L1361 F1365 N1403 I1404 L1405 L1409 K1410 S1411 | L1361-L1407 HydrophobicContact CD1-CB 4.29Å; L1361-L1407 HydrophobicContact CD1-CD2 3.94Å; L1361-L1407 HydrophobicContact CG-CD2 4.43Å; F1365-L1407 HydrophobicContact CB-CD1 3.99Å; F1365-L1407 HydrophobicContact CD2-CD1 4.11Å; F1365-L1407 HydrophobicContact CG-CD1 4.35Å; N1403-L1407 WeakPolarHBondContact O-CB 3.19Å; N1403-L1407 WeakPolarHBondContact O-CG 3.3Å; N1403-L1407 PolarHBondContact O-N 3.33Å; N1403-L1407 VanDerWaalsContact O-N 3.08Å; I1404-L1407 WeakPolarHBondContact O-CB 3.29Å; I1404-L1407 PolarHBondContact O-N 3.29Å; L1405-L1407 VanDerWaalsContact C-N 3.32Å; L1405-L1407 PolarHBondContact O-N 3.01Å; L1407-L1409 VanDerWaalsContact C-N 3.35Å; L1407-L1409 PolarHBondContact O-N 3.27Å; L1407-K1410 PolarHBondContact O-N 3.11Å; L1407-S1411 WeakPolarHBondContact O-CB 3.47Å; L1407-S1411 PolarHBondContact O-N 3.2Å; L1407-S1411 VanDerWaalsContact O-N 3.16Å; L1407-S1411 PolarHBondContact O-OG 3.27Å |
| 1408 | I | 94 | Very high | 91.1 | Very high | 0 Ų | 0 | 49.8 Ų | 49.8 | 0% | 0 | 25% | 0.253 | C | S | . | . | H | α-helix | trans | -60.7 | -46.2 | 177.9 | -67 | 165.9 | 0 | 0 | 0 | 111 | L1361 I1404 L1405 K1410 S1411 F1447 F1451 F1515 | L1361-I1408 HydrophobicContact CD2-CG1 4.02Å; I1404-I1408 HydrophobicContact CG1-CD1 4.24Å; I1404-I1408 WeakPolarHBondContact O-CG1 3.41Å; I1404-I1408 PolarHBondContact O-N 3.24Å; L1405-I1408 PolarHBondContact O-N 3.24Å; I1408-K1410 PolarHBondContact O-N 3.02Å; I1408-S1411 WeakPolarHBondContact CA-OG 3.4Å; I1408-S1411 PolarHBondContact O-N 3.09Å; I1408-S1411 VanDerWaalsContact O-N 3.1Å; I1408-S1411 PolarHBondContact O-OG 3.23Å; I1408-F1447 HydrophobicContact CD1-CE1 4.18Å; I1408-F1447 HydrophobicContact CG2-CZ 4.42Å; I1408-F1451 HydrophobicContact CD1-CB 4.45Å; I1408-F1451 HydrophobicContact CD1-CD1 4.1Å; I1408-F1451 HydrophobicContact CD1-CD2 4.44Å; I1408-F1451 HydrophobicContact CD1-CE1 4.42Å; I1408-F1451 HydrophobicContact CD1-CG 4.17Å; I1408-F1451 HydrophobicContact CG1-CD1 4.22Å; I1408-F1451 HydrophobicContact CG1-CE1 4.08Å; I1408-F1451 HydrophobicContact CG1-CZ 4.44Å; I1408-F1451 HydrophobicContact CG2-CD2 4.44Å; I1408-F1451 HydrophobicContact CG2-CE1 4.23Å; I1408-F1451 HydrophobicContact CG2-CE2 3.91Å; I1408-F1451 HydrophobicContact CG2-CZ 3.74Å; I1408-F1515 HydrophobicContact CG2-CE1 4.14Å; I1408-F1515 HydrophobicContact CG2-CE2 4.09Å; I1408-F1515 HydrophobicContact CG2-CZ 3.79Å; I1408-F1515 WeakPolarHBondContact O-CE2 3.31Å |
| 1409 | L | 92.7 | Very high | 91.1 | Very high | 32.4 Ų | 32.4 | 47.7 Ų | 47.7 | 17% | 0.17 | 24% | 0.242 | C | C | . | . | H | α-helix | trans | -65.4 | -39 | -178 | -66.6 | 171.6 | 0 | 0 | 0 | 112.3 | L1405 N1406 L1407 S1411 T1412 V1511 F1515 | L1405-L1409 HydrophobicContact CD1-CD1 4.35Å; L1405-L1409 HydrophobicContact CD1-CD2 4.49Å; L1405-L1409 HydrophobicContact CD1-CG 4.33Å; L1405-L1409 HydrophobicContact CD2-CD1 4.49Å; L1405-L1409 HydrophobicContact CG-CD1 3.94Å; L1405-L1409 HydrophobicContact CG-CG 4.35Å; L1405-L1409 WeakPolarHBondContact O-CB 3.25Å; L1405-L1409 WeakPolarHBondContact O-CG 3.45Å; L1405-L1409 PolarHBondContact O-N 3Å; N1406-L1409 PolarHBondContact O-N 3.29Å; L1407-L1409 VanDerWaalsContact C-N 3.35Å; L1407-L1409 PolarHBondContact O-N 3.27Å; L1409-S1411 VanDerWaalsContact C-N 3.28Å; L1409-S1411 PolarHBondContact O-N 3.29Å; L1409-T1412 PolarHBondContact O-OG1 2.96Å; L1409-V1511 HydrophobicContact CD1-CB 4.37Å; L1409-V1511 HydrophobicContact CD1-CG1 3.56Å; L1409-V1511 HydrophobicContact CD2-CG1 4.13Å; L1409-V1511 HydrophobicContact CG-CG1 4.4Å; L1409-F1515 HydrophobicContact CD2-CB 3.56Å; L1409-F1515 HydrophobicContact CD2-CD2 4.31Å; L1409-F1515 HydrophobicContact CD2-CG 4.04Å |
| 1410 | K | 91.7 | Very high | 91.1 | Very high | 171.4 Ų | 171.4 | 44.4 Ų | 44.4 | 75% | 0.745 | 22% | 0.223 | S | C | * | . | H | α-helix | trans | -72.1 | -19.5 | 177.6 | -74.1 | 177 | -179.4 | 178.1 | 0 | 113.5 | N1406 L1407 I1408 T1412 | N1406-K1410 WeakPolarHBondContact O-CB 3.39Å; N1406-K1410 VanDerWaalsContact O-CG 3.27Å; N1406-K1410 WeakPolarHBondContact O-CG 3.3Å; N1406-K1410 PolarHBondContact O-N 3.21Å; L1407-K1410 PolarHBondContact O-N 3.11Å; I1408-K1410 PolarHBondContact O-N 3.02Å; K1410-T1412 VanDerWaalsContact C-N 3.32Å; K1410-T1412 PolarHBondContact O-N 3.11Å |
| 1411 | S | 92.3 | Very high | 90.9 | Very high | 4.4 Ų | 4.4 | 44.1 Ų | 44.1 | 3% | 0.031 | 22% | 0.223 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -90.5 | 10.7 | -177 | 65.8 | 0 | 0 | 0 | 0 | 114.6 | Y1357 L1361 L1407 I1408 L1409 D1413 Q1414 F1415 | Y1357-S1411 PolarHBondContact OH-OG 3Å; L1361-S1411 VanDerWaalsContact CD1-CB 3.48Å; L1361-S1411 WeakPolarHBondContact CD1-OG 3.43Å; L1407-S1411 WeakPolarHBondContact O-CB 3.47Å; L1407-S1411 PolarHBondContact O-N 3.2Å; L1407-S1411 VanDerWaalsContact O-N 3.16Å; L1407-S1411 PolarHBondContact O-OG 3.27Å; I1408-S1411 WeakPolarHBondContact CA-OG 3.4Å; I1408-S1411 PolarHBondContact O-N 3.09Å; I1408-S1411 VanDerWaalsContact O-N 3.1Å; I1408-S1411 PolarHBondContact O-OG 3.23Å; L1409-S1411 VanDerWaalsContact C-N 3.28Å; L1409-S1411 PolarHBondContact O-N 3.29Å; S1411-D1413 VanDerWaalsContact C-N 3.26Å; S1411-D1413 PolarHBondContact O-N 3.18Å; S1411-D1413 VanDerWaalsContact O-N 3.13Å; S1411-Q1414 PolarHBondContact O-N 2.95Å; S1411-Q1414 VanDerWaalsContact O-N 3.08Å; S1411-F1415 PolarHBondContact O-N 3.03Å |
| 1412 | T | 89.5 | Confident | 90.8 | Very high | 19.2 Ų | 19.2 | 44.2 Ų | 44.2 | 12% | 0.118 | 22% | 0.223 | C | C | . | . | G | 310 helix | trans | -53.1 | -38 | -178.4 | -55.2 | 0 | 0 | 0 | 0 | 113.5 | L1409 K1410 Q1414 F1415 K1420 F1515 S1518 I1519 | L1409-T1412 PolarHBondContact O-OG1 2.96Å; K1410-T1412 VanDerWaalsContact C-N 3.32Å; K1410-T1412 PolarHBondContact O-N 3.11Å; T1412-Q1414 VanDerWaalsContact C-N 3.33Å; T1412-Q1414 PolarHBondContact O-N 3.47Å; T1412-F1415 WeakPolarHBondContact O-CB 3.42Å; T1412-F1415 PolarHBondContact O-N 3.23Å; T1412-K1420 PolarHBondContact O-NZ 3.16Å; T1412-K1420 VanDerWaalsContact O-NZ 3.15Å; T1412-F1515 HydrophobicContact CG2-CD2 4.41Å; T1412-F1515 VanDerWaalsContact OG1-CD2 3.26Å; T1412-F1515 WeakPolarHBondContact OG1-CD2 3.33Å; T1412-S1518 VanDerWaalsContact CG2-CB 3.42Å; T1412-S1518 WeakPolarHBondContact CG2-OG 3.44Å; T1412-I1519 HydrophobicContact CG2-CG2 4.22Å |
| 1413 | D | 86.5 | Confident | 90.8 | Very high | 147.8 Ų | 147.8 | 41.3 Ų | 41.3 | 79% | 0.79 | 21% | 0.209 | S | C | * | . | G | 310 helix | trans | -73.5 | -28.1 | -178.9 | -57.4 | -28.1 | 0 | 0 | 0 | 112.5 | S1411 F1415 | S1411-D1413 VanDerWaalsContact C-N 3.26Å; S1411-D1413 PolarHBondContact O-N 3.18Å; S1411-D1413 VanDerWaalsContact O-N 3.13Å; D1413-F1415 VanDerWaalsContact C-N 3.3Å; D1413-F1415 PolarHBondContact O-N 3.24Å |
| 1414 | Q | 88.7 | Confident | 90.8 | Very high | 131.8 Ų | 131.8 | 37.8 Ų | 37.8 | 62% | 0.616 | 19% | 0.191 | S | C | * | . | G | 310 helix | trans | -86.5 | -4.6 | 179.6 | -59.9 | 175.7 | 18.5 | 0 | 0 | 112.5 | Y1357 S1411 T1412 | Y1357-Q1414 HydrophobicContact CD2-CB 4.35Å; Y1357-Q1414 WeakPolarHBondContact CD2-O 3.41Å; Y1357-Q1414 HydrophobicContact CE2-CB 4.3Å; S1411-Q1414 PolarHBondContact O-N 2.95Å; S1411-Q1414 VanDerWaalsContact O-N 3.08Å; T1412-Q1414 VanDerWaalsContact C-N 3.33Å; T1412-Q1414 PolarHBondContact O-N 3.47Å |
| 1415 | F | 90.4 | Very high | 90.7 | Very high | 5.2 Ų | 5.2 | 37.8 Ų | 37.8 | 2% | 0.023 | 19% | 0.191 | C | C | . | . | S | Bend | trans | -66.4 | 130.3 | -176.5 | -162.4 | -86.2 | 0 | 0 | 0 | 111 | Y1357 S1411 T1412 D1413 V1417 L1419 K1420 L1423 F1450 F1451 F1515 I1519 | Y1357-F1415 AromaticContact CE1-CD2 3.82Å; Y1357-F1415 HydrophobicContact CE1-CD2 3.82Å; Y1357-F1415 AromaticContact CE1-CE2 3.98Å; Y1357-F1415 HydrophobicContact CE1-CE2 4.03Å; Y1357-F1415 HydrophobicContact CE2-CB 4.43Å; Y1357-F1415 HydrophobicContact CE2-CD2 4.26Å; Y1357-F1415 AromaticContact CZ-CD2 3.65Å; S1411-F1415 PolarHBondContact O-N 3.03Å; T1412-F1415 WeakPolarHBondContact O-CB 3.42Å; T1412-F1415 PolarHBondContact O-N 3.23Å; D1413-F1415 VanDerWaalsContact C-N 3.3Å; D1413-F1415 PolarHBondContact O-N 3.24Å; F1415-V1417 PolarHBondContact O-N 3.12Å; F1415-L1419 HydrophobicContact CD1-CB 4.26Å; F1415-L1419 HydrophobicContact CE1-CB 3.51Å; F1415-L1419 VanDerWaalsContact CE1-CB 3.46Å; F1415-L1419 HydrophobicContact CE1-CD1 4.25Å; F1415-L1419 HydrophobicContact CZ-CB 4.21Å; F1415-L1419 HydrophobicContact CZ-CD1 4.26Å; F1415-K1420 HydrophobicContact CD1-CG 3.79Å; F1415-K1420 HydrophobicContact CE1-CG 4.38Å; F1415-K1420 VanDerWaalsContact O-CE 3.3Å; F1415-K1420 WeakPolarHBondContact O-CE 3.34Å; F1415-L1423 HydrophobicContact CE1-CD1 3.94Å; F1415-L1423 HydrophobicContact CZ-CD1 4.07Å; F1415-F1450 HydrophobicContact CE2-CD1 4.23Å; F1415-F1450 AromaticContact CE2-CE1 3.76Å; F1415-F1450 HydrophobicContact CE2-CE1 3.76Å; F1415-F1450 HydrophobicContact CZ-CD1 4.33Å; F1415-F1450 AromaticContact CZ-CE1 3.95Å; F1415-F1450 HydrophobicContact CZ-CE1 4Å; F1415-F1451 HydrophobicContact CD2-CZ 4.48Å; F1415-F1451 HydrophobicContact CE2-CE2 4.46Å; F1415-F1451 AromaticContact CE2-CZ 3.99Å; F1415-F1451 HydrophobicContact CE2-CZ 4.09Å; F1415-F1515 HydrophobicContact CD2-CZ 4.39Å; F1415-I1519 HydrophobicContact CB-CG2 4.4Å; F1415-I1519 HydrophobicContact CD1-CB 4.41Å; F1415-I1519 HydrophobicContact CD1-CG2 4.29Å; F1415-I1519 HydrophobicContact CD2-CG2 4.39Å; F1415-I1519 HydrophobicContact CE1-CB 4.39Å; F1415-I1519 HydrophobicContact CE2-CD1 4.44Å; F1415-I1519 HydrophobicContact CG-CG2 4.12Å; F1415-I1519 HydrophobicContact CZ-CD1 4.36Å |
| 1416 | P | 89 | Confident | 90.7 | Very high | 18.2 Ų | 18.2 | 37.7 Ų | 37.7 | 12% | 0.118 | 19% | 0.19 | C | C | . | . | trans | -59.3 | 131.7 | -171.7 | -25.2 | 33.1 | 0 | 0 | 0 | 114 | Y1353 Y1357 Q1418 L1419 K1420 | Y1353-P1416 WeakPolarHBondContact O-CG 3.29Å; Y1357-P1416 HydrophobicContact CG-CG 4.3Å; P1416-Q1418 VanDerWaalsContact C-N 3.28Å; P1416-Q1418 PolarHBondContact O-N 3.03Å; P1416-L1419 HydrophobicContact CB-CB 4.37Å; P1416-L1419 HydrophobicContact CB-CD1 4.23Å; P1416-L1419 HydrophobicContact CB-CG 4.15Å; P1416-L1419 HydrophobicContact CG-CD1 4.02Å; P1416-L1419 HydrophobicContact CG-CG 4.47Å; P1416-L1419 WeakPolarHBondContact O-CB 3.44Å; P1416-L1419 PolarHBondContact O-N 3.01Å; P1416-L1419 VanDerWaalsContact O-N 3.08Å; P1416-K1420 PolarHBondContact O-N 3.16Å | ||
| 1417 | V | 85.2 | Confident | 90.6 | Very high | 41.4 Ų | 41.4 | 35.8 Ų | 35.8 | 25% | 0.251 | 18% | 0.179 | S | C | . | . | H | α-helix | trans | -60.9 | -35 | -177.4 | -165.5 | 0 | 0 | 0 | 0 | 112.6 | F1415 L1419 K1420 S1421 L1530 | F1415-V1417 PolarHBondContact O-N 3.12Å; V1417-L1419 VanDerWaalsContact C-N 3.31Å; V1417-L1419 PolarHBondContact O-N 3.19Å; V1417-K1420 WeakPolarHBondContact O-CB 3.38Å; V1417-K1420 PolarHBondContact O-N 3.28Å; V1417-S1421 PolarHBondContact O-N 3.08Å; V1417-L1530 HydrophobicContact CG1-CD2 4.38Å |
| 1418 | Q | 85.4 | Confident | 90.6 | Very high | 33 Ų | 33 | 36.8 Ų | 36.8 | 15% | 0.154 | 18% | 0.182 | C | C | . | . | H | α-helix | trans | -63.7 | -39.1 | 176.6 | -57.9 | 80.9 | -1.9 | 0 | 0 | 111.2 | Y1353 P1416 S1421 M1422 L1530 S1533 | Y1353-Q1418 HydrophobicContact CD1-CB 4.02Å; Y1353-Q1418 HydrophobicContact CD1-CG 3.89Å; Y1353-Q1418 HydrophobicContact CD2-CB 3.97Å; Y1353-Q1418 HydrophobicContact CE1-CB 4.41Å; Y1353-Q1418 HydrophobicContact CE1-CG 4.08Å; Y1353-Q1418 HydrophobicContact CE2-CB 4.31Å; Y1353-Q1418 HydrophobicContact CG-CB 3.79Å; Y1353-Q1418 HydrophobicContact CG-CG 4.2Å; P1416-Q1418 VanDerWaalsContact C-N 3.28Å; P1416-Q1418 PolarHBondContact O-N 3.03Å; Q1418-S1421 PolarHBondContact O-N 3.23Å; Q1418-M1422 PolarHBondContact O-N 3.23Å; Q1418-M1422 VanDerWaalsContact O-N 3.09Å; Q1418-L1530 HydrophobicContact CG-CD2 4.43Å; Q1418-S1533 VanDerWaalsContact NE2-CB 3.26Å; Q1418-S1533 PolarHBondContact NE2-OG 3.32Å |
| 1419 | L | 90.8 | Very high | 90.5 | Very high | 0 Ų | 0 | 37.2 Ų | 37.2 | 0% | 0 | 18% | 0.184 | C | C | . | . | H | α-helix | trans | -71.6 | -39.1 | 175.2 | -64.5 | -177.9 | 0 | 0 | 0 | 110.9 | C1349 F1350 Y1353 F1415 P1416 V1417 S1421 M1422 L1423 F1450 | C1349-L1419 HydrophobicContact CB-CD2 4.39Å; F1350-L1419 HydrophobicContact CD1-CD1 4.16Å; F1350-L1419 HydrophobicContact CD1-CD2 3.86Å; F1350-L1419 HydrophobicContact CE1-CD2 4.38Å; Y1353-L1419 HydrophobicContact CD2-CD2 4.4Å; F1415-L1419 HydrophobicContact CD1-CB 4.26Å; F1415-L1419 HydrophobicContact CE1-CB 3.51Å; F1415-L1419 VanDerWaalsContact CE1-CB 3.46Å; F1415-L1419 HydrophobicContact CE1-CD1 4.25Å; F1415-L1419 HydrophobicContact CZ-CB 4.21Å; F1415-L1419 HydrophobicContact CZ-CD1 4.26Å; P1416-L1419 HydrophobicContact CB-CB 4.37Å; P1416-L1419 HydrophobicContact CB-CD1 4.23Å; P1416-L1419 HydrophobicContact CB-CG 4.15Å; P1416-L1419 HydrophobicContact CG-CD1 4.02Å; P1416-L1419 HydrophobicContact CG-CG 4.47Å; P1416-L1419 WeakPolarHBondContact O-CB 3.44Å; P1416-L1419 PolarHBondContact O-N 3.01Å; P1416-L1419 VanDerWaalsContact O-N 3.08Å; V1417-L1419 VanDerWaalsContact C-N 3.31Å; V1417-L1419 PolarHBondContact O-N 3.19Å; L1419-S1421 VanDerWaalsContact C-N 3.29Å; L1419-S1421 PolarHBondContact O-N 3.13Å; L1419-M1422 HydrophobicContact CD2-CE 3.92Å; L1419-M1422 PolarHBondContact O-N 3.13Å; L1419-M1422 VanDerWaalsContact O-N 3.14Å; L1419-L1423 WeakPolarHBondContact O-CB 3.37Å; L1419-L1423 VanDerWaalsContact O-CG 3.26Å; L1419-L1423 WeakPolarHBondContact O-CG 3.36Å; L1419-L1423 PolarHBondContact O-N 3.04Å; L1419-F1450 HydrophobicContact CD1-CE1 4.14Å; L1419-F1450 HydrophobicContact CD1-CE2 4.27Å; L1419-F1450 HydrophobicContact CD1-CZ 3.79Å |
| 1420 | K | 91.1 | Very high | 90.5 | Very high | 25 Ų | 25 | 35.7 Ų | 35.7 | 11% | 0.109 | 18% | 0.176 | C | C | . | . | H | α-helix | trans | -55.8 | -45.7 | 172.1 | -62.4 | -170.2 | 179 | -179.8 | 0 | 111.2 | T1412 F1415 P1416 V1417 M1422 L1423 N1424 I1519 F1523 | T1412-K1420 PolarHBondContact O-NZ 3.16Å; T1412-K1420 VanDerWaalsContact O-NZ 3.15Å; F1415-K1420 HydrophobicContact CD1-CG 3.79Å; F1415-K1420 HydrophobicContact CE1-CG 4.38Å; F1415-K1420 VanDerWaalsContact O-CE 3.3Å; F1415-K1420 WeakPolarHBondContact O-CE 3.34Å; P1416-K1420 PolarHBondContact O-N 3.16Å; V1417-K1420 WeakPolarHBondContact O-CB 3.38Å; V1417-K1420 PolarHBondContact O-N 3.28Å; K1420-M1422 PolarHBondContact O-N 3.07Å; K1420-L1423 PolarHBondContact O-N 3.08Å; K1420-N1424 WeakPolarHBondContact O-CB 3.3Å; K1420-N1424 PolarHBondContact O-N 2.97Å; K1420-I1519 VanDerWaalsContact CA-O 3.26Å; K1420-I1519 WeakPolarHBondContact CA-O 3.34Å; K1420-I1519 VanDerWaalsContact CB-O 3.29Å; K1420-I1519 WeakPolarHBondContact CB-O 3.4Å; K1420-I1519 WeakPolarHBondContact CG-O 3.45Å; K1420-F1523 VanDerWaalsContact C-CZ 3.42Å; K1420-F1523 HydrophobicContact CB-CD1 3.93Å; K1420-F1523 HydrophobicContact CB-CD2 3.79Å; K1420-F1523 HydrophobicContact CB-CE1 3.86Å; K1420-F1523 HydrophobicContact CB-CE2 3.67Å; K1420-F1523 VanDerWaalsContact CB-CE2 3.5Å; K1420-F1523 HydrophobicContact CB-CG 3.92Å; K1420-F1523 HydrophobicContact CB-CZ 3.76Å; K1420-F1523 HydrophobicContact CD-CB 3.94Å; K1420-F1523 HydrophobicContact CD-CD1 4.4Å; K1420-F1523 HydrophobicContact CD-CD2 4.16Å; K1420-F1523 HydrophobicContact CD-CG 3.94Å; K1420-F1523 HydrophobicContact CG-CD1 4.47Å; K1420-F1523 HydrophobicContact CG-CD2 4.49Å; K1420-F1523 HydrophobicContact CG-CG 4.47Å; K1420-F1523 WeakPolarHBondContact O-CE1 3.43Å; K1420-F1523 VanDerWaalsContact O-CZ 3.26Å; K1420-F1523 WeakPolarHBondContact O-CZ 3.32Å |
| 1421 | S | 88.1 | Confident | 90.5 | Very high | 9.2 Ų | 9.2 | 29.7 Ų | 29.7 | 6% | 0.064 | 15% | 0.153 | C | C | . | . | H | α-helix | trans | -58.9 | -45.7 | 174.8 | -176 | 0 | 0 | 0 | 0 | 112.7 | H1315 V1417 Q1418 L1419 L1423 N1424 V1425 | H1315-S1421 PolarHBondContact ND1-OG 3.33Å; V1417-S1421 PolarHBondContact O-N 3.08Å; Q1418-S1421 PolarHBondContact O-N 3.23Å; L1419-S1421 VanDerWaalsContact C-N 3.29Å; L1419-S1421 PolarHBondContact O-N 3.13Å; S1421-L1423 PolarHBondContact O-N 3.06Å; S1421-N1424 WeakPolarHBondContact O-CB 3.34Å; S1421-N1424 PolarHBondContact O-N 3.35Å; S1421-V1425 WeakPolarHBondContact O-CG2 3.39Å; S1421-V1425 PolarHBondContact O-N 3.09Å; S1421-V1425 VanDerWaalsContact O-N 3.11Å |
| 1422 | M | 91.6 | Very high | 90.5 | Very high | 1.8 Ų | 1.8 | 33.7 Ų | 33.7 | 1% | 0.009 | 19% | 0.186 | C | C | . | . | H | α-helix | trans | -61.7 | -43.4 | 176.6 | 179.3 | -175.3 | 72.9 | 0 | 0 | 112.2 | L1318 F1322 M1346 C1349 F1350 Q1418 L1419 K1420 N1424 V1425 L1426 | L1318-M1422 HydrophobicContact CD1-CB 3.96Å; L1318-M1422 HydrophobicContact CD1-CG 3.93Å; L1318-M1422 HydrophobicContact CD2-CG 4.3Å; L1318-M1422 HydrophobicContact CD2-SD 4.46Å; F1322-M1422 HydrophobicContact CE2-CG 3.89Å; F1322-M1422 HydrophobicContact CZ-CG 4Å; F1322-M1422 HydrophobicContact CZ-SD 4.36Å; M1346-M1422 HydrophobicContact CB-SD 4.46Å; M1346-M1422 HydrophobicContact CG-CE 4.03Å; M1346-M1422 HydrophobicContact CG-SD 3.9Å; C1349-M1422 HydrophobicContact CB-CE 4.36Å; C1349-M1422 HydrophobicContact CB-SD 3.46Å; C1349-M1422 VanDerWaalsContact CB-SD 3.52Å; C1349-M1422 WeakPolarHBondContact CB-SD 3.38Å; F1350-M1422 HydrophobicContact CD1-CE 3.86Å; F1350-M1422 HydrophobicContact CD2-CE 4.35Å; F1350-M1422 HydrophobicContact CE1-CE 3.44Å; F1350-M1422 VanDerWaalsContact CE1-CE 3.44Å; F1350-M1422 HydrophobicContact CE2-CE 3.99Å; F1350-M1422 HydrophobicContact CG-CE 4.29Å; F1350-M1422 HydrophobicContact CZ-CE 3.51Å; Q1418-M1422 PolarHBondContact O-N 3.23Å; Q1418-M1422 VanDerWaalsContact O-N 3.09Å; L1419-M1422 HydrophobicContact CD2-CE 3.92Å; L1419-M1422 PolarHBondContact O-N 3.13Å; L1419-M1422 VanDerWaalsContact O-N 3.14Å; K1420-M1422 PolarHBondContact O-N 3.07Å; M1422-N1424 VanDerWaalsContact C-N 3.32Å; M1422-N1424 PolarHBondContact O-N 3.29Å; M1422-V1425 PolarHBondContact O-N 3.17Å; M1422-L1426 WeakPolarHBondContact O-CB 3.38Å; M1422-L1426 PolarHBondContact O-N 3.27Å |
| 1423 | L | 93 | Very high | 90.4 | Very high | 0 Ų | 0 | 38.6 Ų | 38.6 | 0% | 0 | 20% | 0.202 | C | C | . | . | H | α-helix | trans | -69.4 | -31 | -180 | -64.6 | 176.4 | 0 | 0 | 0 | 112.2 | F1350 F1415 L1419 K1420 S1421 L1426 F1427 V1442 V1446 I1519 A1520 | F1350-L1423 HydrophobicContact CE1-CD2 4.46Å; F1350-L1423 HydrophobicContact CZ-CD2 4.21Å; F1415-L1423 HydrophobicContact CE1-CD1 3.94Å; F1415-L1423 HydrophobicContact CZ-CD1 4.07Å; L1419-L1423 WeakPolarHBondContact O-CB 3.37Å; L1419-L1423 VanDerWaalsContact O-CG 3.26Å; L1419-L1423 WeakPolarHBondContact O-CG 3.36Å; L1419-L1423 PolarHBondContact O-N 3.04Å; K1420-L1423 PolarHBondContact O-N 3.08Å; S1421-L1423 PolarHBondContact O-N 3.06Å; L1423-L1426 HydrophobicContact CD2-CD2 4.24Å; L1423-L1426 PolarHBondContact O-N 3.19Å; L1423-F1427 WeakPolarHBondContact O-CB 3.29Å; L1423-F1427 PolarHBondContact O-N 3.06Å; L1423-V1442 HydrophobicContact CB-CG1 4.31Å; L1423-V1442 HydrophobicContact CD1-CG1 4.44Å; L1423-V1442 HydrophobicContact CD2-CG1 4.24Å; L1423-V1446 HydrophobicContact CD1-CG2 3.61Å; L1423-V1446 HydrophobicContact CD2-CG2 3.5Å; L1423-V1446 VanDerWaalsContact CD2-CG2 3.46Å; L1423-V1446 HydrophobicContact CG-CG2 4.2Å; L1423-I1519 HydrophobicContact CD1-CB 4.41Å; L1423-I1519 HydrophobicContact CD1-CD1 3.71Å; L1423-I1519 HydrophobicContact CD1-CG1 4.02Å; L1423-A1520 HydrophobicContact CB-CB 4.3Å |
| 1424 | N | 92.2 | Very high | 90.6 | Very high | 23.4 Ų | 23.4 | 33.3 Ų | 33.3 | 13% | 0.125 | 17% | 0.172 | C | C | . | . | H | α-helix | trans | -65 | -45.7 | 171.5 | -179 | -101.6 | 0 | 0 | 0 | 112.3 | K1420 S1421 M1422 L1426 F1427 H1428 A1520 F1523 | K1420-N1424 WeakPolarHBondContact O-CB 3.3Å; K1420-N1424 PolarHBondContact O-N 2.97Å; S1421-N1424 WeakPolarHBondContact O-CB 3.34Å; S1421-N1424 PolarHBondContact O-N 3.35Å; M1422-N1424 VanDerWaalsContact C-N 3.32Å; M1422-N1424 PolarHBondContact O-N 3.29Å; N1424-L1426 VanDerWaalsContact C-N 3.31Å; N1424-L1426 PolarHBondContact O-N 3.27Å; N1424-F1427 WeakPolarHBondContact O-CB 3.4Å; N1424-F1427 PolarHBondContact O-N 3.25Å; N1424-H1428 PolarHBondContact ND2-NE2 3.02Å; N1424-H1428 PolarHBondContact O-CD2 3.23Å; N1424-H1428 VanDerWaalsContact O-CD2 3.25Å; N1424-H1428 PolarHBondContact O-N 3.27Å; N1424-H1428 PolarHBondContact OD1-CD2 3.07Å; N1424-A1520 WeakPolarHBondContact CA-O 3.24Å; N1424-A1520 VanDerWaalsContact CB-O 3.3Å; N1424-A1520 WeakPolarHBondContact CB-O 3.35Å; N1424-A1520 PolarHBondContact ND2-O 3.28Å; N1424-F1523 HydrophobicContact CB-CE1 3.78Å; N1424-F1523 HydrophobicContact CB-CZ 3.73Å; N1424-F1523 VanDerWaalsContact CB-CZ 3.41Å |
| 1425 | V | 91.9 | Very high | 90.6 | Very high | 0 Ų | 0 | 31.5 Ų | 31.5 | 0% | 0 | 17% | 0.172 | C | C | . | . | H | α-helix | trans | -57.8 | -48.4 | 173.4 | 175 | 0 | 0 | 0 | 0 | 110 | H1315 L1318 W1319 F1322 S1421 M1422 F1427 H1428 V1429 | H1315-V1425 WeakPolarHBondContact CE1-CG2 3.37Å; H1315-V1425 VanDerWaalsContact ND1-CG2 3.3Å; H1315-V1425 WeakPolarHBondContact ND1-CG2 3.35Å; L1318-V1425 HydrophobicContact CB-CG1 4.36Å; W1319-V1425 VanDerWaalsContact CA-CG1 3.48Å; W1319-V1425 HydrophobicContact CB-CG1 4.04Å; W1319-V1425 HydrophobicContact CD2-CG1 4.3Å; W1319-V1425 HydrophobicContact CE3-CB 4.39Å; W1319-V1425 HydrophobicContact CE3-CG1 3.84Å; W1319-V1425 HydrophobicContact CE3-CG2 4.13Å; W1319-V1425 HydrophobicContact CG-CG1 4.45Å; W1319-V1425 HydrophobicContact CZ3-CG1 4.48Å; F1322-V1425 HydrophobicContact CD2-CG1 3.97Å; S1421-V1425 WeakPolarHBondContact O-CG2 3.39Å; S1421-V1425 PolarHBondContact O-N 3.09Å; S1421-V1425 VanDerWaalsContact O-N 3.11Å; M1422-V1425 PolarHBondContact O-N 3.17Å; V1425-F1427 VanDerWaalsContact C-N 3.34Å; V1425-F1427 PolarHBondContact O-N 3.12Å; V1425-H1428 PolarHBondContact O-N 3.18Å; V1425-V1429 HydrophobicContact CG1-CG2 4.11Å; V1425-V1429 WeakPolarHBondContact O-CB 3.27Å; V1425-V1429 VanDerWaalsContact O-CG2 3.24Å; V1425-V1429 WeakPolarHBondContact O-CG2 3.39Å; V1425-V1429 PolarHBondContact O-N 3.06Å |
| 1426 | L | 92.8 | Very high | 90.4 | Very high | 0.2 Ų | 0.2 | 38.7 Ų | 38.7 | 0% | 0.001 | 21% | 0.211 | C | C | . | . | H | α-helix | trans | -57.2 | -46.2 | 177.6 | 179.7 | 64 | 0 | 0 | 0 | 111.8 | F1322 F1336 M1346 M1422 L1423 N1424 H1428 V1429 V1430 V1442 I1445 | F1322-L1426 HydrophobicContact CD2-CB 4.17Å; F1322-L1426 HydrophobicContact CD2-CD1 4.26Å; F1322-L1426 HydrophobicContact CE2-CB 4.16Å; F1322-L1426 HydrophobicContact CE2-CD1 4.48Å; F1336-L1426 HydrophobicContact CD2-CD1 4.16Å; F1336-L1426 HydrophobicContact CE2-CD1 3.33Å; F1336-L1426 HydrophobicContact CZ-CD1 3.85Å; M1346-L1426 HydrophobicContact CE-CD1 4Å; M1346-L1426 HydrophobicContact CE-CD2 4.02Å; M1346-L1426 HydrophobicContact CE-CG 4.5Å; M1422-L1426 WeakPolarHBondContact O-CB 3.38Å; M1422-L1426 PolarHBondContact O-N 3.27Å; L1423-L1426 HydrophobicContact CD2-CD2 4.24Å; L1423-L1426 PolarHBondContact O-N 3.19Å; N1424-L1426 VanDerWaalsContact C-N 3.31Å; N1424-L1426 PolarHBondContact O-N 3.27Å; L1426-H1428 PolarHBondContact O-N 3.29Å; L1426-V1429 PolarHBondContact O-N 3Å; L1426-V1430 HydrophobicContact CD1-CG2 3.88Å; L1426-V1430 HydrophobicContact CG-CG2 4.43Å; L1426-V1430 WeakPolarHBondContact O-CB 3.32Å; L1426-V1430 VanDerWaalsContact O-CG2 3.23Å; L1426-V1430 WeakPolarHBondContact O-CG2 3.37Å; L1426-V1430 PolarHBondContact O-N 3.2Å; L1426-V1442 HydrophobicContact CB-CG2 4.46Å; L1426-V1442 HydrophobicContact CD2-CG2 4.11Å; L1426-V1442 HydrophobicContact CG-CG2 4.19Å; L1426-I1445 HydrophobicContact CD1-CD1 4.27Å; L1426-I1445 HydrophobicContact CD2-CB 4.39Å; L1426-I1445 HydrophobicContact CD2-CD1 3.86Å; L1426-I1445 HydrophobicContact CD2-CG2 4.28Å; L1426-I1445 HydrophobicContact CG-CD1 4.45Å |
| 1427 | F | 93.4 | Very high | 90.3 | Very high | 26.2 Ų | 26.2 | 39.4 Ų | 39.4 | 12% | 0.115 | 22% | 0.215 | C | C | . | . | H | α-helix | trans | -56.1 | -53.2 | 177.1 | 169.3 | -99.6 | 0 | 0 | 0 | 111.6 | L1423 N1424 V1425 N1431 L1439 V1442 A1520 I1521 | L1423-F1427 WeakPolarHBondContact O-CB 3.29Å; L1423-F1427 PolarHBondContact O-N 3.06Å; N1424-F1427 WeakPolarHBondContact O-CB 3.4Å; N1424-F1427 PolarHBondContact O-N 3.25Å; V1425-F1427 VanDerWaalsContact C-N 3.34Å; V1425-F1427 PolarHBondContact O-N 3.12Å; F1427-N1431 VanDerWaalsContact CE2-ND2 3.31Å; F1427-N1431 WeakPolarHBondContact CE2-ND2 3.32Å; F1427-N1431 WeakPolarHBondContact CZ-ND2 3.39Å; F1427-N1431 WeakPolarHBondContact O-CB 3.32Å; F1427-N1431 PolarHBondContact O-N 3.38Å; F1427-L1439 HydrophobicContact CD2-CB 4.4Å; F1427-L1439 HydrophobicContact CE2-CB 4.19Å; F1427-V1442 HydrophobicContact CB-CG2 4.01Å; F1427-A1520 HydrophobicContact CB-CB 4.45Å; F1427-I1521 HydrophobicContact CD1-CD1 4.44Å; F1427-I1521 HydrophobicContact CD1-CG1 4.24Å; F1427-I1521 HydrophobicContact CD2-CD1 4.22Å; F1427-I1521 HydrophobicContact CD2-CG1 4.45Å; F1427-I1521 HydrophobicContact CE1-CD1 3.94Å; F1427-I1521 HydrophobicContact CE1-CG1 4.12Å; F1427-I1521 HydrophobicContact CE2-CD1 3.68Å; F1427-I1521 HydrophobicContact CE2-CG1 4.35Å; F1427-I1521 HydrophobicContact CG-CD1 4.5Å; F1427-I1521 HydrophobicContact CG-CG1 4.4Å; F1427-I1521 HydrophobicContact CZ-CD1 3.52Å; F1427-I1521 VanDerWaalsContact CZ-CD1 3.48Å; F1427-I1521 HydrophobicContact CZ-CG1 4.18Å |
| 1428 | H | 92.4 | Very high | 90.5 | Very high | 83.2 Ų | 83.2 | 37.5 Ų | 37.5 | 39% | 0.385 | 20% | 0.203 | S | C | . | . | H | α-helix | trans | -65.4 | -43.8 | -176.9 | -76.2 | -62.1 | 0 | 0 | 0 | 112.5 | W1319 N1424 V1425 L1426 N1431 A1432 | W1319-H1428 HydrophobicContact CH2-CB 3.92Å; W1319-H1428 HydrophobicContact CZ3-CB 4.23Å; N1424-H1428 PolarHBondContact ND2-NE2 3.02Å; N1424-H1428 PolarHBondContact O-CD2 3.23Å; N1424-H1428 VanDerWaalsContact O-CD2 3.25Å; N1424-H1428 PolarHBondContact O-N 3.27Å; N1424-H1428 PolarHBondContact OD1-CD2 3.07Å; V1425-H1428 PolarHBondContact O-N 3.18Å; L1426-H1428 PolarHBondContact O-N 3.29Å; H1428-N1431 PolarHBondContact O-N 3.03Å; H1428-A1432 WeakPolarHBondContact O-CB 3.31Å; H1428-A1432 PolarHBondContact O-N 3.19Å |
| 1429 | V | 92.3 | Very high | 90.7 | Very high | 7.8 Ų | 7.8 | 37.4 Ų | 37.4 | 5% | 0.047 | 20% | 0.203 | C | C | . | . | H | α-helix | trans | -65.5 | -43.7 | -179.6 | 175.8 | 0 | 0 | 0 | 0 | 111.1 | W1319 F1322 T1323 V1326 V1425 L1426 A1432 R1433 | W1319-V1429 HydrophobicContact CD2-CG2 4.22Å; W1319-V1429 HydrophobicContact CE3-CG2 4.5Å; W1319-V1429 HydrophobicContact CG-CG2 4.43Å; W1319-V1429 HydrophobicContact CZ2-CG2 4.42Å; F1322-V1429 HydrophobicContact CB-CB 4.47Å; F1322-V1429 HydrophobicContact CB-CG1 4.23Å; F1322-V1429 HydrophobicContact CB-CG2 4.46Å; T1323-V1429 VanDerWaalsContact CA-CG1 3.46Å; V1326-V1429 HydrophobicContact CB-CG1 4.05Å; V1326-V1429 HydrophobicContact CG1-CG1 4.42Å; V1326-V1429 HydrophobicContact CG2-CG1 3.87Å; V1425-V1429 HydrophobicContact CG1-CG2 4.11Å; V1425-V1429 WeakPolarHBondContact O-CB 3.27Å; V1425-V1429 VanDerWaalsContact O-CG2 3.24Å; V1425-V1429 WeakPolarHBondContact O-CG2 3.39Å; V1425-V1429 PolarHBondContact O-N 3.06Å; L1426-V1429 PolarHBondContact O-N 3Å; V1429-A1432 PolarHBondContact O-N 3.05Å; V1429-R1433 PolarHBondContact O-N 3.08Å |
| 1430 | V | 92.5 | Very high | 90.7 | Very high | 0 Ų | 0 | 39.8 Ų | 39.8 | 0% | 0 | 22% | 0.216 | C | C | . | . | H | α-helix | trans | -66.6 | -43.4 | 177.2 | 175.3 | 0 | 0 | 0 | 0 | 110.8 | V1326 L1335 L1426 A1432 R1433 F1434 A1441 | V1326-V1430 HydrophobicContact CG2-CG2 3.94Å; L1335-V1430 HydrophobicContact CD1-CB 4.38Å; L1335-V1430 HydrophobicContact CD1-CG1 3.99Å; L1335-V1430 HydrophobicContact CD1-CG2 3.89Å; L1335-V1430 HydrophobicContact CD2-CG2 4.16Å; L1426-V1430 HydrophobicContact CD1-CG2 3.88Å; L1426-V1430 HydrophobicContact CG-CG2 4.43Å; L1426-V1430 WeakPolarHBondContact O-CB 3.32Å; L1426-V1430 VanDerWaalsContact O-CG2 3.23Å; L1426-V1430 WeakPolarHBondContact O-CG2 3.37Å; L1426-V1430 PolarHBondContact O-N 3.2Å; V1430-A1432 VanDerWaalsContact C-N 3.26Å; V1430-A1432 PolarHBondContact O-N 3.18Å; V1430-R1433 PolarHBondContact O-N 3.3Å; V1430-F1434 HydrophobicContact CG1-CD2 4.42Å; V1430-F1434 PolarHBondContact O-N 3.34Å; V1430-A1441 HydrophobicContact CB-CB 4.45Å; V1430-A1441 HydrophobicContact CG1-CB 3.82Å; V1430-A1441 HydrophobicContact CG2-CB 4.31Å |
| 1431 | N | 91.7 | Very high | 90.6 | Very high | 46.2 Ų | 46.2 | 38.6 Ų | 38.6 | 25% | 0.247 | 21% | 0.211 | C | C | . | . | H | α-helix | trans | -66.1 | -27.9 | 179.7 | -126.9 | 18.9 | 0 | 0 | 0 | 113 | F1427 H1428 R1433 P1435 N1436 T1437 G1438 | F1427-N1431 VanDerWaalsContact CE2-ND2 3.31Å; F1427-N1431 WeakPolarHBondContact CE2-ND2 3.32Å; F1427-N1431 WeakPolarHBondContact CZ-ND2 3.39Å; F1427-N1431 WeakPolarHBondContact O-CB 3.32Å; F1427-N1431 PolarHBondContact O-N 3.38Å; H1428-N1431 PolarHBondContact O-N 3.03Å; N1431-R1433 VanDerWaalsContact C-N 3.31Å; N1431-R1433 PolarHBondContact O-N 3.14Å; N1431-P1435 WeakPolarHBondContact O-CA 3.36Å; N1431-N1436 WeakPolarHBondContact OD1-CA 3.45Å; N1431-N1436 PolarHBondContact OD1-N 3.13Å; N1431-N1436 VanDerWaalsContact OD1-N 3.12Å; N1431-T1437 PolarHBondContact OD1-N 3.13Å; N1431-G1438 WeakPolarHBondContact OD1-CA 3.39Å; N1431-G1438 PolarHBondContact OD1-N 3.25Å |
| 1432 | A | 91.3 | Very high | 90.8 | Very high | 88.2 Ų | 88.2 | 38.2 Ų | 38.2 | 73% | 0.729 | 21% | 0.208 | S | C | * | . | H | α-helix | trans | -66.2 | -35.3 | 175 | 0 | 0 | 0 | 0 | 0 | 112.4 | H1428 V1429 V1430 | H1428-A1432 WeakPolarHBondContact O-CB 3.31Å; H1428-A1432 PolarHBondContact O-N 3.19Å; V1429-A1432 PolarHBondContact O-N 3.05Å; V1430-A1432 VanDerWaalsContact C-N 3.26Å; V1430-A1432 PolarHBondContact O-N 3.18Å |
| 1433 | R | 88.8 | Confident | 90.8 | Very high | 122 Ų | 122 | 38.2 Ų | 38.2 | 46% | 0.46 | 21% | 0.209 | S | C | . | . | H | α-helix | trans | -90.7 | -42.3 | 178.2 | -176.8 | 106.9 | 175.3 | 179.5 | -2 | 113.1 | V1326 E1327 A1329 V1429 V1430 N1431 P1435 | V1326-R1433 HydrophobicContact CG1-CB 3.42Å; V1326-R1433 VanDerWaalsContact CG1-CB 3.41Å; V1326-R1433 HydrophobicContact CG1-CG 3.77Å; V1326-R1433 VanDerWaalsContact O-CD 3.28Å; V1326-R1433 WeakPolarHBondContact O-CD 3.48Å; V1326-R1433 PolarHBondContact O-NE 3.43Å; E1327-R1433 VanDerWaalsContact C-CZ 3.48Å; E1327-R1433 VanDerWaalsContact CA-NH1 3.27Å; E1327-R1433 VanDerWaalsContact O-CZ 3.31Å; E1327-R1433 PolarHBondContact O-NH1 3.22Å; E1327-R1433 PolarHBondContact O-NH2 3.23Å; A1329-R1433 PolarHBondContact O-NH2 3.31Å; V1429-R1433 PolarHBondContact O-N 3.08Å; V1430-R1433 PolarHBondContact O-N 3.3Å; N1431-R1433 VanDerWaalsContact C-N 3.31Å; N1431-R1433 PolarHBondContact O-N 3.14Å; R1433-P1435 WeakPolarHBondContact O-CD 3.46Å |
| 1434 | F | 90.1 | Very high | 90.7 | Very high | 36 Ų | 36 | 38.9 Ų | 38.9 | 16% | 0.158 | 21% | 0.212 | C | C | . | . | S | Bend | trans | -123.5 | 87.2 | -175.9 | -59.3 | -71 | 0 | 0 | 0 | 109.5 | V1326 A1329 P1332 L1335 V1430 N1436 T1437 | V1326-F1434 HydrophobicContact CG1-CD2 4.41Å; V1326-F1434 HydrophobicContact CG1-CE2 4.28Å; A1329-F1434 WeakPolarHBondContact O-CZ 3.35Å; P1332-F1434 HydrophobicContact CG-CB 4.08Å; P1332-F1434 HydrophobicContact CG-CD1 4.13Å; P1332-F1434 HydrophobicContact CG-CD2 4.26Å; P1332-F1434 HydrophobicContact CG-CG 3.92Å; L1335-F1434 HydrophobicContact CD1-CD2 4.14Å; L1335-F1434 HydrophobicContact CD1-CE2 3.9Å; V1430-F1434 HydrophobicContact CG1-CD2 4.42Å; V1430-F1434 PolarHBondContact O-N 3.34Å; F1434-N1436 PolarHBondContact O-N 3.2Å; F1434-T1437 HydrophobicContact CB-CG2 4.44Å; F1434-T1437 WeakPolarHBondContact CB-OG1 3.33Å; F1434-T1437 PolarHBondContact O-N 3.18Å; F1434-T1437 VanDerWaalsContact O-N 3.16Å; F1434-T1437 PolarHBondContact O-OG1 3.2Å |
| 1435 | P | 88 | Confident | 90.7 | Very high | 93.8 Ų | 93.8 | 38.1 Ų | 38.1 | 61% | 0.609 | 21% | 0.208 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -54 | 139.1 | -175.2 | -25.5 | 33.5 | 0 | 0 | 0 | 112.5 | N1431 R1433 T1437 | N1431-P1435 WeakPolarHBondContact O-CA 3.36Å; R1433-P1435 WeakPolarHBondContact O-CD 3.46Å; P1435-T1437 PolarHBondContact O-N 3.21Å; P1435-T1437 VanDerWaalsContact O-N 3.14Å |
| 1436 | N | 86.2 | Confident | 90.7 | Very high | 157.4 Ų | 157.4 | 38.1 Ų | 38.1 | 84% | 0.842 | 21% | 0.208 | S | C | * | . | T | Hydrogen-bonded Turn | trans | 64.1 | 8.4 | 178.9 | -55.1 | -36 | 0 | 0 | 0 | 116.1 | N1431 F1434 | N1431-N1436 WeakPolarHBondContact OD1-CA 3.45Å; N1431-N1436 PolarHBondContact OD1-N 3.13Å; N1431-N1436 VanDerWaalsContact OD1-N 3.12Å; F1434-N1436 PolarHBondContact O-N 3.2Å |
| 1437 | T | 88.3 | Confident | 90.8 | Very high | 33.6 Ų | 33.6 | 38.2 Ų | 38.2 | 21% | 0.206 | 21% | 0.208 | C | C | . | . | trans | -108.3 | -6.3 | 178 | 68.5 | 0 | 0 | 0 | 0 | 113.7 | P1332 N1431 F1434 P1435 L1439 L1440 A1441 | P1332-T1437 HydrophobicContact CG-CG2 4.13Å; N1431-T1437 PolarHBondContact OD1-N 3.13Å; F1434-T1437 HydrophobicContact CB-CG2 4.44Å; F1434-T1437 WeakPolarHBondContact CB-OG1 3.33Å; F1434-T1437 PolarHBondContact O-N 3.18Å; F1434-T1437 VanDerWaalsContact O-N 3.16Å; F1434-T1437 PolarHBondContact O-OG1 3.2Å; P1435-T1437 PolarHBondContact O-N 3.21Å; P1435-T1437 VanDerWaalsContact O-N 3.14Å; T1437-L1439 VanDerWaalsContact C-N 3.32Å; T1437-L1439 PolarHBondContact O-N 3.07Å; T1437-L1440 WeakPolarHBondContact O-CB 3.42Å; T1437-L1440 PolarHBondContact O-N 3.28Å; T1437-L1440 VanDerWaalsContact O-N 3.14Å; T1437-A1441 PolarHBondContact O-N 3.16Å | ||
| 1438 | G | 88.3 | Confident | 90.6 | Very high | 0 Ų | 0 | 40 Ų | 40 | 0% | 0 | 22% | 0.219 | C | C | . | . | H | α-helix | trans | -55.7 | -43.9 | -177.1 | 0 | 0 | 0 | 0 | 0 | 113.3 | N1431 A1441 V1442 | N1431-G1438 WeakPolarHBondContact OD1-CA 3.39Å; N1431-G1438 PolarHBondContact OD1-N 3.25Å; G1438-A1441 PolarHBondContact O-N 3.3Å; G1438-V1442 WeakPolarHBondContact O-CG2 3.44Å; G1438-V1442 PolarHBondContact O-N 3.13Å; G1438-V1442 VanDerWaalsContact O-N 3.08Å |
| 1439 | L | 90.2 | Very high | 90.5 | Very high | 30.4 Ų | 30.4 | 39.3 Ų | 39.3 | 16% | 0.159 | 21% | 0.213 | C | C | . | . | H | α-helix | trans | -67.9 | -40.1 | 180 | -167.9 | 70.2 | 0 | 0 | 0 | 112.3 | F1427 T1437 A1441 V1442 G1443 K1513 S1516 T1517 I1521 | F1427-L1439 HydrophobicContact CD2-CB 4.4Å; F1427-L1439 HydrophobicContact CE2-CB 4.19Å; T1437-L1439 VanDerWaalsContact C-N 3.32Å; T1437-L1439 PolarHBondContact O-N 3.07Å; L1439-A1441 VanDerWaalsContact C-N 3.35Å; L1439-V1442 PolarHBondContact O-N 3.21Å; L1439-G1443 PolarHBondContact O-N 3.18Å; L1439-K1513 HydrophobicContact CD2-CG 3.71Å; L1439-S1516 VanDerWaalsContact CD1-C 3.48Å; L1439-T1517 WeakPolarHBondContact CD2-OG1 3.43Å; L1439-I1521 HydrophobicContact CD1-CD1 4.11Å |
| 1440 | L | 89.9 | Confident | 90.5 | Very high | 50.6 Ų | 50.6 | 39.1 Ų | 39.1 | 27% | 0.265 | 21% | 0.211 | S | C | . | . | H | α-helix | trans | -62.2 | -44.7 | 176.1 | -178.3 | 69.1 | 0 | 0 | 0 | 110.5 | T1437 V1442 G1443 M1444 Q1489 | T1437-L1440 WeakPolarHBondContact O-CB 3.42Å; T1437-L1440 PolarHBondContact O-N 3.28Å; T1437-L1440 VanDerWaalsContact O-N 3.14Å; L1440-V1442 PolarHBondContact O-N 3.2Å; L1440-G1443 PolarHBondContact O-N 3.12Å; L1440-M1444 HydrophobicContact CD1-CG 4.46Å; L1440-M1444 HydrophobicContact CD2-CE 4.47Å; L1440-M1444 HydrophobicContact CG-CE 4.08Å; L1440-M1444 HydrophobicContact CG-CG 4.47Å; L1440-M1444 HydrophobicContact CG-SD 4.38Å; L1440-M1444 WeakPolarHBondContact O-CB 3.48Å; L1440-M1444 VanDerWaalsContact O-CG 3.29Å; L1440-M1444 WeakPolarHBondContact O-CG 3.33Å; L1440-M1444 PolarHBondContact O-N 3.09Å; L1440-Q1489 HydrophobicContact CD1-CB 4.06Å; L1440-Q1489 HydrophobicContact CD1-CG 3.93Å |
| 1441 | A | 90.2 | Very high | 90.6 | Very high | 0.4 Ų | 0.4 | 39.1 Ų | 39.1 | 0% | 0.003 | 21% | 0.211 | C | C | . | . | H | α-helix | trans | -61.6 | -43.3 | 177.6 | 0 | 0 | 0 | 0 | 0 | 112.2 | L1335 V1430 T1437 G1438 L1439 G1443 M1444 I1445 | L1335-A1441 HydrophobicContact CD1-CB 4.2Å; V1430-A1441 HydrophobicContact CB-CB 4.45Å; V1430-A1441 HydrophobicContact CG1-CB 3.82Å; V1430-A1441 HydrophobicContact CG2-CB 4.31Å; T1437-A1441 PolarHBondContact O-N 3.16Å; G1438-A1441 PolarHBondContact O-N 3.3Å; L1439-A1441 VanDerWaalsContact C-N 3.35Å; A1441-G1443 PolarHBondContact O-N 2.91Å; A1441-M1444 HydrophobicContact CB-CE 4.43Å; A1441-M1444 PolarHBondContact O-N 3.1Å; A1441-I1445 HydrophobicContact CB-CD1 4.48Å; A1441-I1445 VanDerWaalsContact O-CB 3.29Å; A1441-I1445 WeakPolarHBondContact O-CB 3.35Å; A1441-I1445 WeakPolarHBondContact O-CD1 3.39Å; A1441-I1445 VanDerWaalsContact O-CG1 3.26Å; A1441-I1445 WeakPolarHBondContact O-CG1 3.26Å; A1441-I1445 PolarHBondContact O-N 3.03Å |
| 1442 | V | 92 | Very high | 90.6 | Very high | 0 Ų | 0 | 37.2 Ų | 37.2 | 0% | 0 | 20% | 0.201 | C | C | . | . | H | α-helix | trans | -57.7 | -51.1 | 174.8 | 167.5 | 0 | 0 | 0 | 0 | 111.1 | L1423 L1426 F1427 G1438 L1439 L1440 M1444 I1445 V1446 A1520 | L1423-V1442 HydrophobicContact CB-CG1 4.31Å; L1423-V1442 HydrophobicContact CD1-CG1 4.44Å; L1423-V1442 HydrophobicContact CD2-CG1 4.24Å; L1426-V1442 HydrophobicContact CB-CG2 4.46Å; L1426-V1442 HydrophobicContact CD2-CG2 4.11Å; L1426-V1442 HydrophobicContact CG-CG2 4.19Å; F1427-V1442 HydrophobicContact CB-CG2 4.01Å; G1438-V1442 WeakPolarHBondContact O-CG2 3.44Å; G1438-V1442 PolarHBondContact O-N 3.13Å; G1438-V1442 VanDerWaalsContact O-N 3.08Å; L1439-V1442 PolarHBondContact O-N 3.21Å; L1440-V1442 PolarHBondContact O-N 3.2Å; V1442-M1444 PolarHBondContact O-N 3.18Å; V1442-I1445 PolarHBondContact O-N 3.3Å; V1442-V1446 HydrophobicContact CG1-CG2 4.25Å; V1442-V1446 WeakPolarHBondContact O-CB 3.34Å; V1442-V1446 VanDerWaalsContact O-CG2 3.24Å; V1442-V1446 WeakPolarHBondContact O-CG2 3.46Å; V1442-V1446 PolarHBondContact O-N 2.9Å; V1442-A1520 HydrophobicContact CG1-CB 4.01Å; V1442-A1520 HydrophobicContact CG2-CB 4.4Å |
| 1443 | G | 91.1 | Very high | 90.6 | Very high | 3.2 Ų | 3.2 | 34.7 Ų | 34.7 | 3% | 0.033 | 18% | 0.178 | C | C | . | . | H | α-helix | trans | -57.8 | -50.5 | 178.6 | 0 | 0 | 0 | 0 | 0 | 111.9 | L1439 L1440 A1441 I1445 V1446 F1447 | L1439-G1443 PolarHBondContact O-N 3.18Å; L1440-G1443 PolarHBondContact O-N 3.12Å; A1441-G1443 PolarHBondContact O-N 2.91Å; G1443-I1445 VanDerWaalsContact C-N 3.33Å; G1443-I1445 PolarHBondContact O-N 3.22Å; G1443-V1446 PolarHBondContact O-N 3.26Å; G1443-F1447 WeakPolarHBondContact O-CD2 3.3Å; G1443-F1447 PolarHBondContact O-N 3.14Å; G1443-F1447 VanDerWaalsContact O-N 3.17Å |
| 1444 | M | 91.1 | Very high | 90.6 | Very high | 13.6 Ų | 13.6 | 28.9 Ų | 28.9 | 7% | 0.067 | 16% | 0.156 | C | C | . | . | H | α-helix | trans | -56.3 | -46.2 | 178.1 | -73.1 | -166.6 | -59.7 | 0 | 0 | 112.5 | P1332 T1333 L1440 A1441 V1442 L1448 Q1484 A1487 N1488 | P1332-M1444 WeakPolarHBondContact O-CE 3.44Å; T1333-M1444 HydrophobicContact CG2-CE 4.33Å; T1333-M1444 HydrophobicContact CG2-SD 4.11Å; L1440-M1444 HydrophobicContact CD1-CG 4.46Å; L1440-M1444 HydrophobicContact CD2-CE 4.47Å; L1440-M1444 HydrophobicContact CG-CE 4.08Å; L1440-M1444 HydrophobicContact CG-CG 4.47Å; L1440-M1444 HydrophobicContact CG-SD 4.38Å; L1440-M1444 WeakPolarHBondContact O-CB 3.48Å; L1440-M1444 VanDerWaalsContact O-CG 3.29Å; L1440-M1444 WeakPolarHBondContact O-CG 3.33Å; L1440-M1444 PolarHBondContact O-N 3.09Å; A1441-M1444 HydrophobicContact CB-CE 4.43Å; A1441-M1444 PolarHBondContact O-N 3.1Å; V1442-M1444 PolarHBondContact O-N 3.18Å; M1444-L1448 WeakPolarHBondContact O-CB 3.32Å; M1444-L1448 PolarHBondContact O-N 3Å; M1444-Q1484 PolarHBondContact O-NE2 3.04Å; M1444-A1487 WeakPolarHBondContact CG-O 3.29Å; M1444-N1488 VanDerWaalsContact CG-OD1 3.31Å; M1444-N1488 WeakPolarHBondContact CG-OD1 3.32Å; M1444-N1488 HydrophobicContact SD-CB 4.49Å; M1444-N1488 PolarHBondContact SD-OD1 3.19Å |
| 1445 | I | 91.6 | Very high | 90.7 | Very high | 7.4 Ų | 7.4 | 27.3 Ų | 27.3 | 4% | 0.038 | 15% | 0.149 | C | C | . | . | H | α-helix | trans | -72 | -42.7 | -174.9 | -72.8 | 165.8 | 0 | 0 | 0 | 111.7 | L1335 F1336 M1346 F1350 L1426 A1441 V1442 G1443 F1447 L1448 R1449 | L1335-I1445 HydrophobicContact CB-CD1 4.37Å; F1336-I1445 HydrophobicContact CB-CD1 4.33Å; F1336-I1445 HydrophobicContact CD2-CD1 3.58Å; F1336-I1445 VanDerWaalsContact CD2-CD1 3.5Å; F1336-I1445 HydrophobicContact CD2-CG1 4.5Å; F1336-I1445 HydrophobicContact CE2-CD1 4.28Å; F1336-I1445 HydrophobicContact CG-CD1 4.32Å; M1346-I1445 HydrophobicContact CE-CG2 4.37Å; M1346-I1445 HydrophobicContact SD-CG2 3.46Å; M1346-I1445 VanDerWaalsContact SD-CG2 3.52Å; M1346-I1445 WeakPolarHBondContact SD-CG2 3.29Å; F1350-I1445 HydrophobicContact CE2-CG2 4.3Å; F1350-I1445 HydrophobicContact CZ-CG2 4.41Å; L1426-I1445 HydrophobicContact CD1-CD1 4.27Å; L1426-I1445 HydrophobicContact CD2-CB 4.39Å; L1426-I1445 HydrophobicContact CD2-CD1 3.86Å; L1426-I1445 HydrophobicContact CD2-CG2 4.28Å; L1426-I1445 HydrophobicContact CG-CD1 4.45Å; A1441-I1445 HydrophobicContact CB-CD1 4.48Å; A1441-I1445 VanDerWaalsContact O-CB 3.29Å; A1441-I1445 WeakPolarHBondContact O-CB 3.35Å; A1441-I1445 WeakPolarHBondContact O-CD1 3.39Å; A1441-I1445 VanDerWaalsContact O-CG1 3.26Å; A1441-I1445 WeakPolarHBondContact O-CG1 3.26Å; A1441-I1445 PolarHBondContact O-N 3.03Å; V1442-I1445 PolarHBondContact O-N 3.3Å; G1443-I1445 VanDerWaalsContact C-N 3.33Å; G1443-I1445 PolarHBondContact O-N 3.22Å; I1445-F1447 PolarHBondContact O-N 3.19Å; I1445-L1448 PolarHBondContact O-N 3.27Å; I1445-R1449 WeakPolarHBondContact O-CB 3.34Å; I1445-R1449 PolarHBondContact O-N 3.24Å |
| 1446 | V | 93.1 | Very high | 90.8 | Very high | 0.8 Ų | 0.8 | 24.6 Ų | 24.6 | 1% | 0.005 | 13% | 0.131 | C | C | . | . | H | α-helix | trans | -61.1 | -46.7 | 178.8 | 161.7 | 0 | 0 | 0 | 0 | 110.6 | F1350 L1423 V1442 G1443 F1450 F1451 I1519 | F1350-V1446 HydrophobicContact CE1-CG2 4.38Å; F1350-V1446 HydrophobicContact CZ-CG2 4.26Å; L1423-V1446 HydrophobicContact CD1-CG2 3.61Å; L1423-V1446 HydrophobicContact CD2-CG2 3.5Å; L1423-V1446 VanDerWaalsContact CD2-CG2 3.46Å; L1423-V1446 HydrophobicContact CG-CG2 4.2Å; V1442-V1446 HydrophobicContact CG1-CG2 4.25Å; V1442-V1446 WeakPolarHBondContact O-CB 3.34Å; V1442-V1446 VanDerWaalsContact O-CG2 3.24Å; V1442-V1446 WeakPolarHBondContact O-CG2 3.46Å; V1442-V1446 PolarHBondContact O-N 2.9Å; G1443-V1446 PolarHBondContact O-N 3.26Å; V1446-F1450 HydrophobicContact CG1-CD1 4.37Å; V1446-F1450 WeakPolarHBondContact O-CA 3.4Å; V1446-F1450 WeakPolarHBondContact O-CB 3.36Å; V1446-F1450 PolarHBondContact O-N 3.08Å; V1446-F1451 HydrophobicContact CG1-CD2 3.64Å; V1446-F1451 HydrophobicContact CG1-CE2 3.46Å; V1446-F1451 VanDerWaalsContact CG1-CE2 3.45Å; V1446-F1451 HydrophobicContact CG1-CZ 4.49Å; V1446-F1451 PolarHBondContact O-N 2.97Å; V1446-I1519 HydrophobicContact CG1-CD1 4.44Å; V1446-I1519 HydrophobicContact CG2-CD1 4.31Å |
| 1447 | F | 93.5 | Very high | 90.8 | Very high | 1.8 Ų | 1.8 | 19 Ų | 19 | 1% | 0.008 | 10% | 0.103 | C | C | . | . | I | π-helix | trans | -66.3 | -45.2 | 176.5 | -81.8 | -89.5 | 0 | 0 | 0 | 111.5 | L1405 I1408 G1443 I1445 R1449 F1451 N1452 L1483 A1487 V1512 F1515 | L1405-F1447 HydrophobicContact CD1-CZ 4.4Å; I1408-F1447 HydrophobicContact CD1-CE1 4.18Å; I1408-F1447 HydrophobicContact CG2-CZ 4.42Å; G1443-F1447 WeakPolarHBondContact O-CD2 3.3Å; G1443-F1447 PolarHBondContact O-N 3.14Å; G1443-F1447 VanDerWaalsContact O-N 3.17Å; I1445-F1447 PolarHBondContact O-N 3.19Å; F1447-R1449 PolarHBondContact O-N 3.12Å; F1447-F1451 HydrophobicContact CD1-CB 4.4Å; F1447-F1451 HydrophobicContact CD1-CD2 4.34Å; F1447-F1451 HydrophobicContact CE1-CD2 4.37Å; F1447-F1451 HydrophobicContact CG-CD2 4.47Å; F1447-N1452 WeakPolarHBondContact O-CB 3.28Å; F1447-N1452 VanDerWaalsContact O-CG 3.22Å; F1447-N1452 PolarHBondContact O-N 3.08Å; F1447-N1452 PolarHBondContact O-ND2 3.04Å; F1447-L1483 HydrophobicContact CD1-CB 4.05Å; F1447-L1483 HydrophobicContact CE1-CB 4.3Å; F1447-L1483 HydrophobicContact CE1-CD1 4.47Å; F1447-L1483 HydrophobicContact CE1-CD2 4.28Å; F1447-A1487 HydrophobicContact CB-CB 3.82Å; F1447-A1487 HydrophobicContact CD2-CB 3.68Å; F1447-A1487 HydrophobicContact CE2-CB 4.44Å; F1447-A1487 HydrophobicContact CG-CB 3.82Å; F1447-V1512 HydrophobicContact CE2-CG1 3.82Å; F1447-V1512 HydrophobicContact CZ-CG1 4.31Å; F1447-F1515 HydrophobicContact CE2-CE1 4.47Å |
| 1448 | L | 90.8 | Very high | 90.6 | Very high | 64.2 Ų | 64.2 | 17.5 Ų | 17.5 | 34% | 0.336 | 9% | 0.094 | S | C | . | . | I | π-helix | trans | -66.5 | -40 | -175.2 | -176.1 | 62.7 | 0 | 0 | 0 | 114 | R1337 M1444 I1445 P1453 Q1484 | R1337-L1448 HydrophobicContact CG-CD2 4.49Å; M1444-L1448 WeakPolarHBondContact O-CB 3.32Å; M1444-L1448 PolarHBondContact O-N 3Å; I1445-L1448 PolarHBondContact O-N 3.27Å; L1448-P1453 VanDerWaalsContact O-CD 3.29Å; L1448-P1453 WeakPolarHBondContact O-CD 3.34Å; L1448-P1453 VanDerWaalsContact O-CG 3.25Å; L1448-P1453 WeakPolarHBondContact O-CG 3.39Å; L1448-Q1484 VanDerWaalsContact CB-OE1 3.3Å; L1448-Q1484 VanDerWaalsContact N-OE1 3.14Å |
| 1449 | R | 88.9 | Confident | 90.2 | Very high | 68.6 Ų | 68.6 | 18.8 Ų | 18.8 | 26% | 0.259 | 10% | 0.102 | S | C | . | . | I | π-helix | trans | -110.2 | -12.8 | -170.4 | -68.9 | -163.1 | 170.2 | -107.6 | 0.8 | 114.6 | F1336 G1338 S1343 F1350 I1445 F1447 | F1336-R1449 PolarHBondContact O-NE 3.14Å; F1336-R1449 PolarHBondContact O-NH2 3.37Å; G1338-R1449 PolarHBondContact O-NH2 3.49Å; S1343-R1449 PolarHBondContact O-NH1 3.11Å; F1350-R1449 HydrophobicContact CD2-CB 4.3Å; F1350-R1449 HydrophobicContact CE2-CB 4.11Å; I1445-R1449 WeakPolarHBondContact O-CB 3.34Å; I1445-R1449 PolarHBondContact O-N 3.24Å; F1447-R1449 PolarHBondContact O-N 3.12Å |
| 1450 | F | 92.4 | Very high | 89.5 | Confident | 2.4 Ų | 2.4 | 23.6 Ų | 23.6 | 1% | 0.011 | 12% | 0.124 | C | C | . | . | I | π-helix | trans | -115.6 | -61.6 | -178.1 | -171.7 | -132.9 | 0 | 0 | 0 | 112.5 | F1350 Y1357 L1358 F1415 L1419 V1446 | F1350-F1450 HydrophobicContact CB-CD2 3.74Å; F1350-F1450 HydrophobicContact CB-CE2 4.27Å; F1350-F1450 HydrophobicContact CB-CG 4.46Å; F1350-F1450 HydrophobicContact CD1-CB 3.78Å; F1350-F1450 HydrophobicContact CD1-CD1 4.24Å; F1350-F1450 AromaticContact CD1-CD2 3.6Å; F1350-F1450 HydrophobicContact CD1-CD2 3.6Å; F1350-F1450 HydrophobicContact CD1-CE2 4.19Å; F1350-F1450 AromaticContact CD1-CG 3.62Å; F1350-F1450 HydrophobicContact CD1-CG 3.62Å; F1350-F1450 HydrophobicContact CD2-CB 4.36Å; F1350-F1450 HydrophobicContact CE1-CB 3.9Å; F1350-F1450 HydrophobicContact CE1-CD1 4.39Å; F1350-F1450 HydrophobicContact CE1-CD2 4.4Å; F1350-F1450 AromaticContact CE1-CG 3.96Å; F1350-F1450 HydrophobicContact CE1-CG 4.02Å; F1350-F1450 HydrophobicContact CE2-CB 4.41Å; F1350-F1450 HydrophobicContact CG-CB 4.04Å; F1350-F1450 AromaticContact CG-CD2 3.86Å; F1350-F1450 HydrophobicContact CG-CD2 3.86Å; F1350-F1450 HydrophobicContact CG-CG 4.14Å; F1350-F1450 HydrophobicContact CZ-CB 4.24Å; F1350-F1450 WeakPolarHBondContact O-CE2 3.23Å; Y1357-F1450 AromaticContact CD1-CE1 3.86Å; Y1357-F1450 HydrophobicContact CD1-CE1 3.86Å; Y1357-F1450 AromaticContact CD1-CZ 3.83Å; Y1357-F1450 HydrophobicContact CD1-CZ 3.83Å; Y1357-F1450 AromaticContact CE1-CE1 3.87Å; Y1357-F1450 HydrophobicContact CE1-CE1 3.87Å; Y1357-F1450 HydrophobicContact CE1-CZ 4.31Å; L1358-F1450 HydrophobicContact CD1-CD2 3.69Å; L1358-F1450 HydrophobicContact CD1-CE2 3.29Å; L1358-F1450 HydrophobicContact CD1-CZ 3.9Å; L1358-F1450 HydrophobicContact CD2-CD1 4.41Å; L1358-F1450 HydrophobicContact CD2-CD2 4.4Å; L1358-F1450 HydrophobicContact CD2-CE1 4.24Å; L1358-F1450 HydrophobicContact CD2-CE2 4.18Å; L1358-F1450 HydrophobicContact CD2-CZ 4.05Å; L1358-F1450 HydrophobicContact CG-CD2 4.25Å; L1358-F1450 HydrophobicContact CG-CE1 4.3Å; L1358-F1450 HydrophobicContact CG-CE2 3.58Å; L1358-F1450 HydrophobicContact CG-CZ 3.61Å; F1415-F1450 HydrophobicContact CE2-CD1 4.23Å; F1415-F1450 AromaticContact CE2-CE1 3.76Å; F1415-F1450 HydrophobicContact CE2-CE1 3.76Å; F1415-F1450 HydrophobicContact CZ-CD1 4.33Å; F1415-F1450 AromaticContact CZ-CE1 3.95Å; F1415-F1450 HydrophobicContact CZ-CE1 4Å; L1419-F1450 HydrophobicContact CD1-CE1 4.14Å; L1419-F1450 HydrophobicContact CD1-CE2 4.27Å; L1419-F1450 HydrophobicContact CD1-CZ 3.79Å; V1446-F1450 HydrophobicContact CG1-CD1 4.37Å; V1446-F1450 WeakPolarHBondContact O-CA 3.4Å; V1446-F1450 WeakPolarHBondContact O-CB 3.36Å; V1446-F1450 PolarHBondContact O-N 3.08Å |
| 1451 | F | 94.1 | Very high | 88.9 | Confident | 0 Ų | 0 | 24.6 Ų | 24.6 | 0% | 0 | 13% | 0.125 | C | C | . | . | I | π-helix | trans | -77.5 | -54.9 | -176 | -68.6 | -63.8 | 0 | 0 | 0 | 113.2 | Y1357 L1358 L1361 I1408 F1415 V1446 F1447 A1454 I1455 F1515 | Y1357-F1451 AromaticContact CE1-CE1 3.73Å; Y1357-F1451 HydrophobicContact CE1-CE1 3.73Å; Y1357-F1451 AromaticContact CE1-CZ 3.95Å; Y1357-F1451 HydrophobicContact CE1-CZ 3.95Å; L1358-F1451 HydrophobicContact CD2-CD1 3.84Å; L1358-F1451 HydrophobicContact CD2-CE1 4.13Å; L1361-F1451 HydrophobicContact CD2-CD1 4.45Å; L1361-F1451 HydrophobicContact CD2-CE1 3.82Å; I1408-F1451 HydrophobicContact CD1-CB 4.45Å; I1408-F1451 HydrophobicContact CD1-CD1 4.1Å; I1408-F1451 HydrophobicContact CD1-CD2 4.44Å; I1408-F1451 HydrophobicContact CD1-CE1 4.42Å; I1408-F1451 HydrophobicContact CD1-CG 4.17Å; I1408-F1451 HydrophobicContact CG1-CD1 4.22Å; I1408-F1451 HydrophobicContact CG1-CE1 4.08Å; I1408-F1451 HydrophobicContact CG1-CZ 4.44Å; I1408-F1451 HydrophobicContact CG2-CD2 4.44Å; I1408-F1451 HydrophobicContact CG2-CE1 4.23Å; I1408-F1451 HydrophobicContact CG2-CE2 3.91Å; I1408-F1451 HydrophobicContact CG2-CZ 3.74Å; F1415-F1451 HydrophobicContact CD2-CZ 4.48Å; F1415-F1451 HydrophobicContact CE2-CE2 4.46Å; F1415-F1451 AromaticContact CE2-CZ 3.99Å; F1415-F1451 HydrophobicContact CE2-CZ 4.09Å; V1446-F1451 HydrophobicContact CG1-CD2 3.64Å; V1446-F1451 HydrophobicContact CG1-CE2 3.46Å; V1446-F1451 VanDerWaalsContact CG1-CE2 3.45Å; V1446-F1451 HydrophobicContact CG1-CZ 4.49Å; V1446-F1451 PolarHBondContact O-N 2.97Å; F1447-F1451 HydrophobicContact CD1-CB 4.4Å; F1447-F1451 HydrophobicContact CD1-CD2 4.34Å; F1447-F1451 HydrophobicContact CE1-CD2 4.37Å; F1447-F1451 HydrophobicContact CG-CD2 4.47Å; F1451-A1454 WeakPolarHBondContact O-CB 3.27Å; F1451-A1454 PolarHBondContact O-N 3.22Å; F1451-A1454 VanDerWaalsContact O-N 3.12Å; F1451-I1455 HydrophobicContact CB-CD1 4.32Å; F1451-I1455 VanDerWaalsContact O-CG1 3.27Å; F1451-I1455 WeakPolarHBondContact O-CG1 3.28Å; F1451-I1455 PolarHBondContact O-N 3.1Å; F1451-F1515 HydrophobicContact CE2-CE1 4.18Å; F1451-F1515 HydrophobicContact CE2-CZ 4.11Å; F1451-F1515 HydrophobicContact CZ-CZ 4.22Å |
| 1452 | N | 93.1 | Very high | 88.2 | Confident | 7.2 Ų | 7.2 | 25.7 Ų | 25.7 | 4% | 0.039 | 14% | 0.136 | C | C | . | . | H | α-helix | trans | -59.1 | -43.5 | -172.8 | -72.3 | -17.2 | 0 | 0 | 0 | 113.7 | F1447 A1454 I1455 V1456 S1480 Q1484 | F1447-N1452 WeakPolarHBondContact O-CB 3.28Å; F1447-N1452 VanDerWaalsContact O-CG 3.22Å; F1447-N1452 PolarHBondContact O-N 3.08Å; F1447-N1452 PolarHBondContact O-ND2 3.04Å; N1452-A1454 VanDerWaalsContact C-N 3.29Å; N1452-A1454 PolarHBondContact O-N 3.17Å; N1452-I1455 PolarHBondContact O-N 3.21Å; N1452-V1456 VanDerWaalsContact O-CG2 3.31Å; N1452-V1456 WeakPolarHBondContact O-CG2 3.44Å; N1452-V1456 PolarHBondContact O-N 3.03Å; N1452-S1480 VanDerWaalsContact CB-OG 3.29Å; N1452-S1480 WeakPolarHBondContact CB-OG 3.24Å; N1452-S1480 VanDerWaalsContact CG-OG 3.3Å; N1452-S1480 PolarHBondContact ND2-O 3.12Å; N1452-S1480 WeakPolarHBondContact OD1-CA 3.29Å; N1452-S1480 PolarHBondContact OD1-O 2.99Å; N1452-Q1484 PolarHBondContact ND2-OE1 3.11Å; N1452-Q1484 VanDerWaalsContact ND2-OE1 3.07Å |
| 1453 | P | 90.6 | Very high | 87.6 | Confident | 36 Ų | 36 | 25.8 Ų | 25.8 | 23% | 0.234 | 14% | 0.137 | C | C | . | . | H | α-helix | trans | -60.7 | -38.7 | 176.2 | -25.5 | 36.9 | 0 | 0 | 0 | 113 | L1448 S1457 Y1461 | L1448-P1453 VanDerWaalsContact O-CD 3.29Å; L1448-P1453 WeakPolarHBondContact O-CD 3.34Å; L1448-P1453 VanDerWaalsContact O-CG 3.25Å; L1448-P1453 WeakPolarHBondContact O-CG 3.39Å; P1453-S1457 PolarHBondContact O-N 3.04Å; P1453-S1457 VanDerWaalsContact O-N 3.12Å; P1453-Y1461 HydrophobicContact CB-CE2 3.75Å; P1453-Y1461 VanDerWaalsContact CB-OH 3.24Å; P1453-Y1461 WeakPolarHBondContact CB-OH 3.3Å; P1453-Y1461 WeakPolarHBondContact O-CE2 3.41Å |
| 1454 | A | 89.5 | Confident | 87 | Confident | 0 Ų | 0 | 26.1 Ų | 26.1 | 0% | 0 | 14% | 0.138 | C | C | . | . | H | α-helix | trans | -70.9 | -31.8 | 179.1 | 0 | 0 | 0 | 0 | 0 | 112.7 | L1358 L1362 F1451 N1452 P1458 Y1461 I1463 | L1358-A1454 HydrophobicContact CD1-CB 3.96Å; L1358-A1454 HydrophobicContact CD2-CB 4.15Å; L1362-A1454 HydrophobicContact CD1-CB 3.71Å; F1451-A1454 WeakPolarHBondContact O-CB 3.27Å; F1451-A1454 PolarHBondContact O-N 3.22Å; F1451-A1454 VanDerWaalsContact O-N 3.12Å; N1452-A1454 VanDerWaalsContact C-N 3.29Å; N1452-A1454 PolarHBondContact O-N 3.17Å; A1454-P1458 VanDerWaalsContact O-CA 3.31Å; A1454-P1458 WeakPolarHBondContact O-CA 3.27Å; A1454-Y1461 HydrophobicContact CB-CD1 4.02Å; A1454-Y1461 HydrophobicContact CB-CE1 4.33Å; A1454-Y1461 HydrophobicContact CB-CG 4.16Å; A1454-I1463 HydrophobicContact CB-CD1 3.88Å |
| 1455 | I | 91.4 | Very high | 86.3 | Confident | 1.2 Ų | 1.2 | 31.8 Ų | 31.8 | 1% | 0.006 | 17% | 0.168 | C | C | . | . | H | α-helix | trans | -73.7 | -43.8 | 176.3 | -66.2 | 165.2 | 0 | 0 | 0 | 111.2 | L1362 I1404 F1451 N1452 L1476 V1479 L1483 | L1362-I1455 HydrophobicContact CD1-CG1 4.24Å; L1362-I1455 HydrophobicContact CD2-CG1 4.14Å; I1404-I1455 HydrophobicContact CD1-CB 4.49Å; I1404-I1455 HydrophobicContact CD1-CD1 3.75Å; I1404-I1455 VanDerWaalsContact CD1-CD1 3.42Å; I1404-I1455 HydrophobicContact CD1-CG1 3.55Å; I1404-I1455 HydrophobicContact CD1-CG2 4.22Å; I1404-I1455 HydrophobicContact CG1-CD1 4.19Å; F1451-I1455 HydrophobicContact CB-CD1 4.32Å; F1451-I1455 VanDerWaalsContact O-CG1 3.27Å; F1451-I1455 WeakPolarHBondContact O-CG1 3.28Å; F1451-I1455 PolarHBondContact O-N 3.1Å; N1452-I1455 PolarHBondContact O-N 3.21Å; I1455-L1476 HydrophobicContact CG2-CB 4.31Å; I1455-L1476 HydrophobicContact CG2-CD2 4.02Å; I1455-V1479 HydrophobicContact CG2-CG1 4.38Å; I1455-L1483 HydrophobicContact CD1-CD1 3.78Å |
| 1456 | V | 90 | Very high | 85.5 | Confident | 38.2 Ų | 38.2 | 35.7 Ų | 35.7 | 23% | 0.232 | 19% | 0.192 | C | C | . | . | H | α-helix | trans | -72 | -39.1 | -176.5 | 175.8 | 0 | 0 | 0 | 0 | 111.9 | N1452 P1458 S1480 | N1452-V1456 VanDerWaalsContact O-CG2 3.31Å; N1452-V1456 WeakPolarHBondContact O-CG2 3.44Å; N1452-V1456 PolarHBondContact O-N 3.03Å; V1456-P1458 VanDerWaalsContact C-CD 3.46Å; V1456-P1458 WeakPolarHBondContact O-CD 3.36Å; V1456-S1480 VanDerWaalsContact CG2-CB 3.44Å; V1456-S1480 WeakPolarHBondContact CG2-OG 3.45Å |
| 1457 | S | 86.3 | Confident | 84.9 | Confident | 38.8 Ų | 38.8 | 42.6 Ų | 42.6 | 27% | 0.271 | 22% | 0.219 | S | C | . | . | trans | -124.8 | 65.6 | -176.5 | -65.4 | 0 | 0 | 0 | 0 | 112.1 | P1453 V1459 E1460 Y1461 | P1453-S1457 PolarHBondContact O-N 3.04Å; P1453-S1457 VanDerWaalsContact O-N 3.12Å; S1457-V1459 VanDerWaalsContact C-N 3.27Å; S1457-V1459 PolarHBondContact O-N 3.14Å; S1457-E1460 WeakPolarHBondContact CB-OE2 3.36Å; S1457-E1460 PolarHBondContact O-N 3.27Å; S1457-E1460 PolarHBondContact OG-OE2 3.18Å; S1457-E1460 VanDerWaalsContact OG-OE2 3.06Å; S1457-Y1461 WeakPolarHBondContact O-CD2 3.02Å; S1457-Y1461 PolarHBondContact O-N 3.14Å; S1457-Y1461 VanDerWaalsContact O-N 3.16Å | ||
| 1458 | P | 85.3 | Confident | 84.3 | Confident | 2.2 Ų | 2.2 | 42.8 Ų | 42.8 | 1% | 0.014 | 22% | 0.221 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -67.2 | -26.9 | -171.6 | 28 | -35.6 | 0 | 0 | 0 | 113.2 | V1366 A1454 V1456 G1462 I1463 T1464 P1468 L1476 | V1366-P1458 HydrophobicContact CG1-CB 3.9Å; V1366-P1458 HydrophobicContact CG1-CG 3.85Å; V1366-P1458 HydrophobicContact CG2-CB 4.04Å; V1366-P1458 HydrophobicContact CG2-CG 4.47Å; A1454-P1458 VanDerWaalsContact O-CA 3.31Å; A1454-P1458 WeakPolarHBondContact O-CA 3.27Å; V1456-P1458 VanDerWaalsContact C-CD 3.46Å; V1456-P1458 WeakPolarHBondContact O-CD 3.36Å; P1458-G1462 PolarHBondContact O-N 3.15Å; P1458-I1463 HydrophobicContact CB-CB 4.26Å; P1458-I1463 WeakPolarHBondContact O-CB 3.33Å; P1458-I1463 PolarHBondContact O-N 3.3Å; P1458-T1464 HydrophobicContact CB-CG2 3.99Å; P1458-T1464 HydrophobicContact CG-CG2 4.16Å; P1458-P1468 HydrophobicContact CG-CG 4.18Å; P1458-L1476 HydrophobicContact CG-CD1 4.5Å |
| 1459 | V | 78.7 | Confident | 83.9 | Confident | 27.8 Ų | 27.8 | 42.2 Ų | 42.2 | 17% | 0.168 | 22% | 0.222 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -71.8 | -45.8 | 175.7 | -175.8 | 0 | 0 | 0 | 0 | 111.4 | S1457 Y1461 G1462 T1464 V1466 Y1467 | S1457-V1459 VanDerWaalsContact C-N 3.27Å; S1457-V1459 PolarHBondContact O-N 3.14Å; V1459-Y1461 PolarHBondContact O-N 3.08Å; V1459-G1462 PolarHBondContact O-N 3.07Å; V1459-T1464 WeakPolarHBondContact CA-O 3.34Å; V1459-T1464 HydrophobicContact CG2-CG2 3.97Å; V1459-V1466 WeakPolarHBondContact CG2-O 3.42Å; V1459-Y1467 HydrophobicContact CB-CD1 4.3Å; V1459-Y1467 HydrophobicContact CB-CD2 4.38Å; V1459-Y1467 HydrophobicContact CB-CE1 4.16Å; V1459-Y1467 HydrophobicContact CB-CE2 4.25Å; V1459-Y1467 HydrophobicContact CG1-CD1 4.39Å; V1459-Y1467 HydrophobicContact CG1-CD2 4.14Å; V1459-Y1467 HydrophobicContact CG1-CE1 4.22Å; V1459-Y1467 HydrophobicContact CG1-CE2 3.67Å; V1459-Y1467 HydrophobicContact CG2-CD1 4.09Å; V1459-Y1467 HydrophobicContact CG2-CD2 4.24Å; V1459-Y1467 HydrophobicContact CG2-CE1 4.25Å; V1459-Y1467 HydrophobicContact CG2-CE2 4.33Å; V1459-Y1467 HydrophobicContact CG2-CG 4.06Å |
| 1460 | E | 76.9 | Confident | 83.6 | Confident | 132.2 Ų | 132.2 | 42.5 Ų | 42.5 | 62% | 0.618 | 24% | 0.239 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -65.6 | -27.5 | -179.9 | -60.9 | -172.3 | 164.1 | 0 | 0 | 112.2 | S1457 G1462 Y1467 | S1457-E1460 WeakPolarHBondContact CB-OE2 3.36Å; S1457-E1460 PolarHBondContact O-N 3.27Å; S1457-E1460 PolarHBondContact OG-OE2 3.18Å; S1457-E1460 VanDerWaalsContact OG-OE2 3.06Å; E1460-G1462 VanDerWaalsContact C-N 3.34Å; E1460-Y1467 PolarHBondContact OE1-OH 3.33Å |
| 1461 | Y | 77.1 | Confident | 83.2 | Confident | 70.4 Ų | 70.4 | 44.6 Ų | 44.6 | 28% | 0.276 | 25% | 0.254 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -85.2 | -3.8 | 173.1 | -92 | -100.4 | 0 | 0 | 0 | 113.9 | Y1355 L1358 P1453 A1454 S1457 V1459 I1463 | Y1355-Y1461 VanDerWaalsContact CE2-O 3.3Å; Y1355-Y1461 WeakPolarHBondContact CE2-O 3.38Å; L1358-Y1461 HydrophobicContact CD1-CD1 4.31Å; P1453-Y1461 HydrophobicContact CB-CE2 3.75Å; P1453-Y1461 VanDerWaalsContact CB-OH 3.24Å; P1453-Y1461 WeakPolarHBondContact CB-OH 3.3Å; P1453-Y1461 WeakPolarHBondContact O-CE2 3.41Å; A1454-Y1461 HydrophobicContact CB-CD1 4.02Å; A1454-Y1461 HydrophobicContact CB-CE1 4.33Å; A1454-Y1461 HydrophobicContact CB-CG 4.16Å; S1457-Y1461 WeakPolarHBondContact O-CD2 3.02Å; S1457-Y1461 PolarHBondContact O-N 3.14Å; S1457-Y1461 VanDerWaalsContact O-N 3.16Å; V1459-Y1461 PolarHBondContact O-N 3.08Å; Y1461-I1463 VanDerWaalsContact C-N 3.32Å; Y1461-I1463 PolarHBondContact O-N 2.9Å |
| 1462 | G | 73.9 | Confident | 82.8 | Confident | 22.8 Ų | 22.8 | 44.7 Ų | 44.7 | 24% | 0.235 | 26% | 0.255 | C | S | . | . | T | Hydrogen-bonded Turn | trans | 71.3 | 29.3 | 177.7 | 0 | 0 | 0 | 0 | 0 | 114.5 | Y1355 P1458 V1459 E1460 | Y1355-G1462 PolarHBondContact OH-O 3.21Å; Y1355-G1462 VanDerWaalsContact OH-O 3.11Å; P1458-G1462 PolarHBondContact O-N 3.15Å; V1459-G1462 PolarHBondContact O-N 3.07Å; E1460-G1462 VanDerWaalsContact C-N 3.34Å |
| 1463 | I | 81.4 | Confident | 82.6 | Confident | 3.4 Ų | 3.4 | 49.8 Ų | 49.8 | 2% | 0.017 | 27% | 0.273 | C | S | . | . | S | Bend | trans | -85.2 | -40.3 | 178.1 | -64.2 | 169.4 | 0 | 0 | 0 | 110.7 | L1362 R1363 V1366 A1454 P1458 Y1461 | L1362-I1463 HydrophobicContact CB-CD1 4.04Å; L1362-I1463 HydrophobicContact CB-CG2 4.02Å; L1362-I1463 HydrophobicContact CD1-CD1 3.65Å; L1362-I1463 HydrophobicContact CG-CD1 4.43Å; R1363-I1463 HydrophobicContact CB-CG2 4.07Å; V1366-I1463 HydrophobicContact CG2-CG2 4.47Å; A1454-I1463 HydrophobicContact CB-CD1 3.88Å; P1458-I1463 HydrophobicContact CB-CB 4.26Å; P1458-I1463 WeakPolarHBondContact O-CB 3.33Å; P1458-I1463 PolarHBondContact O-N 3.3Å; Y1461-I1463 VanDerWaalsContact C-N 3.32Å; Y1461-I1463 PolarHBondContact O-N 2.9Å |
| 1464 | T | 78.2 | Confident | 82.4 | Confident | 10 Ų | 10 | 49.9 Ų | 49.9 | 6% | 0.061 | 27% | 0.269 | C | S | . | . | trans | -135.9 | 151.7 | 177.9 | -176.6 | 0 | 0 | 0 | 0 | 110.3 | V1366 P1458 V1459 V1466 | V1366-T1464 HydrophobicContact CG1-CG2 3.81Å; P1458-T1464 HydrophobicContact CB-CG2 3.99Å; P1458-T1464 HydrophobicContact CG-CG2 4.16Å; V1459-T1464 WeakPolarHBondContact CA-O 3.34Å; V1459-T1464 HydrophobicContact CG2-CG2 3.97Å; T1464-V1466 WeakPolarHBondContact CG2-O 3.41Å; T1464-V1466 PolarHBondContact OG1-N 3.17Å; T1464-V1466 VanDerWaalsContact OG1-N 3.15Å | ||
| 1465 | D | 74.7 | Confident | 82.4 | Confident | 132.6 Ų | 132.6 | 49.9 Ų | 49.9 | 71% | 0.709 | 27% | 0.269 | S | S | * | . | S | Bend | trans | -91.6 | -11.3 | 175.2 | -54.5 | -49 | 0 | 0 | 0 | 111.9 | ||
| 1466 | V | 76.1 | Confident | 82.4 | Confident | 89.2 Ų | 89.2 | 49.9 Ų | 49.9 | 54% | 0.541 | 27% | 0.269 | S | S | . | . | S | Bend | trans | -96.9 | 124.2 | -177.3 | -177 | 0 | 0 | 0 | 0 | 110.2 | T1370 V1459 T1464 P1468 | T1370-V1466 HydrophobicContact CG2-CG1 4.24Å; V1459-V1466 WeakPolarHBondContact CG2-O 3.42Å; T1464-V1466 WeakPolarHBondContact CG2-O 3.41Å; T1464-V1466 PolarHBondContact OG1-N 3.17Å; T1464-V1466 VanDerWaalsContact OG1-N 3.15Å; V1466-P1468 WeakPolarHBondContact O-CD 3.44Å |
| 1467 | Y | 79.4 | Confident | 82.4 | Confident | 145.6 Ų | 145.6 | 51.5 Ų | 51.5 | 57% | 0.571 | 28% | 0.275 | S | S | * | . | P | Polyproline II helix | trans | -69.4 | 125.6 | 174.6 | -92.4 | -86.3 | 0 | 0 | 0 | 111.4 | V1459 E1460 | V1459-Y1467 HydrophobicContact CB-CD1 4.3Å; V1459-Y1467 HydrophobicContact CB-CD2 4.38Å; V1459-Y1467 HydrophobicContact CB-CE1 4.16Å; V1459-Y1467 HydrophobicContact CB-CE2 4.25Å; V1459-Y1467 HydrophobicContact CG1-CD1 4.39Å; V1459-Y1467 HydrophobicContact CG1-CD2 4.14Å; V1459-Y1467 HydrophobicContact CG1-CE1 4.22Å; V1459-Y1467 HydrophobicContact CG1-CE2 3.67Å; V1459-Y1467 HydrophobicContact CG2-CD1 4.09Å; V1459-Y1467 HydrophobicContact CG2-CD2 4.24Å; V1459-Y1467 HydrophobicContact CG2-CE1 4.25Å; V1459-Y1467 HydrophobicContact CG2-CE2 4.33Å; V1459-Y1467 HydrophobicContact CG2-CG 4.06Å; E1460-Y1467 PolarHBondContact OE1-OH 3.33Å |
| 1468 | P | 81 | Confident | 82.6 | Confident | 5.8 Ų | 5.8 | 49.7 Ų | 49.7 | 4% | 0.038 | 26% | 0.262 | C | S | . | . | P | Polyproline II helix | trans | -66 | 143.3 | 174.8 | 7.5 | -7 | 0 | 0 | 0 | 111.5 | T1370 P1458 V1466 I1472 R1473 L1476 | T1370-P1468 HydrophobicContact CG2-CB 4.5Å; P1458-P1468 HydrophobicContact CG-CG 4.18Å; V1466-P1468 WeakPolarHBondContact O-CD 3.44Å; P1468-I1472 HydrophobicContact CB-CB 4.24Å; P1468-I1472 HydrophobicContact CB-CG2 3.9Å; P1468-R1473 HydrophobicContact CB-CB 4.48Å; P1468-R1473 HydrophobicContact CG-CB 4.5Å; P1468-R1473 PolarHBondContact O-NH2 3.15Å; P1468-R1473 VanDerWaalsContact O-NH2 3.16Å; P1468-L1476 HydrophobicContact CB-CD1 4.45Å; P1468-L1476 HydrophobicContact CG-CD1 4.34Å |
| 1469 | S | 83.3 | Confident | 82.9 | Confident | 50.8 Ų | 50.8 | 49.6 Ų | 49.6 | 36% | 0.355 | 26% | 0.262 | S | S | . | . | P | Polyproline II helix | trans | -59.8 | 162.6 | 174.3 | 72.8 | 0 | 0 | 0 | 0 | 111.5 | S1471 I1472 R1473 | S1469-S1471 VanDerWaalsContact C-N 3.31Å; S1469-S1471 PolarHBondContact O-N 3.26Å; S1469-S1471 PolarHBondContact OG-OG 2.94Å; S1469-S1471 VanDerWaalsContact OG-OG 3.1Å; S1469-I1472 PolarHBondContact O-N 3.08Å; S1469-I1472 WeakPolarHBondContact OG-CB 3.43Å; S1469-I1472 VanDerWaalsContact OG-CD1 3.25Å; S1469-I1472 WeakPolarHBondContact OG-CD1 3.38Å; S1469-I1472 VanDerWaalsContact OG-CG1 3.25Å; S1469-I1472 WeakPolarHBondContact OG-CG1 3.32Å; S1469-I1472 PolarHBondContact OG-N 3.1Å; S1469-R1473 VanDerWaalsContact O-CB 3.3Å; S1469-R1473 WeakPolarHBondContact O-CB 3.39Å; S1469-R1473 PolarHBondContact O-N 2.93Å |
| 1470 | A | 82.3 | Confident | 83.6 | Confident | 76.6 Ų | 76.6 | 49.1 Ų | 49.1 | 63% | 0.633 | 26% | 0.26 | S | S | * | . | H | α-helix | trans | -58.3 | -41.9 | -177.8 | 0 | 0 | 0 | 0 | 0 | 112.9 | R1473 R1474 | A1470-R1473 PolarHBondContact O-N 3.2Å; A1470-R1474 WeakPolarHBondContact O-CB 3.36Å; A1470-R1474 PolarHBondContact O-N 3.28Å |
| 1471 | S | 83.5 | Confident | 84.2 | Confident | 45.4 Ų | 45.4 | 45.5 Ų | 45.5 | 32% | 0.317 | 24% | 0.242 | S | C | . | . | H | α-helix | trans | -60.9 | -47.5 | 175.8 | 160.6 | 0 | 0 | 0 | 0 | 111.9 | K1375 S1469 R1473 R1474 G1475 | K1375-S1471 PolarHBondContact O-OG 2.84Å; S1469-S1471 VanDerWaalsContact C-N 3.31Å; S1469-S1471 PolarHBondContact O-N 3.26Å; S1469-S1471 PolarHBondContact OG-OG 2.94Å; S1469-S1471 VanDerWaalsContact OG-OG 3.1Å; S1471-R1473 PolarHBondContact O-N 3.29Å; S1471-R1474 WeakPolarHBondContact O-CB 3.37Å; S1471-R1474 PolarHBondContact O-N 3.06Å; S1471-G1475 PolarHBondContact O-N 3.13Å |
| 1472 | I | 87.3 | Confident | 84.9 | Confident | 2.2 Ų | 2.2 | 42.1 Ų | 42.1 | 1% | 0.011 | 23% | 0.229 | C | C | . | . | H | α-helix | trans | -67.7 | -42 | -178.6 | -65.2 | 171.4 | 0 | 0 | 0 | 110.8 | T1369 T1370 P1468 S1469 R1474 G1475 L1476 | T1369-I1472 HydrophobicContact CG2-CG2 3.95Å; T1369-I1472 WeakPolarHBondContact O-CD1 3.23Å; T1370-I1472 HydrophobicContact CG2-CD1 4.49Å; T1370-I1472 WeakPolarHBondContact O-CD1 3.38Å; P1468-I1472 HydrophobicContact CB-CB 4.24Å; P1468-I1472 HydrophobicContact CB-CG2 3.9Å; S1469-I1472 PolarHBondContact O-N 3.08Å; S1469-I1472 WeakPolarHBondContact OG-CB 3.43Å; S1469-I1472 VanDerWaalsContact OG-CD1 3.25Å; S1469-I1472 WeakPolarHBondContact OG-CD1 3.38Å; S1469-I1472 VanDerWaalsContact OG-CG1 3.25Å; S1469-I1472 WeakPolarHBondContact OG-CG1 3.32Å; S1469-I1472 PolarHBondContact OG-N 3.1Å; I1472-R1474 VanDerWaalsContact C-N 3.26Å; I1472-R1474 PolarHBondContact O-N 3.05Å; I1472-G1475 WeakPolarHBondContact O-CA 3.33Å; I1472-G1475 PolarHBondContact O-N 3.04Å; I1472-G1475 VanDerWaalsContact O-N 3.12Å; I1472-L1476 HydrophobicContact CG2-CD1 4.06Å; I1472-L1476 HydrophobicContact CG2-CG 4.32Å; I1472-L1476 WeakPolarHBondContact O-CG 3.4Å; I1472-L1476 PolarHBondContact O-N 3.14Å |
| 1473 | R | 87.3 | Confident | 85.8 | Confident | 115 Ų | 115 | 41.1 Ų | 41.1 | 43% | 0.434 | 22% | 0.218 | S | C | . | . | H | α-helix | trans | -59.8 | -39.7 | 175.9 | -162.4 | -173.5 | -47.3 | 162.3 | 7.8 | 111.5 | P1468 S1469 A1470 S1471 M1477 | P1468-R1473 HydrophobicContact CB-CB 4.48Å; P1468-R1473 HydrophobicContact CG-CB 4.5Å; P1468-R1473 PolarHBondContact O-NH2 3.15Å; P1468-R1473 VanDerWaalsContact O-NH2 3.16Å; S1469-R1473 VanDerWaalsContact O-CB 3.3Å; S1469-R1473 WeakPolarHBondContact O-CB 3.39Å; S1469-R1473 PolarHBondContact O-N 2.93Å; A1470-R1473 PolarHBondContact O-N 3.2Å; S1471-R1473 PolarHBondContact O-N 3.29Å; R1473-M1477 WeakPolarHBondContact O-CB 3.26Å; R1473-M1477 PolarHBondContact O-N 3.28Å |
| 1474 | R | 87 | Confident | 86.2 | Confident | 37.2 Ų | 37.2 | 41.9 Ų | 41.9 | 14% | 0.14 | 22% | 0.222 | C | C | . | . | H | α-helix | trans | -64.3 | -44.7 | 173.4 | -180 | 58.4 | 170.5 | 165.3 | 6.5 | 111.5 | E1378 A1470 S1471 I1472 M1477 L1478 | E1378-R1474 IonicContact OE1-CZ 3.29Å; E1378-R1474 IonicContact OE1-NE 3.66Å; E1378-R1474 IonicContact OE1-NH2 3.18Å; E1378-R1474 PolarHBondContact OE1-NH2 3.06Å; E1378-R1474 VanDerWaalsContact OE1-NH2 3.12Å; E1378-R1474 WeakPolarHBondContact OE2-CG 3.22Å; E1378-R1474 IonicContact OE2-CZ 3.52Å; E1378-R1474 IonicContact OE2-NE 2.75Å; E1378-R1474 PolarHBondContact OE2-NE 3.04Å; E1378-R1474 IonicContact OE2-NH2 3.36Å; E1378-R1474 PolarHBondContact OE2-NH2 3.17Å; A1470-R1474 WeakPolarHBondContact O-CB 3.36Å; A1470-R1474 PolarHBondContact O-N 3.28Å; S1471-R1474 WeakPolarHBondContact O-CB 3.37Å; S1471-R1474 PolarHBondContact O-N 3.06Å; I1472-R1474 VanDerWaalsContact C-N 3.26Å; I1472-R1474 PolarHBondContact O-N 3.05Å; R1474-M1477 WeakPolarHBondContact O-CB 3.31Å; R1474-M1477 PolarHBondContact O-N 3.39Å; R1474-L1478 HydrophobicContact CG-CD1 4.4Å; R1474-L1478 WeakPolarHBondContact O-CG 3.41Å; R1474-L1478 PolarHBondContact O-N 2.97Å |
| 1475 | G | 89.3 | Confident | 86.7 | Confident | 0.2 Ų | 0.2 | 43.1 Ų | 43.1 | 0% | 0.002 | 23% | 0.226 | C | C | . | . | H | α-helix | trans | -57 | -50 | 173.4 | 0 | 0 | 0 | 0 | 0 | 112.7 | S1471 I1472 M1477 L1478 V1479 | S1471-G1475 PolarHBondContact O-N 3.13Å; I1472-G1475 WeakPolarHBondContact O-CA 3.33Å; I1472-G1475 PolarHBondContact O-N 3.04Å; I1472-G1475 VanDerWaalsContact O-N 3.12Å; G1475-M1477 VanDerWaalsContact C-N 3.29Å; G1475-M1477 PolarHBondContact O-N 3.14Å; G1475-L1478 PolarHBondContact O-N 3.32Å; G1475-L1478 VanDerWaalsContact O-N 3.09Å; G1475-V1479 WeakPolarHBondContact O-CG2 3.33Å; G1475-V1479 PolarHBondContact O-N 3.09Å |
| 1476 | L | 90.8 | Very high | 87.5 | Confident | 0.8 Ų | 0.8 | 36.8 Ų | 36.8 | 0% | 0.004 | 19% | 0.193 | C | C | . | . | H | α-helix | trans | -61.2 | -35.5 | 177.1 | -66.7 | 172.3 | 0 | 0 | 0 | 112.6 | F1365 T1369 L1400 I1455 P1458 P1468 I1472 V1479 S1480 | F1365-L1476 HydrophobicContact CE1-CD2 4.07Å; T1369-L1476 HydrophobicContact CG2-CD2 4.46Å; L1400-L1476 HydrophobicContact CD2-CD2 4.47Å; I1455-L1476 HydrophobicContact CG2-CB 4.31Å; I1455-L1476 HydrophobicContact CG2-CD2 4.02Å; P1458-L1476 HydrophobicContact CG-CD1 4.5Å; P1468-L1476 HydrophobicContact CB-CD1 4.45Å; P1468-L1476 HydrophobicContact CG-CD1 4.34Å; I1472-L1476 HydrophobicContact CG2-CD1 4.06Å; I1472-L1476 HydrophobicContact CG2-CG 4.32Å; I1472-L1476 WeakPolarHBondContact O-CG 3.4Å; I1472-L1476 PolarHBondContact O-N 3.14Å; L1476-V1479 PolarHBondContact O-N 3.28Å; L1476-S1480 WeakPolarHBondContact O-CB 3.27Å; L1476-S1480 PolarHBondContact O-N 3.19Å |
| 1477 | M | 90.3 | Very high | 88.1 | Confident | 73 Ų | 73 | 32.8 Ų | 32.8 | 36% | 0.36 | 17% | 0.168 | S | C | . | . | H | α-helix | trans | -64.3 | -44.2 | 173.1 | -169.9 | -159.1 | -59.9 | 0 | 0 | 111.9 | R1473 R1474 G1475 S1480 K1481 | R1473-M1477 WeakPolarHBondContact O-CB 3.26Å; R1473-M1477 PolarHBondContact O-N 3.28Å; R1474-M1477 WeakPolarHBondContact O-CB 3.31Å; R1474-M1477 PolarHBondContact O-N 3.39Å; G1475-M1477 VanDerWaalsContact C-N 3.29Å; G1475-M1477 PolarHBondContact O-N 3.14Å; M1477-S1480 WeakPolarHBondContact O-CB 3.39Å; M1477-S1480 PolarHBondContact O-N 3.01Å; M1477-S1480 PolarHBondContact O-OG 3.1Å; M1477-K1481 WeakPolarHBondContact O-CG 3.23Å; M1477-K1481 PolarHBondContact O-N 3.24Å; M1477-K1481 VanDerWaalsContact O-N 3.12Å |
| 1478 | L | 90.7 | Very high | 88.5 | Confident | 0.2 Ų | 0.2 | 27.7 Ų | 27.7 | 0% | 0.001 | 15% | 0.151 | C | C | . | . | H | α-helix | trans | -66.6 | -39.3 | 177.1 | -69.1 | 168.4 | 0 | 0 | 0 | 111.7 | Y1377 V1379 L1397 R1474 G1475 S1480 K1481 I1482 | Y1377-L1478 VanDerWaalsContact O-CD1 3.28Å; Y1377-L1478 WeakPolarHBondContact O-CD1 3.32Å; V1379-L1478 HydrophobicContact CG2-CD1 4.11Å; V1379-L1478 HydrophobicContact CG2-CD2 4.41Å; L1397-L1478 HydrophobicContact CD1-CB 3.99Å; L1397-L1478 HydrophobicContact CD1-CD1 4.43Å; L1397-L1478 HydrophobicContact CD2-CB 3.98Å; L1397-L1478 HydrophobicContact CD2-CD1 4.3Å; R1474-L1478 HydrophobicContact CG-CD1 4.4Å; R1474-L1478 WeakPolarHBondContact O-CG 3.41Å; R1474-L1478 PolarHBondContact O-N 2.97Å; G1475-L1478 PolarHBondContact O-N 3.32Å; G1475-L1478 VanDerWaalsContact O-N 3.09Å; L1478-S1480 VanDerWaalsContact C-N 3.32Å; L1478-S1480 PolarHBondContact O-N 3.22Å; L1478-K1481 WeakPolarHBondContact O-CB 3.38Å; L1478-K1481 PolarHBondContact O-N 3.14Å; L1478-K1481 VanDerWaalsContact O-N 3.13Å; L1478-I1482 WeakPolarHBondContact O-CG1 3.43Å; L1478-I1482 PolarHBondContact O-N 2.97Å |
| 1479 | V | 92.4 | Very high | 88.6 | Confident | 0 Ų | 0 | 30.9 Ų | 30.9 | 0% | 0 | 17% | 0.166 | C | C | . | . | H | α-helix | trans | -56 | -49.4 | 172.5 | 169.1 | 0 | 0 | 0 | 0 | 110.7 | L1397 L1400 V1401 I1404 I1455 G1475 L1476 K1481 I1482 L1483 | L1397-V1479 HydrophobicContact CD1-CG2 4.05Å; L1400-V1479 HydrophobicContact CB-CG2 4.33Å; L1400-V1479 HydrophobicContact CD2-CB 4.38Å; L1400-V1479 HydrophobicContact CD2-CG2 3.48Å; L1400-V1479 HydrophobicContact CG-CG2 4.26Å; V1401-V1479 HydrophobicContact CG2-CB 4.22Å; V1401-V1479 HydrophobicContact CG2-CG1 4.22Å; V1401-V1479 HydrophobicContact CG2-CG2 3.88Å; I1404-V1479 HydrophobicContact CG2-CG1 3.76Å; I1455-V1479 HydrophobicContact CG2-CG1 4.38Å; G1475-V1479 WeakPolarHBondContact O-CG2 3.33Å; G1475-V1479 PolarHBondContact O-N 3.09Å; L1476-V1479 PolarHBondContact O-N 3.28Å; V1479-K1481 VanDerWaalsContact C-N 3.3Å; V1479-K1481 PolarHBondContact O-N 3.23Å; V1479-I1482 PolarHBondContact O-N 3.36Å; V1479-L1483 HydrophobicContact CG1-CD1 3.86Å; V1479-L1483 HydrophobicContact CG1-CG 4.27Å; V1479-L1483 WeakPolarHBondContact O-CB 3.39Å; V1479-L1483 VanDerWaalsContact O-CG 3.31Å; V1479-L1483 WeakPolarHBondContact O-CG 3.33Å; V1479-L1483 PolarHBondContact O-N 3.1Å |
| 1480 | S | 92.6 | Very high | 88 | Confident | 18.2 Ų | 18.2 | 30 Ų | 30 | 13% | 0.127 | 16% | 0.161 | C | C | . | . | H | α-helix | trans | -57 | -42.1 | 176.6 | 146.6 | 0 | 0 | 0 | 0 | 112.3 | N1452 V1456 L1476 M1477 L1478 L1483 Q1484 | N1452-S1480 VanDerWaalsContact CB-OG 3.29Å; N1452-S1480 WeakPolarHBondContact CB-OG 3.24Å; N1452-S1480 VanDerWaalsContact CG-OG 3.3Å; N1452-S1480 PolarHBondContact ND2-O 3.12Å; N1452-S1480 WeakPolarHBondContact OD1-CA 3.29Å; N1452-S1480 PolarHBondContact OD1-O 2.99Å; V1456-S1480 VanDerWaalsContact CG2-CB 3.44Å; V1456-S1480 WeakPolarHBondContact CG2-OG 3.45Å; L1476-S1480 WeakPolarHBondContact O-CB 3.27Å; L1476-S1480 PolarHBondContact O-N 3.19Å; M1477-S1480 WeakPolarHBondContact O-CB 3.39Å; M1477-S1480 PolarHBondContact O-N 3.01Å; M1477-S1480 PolarHBondContact O-OG 3.1Å; L1478-S1480 VanDerWaalsContact C-N 3.32Å; L1478-S1480 PolarHBondContact O-N 3.22Å; S1480-L1483 PolarHBondContact O-N 3.11Å; S1480-Q1484 VanDerWaalsContact O-CB 3.32Å; S1480-Q1484 WeakPolarHBondContact O-CB 3.41Å; S1480-Q1484 PolarHBondContact O-N 3.22Å |
| 1481 | K | 89.7 | Confident | 87.2 | Confident | 55.6 Ų | 55.6 | 36.2 Ų | 36.2 | 24% | 0.242 | 18% | 0.177 | C | C | . | . | H | α-helix | trans | -63.6 | -45.7 | 176.5 | -72.6 | -172.4 | 176.2 | -160.6 | 0 | 112.2 | M1477 L1478 V1479 Q1484 Q1485 E1495 L1498 | M1477-K1481 WeakPolarHBondContact O-CG 3.23Å; M1477-K1481 PolarHBondContact O-N 3.24Å; M1477-K1481 VanDerWaalsContact O-N 3.12Å; L1478-K1481 WeakPolarHBondContact O-CB 3.38Å; L1478-K1481 PolarHBondContact O-N 3.14Å; L1478-K1481 VanDerWaalsContact O-N 3.13Å; V1479-K1481 VanDerWaalsContact C-N 3.3Å; V1479-K1481 PolarHBondContact O-N 3.23Å; K1481-Q1484 PolarHBondContact O-N 3.13Å; K1481-Q1485 WeakPolarHBondContact O-CG 3.4Å; K1481-Q1485 PolarHBondContact O-N 3.14Å; K1481-E1495 IonicContact NZ-OE1 3.56Å; K1481-E1495 PolarHBondContact NZ-OE1 3.13Å; K1481-E1495 IonicContact NZ-OE2 3.13Å; K1481-E1495 PolarHBondContact NZ-OE2 3.12Å; K1481-L1498 HydrophobicContact CB-CD1 4.27Å; K1481-L1498 HydrophobicContact CD-CD1 4.43Å |
| 1482 | I | 91.1 | Very high | 86.4 | Confident | 0 Ų | 0 | 38 Ų | 38 | 0% | 0 | 19% | 0.19 | C | C | . | . | H | α-helix | trans | -64.3 | -46.9 | 179.4 | -65.5 | 168.7 | 0 | 0 | 0 | 110 | L1397 V1401 L1478 V1479 Q1484 Q1485 I1486 L1498 F1501 F1504 I1505 | L1397-I1482 HydrophobicContact CD1-CD1 4.4Å; L1397-I1482 HydrophobicContact CD2-CD1 3.65Å; L1397-I1482 HydrophobicContact CG-CD1 4.07Å; V1401-I1482 HydrophobicContact CG1-CB 4.49Å; V1401-I1482 HydrophobicContact CG1-CG2 3.92Å; V1401-I1482 HydrophobicContact CG2-CB 4.16Å; V1401-I1482 HydrophobicContact CG2-CD1 3.92Å; V1401-I1482 HydrophobicContact CG2-CG2 4.16Å; L1478-I1482 WeakPolarHBondContact O-CG1 3.43Å; L1478-I1482 PolarHBondContact O-N 2.97Å; V1479-I1482 PolarHBondContact O-N 3.36Å; I1482-Q1484 VanDerWaalsContact C-N 3.29Å; I1482-Q1484 PolarHBondContact O-N 3.19Å; I1482-Q1485 WeakPolarHBondContact O-CB 3.41Å; I1482-Q1485 PolarHBondContact O-N 3.27Å; I1482-Q1485 VanDerWaalsContact O-N 3.09Å; I1482-I1486 HydrophobicContact CG2-CD1 4.12Å; I1482-I1486 VanDerWaalsContact O-CG1 3.3Å; I1482-I1486 WeakPolarHBondContact O-CG1 3.39Å; I1482-I1486 PolarHBondContact O-N 3.01Å; I1482-L1498 HydrophobicContact CD1-CD2 4.2Å; I1482-L1498 HydrophobicContact CG1-CD2 3.85Å; I1482-F1501 HydrophobicContact CD1-CD1 3.88Å; I1482-F1501 HydrophobicContact CD1-CD2 4.47Å; I1482-F1501 HydrophobicContact CD1-CE1 4.05Å; I1482-F1501 HydrophobicContact CD1-CG 4.15Å; I1482-F1501 HydrophobicContact CD1-CZ 4.42Å; I1482-F1504 HydrophobicContact CG2-CE1 4.41Å; I1482-I1505 HydrophobicContact CG2-CD1 4.31Å; I1482-I1505 HydrophobicContact CG2-CG1 3.94Å |
| 1483 | L | 92.6 | Very high | 85.5 | Confident | 0.8 Ų | 0.8 | 38.8 Ų | 38.8 | 0% | 0.004 | 20% | 0.195 | C | C | . | . | H | α-helix | trans | -58.5 | -40.3 | 175.5 | -70.5 | 176.9 | 0 | 0 | 0 | 112.1 | V1401 I1404 L1405 F1447 I1455 V1479 S1480 Q1485 I1486 A1487 | V1401-L1483 HydrophobicContact CG1-CD2 4.11Å; V1401-L1483 HydrophobicContact CG1-CG 4.49Å; I1404-L1483 HydrophobicContact CG2-CD1 4.03Å; I1404-L1483 HydrophobicContact CG2-CD2 4.5Å; L1405-L1483 HydrophobicContact CB-CD2 4.22Å; L1405-L1483 HydrophobicContact CD1-CD2 3.9Å; L1405-L1483 HydrophobicContact CG-CD2 4.5Å; F1447-L1483 HydrophobicContact CD1-CB 4.05Å; F1447-L1483 HydrophobicContact CE1-CB 4.3Å; F1447-L1483 HydrophobicContact CE1-CD1 4.47Å; F1447-L1483 HydrophobicContact CE1-CD2 4.28Å; I1455-L1483 HydrophobicContact CD1-CD1 3.78Å; V1479-L1483 HydrophobicContact CG1-CD1 3.86Å; V1479-L1483 HydrophobicContact CG1-CG 4.27Å; V1479-L1483 WeakPolarHBondContact O-CB 3.39Å; V1479-L1483 VanDerWaalsContact O-CG 3.31Å; V1479-L1483 WeakPolarHBondContact O-CG 3.33Å; V1479-L1483 PolarHBondContact O-N 3.1Å; S1480-L1483 PolarHBondContact O-N 3.11Å; L1483-Q1485 VanDerWaalsContact C-N 3.35Å; L1483-Q1485 PolarHBondContact O-N 3.19Å; L1483-I1486 HydrophobicContact CD2-CD1 4.45Å; L1483-I1486 PolarHBondContact O-N 3.17Å; L1483-A1487 WeakPolarHBondContact O-CB 3.49Å; L1483-A1487 PolarHBondContact O-N 3.02Å |
| 1484 | Q | 90.6 | Very high | 84.6 | Confident | 21.6 Ų | 21.6 | 41.7 Ų | 41.7 | 10% | 0.101 | 21% | 0.21 | C | C | . | . | H | α-helix | trans | -65.8 | -38.1 | 176.2 | -166.7 | 62.2 | 53.6 | 0 | 0 | 112.2 | M1444 L1448 N1452 S1480 K1481 I1482 I1486 A1487 N1488 | M1444-Q1484 PolarHBondContact O-NE2 3.04Å; L1448-Q1484 VanDerWaalsContact CB-OE1 3.3Å; L1448-Q1484 VanDerWaalsContact N-OE1 3.14Å; N1452-Q1484 PolarHBondContact ND2-OE1 3.11Å; N1452-Q1484 VanDerWaalsContact ND2-OE1 3.07Å; S1480-Q1484 VanDerWaalsContact O-CB 3.32Å; S1480-Q1484 WeakPolarHBondContact O-CB 3.41Å; S1480-Q1484 PolarHBondContact O-N 3.22Å; K1481-Q1484 PolarHBondContact O-N 3.13Å; I1482-Q1484 VanDerWaalsContact C-N 3.29Å; I1482-Q1484 PolarHBondContact O-N 3.19Å; Q1484-I1486 VanDerWaalsContact C-N 3.34Å; Q1484-A1487 PolarHBondContact O-N 3.17Å; Q1484-N1488 PolarHBondContact NE2-OD1 3.14Å; Q1484-N1488 WeakPolarHBondContact O-CB 3.31Å; Q1484-N1488 PolarHBondContact O-N 3.05Å; Q1484-N1488 PolarHBondContact O-ND2 3.05Å; Q1484-N1488 PolarHBondContact O-OD1 3.17Å |
| 1485 | Q | 89 | Confident | 84 | Confident | 34 Ų | 34 | 43 Ų | 43 | 16% | 0.159 | 22% | 0.218 | C | C | . | . | H | α-helix | trans | -65.1 | -39.5 | 174.6 | -69.7 | -65.1 | -10.2 | 0 | 0 | 111.8 | K1481 I1482 L1483 A1487 N1488 Q1489 L1498 I1505 | K1481-Q1485 WeakPolarHBondContact O-CG 3.4Å; K1481-Q1485 PolarHBondContact O-N 3.14Å; I1482-Q1485 WeakPolarHBondContact O-CB 3.41Å; I1482-Q1485 PolarHBondContact O-N 3.27Å; I1482-Q1485 VanDerWaalsContact O-N 3.09Å; L1483-Q1485 VanDerWaalsContact C-N 3.35Å; L1483-Q1485 PolarHBondContact O-N 3.19Å; Q1485-A1487 VanDerWaalsContact C-N 3.33Å; Q1485-A1487 PolarHBondContact O-N 3.08Å; Q1485-N1488 PolarHBondContact O-N 3.19Å; Q1485-Q1489 PolarHBondContact O-N 3.36Å; Q1485-L1498 HydrophobicContact CG-CD1 4.47Å; Q1485-I1505 HydrophobicContact CB-CD1 4.09Å; Q1485-I1505 HydrophobicContact CB-CG2 4.28Å |
| 1486 | I | 90.9 | Very high | 83.3 | Confident | 1.6 Ų | 1.6 | 49.6 Ų | 49.6 | 1% | 0.008 | 25% | 0.253 | C | S | . | . | H | α-helix | trans | -59.5 | -47.6 | 173.1 | -62.2 | 167.1 | 0 | 0 | 0 | 110.3 | V1401 L1405 I1482 L1483 Q1484 N1488 Q1489 F1504 I1505 K1508 Y1509 V1512 | V1401-I1486 HydrophobicContact CG1-CD1 4.44Å; L1405-I1486 HydrophobicContact CD2-CD1 4.39Å; I1482-I1486 HydrophobicContact CG2-CD1 4.12Å; I1482-I1486 VanDerWaalsContact O-CG1 3.3Å; I1482-I1486 WeakPolarHBondContact O-CG1 3.39Å; I1482-I1486 PolarHBondContact O-N 3.01Å; L1483-I1486 HydrophobicContact CD2-CD1 4.45Å; L1483-I1486 PolarHBondContact O-N 3.17Å; Q1484-I1486 VanDerWaalsContact C-N 3.34Å; I1486-N1488 VanDerWaalsContact C-N 3.33Å; I1486-N1488 PolarHBondContact O-N 3.14Å; I1486-Q1489 PolarHBondContact O-N 3Å; I1486-F1504 HydrophobicContact CD1-CE1 4.43Å; I1486-I1505 HydrophobicContact CG1-CB 4.22Å; I1486-I1505 HydrophobicContact CG1-CG1 4.13Å; I1486-I1505 HydrophobicContact CG1-CG2 3.92Å; I1486-K1508 HydrophobicContact CD1-CB 4.11Å; I1486-K1508 HydrophobicContact CD1-CG 4.34Å; I1486-K1508 HydrophobicContact CG1-CB 4.4Å; I1486-K1508 HydrophobicContact CG2-CB 3.84Å; I1486-Y1509 HydrophobicContact CG2-CD1 4.32Å; I1486-Y1509 WeakPolarHBondContact O-CD1 3.41Å; I1486-V1512 HydrophobicContact CG2-CB 4.07Å; I1486-V1512 HydrophobicContact CG2-CG1 4.44Å; I1486-V1512 HydrophobicContact CG2-CG2 3.53Å; I1486-V1512 VanDerWaalsContact CG2-CG2 3.49Å |
| 1487 | A | 89.4 | Confident | 82.6 | Confident | 3.6 Ų | 3.6 | 50.8 Ų | 50.8 | 3% | 0.03 | 26% | 0.261 | C | S | . | . | H | α-helix | trans | -66.8 | -32.2 | 179.7 | 0 | 0 | 0 | 0 | 0 | 113.7 | M1444 F1447 L1483 Q1484 Q1485 Q1489 | M1444-A1487 WeakPolarHBondContact CG-O 3.29Å; F1447-A1487 HydrophobicContact CB-CB 3.82Å; F1447-A1487 HydrophobicContact CD2-CB 3.68Å; F1447-A1487 HydrophobicContact CE2-CB 4.44Å; F1447-A1487 HydrophobicContact CG-CB 3.82Å; L1483-A1487 WeakPolarHBondContact O-CB 3.49Å; L1483-A1487 PolarHBondContact O-N 3.02Å; Q1484-A1487 PolarHBondContact O-N 3.17Å; Q1485-A1487 VanDerWaalsContact C-N 3.33Å; Q1485-A1487 PolarHBondContact O-N 3.08Å; A1487-Q1489 VanDerWaalsContact C-N 3.31Å; A1487-Q1489 PolarHBondContact O-N 3.01Å |
| 1488 | N | 86.7 | Confident | 82.2 | Confident | 40 Ų | 40 | 47.4 Ų | 47.4 | 21% | 0.214 | 24% | 0.244 | C | C | . | . | H | α-helix | trans | -75.7 | -16.2 | 179.1 | -68.5 | -12 | 0 | 0 | 0 | 113.6 | M1444 Q1484 Q1485 I1486 A1490 | M1444-N1488 VanDerWaalsContact CG-OD1 3.31Å; M1444-N1488 WeakPolarHBondContact CG-OD1 3.32Å; M1444-N1488 HydrophobicContact SD-CB 4.49Å; M1444-N1488 PolarHBondContact SD-OD1 3.19Å; Q1484-N1488 PolarHBondContact NE2-OD1 3.14Å; Q1484-N1488 WeakPolarHBondContact O-CB 3.31Å; Q1484-N1488 PolarHBondContact O-N 3.05Å; Q1484-N1488 PolarHBondContact O-ND2 3.05Å; Q1484-N1488 PolarHBondContact O-OD1 3.17Å; Q1485-N1488 PolarHBondContact O-N 3.19Å; I1486-N1488 VanDerWaalsContact C-N 3.33Å; I1486-N1488 PolarHBondContact O-N 3.14Å; N1488-A1490 HydrophobicContact CB-CB 4.39Å; N1488-A1490 PolarHBondContact O-N 3.04Å; N1488-A1490 VanDerWaalsContact O-N 3.12Å |
| 1489 | Q | 84.2 | Confident | 81.7 | Confident | 73 Ų | 73 | 52.7 Ų | 52.7 | 34% | 0.341 | 27% | 0.269 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 50.6 | 36.4 | -174.1 | -58 | -176.4 | -10.5 | 0 | 0 | 113.1 | L1440 Q1485 I1486 A1487 Q1491 Y1509 | L1440-Q1489 HydrophobicContact CD1-CB 4.06Å; L1440-Q1489 HydrophobicContact CD1-CG 3.93Å; Q1485-Q1489 PolarHBondContact O-N 3.36Å; I1486-Q1489 PolarHBondContact O-N 3Å; A1487-Q1489 VanDerWaalsContact C-N 3.31Å; A1487-Q1489 PolarHBondContact O-N 3.01Å; Q1489-Q1491 PolarHBondContact O-N 3.23Å; Q1489-Y1509 HydrophobicContact CB-CD2 4.48Å; Q1489-Y1509 HydrophobicContact CB-CE2 4.49Å; Q1489-Y1509 HydrophobicContact CG-CD1 4.3Å; Q1489-Y1509 HydrophobicContact CG-CG 4.32Å |
| 1490 | A | 70.7 | Confident | 81.3 | Confident | 30.2 Ų | 30.2 | 56.8 Ų | 56.8 | 25% | 0.25 | 30% | 0.296 | C | S | . | . | trans | -70.3 | 134.8 | -173.5 | 0 | 0 | 0 | 0 | 0 | 111.4 | N1488 S1492 Y1509 | N1488-A1490 HydrophobicContact CB-CB 4.39Å; N1488-A1490 PolarHBondContact O-N 3.04Å; N1488-A1490 VanDerWaalsContact O-N 3.12Å; A1490-S1492 VanDerWaalsContact C-N 3.27Å; A1490-S1492 PolarHBondContact O-N 3.21Å; A1490-Y1509 PolarHBondContact N-OH 3.44Å; A1490-Y1509 PolarHBondContact O-OH 3.16Å | ||
| 1491 | Q | 66 | Low | 80.9 | Confident | 207 Ų | 207 | 55.9 Ų | 55.9 | 97% | 0.967 | 29% | 0.29 | S | S | * | . | S | Bend | trans | -70.1 | -20.7 | 178.3 | -71.8 | -177.8 | -6.2 | 0 | 0 | 113.4 | Q1489 | Q1489-Q1491 PolarHBondContact O-N 3.23Š|
| 1492 | S | 66.2 | Low | 80.7 | Confident | 83.6 Ų | 83.6 | 54.8 Ų | 54.8 | 59% | 0.585 | 29% | 0.289 | S | S | * | . | S | Bend | trans | -138.6 | 132.9 | 179.8 | 63 | 0 | 0 | 0 | 0 | 112 | A1490 K1494 | A1490-S1492 VanDerWaalsContact C-N 3.27Å; A1490-S1492 PolarHBondContact O-N 3.21Å; S1492-K1494 PolarHBondContact O-N 3.38Å |
| 1493 | V | 68.3 | Low | 80.5 | Confident | 19.6 Ų | 19.6 | 59.5 Ų | 59.5 | 12% | 0.119 | 31% | 0.314 | C | S | . | . | trans | -79 | 123.4 | 173.5 | -176.1 | 0 | 0 | 0 | 0 | 108.6 | L1498 S1502 I1505 | V1493-L1498 HydrophobicContact CG1-CB 3.42Å; V1493-L1498 VanDerWaalsContact CG1-CB 3.45Å; V1493-L1498 HydrophobicContact CG1-CD1 4.43Å; V1493-S1502 WeakPolarHBondContact CG2-OG 3.31Å; V1493-I1505 HydrophobicContact CG2-CD1 4.22Å | ||
| 1494 | K | 68.9 | Low | 80.3 | Confident | 176.2 Ų | 176.2 | 60.8 Ų | 60.8 | 77% | 0.766 | 32% | 0.32 | S | S | * | . | trans | -80.5 | -25.4 | -174.9 | -69.6 | -173.4 | 177.4 | -175.6 | 0 | 114.6 | S1492 | S1492-K1494 PolarHBondContact O-N 3.38Š| ||
| 1495 | E | 74.2 | Confident | 80.2 | Confident | 64 Ų | 64 | 59.8 Ų | 59.8 | 30% | 0.299 | 32% | 0.315 | S | S | . | . | S | Bend | trans | -97.4 | 123.1 | -177.3 | -70 | -178.4 | -169 | 0 | 0 | 110.2 | K1481 C1497 L1498 H1499 | K1481-E1495 IonicContact NZ-OE1 3.56Å; K1481-E1495 PolarHBondContact NZ-OE1 3.13Å; K1481-E1495 IonicContact NZ-OE2 3.13Å; K1481-E1495 PolarHBondContact NZ-OE2 3.12Å; E1495-C1497 PolarHBondContact O-N 3.28Å; E1495-C1497 VanDerWaalsContact O-N 3.14Å; E1495-L1498 HydrophobicContact CB-CB 4.39Å; E1495-L1498 HydrophobicContact CB-CD1 4.16Å; E1495-L1498 HydrophobicContact CB-CG 4.22Å; E1495-L1498 PolarHBondContact O-N 3.12Å; E1495-L1498 WeakPolarHBondContact OE2-CD1 3.21Å; E1495-H1499 PolarHBondContact O-N 3.25Å |
| 1496 | N | 73.3 | Confident | 80.1 | Confident | 139.4 Ų | 139.4 | 65.1 Ų | 65.1 | 75% | 0.745 | 33% | 0.334 | S | S | * | . | G | 310 helix | trans | -56.4 | -34.9 | -178.1 | -68.8 | -11.9 | 0 | 0 | 0 | 112.9 | L1498 H1499 | N1496-L1498 PolarHBondContact O-N 3.11Å; N1496-H1499 WeakPolarHBondContact O-CB 3.39Å; N1496-H1499 PolarHBondContact O-N 3.3Å |
| 1497 | C | 77.7 | Confident | 80.1 | Confident | 24.8 Ų | 24.8 | 70.8 Ų | 70.8 | 17% | 0.168 | 36% | 0.364 | C | S | . | . | G | 310 helix | trans | -68.4 | -18 | 177.6 | 60.1 | 0 | 0 | 0 | 0 | 113.8 | V1379 D1380 E1495 P1500 | V1379-C1497 HydrophobicContact CG2-CB 4.49Å; D1380-C1497 HydrophobicContact CB-CB 4.3Å; E1495-C1497 PolarHBondContact O-N 3.28Å; E1495-C1497 VanDerWaalsContact O-N 3.14Å; C1497-P1500 WeakPolarHBondContact O-CD 3.44Å |
| 1498 | L | 80.8 | Confident | 80.2 | Confident | 1.4 Ų | 1.4 | 72.5 Ų | 72.5 | 1% | 0.007 | 37% | 0.371 | C | S | . | . | G | 310 helix | trans | -97.7 | -6.1 | 178.7 | -65.9 | 179.3 | 0 | 0 | 0 | 113 | K1481 I1482 Q1485 V1493 E1495 N1496 P1500 F1501 | K1481-L1498 HydrophobicContact CB-CD1 4.27Å; K1481-L1498 HydrophobicContact CD-CD1 4.43Å; I1482-L1498 HydrophobicContact CD1-CD2 4.2Å; I1482-L1498 HydrophobicContact CG1-CD2 3.85Å; Q1485-L1498 HydrophobicContact CG-CD1 4.47Å; V1493-L1498 HydrophobicContact CG1-CB 3.42Å; V1493-L1498 VanDerWaalsContact CG1-CB 3.45Å; V1493-L1498 HydrophobicContact CG1-CD1 4.43Å; E1495-L1498 HydrophobicContact CB-CB 4.39Å; E1495-L1498 HydrophobicContact CB-CD1 4.16Å; E1495-L1498 HydrophobicContact CB-CG 4.22Å; E1495-L1498 PolarHBondContact O-N 3.12Å; E1495-L1498 WeakPolarHBondContact OE2-CD1 3.21Å; N1496-L1498 PolarHBondContact O-N 3.11Å; L1498-P1500 VanDerWaalsContact C-N 3.32Å; L1498-F1501 HydrophobicContact CD2-CD2 4.18Å; L1498-F1501 HydrophobicContact CD2-CE2 4.4Å; L1498-F1501 WeakPolarHBondContact O-CB 3.21Å; L1498-F1501 WeakPolarHBondContact O-CD2 3.35Å; L1498-F1501 PolarHBondContact O-N 3.17Å |
| 1499 | H | 81.1 | Confident | 80.3 | Confident | 111.6 Ų | 111.6 | 72.8 Ų | 72.8 | 52% | 0.517 | 37% | 0.369 | S | S | . | . | G | 310 helix | trans | -53.8 | -38.9 | 177.4 | -124.8 | -62.6 | 0 | 0 | 0 | 114.2 | E1495 N1496 F1501 S1502 | E1495-H1499 PolarHBondContact O-N 3.25Å; N1496-H1499 WeakPolarHBondContact O-CB 3.39Å; N1496-H1499 PolarHBondContact O-N 3.3Å; H1499-F1501 PolarHBondContact O-N 3.01Å; H1499-F1501 VanDerWaalsContact O-N 3.11Å; H1499-S1502 WeakPolarHBondContact O-CB 3.32Å; H1499-S1502 PolarHBondContact O-N 3.27Å; H1499-S1502 VanDerWaalsContact O-N 3.13Å; H1499-S1502 PolarHBondContact O-OG 3Å |
| 1500 | P | 82.4 | Confident | 80.6 | Confident | 85.8 Ų | 85.8 | 74.3 Ų | 74.3 | 56% | 0.557 | 38% | 0.376 | S | S | * | . | G | 310 helix | trans | -59.2 | -20 | 176 | -25.6 | 35.7 | 0 | 0 | 0 | 114.5 | T1394 C1497 L1498 | T1394-P1500 HydrophobicContact CG2-CB 4.49Å; C1497-P1500 WeakPolarHBondContact O-CD 3.44Å; L1498-P1500 VanDerWaalsContact C-N 3.32Å |
| 1501 | F | 85.8 | Confident | 81.6 | Confident | 0.4 Ų | 0.4 | 75.6 Ų | 75.6 | 0% | 0.002 | 38% | 0.381 | C | S | . | . | G | 310 helix | trans | -94.4 | 0.2 | -178.2 | -55.2 | -94.1 | 0 | 0 | 0 | 112.7 | V1379 T1394 L1397 I1398 I1482 L1498 H1499 D1503 F1504 I1505 | V1379-F1501 HydrophobicContact CB-CE2 4.48Å; V1379-F1501 HydrophobicContact CG1-CE2 4.43Å; V1379-F1501 HydrophobicContact CG1-CZ 4.08Å; V1379-F1501 HydrophobicContact CG2-CE2 4.34Å; T1394-F1501 HydrophobicContact CG2-CE1 3.93Å; T1394-F1501 HydrophobicContact CG2-CE2 4.36Å; T1394-F1501 HydrophobicContact CG2-CZ 3.7Å; L1397-F1501 HydrophobicContact CB-CE1 4.27Å; L1397-F1501 HydrophobicContact CB-CZ 4.37Å; L1397-F1501 HydrophobicContact CD2-CE1 3.92Å; L1397-F1501 HydrophobicContact CD2-CE2 4.38Å; L1397-F1501 HydrophobicContact CD2-CZ 3.62Å; L1397-F1501 HydrophobicContact CG-CE1 4.31Å; L1397-F1501 HydrophobicContact CG-CZ 4.41Å; I1398-F1501 HydrophobicContact CD1-CD1 4.38Å; I1398-F1501 HydrophobicContact CD1-CE1 4.36Å; I1398-F1501 HydrophobicContact CG1-CD1 3.81Å; I1398-F1501 HydrophobicContact CG1-CE1 3.68Å; I1482-F1501 HydrophobicContact CD1-CD1 3.88Å; I1482-F1501 HydrophobicContact CD1-CD2 4.47Å; I1482-F1501 HydrophobicContact CD1-CE1 4.05Å; I1482-F1501 HydrophobicContact CD1-CG 4.15Å; I1482-F1501 HydrophobicContact CD1-CZ 4.42Å; L1498-F1501 HydrophobicContact CD2-CD2 4.18Å; L1498-F1501 HydrophobicContact CD2-CE2 4.4Å; L1498-F1501 WeakPolarHBondContact O-CB 3.21Å; L1498-F1501 WeakPolarHBondContact O-CD2 3.35Å; L1498-F1501 PolarHBondContact O-N 3.17Å; H1499-F1501 PolarHBondContact O-N 3.01Å; H1499-F1501 VanDerWaalsContact O-N 3.11Å; F1501-D1503 VanDerWaalsContact C-N 3.34Å; F1501-D1503 PolarHBondContact O-N 3.08Å; F1501-F1504 WeakPolarHBondContact O-CB 3.47Å; F1501-F1504 PolarHBondContact O-N 2.92Å; F1501-F1504 VanDerWaalsContact O-N 3.14Å; F1501-I1505 HydrophobicContact CB-CD1 3.97Å; F1501-I1505 HydrophobicContact CB-CG1 4.3Å; F1501-I1505 WeakPolarHBondContact O-CB 3.34Å; F1501-I1505 VanDerWaalsContact O-CG1 3.25Å; F1501-I1505 WeakPolarHBondContact O-CG1 3.37Å; F1501-I1505 PolarHBondContact O-N 3.18Å |
| 1502 | S | 84.8 | Confident | 82.8 | Confident | 32.2 Ų | 32.2 | 65.9 Ų | 65.9 | 23% | 0.225 | 34% | 0.336 | C | S | . | . | H | α-helix | trans | -58.2 | -43.3 | -171.7 | -56 | 0 | 0 | 0 | 0 | 113 | V1493 H1499 I1505 R1506 | V1493-S1502 WeakPolarHBondContact CG2-OG 3.31Å; H1499-S1502 WeakPolarHBondContact O-CB 3.32Å; H1499-S1502 PolarHBondContact O-N 3.27Å; H1499-S1502 VanDerWaalsContact O-N 3.13Å; H1499-S1502 PolarHBondContact O-OG 3Å; S1502-I1505 PolarHBondContact O-N 3.08Å; S1502-R1506 WeakPolarHBondContact O-CB 3.41Å; S1502-R1506 PolarHBondContact O-N 3.15Å; S1502-R1506 VanDerWaalsContact O-N 3.1Å |
| 1503 | D | 86.3 | Confident | 83.9 | Confident | 99.4 Ų | 99.4 | 65.9 Ų | 65.9 | 53% | 0.532 | 33% | 0.325 | S | S | . | . | H | α-helix | trans | -67.5 | -46.1 | 178 | -69.7 | -37.3 | 0 | 0 | 0 | 111.2 | F1501 I1505 R1506 D1507 | F1501-D1503 VanDerWaalsContact C-N 3.34Å; F1501-D1503 PolarHBondContact O-N 3.08Å; D1503-I1505 VanDerWaalsContact C-N 3.32Å; D1503-I1505 PolarHBondContact O-N 3.07Å; D1503-R1506 PolarHBondContact O-N 3.27Å; D1503-R1506 IonicContact OD1-CZ 3.03Å; D1503-R1506 VanDerWaalsContact OD1-CZ 3.23Å; D1503-R1506 IonicContact OD1-NH1 3.64Å; D1503-R1506 PolarHBondContact OD1-NH1 3.19Å; D1503-R1506 IonicContact OD1-NH2 3.16Å; D1503-R1506 PolarHBondContact OD1-NH2 3.29Å; D1503-D1507 VanDerWaalsContact O-CG 3.28Å; D1503-D1507 PolarHBondContact O-N 3.18Å |
| 1504 | F | 88.7 | Confident | 85 | Confident | 28.4 Ų | 28.4 | 70.5 Ų | 70.5 | 13% | 0.125 | 35% | 0.345 | C | S | . | . | H | α-helix | trans | -57.4 | -44.4 | 175 | 175.1 | -96.3 | 0 | 0 | 0 | 112.1 | I1398 V1401 E1402 I1482 I1486 F1501 R1506 D1507 K1508 | I1398-F1504 HydrophobicContact CG2-CD2 4Å; I1398-F1504 HydrophobicContact CG2-CE2 3.8Å; I1398-F1504 HydrophobicContact CG2-CZ 4.3Å; V1401-F1504 HydrophobicContact CB-CE1 4.21Å; V1401-F1504 HydrophobicContact CB-CZ 4.38Å; V1401-F1504 HydrophobicContact CG1-CE1 3.69Å; V1401-F1504 HydrophobicContact CG1-CZ 4.06Å; E1402-F1504 HydrophobicContact CB-CE2 4.4Å; E1402-F1504 HydrophobicContact CB-CZ 4.32Å; E1402-F1504 WeakPolarHBondContact OE2-CE2 3.39Å; I1482-F1504 HydrophobicContact CG2-CE1 4.41Å; I1486-F1504 HydrophobicContact CD1-CE1 4.43Å; F1501-F1504 WeakPolarHBondContact O-CB 3.47Å; F1501-F1504 PolarHBondContact O-N 2.92Å; F1501-F1504 VanDerWaalsContact O-N 3.14Å; F1504-R1506 PolarHBondContact O-N 3.26Å; F1504-D1507 PolarHBondContact O-N 3.17Å; F1504-K1508 HydrophobicContact CE1-CG 4.49Å; F1504-K1508 VanDerWaalsContact CE2-CE 3.46Å; F1504-K1508 HydrophobicContact CZ-CG 4.39Å; F1504-K1508 WeakPolarHBondContact O-CG 3.41Å; F1504-K1508 PolarHBondContact O-N 3.06Å |
| 1505 | I | 88.1 | Confident | 86.1 | Confident | 0.6 Ų | 0.6 | 62.3 Ų | 62.3 | 0% | 0.003 | 31% | 0.31 | C | S | . | . | H | α-helix | trans | -61.1 | -46.3 | 178.9 | -72.9 | 165.6 | 0 | 0 | 0 | 110.6 | I1482 Q1485 I1486 V1493 F1501 S1502 D1503 D1507 K1508 Y1509 | I1482-I1505 HydrophobicContact CG2-CD1 4.31Å; I1482-I1505 HydrophobicContact CG2-CG1 3.94Å; Q1485-I1505 HydrophobicContact CB-CD1 4.09Å; Q1485-I1505 HydrophobicContact CB-CG2 4.28Å; I1486-I1505 HydrophobicContact CG1-CB 4.22Å; I1486-I1505 HydrophobicContact CG1-CG1 4.13Å; I1486-I1505 HydrophobicContact CG1-CG2 3.92Å; V1493-I1505 HydrophobicContact CG2-CD1 4.22Å; F1501-I1505 HydrophobicContact CB-CD1 3.97Å; F1501-I1505 HydrophobicContact CB-CG1 4.3Å; F1501-I1505 WeakPolarHBondContact O-CB 3.34Å; F1501-I1505 VanDerWaalsContact O-CG1 3.25Å; F1501-I1505 WeakPolarHBondContact O-CG1 3.37Å; F1501-I1505 PolarHBondContact O-N 3.18Å; S1502-I1505 PolarHBondContact O-N 3.08Å; D1503-I1505 VanDerWaalsContact C-N 3.32Å; D1503-I1505 PolarHBondContact O-N 3.07Å; I1505-D1507 VanDerWaalsContact C-N 3.32Å; I1505-D1507 PolarHBondContact O-N 2.96Å; I1505-K1508 PolarHBondContact O-N 3.21Å; I1505-Y1509 HydrophobicContact CG2-CD1 4.48Å; I1505-Y1509 HydrophobicContact CG2-CE1 3.49Å; I1505-Y1509 VanDerWaalsContact CG2-CE1 3.47Å; I1505-Y1509 WeakPolarHBondContact CG2-OH 3.42Å; I1505-Y1509 VanDerWaalsContact O-CD1 3.24Å; I1505-Y1509 WeakPolarHBondContact O-CD1 3.38Å; I1505-Y1509 VanDerWaalsContact O-CE1 3.28Å; I1505-Y1509 WeakPolarHBondContact O-CE1 3.4Å |
| 1506 | R | 87.4 | Confident | 87 | Confident | 144.8 Ų | 144.8 | 59.5 Ų | 59.5 | 55% | 0.546 | 30% | 0.297 | S | S | . | . | H | α-helix | trans | -63.3 | -39.6 | -179.5 | -178.2 | 174.1 | 58.6 | -161.8 | -6.2 | 112.2 | S1502 D1503 F1504 K1508 Y1509 | S1502-R1506 WeakPolarHBondContact O-CB 3.41Å; S1502-R1506 PolarHBondContact O-N 3.15Å; S1502-R1506 VanDerWaalsContact O-N 3.1Å; D1503-R1506 PolarHBondContact O-N 3.27Å; D1503-R1506 IonicContact OD1-CZ 3.03Å; D1503-R1506 VanDerWaalsContact OD1-CZ 3.23Å; D1503-R1506 IonicContact OD1-NH1 3.64Å; D1503-R1506 PolarHBondContact OD1-NH1 3.19Å; D1503-R1506 IonicContact OD1-NH2 3.16Å; D1503-R1506 PolarHBondContact OD1-NH2 3.29Å; F1504-R1506 PolarHBondContact O-N 3.26Å; R1506-K1508 PolarHBondContact O-N 3.29Å; R1506-Y1509 HydrophobicContact CB-CD2 4.48Å; R1506-Y1509 HydrophobicContact CB-CE2 4.23Å; R1506-Y1509 HydrophobicContact CG-CD2 4.26Å; R1506-Y1509 HydrophobicContact CG-CE2 4.19Å; R1506-Y1509 WeakPolarHBondContact O-CB 3.26Å; R1506-Y1509 PolarHBondContact O-N 2.99Å |
| 1507 | D | 90.8 | Very high | 87.8 | Confident | 120.6 Ų | 120.6 | 54.4 Ų | 54.4 | 65% | 0.645 | 27% | 0.271 | S | S | * | . | H | α-helix | trans | -63.3 | -24.4 | 179.2 | -86.1 | 6.9 | 0 | 0 | 0 | 113.1 | D1503 F1504 I1505 | D1503-D1507 VanDerWaalsContact O-CG 3.28Å; D1503-D1507 PolarHBondContact O-N 3.18Å; F1504-D1507 PolarHBondContact O-N 3.17Å; I1505-D1507 VanDerWaalsContact C-N 3.32Å; I1505-D1507 PolarHBondContact O-N 2.96Å |
| 1508 | K | 91 | Very high | 88.4 | Confident | 39.6 Ų | 39.6 | 55.1 Ų | 55.1 | 17% | 0.172 | 28% | 0.276 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -91.8 | -5.8 | -179.1 | -56.4 | -51.4 | -177.6 | -177.4 | 0 | 114.4 | E1402 L1405 I1486 F1504 I1505 R1506 E1510 V1511 V1512 | E1402-K1508 IonicContact OE1-NZ 3.68Å; E1402-K1508 PolarHBondContact OE1-NZ 3.1Å; E1402-K1508 IonicContact OE2-NZ 3.81Å; L1405-K1508 HydrophobicContact CD2-CB 3.97Å; L1405-K1508 HydrophobicContact CD2-CD 4.08Å; L1405-K1508 HydrophobicContact CD2-CG 3.81Å; I1486-K1508 HydrophobicContact CD1-CB 4.11Å; I1486-K1508 HydrophobicContact CD1-CG 4.34Å; I1486-K1508 HydrophobicContact CG1-CB 4.4Å; I1486-K1508 HydrophobicContact CG2-CB 3.84Å; F1504-K1508 HydrophobicContact CE1-CG 4.49Å; F1504-K1508 VanDerWaalsContact CE2-CE 3.46Å; F1504-K1508 HydrophobicContact CZ-CG 4.39Å; F1504-K1508 WeakPolarHBondContact O-CG 3.41Å; F1504-K1508 PolarHBondContact O-N 3.06Å; I1505-K1508 PolarHBondContact O-N 3.21Å; R1506-K1508 PolarHBondContact O-N 3.29Å; K1508-E1510 PolarHBondContact O-N 3.12Å; K1508-V1511 PolarHBondContact O-N 3.24Å; K1508-V1512 PolarHBondContact O-N 3.3Å; K1508-V1512 VanDerWaalsContact O-N 3.15Å |
| 1509 | Y | 89.7 | Confident | 89 | Confident | 46.4 Ų | 46.4 | 55 Ų | 55 | 18% | 0.182 | 28% | 0.276 | C | S | . | . | H | α-helix | trans | -57.7 | -48.3 | -175.6 | -71.7 | -13.8 | 0 | 0 | 0 | 113.6 | I1486 Q1489 A1490 I1505 R1506 V1511 V1512 K1513 | I1486-Y1509 HydrophobicContact CG2-CD1 4.32Å; I1486-Y1509 WeakPolarHBondContact O-CD1 3.41Å; Q1489-Y1509 HydrophobicContact CB-CD2 4.48Å; Q1489-Y1509 HydrophobicContact CB-CE2 4.49Å; Q1489-Y1509 HydrophobicContact CG-CD1 4.3Å; Q1489-Y1509 HydrophobicContact CG-CG 4.32Å; A1490-Y1509 PolarHBondContact N-OH 3.44Å; A1490-Y1509 PolarHBondContact O-OH 3.16Å; I1505-Y1509 HydrophobicContact CG2-CD1 4.48Å; I1505-Y1509 HydrophobicContact CG2-CE1 3.49Å; I1505-Y1509 VanDerWaalsContact CG2-CE1 3.47Å; I1505-Y1509 WeakPolarHBondContact CG2-OH 3.42Å; I1505-Y1509 VanDerWaalsContact O-CD1 3.24Å; I1505-Y1509 WeakPolarHBondContact O-CD1 3.38Å; I1505-Y1509 VanDerWaalsContact O-CE1 3.28Å; I1505-Y1509 WeakPolarHBondContact O-CE1 3.4Å; R1506-Y1509 HydrophobicContact CB-CD2 4.48Å; R1506-Y1509 HydrophobicContact CB-CE2 4.23Å; R1506-Y1509 HydrophobicContact CG-CD2 4.26Å; R1506-Y1509 HydrophobicContact CG-CE2 4.19Å; R1506-Y1509 WeakPolarHBondContact O-CB 3.26Å; R1506-Y1509 PolarHBondContact O-N 2.99Å; Y1509-V1511 VanDerWaalsContact C-N 3.33Å; Y1509-V1511 PolarHBondContact O-N 3.16Å; Y1509-V1512 PolarHBondContact O-N 3.14Å; Y1509-K1513 VanDerWaalsContact O-CB 3.32Å; Y1509-K1513 WeakPolarHBondContact O-CB 3.35Å; Y1509-K1513 PolarHBondContact O-N 3.26Å |
| 1510 | E | 89.9 | Confident | 89.4 | Confident | 103.4 Ų | 103.4 | 49.7 Ų | 49.7 | 48% | 0.483 | 25% | 0.251 | S | S | . | . | H | α-helix | trans | -69.6 | -35.7 | -174.5 | -166 | 58.3 | -157.4 | 0 | 0 | 111.7 | K1508 K1513 Q1514 | K1508-E1510 PolarHBondContact O-N 3.12Å; E1510-K1513 WeakPolarHBondContact O-CB 3.41Å; E1510-K1513 PolarHBondContact O-N 3.19Å; E1510-K1513 IonicContact OE1-NZ 3.03Å; E1510-K1513 IonicContact OE2-NZ 2.95Å; E1510-Q1514 WeakPolarHBondContact O-CG 3.34Å; E1510-Q1514 PolarHBondContact O-N 3.1Å |
| 1511 | V | 91.8 | Very high | 89.6 | Confident | 59 Ų | 59 | 48.9 Ų | 48.9 | 36% | 0.358 | 24% | 0.241 | S | C | . | . | H | α-helix | trans | -68.1 | -42.1 | 179.5 | -159.6 | 0 | 0 | 0 | 0 | 111.1 | L1409 K1508 Y1509 K1513 Q1514 F1515 | L1409-V1511 HydrophobicContact CD1-CB 4.37Å; L1409-V1511 HydrophobicContact CD1-CG1 3.56Å; L1409-V1511 HydrophobicContact CD2-CG1 4.13Å; L1409-V1511 HydrophobicContact CG-CG1 4.4Å; K1508-V1511 PolarHBondContact O-N 3.24Å; Y1509-V1511 VanDerWaalsContact C-N 3.33Å; Y1509-V1511 PolarHBondContact O-N 3.16Å; V1511-K1513 VanDerWaalsContact C-N 3.33Å; V1511-K1513 PolarHBondContact O-N 3.1Å; V1511-Q1514 PolarHBondContact O-N 3.2Å; V1511-F1515 PolarHBondContact O-N 2.95Å |
| 1512 | V | 91.3 | Very high | 89.3 | Confident | 3.6 Ų | 3.6 | 54.2 Ų | 54.2 | 2% | 0.022 | 27% | 0.27 | C | S | . | . | H | α-helix | trans | -68.8 | -33.3 | 175.4 | 172.2 | 0 | 0 | 0 | 0 | 112 | L1405 F1447 I1486 K1508 Y1509 F1515 S1516 | L1405-V1512 HydrophobicContact CD1-CG2 3.84Å; F1447-V1512 HydrophobicContact CE2-CG1 3.82Å; F1447-V1512 HydrophobicContact CZ-CG1 4.31Å; I1486-V1512 HydrophobicContact CG2-CB 4.07Å; I1486-V1512 HydrophobicContact CG2-CG1 4.44Å; I1486-V1512 HydrophobicContact CG2-CG2 3.53Å; I1486-V1512 VanDerWaalsContact CG2-CG2 3.49Å; K1508-V1512 PolarHBondContact O-N 3.3Å; K1508-V1512 VanDerWaalsContact O-N 3.15Å; Y1509-V1512 PolarHBondContact O-N 3.14Å; V1512-F1515 PolarHBondContact O-N 3.04Å; V1512-S1516 WeakPolarHBondContact O-CB 3.41Å; V1512-S1516 PolarHBondContact O-N 3.39Å; V1512-S1516 PolarHBondContact O-OG 3.08Å |
| 1513 | K | 89.9 | Confident | 88.7 | Confident | 81.8 Ų | 81.8 | 54.2 Ų | 54.2 | 36% | 0.356 | 27% | 0.266 | S | S | . | . | H | α-helix | trans | -64.8 | -44 | 173.2 | -172.5 | -175.8 | 173.4 | -166.6 | 0 | 111.4 | L1439 Y1509 E1510 V1511 F1515 S1516 T1517 | L1439-K1513 HydrophobicContact CD2-CG 3.71Å; Y1509-K1513 VanDerWaalsContact O-CB 3.32Å; Y1509-K1513 WeakPolarHBondContact O-CB 3.35Å; Y1509-K1513 PolarHBondContact O-N 3.26Å; E1510-K1513 WeakPolarHBondContact O-CB 3.41Å; E1510-K1513 PolarHBondContact O-N 3.19Å; E1510-K1513 IonicContact OE1-NZ 3.03Å; E1510-K1513 IonicContact OE2-NZ 2.95Å; V1511-K1513 VanDerWaalsContact C-N 3.33Å; V1511-K1513 PolarHBondContact O-N 3.1Å; K1513-F1515 PolarHBondContact O-N 3.14Å; K1513-S1516 WeakPolarHBondContact O-CB 3.43Å; K1513-S1516 PolarHBondContact O-N 3.21Å; K1513-T1517 WeakPolarHBondContact O-CB 3.28Å; K1513-T1517 PolarHBondContact O-N 3.22Å; K1513-T1517 PolarHBondContact O-OG1 3.01Å; K1513-T1517 VanDerWaalsContact O-OG1 3.04Å |
| 1514 | Q | 91 | Very high | 87.6 | Confident | 116.2 Ų | 116.2 | 57.9 Ų | 57.9 | 54% | 0.543 | 28% | 0.277 | S | S | . | . | H | α-helix | trans | -60.7 | -44.1 | 174.4 | -73.8 | 174.7 | 3.9 | 0 | 0 | 112 | E1510 V1511 S1516 T1517 S1518 | E1510-Q1514 WeakPolarHBondContact O-CG 3.34Å; E1510-Q1514 PolarHBondContact O-N 3.1Å; V1511-Q1514 PolarHBondContact O-N 3.2Å; Q1514-S1516 VanDerWaalsContact C-N 3.33Å; Q1514-S1516 PolarHBondContact O-N 3.01Å; Q1514-T1517 WeakPolarHBondContact O-CB 3.35Å; Q1514-T1517 PolarHBondContact O-N 3.32Å; Q1514-T1517 VanDerWaalsContact O-N 3.12Å; Q1514-S1518 PolarHBondContact O-N 3.06Å; Q1514-S1518 PolarHBondContact O-OG 3.39Å |
| 1515 | F | 92.7 | Very high | 86.3 | Confident | 5.4 Ų | 5.4 | 60 Ų | 60 | 2% | 0.024 | 29% | 0.289 | C | S | . | . | H | α-helix | trans | -57.1 | -47.7 | 173 | 170.4 | -100.5 | 0 | 0 | 0 | 112.1 | I1408 L1409 T1412 F1415 F1447 F1451 V1511 V1512 K1513 T1517 S1518 I1519 | I1408-F1515 HydrophobicContact CG2-CE1 4.14Å; I1408-F1515 HydrophobicContact CG2-CE2 4.09Å; I1408-F1515 HydrophobicContact CG2-CZ 3.79Å; I1408-F1515 WeakPolarHBondContact O-CE2 3.31Å; L1409-F1515 HydrophobicContact CD2-CB 3.56Å; L1409-F1515 HydrophobicContact CD2-CD2 4.31Å; L1409-F1515 HydrophobicContact CD2-CG 4.04Å; T1412-F1515 HydrophobicContact CG2-CD2 4.41Å; T1412-F1515 VanDerWaalsContact OG1-CD2 3.26Å; T1412-F1515 WeakPolarHBondContact OG1-CD2 3.33Å; F1415-F1515 HydrophobicContact CD2-CZ 4.39Å; F1447-F1515 HydrophobicContact CE2-CE1 4.47Å; F1451-F1515 HydrophobicContact CE2-CE1 4.18Å; F1451-F1515 HydrophobicContact CE2-CZ 4.11Å; F1451-F1515 HydrophobicContact CZ-CZ 4.22Å; V1511-F1515 PolarHBondContact O-N 2.95Å; V1512-F1515 PolarHBondContact O-N 3.04Å; K1513-F1515 PolarHBondContact O-N 3.14Å; F1515-T1517 VanDerWaalsContact C-N 3.26Å; F1515-T1517 PolarHBondContact O-N 3.17Å; F1515-S1518 PolarHBondContact O-N 2.99Å; F1515-S1518 VanDerWaalsContact O-N 3.14Å; F1515-I1519 HydrophobicContact CD1-CD1 4.23Å; F1515-I1519 HydrophobicContact CD2-CG2 4.4Å; F1515-I1519 HydrophobicContact CE1-CD1 3.67Å; F1515-I1519 HydrophobicContact CE1-CG2 4.48Å; F1515-I1519 HydrophobicContact CE2-CG2 3.96Å; F1515-I1519 HydrophobicContact CZ-CD1 4.02Å; F1515-I1519 HydrophobicContact CZ-CG2 4.03Å; F1515-I1519 WeakPolarHBondContact O-CG1 3.45Å; F1515-I1519 PolarHBondContact O-N 3.12Å; F1515-I1519 VanDerWaalsContact O-N 3.12Å |
| 1516 | S | 91.8 | Very high | 84.9 | Confident | 4 Ų | 4 | 65.2 Ų | 65.2 | 3% | 0.028 | 31% | 0.313 | C | S | . | . | H | α-helix | trans | -61.1 | -36.1 | 178.3 | -56.5 | 0 | 0 | 0 | 0 | 111.9 | L1439 V1512 K1513 Q1514 I1519 A1520 | L1439-S1516 VanDerWaalsContact CD1-C 3.48Å; V1512-S1516 WeakPolarHBondContact O-CB 3.41Å; V1512-S1516 PolarHBondContact O-N 3.39Å; V1512-S1516 PolarHBondContact O-OG 3.08Å; K1513-S1516 WeakPolarHBondContact O-CB 3.43Å; K1513-S1516 PolarHBondContact O-N 3.21Å; Q1514-S1516 VanDerWaalsContact C-N 3.33Å; Q1514-S1516 PolarHBondContact O-N 3.01Å; S1516-I1519 WeakPolarHBondContact O-CG1 3.37Å; S1516-A1520 VanDerWaalsContact O-CB 3.27Å; S1516-A1520 WeakPolarHBondContact O-CB 3.38Å; S1516-A1520 PolarHBondContact O-N 3.05Å |
| 1517 | T | 91.9 | Very high | 83.3 | Confident | 33.6 Ų | 33.6 | 68.2 Ų | 68.2 | 21% | 0.206 | 32% | 0.324 | C | S | . | . | H | α-helix | trans | -65.6 | -45.5 | 175.9 | -54.3 | 0 | 0 | 0 | 0 | 110.7 | L1439 K1513 Q1514 F1515 I1519 A1520 I1521 D1522 | L1439-T1517 WeakPolarHBondContact CD2-OG1 3.43Å; K1513-T1517 WeakPolarHBondContact O-CB 3.28Å; K1513-T1517 PolarHBondContact O-N 3.22Å; K1513-T1517 PolarHBondContact O-OG1 3.01Å; K1513-T1517 VanDerWaalsContact O-OG1 3.04Å; Q1514-T1517 WeakPolarHBondContact O-CB 3.35Å; Q1514-T1517 PolarHBondContact O-N 3.32Å; Q1514-T1517 VanDerWaalsContact O-N 3.12Å; F1515-T1517 VanDerWaalsContact C-N 3.26Å; F1515-T1517 PolarHBondContact O-N 3.17Å; T1517-I1519 VanDerWaalsContact C-N 3.33Å; T1517-I1519 PolarHBondContact O-N 3.35Å; T1517-A1520 PolarHBondContact O-N 2.97Å; T1517-I1521 HydrophobicContact CG2-CB 4.33Å; T1517-I1521 HydrophobicContact CG2-CD1 4.29Å; T1517-I1521 WeakPolarHBondContact O-CA 3.36Å; T1517-I1521 WeakPolarHBondContact O-CB 3.34Å; T1517-I1521 PolarHBondContact O-N 3.17Å; T1517-D1522 WeakPolarHBondContact CG2-OD2 3.38Å; T1517-D1522 PolarHBondContact O-N 3.26Å; T1517-D1522 VanDerWaalsContact O-N 3.1Å |
| 1518 | S | 90.4 | Very high | 81.4 | Confident | 38.8 Ų | 38.8 | 70.3 Ų | 70.3 | 27% | 0.271 | 33% | 0.33 | S | S | . | . | H | α-helix | trans | -64.5 | -37.2 | -177.5 | -123.3 | 0 | 0 | 0 | 0 | 113.2 | T1412 Q1514 F1515 | T1412-S1518 VanDerWaalsContact CG2-CB 3.42Å; T1412-S1518 WeakPolarHBondContact CG2-OG 3.44Å; Q1514-S1518 PolarHBondContact O-N 3.06Å; Q1514-S1518 PolarHBondContact O-OG 3.39Å; F1515-S1518 PolarHBondContact O-N 2.99Å; F1515-S1518 VanDerWaalsContact O-N 3.14Å |
| 1519 | I | 91.6 | Very high | 79.6 | Confident | 0.4 Ų | 0.4 | 73.4 Ų | 73.4 | 0% | 0.002 | 35% | 0.346 | C | S | . | . | H | α-helix | trans | -83 | -19.1 | -179.9 | 67.3 | 178.5 | 0 | 0 | 0 | 114.1 | T1412 F1415 K1420 L1423 V1446 F1515 S1516 T1517 | T1412-I1519 HydrophobicContact CG2-CG2 4.22Å; F1415-I1519 HydrophobicContact CB-CG2 4.4Å; F1415-I1519 HydrophobicContact CD1-CB 4.41Å; F1415-I1519 HydrophobicContact CD1-CG2 4.29Å; F1415-I1519 HydrophobicContact CD2-CG2 4.39Å; F1415-I1519 HydrophobicContact CE1-CB 4.39Å; F1415-I1519 HydrophobicContact CE2-CD1 4.44Å; F1415-I1519 HydrophobicContact CG-CG2 4.12Å; F1415-I1519 HydrophobicContact CZ-CD1 4.36Å; K1420-I1519 VanDerWaalsContact CA-O 3.26Å; K1420-I1519 WeakPolarHBondContact CA-O 3.34Å; K1420-I1519 VanDerWaalsContact CB-O 3.29Å; K1420-I1519 WeakPolarHBondContact CB-O 3.4Å; K1420-I1519 WeakPolarHBondContact CG-O 3.45Å; L1423-I1519 HydrophobicContact CD1-CB 4.41Å; L1423-I1519 HydrophobicContact CD1-CD1 3.71Å; L1423-I1519 HydrophobicContact CD1-CG1 4.02Å; V1446-I1519 HydrophobicContact CG1-CD1 4.44Å; V1446-I1519 HydrophobicContact CG2-CD1 4.31Å; F1515-I1519 HydrophobicContact CD1-CD1 4.23Å; F1515-I1519 HydrophobicContact CD2-CG2 4.4Å; F1515-I1519 HydrophobicContact CE1-CD1 3.67Å; F1515-I1519 HydrophobicContact CE1-CG2 4.48Å; F1515-I1519 HydrophobicContact CE2-CG2 3.96Å; F1515-I1519 HydrophobicContact CZ-CD1 4.02Å; F1515-I1519 HydrophobicContact CZ-CG2 4.03Å; F1515-I1519 WeakPolarHBondContact O-CG1 3.45Å; F1515-I1519 PolarHBondContact O-N 3.12Å; F1515-I1519 VanDerWaalsContact O-N 3.12Å; S1516-I1519 WeakPolarHBondContact O-CG1 3.37Å; T1517-I1519 VanDerWaalsContact C-N 3.33Å; T1517-I1519 PolarHBondContact O-N 3.35Å |
| 1520 | A | 90 | Very high | 77.9 | Confident | 0 Ų | 0 | 73.5 Ų | 73.5 | 0% | 0 | 35% | 0.349 | C | S | . | . | H | α-helix | trans | -113.5 | -25.6 | -173.5 | 0 | 0 | 0 | 0 | 0 | 114.7 | L1423 N1424 F1427 V1442 S1516 T1517 F1523 | L1423-A1520 HydrophobicContact CB-CB 4.3Å; N1424-A1520 WeakPolarHBondContact CA-O 3.24Å; N1424-A1520 VanDerWaalsContact CB-O 3.3Å; N1424-A1520 WeakPolarHBondContact CB-O 3.35Å; N1424-A1520 PolarHBondContact ND2-O 3.28Å; F1427-A1520 HydrophobicContact CB-CB 4.45Å; V1442-A1520 HydrophobicContact CG1-CB 4.01Å; V1442-A1520 HydrophobicContact CG2-CB 4.4Å; S1516-A1520 VanDerWaalsContact O-CB 3.27Å; S1516-A1520 WeakPolarHBondContact O-CB 3.38Å; S1516-A1520 PolarHBondContact O-N 3.05Å; T1517-A1520 PolarHBondContact O-N 2.97Å; A1520-F1523 WeakPolarHBondContact O-CE1 3.45Å |
| 1521 | I | 87.5 | Confident | 75.9 | Confident | 67.6 Ų | 67.6 | 72.1 Ų | 72.1 | 35% | 0.347 | 35% | 0.345 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -122.8 | -52.8 | -174.2 | -54.2 | 179.4 | 0 | 0 | 0 | 110.9 | F1427 L1439 T1517 F1523 | F1427-I1521 HydrophobicContact CD1-CD1 4.44Å; F1427-I1521 HydrophobicContact CD1-CG1 4.24Å; F1427-I1521 HydrophobicContact CD2-CD1 4.22Å; F1427-I1521 HydrophobicContact CD2-CG1 4.45Å; F1427-I1521 HydrophobicContact CE1-CD1 3.94Å; F1427-I1521 HydrophobicContact CE1-CG1 4.12Å; F1427-I1521 HydrophobicContact CE2-CD1 3.68Å; F1427-I1521 HydrophobicContact CE2-CG1 4.35Å; F1427-I1521 HydrophobicContact CG-CD1 4.5Å; F1427-I1521 HydrophobicContact CG-CG1 4.4Å; F1427-I1521 HydrophobicContact CZ-CD1 3.52Å; F1427-I1521 VanDerWaalsContact CZ-CD1 3.48Å; F1427-I1521 HydrophobicContact CZ-CG1 4.18Å; L1439-I1521 HydrophobicContact CD1-CD1 4.11Å; T1517-I1521 HydrophobicContact CG2-CB 4.33Å; T1517-I1521 HydrophobicContact CG2-CD1 4.29Å; T1517-I1521 WeakPolarHBondContact O-CA 3.36Å; T1517-I1521 WeakPolarHBondContact O-CB 3.34Å; T1517-I1521 PolarHBondContact O-N 3.17Å; I1521-F1523 VanDerWaalsContact C-N 3.29Å; I1521-F1523 PolarHBondContact O-N 3.01Å; I1521-F1523 VanDerWaalsContact O-N 3.1Å |
| 1522 | D | 77.9 | Confident | 73.6 | Confident | 111.8 Ų | 111.8 | 73.5 Ų | 73.5 | 60% | 0.598 | 36% | 0.362 | S | S | * | . | S | Bend | trans | -83.3 | 39.5 | -167.2 | -59.7 | -28.4 | 0 | 0 | 0 | 114.2 | T1517 | T1517-D1522 WeakPolarHBondContact CG2-OD2 3.38Å; T1517-D1522 PolarHBondContact O-N 3.26Å; T1517-D1522 VanDerWaalsContact O-N 3.1Å |
| 1523 | F | 73.4 | Confident | 71.5 | Confident | 31.8 Ų | 31.8 | 75.6 Ų | 75.6 | 14% | 0.139 | 38% | 0.378 | C | S | . | . | trans | -124.2 | 139.4 | 175.7 | 75.3 | -77.3 | 0 | 0 | 0 | 112 | K1420 N1424 A1520 I1521 I1525 | K1420-F1523 VanDerWaalsContact C-CZ 3.42Å; K1420-F1523 HydrophobicContact CB-CD1 3.93Å; K1420-F1523 HydrophobicContact CB-CD2 3.79Å; K1420-F1523 HydrophobicContact CB-CE1 3.86Å; K1420-F1523 HydrophobicContact CB-CE2 3.67Å; K1420-F1523 VanDerWaalsContact CB-CE2 3.5Å; K1420-F1523 HydrophobicContact CB-CG 3.92Å; K1420-F1523 HydrophobicContact CB-CZ 3.76Å; K1420-F1523 HydrophobicContact CD-CB 3.94Å; K1420-F1523 HydrophobicContact CD-CD1 4.4Å; K1420-F1523 HydrophobicContact CD-CD2 4.16Å; K1420-F1523 HydrophobicContact CD-CG 3.94Å; K1420-F1523 HydrophobicContact CG-CD1 4.47Å; K1420-F1523 HydrophobicContact CG-CD2 4.49Å; K1420-F1523 HydrophobicContact CG-CG 4.47Å; K1420-F1523 WeakPolarHBondContact O-CE1 3.43Å; K1420-F1523 VanDerWaalsContact O-CZ 3.26Å; K1420-F1523 WeakPolarHBondContact O-CZ 3.32Å; N1424-F1523 HydrophobicContact CB-CE1 3.78Å; N1424-F1523 HydrophobicContact CB-CZ 3.73Å; N1424-F1523 VanDerWaalsContact CB-CZ 3.41Å; A1520-F1523 WeakPolarHBondContact O-CE1 3.45Å; I1521-F1523 VanDerWaalsContact C-N 3.29Å; I1521-F1523 PolarHBondContact O-N 3.01Å; I1521-F1523 VanDerWaalsContact O-N 3.1Å; F1523-I1525 HydrophobicContact CD2-CD1 4.47Å; F1523-I1525 HydrophobicContact CD2-CG1 4Å; F1523-I1525 HydrophobicContact CE2-CB 4.43Å; F1523-I1525 HydrophobicContact CE2-CD1 4Å; F1523-I1525 HydrophobicContact CE2-CG1 3.35Å; F1523-I1525 VanDerWaalsContact CE2-CG1 3.49Å; F1523-I1525 HydrophobicContact CZ-CD1 4.05Å; F1523-I1525 HydrophobicContact CZ-CG1 3.98Å; F1523-I1525 PolarHBondContact O-N 3.01Å | ||
| 1524 | K | 63.6 | Low | 69.4 | Low | 177.6 Ų | 177.6 | 73.9 Ų | 73.9 | 77% | 0.772 | 38% | 0.376 | S | S | * | . | trans | -87.2 | 116.3 | 175.3 | -74.4 | -178.2 | 178.2 | 177 | 0 | 109.5 | H1526 | K1524-H1526 PolarHBondContact O-N 3.17Å; K1524-H1526 PolarHBondContact O-ND1 3.26Å; K1524-H1526 VanDerWaalsContact O-ND1 3.07Å | ||
| 1525 | I | 60.7 | Low | 67.2 | Low | 72.6 Ų | 72.6 | 72.6 Ų | 72.6 | 37% | 0.372 | 37% | 0.372 | S | S | . | . | trans | -73.4 | 102.2 | 172.3 | -62 | 169.5 | 0 | 0 | 0 | 108.8 | F1523 R1527 L1530 | F1523-I1525 HydrophobicContact CD2-CD1 4.47Å; F1523-I1525 HydrophobicContact CD2-CG1 4Å; F1523-I1525 HydrophobicContact CE2-CB 4.43Å; F1523-I1525 HydrophobicContact CE2-CD1 4Å; F1523-I1525 HydrophobicContact CE2-CG1 3.35Å; F1523-I1525 VanDerWaalsContact CE2-CG1 3.49Å; F1523-I1525 HydrophobicContact CZ-CD1 4.05Å; F1523-I1525 HydrophobicContact CZ-CG1 3.98Å; F1523-I1525 PolarHBondContact O-N 3.01Å; I1525-R1527 PolarHBondContact O-N 3.19Å; I1525-L1530 HydrophobicContact CG2-CD1 3.49Å; I1525-L1530 VanDerWaalsContact CG2-CD1 3.41Å; I1525-L1530 HydrophobicContact CG2-CG 4.21Å | ||
| 1526 | H | 58.7 | Low | 64.7 | Low | 109.6 Ų | 109.6 | 75.8 Ų | 75.8 | 51% | 0.507 | 40% | 0.4 | S | S | . | . | trans | -85.5 | 108.4 | 162.1 | -70 | -9.6 | 0 | 0 | 0 | 107.6 | K1524 E1528 E1529 | K1524-H1526 PolarHBondContact O-N 3.17Å; K1524-H1526 PolarHBondContact O-ND1 3.26Å; K1524-H1526 VanDerWaalsContact O-ND1 3.07Å; H1526-E1528 PolarHBondContact O-N 3.15Å; H1526-E1529 HydrophobicContact CB-CG 4.26Å; H1526-E1529 PolarHBondContact O-N 3.1Å | ||
| 1527 | R | 54.7 | Low | 62.5 | Low | 207.4 Ų | 207.4 | 80.5 Ų | 80.5 | 78% | 0.783 | 42% | 0.418 | S | S | * | . | H | α-helix | trans | -53.2 | -26.7 | -179 | -77.1 | -169.6 | -171.4 | -151.9 | 2 | 112.9 | I1525 N1531 | I1525-R1527 PolarHBondContact O-N 3.19Å; R1527-N1531 VanDerWaalsContact O-CG 3.26Å; R1527-N1531 PolarHBondContact O-N 3.33Å; R1527-N1531 PolarHBondContact O-ND2 3.1Å; R1527-N1531 PolarHBondContact O-OD1 3.08Å |
| 1528 | E | 50.4 | Low | 60.4 | Low | 165 Ų | 165 | 80.4 Ų | 80.4 | 77% | 0.771 | 42% | 0.422 | S | S | * | . | H | α-helix | trans | -69.4 | -34.1 | 178.7 | -67 | 178.3 | 169.7 | 0 | 0 | 113.2 | H1526 N1531 A1532 | H1526-E1528 PolarHBondContact O-N 3.15Å; E1528-N1531 PolarHBondContact O-N 3.34Å; E1528-A1532 PolarHBondContact O-N 3.12Å |
| 1529 | E | 52 | Low | 58.4 | Low | 105.6 Ų | 105.6 | 80.4 Ų | 80.4 | 49% | 0.493 | 42% | 0.421 | S | S | . | . | H | α-helix | trans | -75.6 | -32.6 | -179.6 | -69.5 | -177.5 | 163.3 | 0 | 0 | 112.9 | H1526 N1531 A1532 S1533 | H1526-E1529 HydrophobicContact CB-CG 4.26Å; H1526-E1529 PolarHBondContact O-N 3.1Å; E1529-N1531 VanDerWaalsContact C-N 3.29Å; E1529-N1531 PolarHBondContact O-N 3.15Å; E1529-A1532 PolarHBondContact O-N 2.97Å; E1529-S1533 PolarHBondContact O-OG 3.11Å; E1529-S1533 VanDerWaalsContact O-OG 3.06Å |
| 1530 | L | 54.1 | Low | 56.6 | Low | 47.8 Ų | 47.8 | 83.1 Ų | 83.1 | 25% | 0.25 | 44% | 0.435 | S | S | . | . | H | α-helix | trans | -61.3 | -34.6 | 172.9 | -82.2 | 155.4 | 0 | 0 | 0 | 111.8 | V1417 Q1418 I1525 S1533 | V1417-L1530 HydrophobicContact CG1-CD2 4.38Å; Q1418-L1530 HydrophobicContact CG-CD2 4.43Å; I1525-L1530 HydrophobicContact CG2-CD1 3.49Å; I1525-L1530 VanDerWaalsContact CG2-CD1 3.41Å; I1525-L1530 HydrophobicContact CG2-CG 4.21Å; L1530-S1533 PolarHBondContact O-OG 3.21Å |
| 1531 | N | 47.7 | Very low | 55.2 | Low | 74.8 Ų | 74.8 | 86 Ų | 86 | 40% | 0.4 | 45% | 0.453 | S | S | . | . | H | α-helix | trans | -81.6 | -31.9 | -177.8 | -65.3 | -16 | 0 | 0 | 0 | 112.5 | N1312 R1527 E1528 E1529 S1533 S1534 | N1312-N1531 PolarHBondContact OD1-OD1 3.09Å; N1312-N1531 VanDerWaalsContact OD1-OD1 3.13Å; R1527-N1531 VanDerWaalsContact O-CG 3.26Å; R1527-N1531 PolarHBondContact O-N 3.33Å; R1527-N1531 PolarHBondContact O-ND2 3.1Å; R1527-N1531 PolarHBondContact O-OD1 3.08Å; E1528-N1531 PolarHBondContact O-N 3.34Å; E1529-N1531 VanDerWaalsContact C-N 3.29Å; E1529-N1531 PolarHBondContact O-N 3.15Å; N1531-S1533 VanDerWaalsContact C-N 3.27Å; N1531-S1533 PolarHBondContact O-N 3.12Å; N1531-S1533 VanDerWaalsContact O-N 3.15Å; N1531-S1534 WeakPolarHBondContact O-CB 3.44Å; N1531-S1534 PolarHBondContact O-N 3.34Å; N1531-S1534 VanDerWaalsContact O-N 3.16Å |
| 1532 | A | 45.3 | Very low | 54.3 | Low | 87.2 Ų | 87.2 | 83.4 Ų | 83.4 | 72% | 0.721 | 44% | 0.441 | S | S | * | . | H | α-helix | trans | -65.7 | -20.8 | -175 | 0 | 0 | 0 | 0 | 0 | 113.9 | E1528 E1529 | E1528-A1532 PolarHBondContact O-N 3.12Å; E1529-A1532 PolarHBondContact O-N 2.97Å |
| 1533 | S | 47 | Very low | 54.1 | Low | 49.2 Ų | 49.2 | 78.3 Ų | 78.3 | 34% | 0.344 | 41% | 0.414 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -108 | 11.2 | -178.8 | 28.6 | 0 | 0 | 0 | 0 | 113.5 | Q1418 E1529 L1530 N1531 L1535 | Q1418-S1533 VanDerWaalsContact NE2-CB 3.26Å; Q1418-S1533 PolarHBondContact NE2-OG 3.32Å; E1529-S1533 PolarHBondContact O-OG 3.11Å; E1529-S1533 VanDerWaalsContact O-OG 3.06Å; L1530-S1533 PolarHBondContact O-OG 3.21Å; N1531-S1533 VanDerWaalsContact C-N 3.27Å; N1531-S1533 PolarHBondContact O-N 3.12Å; N1531-S1533 VanDerWaalsContact O-N 3.15Å; S1533-L1535 VanDerWaalsContact C-N 3.3Å; S1533-L1535 PolarHBondContact O-N 3.1Å |
| 1534 | S | 44.3 | Very low | 54.1 | Low | 46.4 Ų | 46.4 | 80.8 Ų | 80.8 | 32% | 0.324 | 42% | 0.423 | S | S | . | . | trans | -56.9 | 83.9 | 170.9 | -116.5 | 0 | 0 | 0 | 0 | 109 | A1309 N1531 A1536 | A1309-S1534 VanDerWaalsContact C-OG 3.3Å; A1309-S1534 PolarHBondContact O-OG 3.23Å; N1531-S1534 WeakPolarHBondContact O-CB 3.44Å; N1531-S1534 PolarHBondContact O-N 3.34Å; N1531-S1534 VanDerWaalsContact O-N 3.16Å; S1534-A1536 VanDerWaalsContact C-N 3.34Å; S1534-A1536 PolarHBondContact O-N 3.31Å; S1534-A1536 VanDerWaalsContact O-N 3.15Å | ||
| 1535 | L | 45.3 | Very low | 54.6 | Low | 87 Ų | 87 | 73.3 Ų | 73.3 | 46% | 0.455 | 39% | 0.394 | S | S | . | . | trans | -54.3 | 104.1 | 177.4 | -85.4 | 120.1 | 0 | 0 | 0 | 107.9 | Y1353 S1533 Y1537 | Y1353-L1535 HydrophobicContact CD1-CD1 4.2Å; Y1353-L1535 HydrophobicContact CE1-CD1 3.9Å; S1533-L1535 VanDerWaalsContact C-N 3.3Å; S1533-L1535 PolarHBondContact O-N 3.1Å; L1535-Y1537 HydrophobicContact CB-CD2 3.68Å; L1535-Y1537 VanDerWaalsContact CB-CD2 3.49Å; L1535-Y1537 HydrophobicContact CB-CE2 4Å; L1535-Y1537 HydrophobicContact CD1-CE2 4.16Å; L1535-Y1537 HydrophobicContact CD2-CD2 4.08Å; L1535-Y1537 HydrophobicContact CD2-CE2 3.64Å; L1535-Y1537 VanDerWaalsContact CD2-CE2 3.44Å; L1535-Y1537 HydrophobicContact CG-CD2 4.41Å; L1535-Y1537 HydrophobicContact CG-CE2 4.26Å; L1535-Y1537 PolarHBondContact O-N 3.25Å | ||
| 1536 | A | 40.5 | Very low | 55.8 | Low | 73.4 Ų | 73.4 | 69.8 Ų | 69.8 | 61% | 0.607 | 38% | 0.376 | S | S | * | . | trans | -72.2 | 40.6 | -179.3 | 0 | 0 | 0 | 0 | 0 | 111.6 | S1534 G1538 | S1534-A1536 VanDerWaalsContact C-N 3.34Å; S1534-A1536 PolarHBondContact O-N 3.31Å; S1534-A1536 VanDerWaalsContact O-N 3.15Å; A1536-G1538 VanDerWaalsContact C-N 3.29Å; A1536-G1538 PolarHBondContact O-N 3.45Å | ||
| 1537 | Y | 45.8 | Very low | 57.1 | Low | 103.8 Ų | 103.8 | 64.9 Ų | 64.9 | 41% | 0.407 | 35% | 0.353 | S | S | . | . | trans | -77.9 | 112.5 | 164.6 | -74.1 | -72.3 | 0 | 0 | 0 | 107.4 | T1306 L1535 V1539 V1596 | T1306-Y1537 HydrophobicContact CG2-CD2 4.09Å; T1306-Y1537 HydrophobicContact CG2-CE2 4.5Å; T1306-Y1537 HydrophobicContact CG2-CG 4.28Å; L1535-Y1537 HydrophobicContact CB-CD2 3.68Å; L1535-Y1537 VanDerWaalsContact CB-CD2 3.49Å; L1535-Y1537 HydrophobicContact CB-CE2 4Å; L1535-Y1537 HydrophobicContact CD1-CE2 4.16Å; L1535-Y1537 HydrophobicContact CD2-CD2 4.08Å; L1535-Y1537 HydrophobicContact CD2-CE2 3.64Å; L1535-Y1537 VanDerWaalsContact CD2-CE2 3.44Å; L1535-Y1537 HydrophobicContact CG-CD2 4.41Å; L1535-Y1537 HydrophobicContact CG-CE2 4.26Å; L1535-Y1537 PolarHBondContact O-N 3.25Å; Y1537-V1539 PolarHBondContact O-N 3.15Å; Y1537-V1539 VanDerWaalsContact O-N 3.15Å; Y1537-V1596 HydrophobicContact CD1-CG1 4.44Å; Y1537-V1596 HydrophobicContact CE1-CG1 3.71Å | ||
| 1538 | G | 47.7 | Very low | 58.4 | Low | 29.6 Ų | 29.6 | 56.2 Ų | 56.2 | 31% | 0.305 | 32% | 0.321 | S | S | . | . | trans | -51.3 | 125.1 | -179.6 | 0 | 0 | 0 | 0 | 0 | 110.9 | A1536 D1540 T1541 P1542 | A1536-G1538 VanDerWaalsContact C-N 3.29Å; A1536-G1538 PolarHBondContact O-N 3.45Å; G1538-D1540 PolarHBondContact O-N 3.13Å; G1538-T1541 PolarHBondContact O-N 3.4Å; G1538-T1541 VanDerWaalsContact O-N 3.15Å; G1538-T1541 PolarHBondContact O-OG1 3.29Å; G1538-P1542 WeakPolarHBondContact O-CD 3.26Å | ||
| 1539 | V | 48.8 | Very low | 60 | Low | 39.4 Ų | 39.4 | 48.5 Ų | 48.5 | 24% | 0.239 | 29% | 0.286 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -54.6 | -23.9 | -177.5 | -179.7 | 0 | 0 | 0 | 0 | 112.6 | V1270 Y1537 T1541 P1542 A1543 | V1270-V1539 HydrophobicContact CG2-CG1 4.16Å; Y1537-V1539 PolarHBondContact O-N 3.15Å; Y1537-V1539 VanDerWaalsContact O-N 3.15Å; V1539-T1541 VanDerWaalsContact C-N 3.32Å; V1539-T1541 PolarHBondContact O-N 2.95Å; V1539-P1542 VanDerWaalsContact O-CD 3.29Å; V1539-P1542 WeakPolarHBondContact O-CD 3.39Å; V1539-P1542 VanDerWaalsContact O-CG 3.32Å; V1539-P1542 WeakPolarHBondContact O-CG 3.34Å; V1539-A1543 VanDerWaalsContact O-CB 3.27Å; V1539-A1543 WeakPolarHBondContact O-CB 3.26Å; V1539-A1543 PolarHBondContact O-N 3.14Å; V1539-A1543 VanDerWaalsContact O-N 3.15Å |
| 1540 | D | 52.9 | Low | 61.8 | Low | 57 Ų | 57 | 43.5 Ų | 43.5 | 31% | 0.305 | 26% | 0.262 | S | S | . | . | H | α-helix | trans | -64.6 | -39.9 | -175.6 | -52.8 | -34.4 | 0 | 0 | 0 | 111.8 | R1263 G1538 A1543 Y1544 | R1263-D1540 IonicContact CZ-OD1 3.03Å; R1263-D1540 IonicContact CZ-OD2 3.72Å; R1263-D1540 IonicContact NE-OD1 3.59Å; R1263-D1540 PolarHBondContact NE-OD1 3.27Å; R1263-D1540 VanDerWaalsContact NE-OD1 3.13Å; R1263-D1540 IonicContact NE-OD2 3.42Å; R1263-D1540 PolarHBondContact NE-OD2 2.83Å; R1263-D1540 IonicContact NH2-OD1 3.29Å; R1263-D1540 IonicContact NH2-OD2 3.36Å; R1263-D1540 PolarHBondContact NH2-OD2 2.94Å; G1538-D1540 PolarHBondContact O-N 3.13Å; D1540-A1543 WeakPolarHBondContact O-CB 3.4Å; D1540-A1543 PolarHBondContact O-N 3.16Å; D1540-A1543 VanDerWaalsContact O-N 3.16Å; D1540-Y1544 WeakPolarHBondContact O-CB 3.13Å; D1540-Y1544 VanDerWaalsContact O-CD2 3.28Å; D1540-Y1544 WeakPolarHBondContact O-CD2 3.28Å; D1540-Y1544 PolarHBondContact O-N 3.36Å |
| 1541 | T | 61.2 | Low | 63.4 | Low | 62.2 Ų | 62.2 | 45 Ų | 45 | 38% | 0.382 | 26% | 0.264 | S | S | . | . | H | α-helix | trans | -68.1 | -46.5 | -177.9 | -43.4 | 0 | 0 | 0 | 0 | 114 | G1538 V1539 A1543 Y1544 A1545 Q1592 R1729 | G1538-T1541 PolarHBondContact O-N 3.4Å; G1538-T1541 VanDerWaalsContact O-N 3.15Å; G1538-T1541 PolarHBondContact O-OG1 3.29Å; V1539-T1541 VanDerWaalsContact C-N 3.32Å; V1539-T1541 PolarHBondContact O-N 2.95Å; T1541-A1543 VanDerWaalsContact C-N 3.32Å; T1541-A1543 PolarHBondContact O-N 3.21Å; T1541-Y1544 PolarHBondContact O-N 3.04Å; T1541-A1545 WeakPolarHBondContact O-CB 3.31Å; T1541-A1545 PolarHBondContact O-N 3.02Å; T1541-A1545 VanDerWaalsContact O-N 3.08Å; T1541-Q1592 HydrophobicContact CG2-CG 4.3Å; T1541-R1729 VanDerWaalsContact CG2-NH1 3.29Å; T1541-R1729 WeakPolarHBondContact OG1-CD 3.46Å; T1541-R1729 PolarHBondContact OG1-NE 3.46Å; T1541-R1729 PolarHBondContact OG1-NH1 3.16Å |
| 1542 | P | 68.3 | Low | 65.2 | Low | 13 Ų | 13 | 48 Ų | 48 | 8% | 0.084 | 27% | 0.27 | C | S | . | . | H | α-helix | trans | -62.2 | -37.4 | 170.5 | 3.5 | -4.6 | 0 | 0 | 0 | 112.3 | L1303 T1306 L1307 G1538 V1539 Y1544 A1545 L1546 | L1303-P1542 HydrophobicContact CD1-CB 3.84Å; L1303-P1542 WeakPolarHBondContact CD1-O 3.24Å; T1306-P1542 HydrophobicContact CG2-CG 4.21Å; L1307-P1542 HydrophobicContact CB-CB 4.37Å; L1307-P1542 HydrophobicContact CD1-CB 3.94Å; L1307-P1542 HydrophobicContact CD1-CG 4.38Å; G1538-P1542 WeakPolarHBondContact O-CD 3.26Å; V1539-P1542 VanDerWaalsContact O-CD 3.29Å; V1539-P1542 WeakPolarHBondContact O-CD 3.39Å; V1539-P1542 VanDerWaalsContact O-CG 3.32Å; V1539-P1542 WeakPolarHBondContact O-CG 3.34Å; P1542-Y1544 VanDerWaalsContact C-N 3.33Å; P1542-Y1544 PolarHBondContact O-N 3.2Å; P1542-A1545 PolarHBondContact O-N 3.17Å; P1542-L1546 VanDerWaalsContact O-CB 3.27Å; P1542-L1546 WeakPolarHBondContact O-CB 3.44Å; P1542-L1546 PolarHBondContact O-N 3Å |
| 1543 | A | 73.9 | Confident | 67.2 | Low | 3.2 Ų | 3.2 | 44.3 Ų | 44.3 | 3% | 0.026 | 24% | 0.238 | C | C | . | . | H | α-helix | trans | -63.4 | -42.5 | 179.4 | 0 | 0 | 0 | 0 | 0 | 112.7 | F1266 V1270 V1539 D1540 T1541 L1546 H1547 | F1266-A1543 HydrophobicContact CB-CB 3.98Å; F1266-A1543 HydrophobicContact CD1-CB 4.02Å; F1266-A1543 HydrophobicContact CG-CB 4.23Å; V1270-A1543 HydrophobicContact CG2-CB 3.86Å; V1539-A1543 VanDerWaalsContact O-CB 3.27Å; V1539-A1543 WeakPolarHBondContact O-CB 3.26Å; V1539-A1543 PolarHBondContact O-N 3.14Å; V1539-A1543 VanDerWaalsContact O-N 3.15Å; D1540-A1543 WeakPolarHBondContact O-CB 3.4Å; D1540-A1543 PolarHBondContact O-N 3.16Å; D1540-A1543 VanDerWaalsContact O-N 3.16Å; T1541-A1543 VanDerWaalsContact C-N 3.32Å; T1541-A1543 PolarHBondContact O-N 3.21Å; A1543-L1546 WeakPolarHBondContact O-CB 3.28Å; A1543-L1546 PolarHBondContact O-N 3.32Å; A1543-H1547 WeakPolarHBondContact O-CB 3.25Å; A1543-H1547 PolarHBondContact O-N 3.04Å |
| 1544 | Y | 72.6 | Confident | 69.2 | Low | 85.4 Ų | 85.4 | 44.7 Ų | 44.7 | 34% | 0.335 | 23% | 0.234 | S | C | . | . | H | α-helix | trans | -65.6 | -43.7 | 174.2 | -99.7 | -82.7 | 0 | 0 | 0 | 112.5 | F1266 D1540 T1541 P1542 L1546 H1547 F1548 P1584 D1585 L1588 | F1266-Y1544 HydrophobicContact CD2-CD2 4.43Å; F1266-Y1544 AromaticContact CD2-CE2 3.96Å; F1266-Y1544 HydrophobicContact CD2-CE2 4.23Å; F1266-Y1544 AromaticContact CE1-CD1 3.93Å; F1266-Y1544 HydrophobicContact CE1-CD1 4.07Å; F1266-Y1544 HydrophobicContact CE1-CD2 4.11Å; F1266-Y1544 HydrophobicContact CE1-CE1 4.21Å; F1266-Y1544 HydrophobicContact CE1-CE2 4.25Å; F1266-Y1544 HydrophobicContact CE1-CG 4.33Å; F1266-Y1544 HydrophobicContact CE2-CD1 4.28Å; F1266-Y1544 AromaticContact CE2-CD2 3.98Å; F1266-Y1544 HydrophobicContact CE2-CD2 3.98Å; F1266-Y1544 AromaticContact CE2-CE1 3.72Å; F1266-Y1544 HydrophobicContact CE2-CE1 3.72Å; F1266-Y1544 AromaticContact CE2-CE2 3.33Å; F1266-Y1544 HydrophobicContact CE2-CE2 3.99Å; F1266-Y1544 AromaticContact CE2-CZ 3.5Å; F1266-Y1544 VanDerWaalsContact CE2-CZ 3.44Å; F1266-Y1544 WeakPolarHBondContact CE2-OH 3.35Å; F1266-Y1544 AromaticContact CZ-CD1 3.65Å; F1266-Y1544 HydrophobicContact CZ-CD1 3.65Å; F1266-Y1544 AromaticContact CZ-CD2 3.82Å; F1266-Y1544 HydrophobicContact CZ-CD2 3.82Å; F1266-Y1544 AromaticContact CZ-CE1 3.35Å; F1266-Y1544 HydrophobicContact CZ-CE1 3.35Å; F1266-Y1544 VanDerWaalsContact CZ-CE1 3.45Å; F1266-Y1544 AromaticContact CZ-CE2 3.51Å; F1266-Y1544 HydrophobicContact CZ-CE2 4.07Å; F1266-Y1544 AromaticContact CZ-CG 3.95Å; F1266-Y1544 HydrophobicContact CZ-CG 4.21Å; F1266-Y1544 AromaticContact CZ-CZ 3.65Å; D1540-Y1544 WeakPolarHBondContact O-CB 3.13Å; D1540-Y1544 VanDerWaalsContact O-CD2 3.28Å; D1540-Y1544 WeakPolarHBondContact O-CD2 3.28Å; D1540-Y1544 PolarHBondContact O-N 3.36Å; T1541-Y1544 PolarHBondContact O-N 3.04Å; P1542-Y1544 VanDerWaalsContact C-N 3.33Å; P1542-Y1544 PolarHBondContact O-N 3.2Å; Y1544-L1546 VanDerWaalsContact C-N 3.3Å; Y1544-L1546 PolarHBondContact O-N 3.18Å; Y1544-H1547 WeakPolarHBondContact O-CB 3.37Å; Y1544-H1547 PolarHBondContact O-N 3.24Å; Y1544-F1548 PolarHBondContact O-N 3.16Å; Y1544-P1584 HydrophobicContact CE2-CB 4.46Å; Y1544-D1585 PolarHBondContact OH-N 2.82Å; Y1544-D1585 VanDerWaalsContact OH-N 3.12Å; Y1544-D1585 PolarHBondContact OH-O 2.79Å; Y1544-L1588 HydrophobicContact CD1-CD1 3.98Å; Y1544-L1588 HydrophobicContact CE1-CD1 3.84Å; Y1544-L1588 HydrophobicContact CG-CD1 4.31Å; Y1544-L1588 WeakPolarHBondContact O-CD1 3.37Å |
| 1545 | A | 75.6 | Confident | 71.1 | Confident | 19.8 Ų | 19.8 | 48.3 Ų | 48.3 | 16% | 0.164 | 25% | 0.249 | C | C | . | . | H | α-helix | trans | -64.6 | -35.3 | 176.7 | 0 | 0 | 0 | 0 | 0 | 112.1 | L1303 T1541 P1542 F1548 L1549 W1593 | L1303-A1545 HydrophobicContact CD1-CB 3.87Å; L1303-A1545 VanDerWaalsContact CD1-CB 3.48Å; T1541-A1545 WeakPolarHBondContact O-CB 3.31Å; T1541-A1545 PolarHBondContact O-N 3.02Å; T1541-A1545 VanDerWaalsContact O-N 3.08Å; P1542-A1545 PolarHBondContact O-N 3.17Å; A1545-F1548 PolarHBondContact O-N 3.18Å; A1545-L1549 WeakPolarHBondContact O-CG 3.39Å; A1545-L1549 PolarHBondContact O-N 3.29Å; A1545-L1549 VanDerWaalsContact O-N 3.11Å; A1545-W1593 VanDerWaalsContact C-CH2 3.47Å; A1545-W1593 HydrophobicContact CB-CD2 4.18Å; A1545-W1593 HydrophobicContact CB-CE3 3.98Å; A1545-W1593 HydrophobicContact CB-CH2 3.78Å; A1545-W1593 HydrophobicContact CB-CZ2 4.2Å; A1545-W1593 HydrophobicContact CB-CZ3 3.66Å; A1545-W1593 VanDerWaalsContact CB-CZ3 3.4Å; A1545-W1593 WeakPolarHBondContact O-CH2 3.36Å; A1545-W1593 VanDerWaalsContact O-CZ3 3.26Å; A1545-W1593 WeakPolarHBondContact O-CZ3 3.18Å |
| 1546 | L | 85.2 | Confident | 73 | Confident | 0 Ų | 0 | 49.9 Ų | 49.9 | 0% | 0 | 25% | 0.25 | C | C | . | . | H | α-helix | trans | -63.3 | -48.8 | 172 | 175.3 | 64.3 | 0 | 0 | 0 | 110.6 | L1269 V1270 T1273 L1288 L1303 L1307 P1542 A1543 Y1544 F1548 L1549 L1550 | L1269-L1546 HydrophobicContact CB-CD2 4.31Å; L1269-L1546 HydrophobicContact CD2-CB 4.5Å; L1269-L1546 HydrophobicContact CD2-CD2 4.08Å; L1269-L1546 HydrophobicContact CD2-CG 4.09Å; L1269-L1546 HydrophobicContact CG-CD2 4.27Å; V1270-L1546 HydrophobicContact CG2-CD2 4.29Å; T1273-L1546 HydrophobicContact CG2-CD1 3.98Å; T1273-L1546 HydrophobicContact CG2-CD2 4.23Å; T1273-L1546 WeakPolarHBondContact OG1-CD2 3.45Å; L1288-L1546 HydrophobicContact CD1-CD1 4.18Å; L1303-L1546 HydrophobicContact CD1-CB 4.02Å; L1303-L1546 VanDerWaalsContact CD1-N 3.34Å; L1303-L1546 HydrophobicContact CD2-CB 3.98Å; L1303-L1546 HydrophobicContact CD2-CD1 3.99Å; L1307-L1546 HydrophobicContact CD1-CD2 4.06Å; L1307-L1546 HydrophobicContact CD2-CD2 4.38Å; P1542-L1546 VanDerWaalsContact O-CB 3.27Å; P1542-L1546 WeakPolarHBondContact O-CB 3.44Å; P1542-L1546 PolarHBondContact O-N 3Å; A1543-L1546 WeakPolarHBondContact O-CB 3.28Å; A1543-L1546 PolarHBondContact O-N 3.32Å; Y1544-L1546 VanDerWaalsContact C-N 3.3Å; Y1544-L1546 PolarHBondContact O-N 3.18Å; L1546-F1548 VanDerWaalsContact C-N 3.31Å; L1546-F1548 PolarHBondContact O-N 3.32Å; L1546-L1549 PolarHBondContact O-N 3.23Å; L1546-L1550 HydrophobicContact CD1-CD1 3.69Å; L1546-L1550 HydrophobicContact CD1-CD2 4.41Å; L1546-L1550 HydrophobicContact CD1-CG 3.97Å; L1546-L1550 HydrophobicContact CD2-CD1 4.41Å; L1546-L1550 HydrophobicContact CG-CD1 3.66Å; L1546-L1550 HydrophobicContact CG-CG 4.33Å; L1546-L1550 WeakPolarHBondContact O-CB 3.38Å; L1546-L1550 VanDerWaalsContact O-CG 3.24Å; L1546-L1550 WeakPolarHBondContact O-CG 3.33Å; L1546-L1550 PolarHBondContact O-N 3.3Å |
| 1547 | H | 84.9 | Confident | 75.2 | Confident | 4.8 Ų | 4.8 | 46.7 Ų | 46.7 | 2% | 0.022 | 22% | 0.222 | C | C | . | . | H | α-helix | trans | -56.5 | -46.7 | 177.1 | 177.1 | -142.1 | 0 | 0 | 0 | 111.8 | F1266 L1269 A1543 Y1544 L1549 L1550 W1551 G1582 | F1266-H1547 HydrophobicContact CD1-CB 4.42Å; F1266-H1547 HydrophobicContact CE1-CB 3.73Å; F1266-H1547 AromaticContact CE1-CG 3.9Å; F1266-H1547 AromaticContact CE1-ND1 3.93Å; L1269-H1547 HydrophobicContact CD1-CB 4.05Å; L1269-H1547 HydrophobicContact CD2-CB 3.87Å; A1543-H1547 WeakPolarHBondContact O-CB 3.25Å; A1543-H1547 PolarHBondContact O-N 3.04Å; Y1544-H1547 WeakPolarHBondContact O-CB 3.37Å; Y1544-H1547 PolarHBondContact O-N 3.24Å; H1547-L1549 PolarHBondContact O-N 3.17Å; H1547-L1550 PolarHBondContact O-N 2.97Å; H1547-W1551 WeakPolarHBondContact O-CB 3.32Å; H1547-W1551 PolarHBondContact O-N 3.2Å; H1547-G1582 PolarHBondContact CE1-O 3.02Å; H1547-G1582 PolarHBondContact NE2-O 3.23Å; H1547-G1582 VanDerWaalsContact NE2-O 3.11Å |
| 1548 | F | 82.8 | Confident | 77 | Confident | 25.6 Ų | 25.6 | 42.7 Ų | 42.7 | 11% | 0.112 | 21% | 0.212 | C | C | . | . | H | α-helix | trans | -59 | -48.1 | 177.4 | 172 | -90.8 | 0 | 0 | 0 | 112.8 | Y1544 A1545 L1546 L1550 W1551 R1552 P1584 D1587 L1588 E1589 W1593 | Y1544-F1548 PolarHBondContact O-N 3.16Å; A1545-F1548 PolarHBondContact O-N 3.18Å; L1546-F1548 VanDerWaalsContact C-N 3.31Å; L1546-F1548 PolarHBondContact O-N 3.32Å; F1548-L1550 VanDerWaalsContact C-N 3.34Å; F1548-L1550 PolarHBondContact O-N 3.19Å; F1548-W1551 PolarHBondContact O-N 3.32Å; F1548-R1552 HydrophobicContact CD1-CB 4.39Å; F1548-R1552 HydrophobicContact CE1-CB 4.38Å; F1548-R1552 HydrophobicContact CE1-CG 4.36Å; F1548-R1552 VanDerWaalsContact O-CB 3.29Å; F1548-R1552 WeakPolarHBondContact O-CB 3.38Å; F1548-R1552 PolarHBondContact O-N 3.06Å; F1548-P1584 HydrophobicContact CB-CB 4.31Å; F1548-P1584 HydrophobicContact CB-CG 4.23Å; F1548-P1584 HydrophobicContact CD2-CB 4.39Å; F1548-P1584 HydrophobicContact CD2-CG 3.84Å; F1548-P1584 HydrophobicContact CG-CG 4.38Å; F1548-D1587 WeakPolarHBondContact CE2-OD1 3.33Å; F1548-D1587 VanDerWaalsContact CZ-OD1 3.3Å; F1548-D1587 WeakPolarHBondContact CZ-OD1 3.35Å; F1548-L1588 HydrophobicContact CB-CB 4.26Å; F1548-L1588 HydrophobicContact CB-CD1 3.93Å; F1548-L1588 HydrophobicContact CD1-CB 4.35Å; F1548-L1588 HydrophobicContact CD2-CB 4.37Å; F1548-L1588 HydrophobicContact CD2-CD1 4.4Å; F1548-L1588 HydrophobicContact CG-CB 4.07Å; F1548-L1588 HydrophobicContact CG-CD1 4.11Å; F1548-E1589 HydrophobicContact CE1-CG 4.27Å; F1548-W1593 HydrophobicContact CB-CH2 3.51Å; F1548-W1593 VanDerWaalsContact CB-CH2 3.49Å; F1548-W1593 HydrophobicContact CB-CZ2 3.4Å; F1548-W1593 VanDerWaalsContact CB-CZ2 3.41Å; F1548-W1593 AromaticContact CD1-CH2 3.08Å; F1548-W1593 HydrophobicContact CD1-CH2 3.08Å; F1548-W1593 AromaticContact CD1-CZ2 3.22Å; F1548-W1593 HydrophobicContact CD1-CZ2 3.22Å; F1548-W1593 HydrophobicContact CD1-CZ3 4.09Å; F1548-W1593 AromaticContact CD2-CZ2 3.96Å; F1548-W1593 HydrophobicContact CD2-CZ2 4.04Å; F1548-W1593 AromaticContact CE1-CH2 3.83Å; F1548-W1593 HydrophobicContact CE1-CH2 3.93Å; F1548-W1593 AromaticContact CE1-CZ2 3.79Å; F1548-W1593 HydrophobicContact CE1-CZ2 3.92Å; F1548-W1593 AromaticContact CG-CH2 3.51Å; F1548-W1593 HydrophobicContact CG-CH2 3.51Å; F1548-W1593 VanDerWaalsContact CG-CH2 3.49Å; F1548-W1593 AromaticContact CG-CZ2 3.27Å; F1548-W1593 HydrophobicContact CG-CZ2 3.27Å; F1548-W1593 HydrophobicContact CZ-CZ2 4.43Å |
| 1549 | L | 85 | Confident | 78.7 | Confident | 3.8 Ų | 3.8 | 47 Ų | 47 | 2% | 0.02 | 23% | 0.225 | C | C | . | . | H | α-helix | trans | -65 | -40.7 | 179.2 | -73.2 | 171.3 | 0 | 0 | 0 | 111.7 | L1288 H1296 L1300 L1303 A1545 L1546 H1547 Y1553 W1593 | L1288-L1549 HydrophobicContact CD2-CB 4.32Å; H1296-L1549 HydrophobicContact CB-CD2 4.11Å; L1300-L1549 HydrophobicContact CB-CD1 4.21Å; L1300-L1549 HydrophobicContact CD1-CD1 4.04Å; L1303-L1549 HydrophobicContact CD2-CD1 4.01Å; A1545-L1549 WeakPolarHBondContact O-CG 3.39Å; A1545-L1549 PolarHBondContact O-N 3.29Å; A1545-L1549 VanDerWaalsContact O-N 3.11Å; L1546-L1549 PolarHBondContact O-N 3.23Å; H1547-L1549 PolarHBondContact O-N 3.17Å; L1549-Y1553 HydrophobicContact CD2-CD2 4.4Å; L1549-Y1553 HydrophobicContact CD2-CE2 4.13Å; L1549-Y1553 WeakPolarHBondContact O-CB 3.39Å; L1549-Y1553 WeakPolarHBondContact O-CD2 3.34Å; L1549-Y1553 PolarHBondContact O-N 3.28Å; L1549-Y1553 VanDerWaalsContact O-N 3.12Å; L1549-W1593 HydrophobicContact CD1-CZ3 3.96Å; L1549-W1593 HydrophobicContact CD2-CH2 4.17Å; L1549-W1593 HydrophobicContact CD2-CZ3 4.04Å; L1549-W1593 HydrophobicContact CG-CH2 3.9Å; L1549-W1593 HydrophobicContact CG-CZ3 3.65Å |
| 1550 | L | 89.3 | Confident | 80.5 | Confident | 0.2 Ų | 0.2 | 46.4 Ų | 46.4 | 0% | 0.001 | 22% | 0.219 | C | C | . | . | H | α-helix | trans | -64.7 | -42.5 | 177.7 | -71.4 | 171 | 0 | 0 | 0 | 111.9 | L1269 I1284 L1288 L1546 H1547 F1548 Q1554 I1557 L1574 L1578 | L1269-L1550 HydrophobicContact CD1-CD1 3.9Å; L1269-L1550 HydrophobicContact CD2-CD1 4.05Å; L1269-L1550 HydrophobicContact CG-CD1 4.03Å; I1284-L1550 HydrophobicContact CG2-CD2 3.78Å; L1288-L1550 HydrophobicContact CD1-CD2 4.16Å; L1288-L1550 HydrophobicContact CD2-CD2 4.17Å; L1288-L1550 HydrophobicContact CG-CD2 4.32Å; L1546-L1550 HydrophobicContact CD1-CD1 3.69Å; L1546-L1550 HydrophobicContact CD1-CD2 4.41Å; L1546-L1550 HydrophobicContact CD1-CG 3.97Å; L1546-L1550 HydrophobicContact CD2-CD1 4.41Å; L1546-L1550 HydrophobicContact CG-CD1 3.66Å; L1546-L1550 HydrophobicContact CG-CG 4.33Å; L1546-L1550 WeakPolarHBondContact O-CB 3.38Å; L1546-L1550 VanDerWaalsContact O-CG 3.24Å; L1546-L1550 WeakPolarHBondContact O-CG 3.33Å; L1546-L1550 PolarHBondContact O-N 3.3Å; H1547-L1550 PolarHBondContact O-N 2.97Å; F1548-L1550 VanDerWaalsContact C-N 3.34Å; F1548-L1550 PolarHBondContact O-N 3.19Å; L1550-Q1554 VanDerWaalsContact O-CA 3.27Å; L1550-Q1554 WeakPolarHBondContact O-CA 3.34Å; L1550-Q1554 WeakPolarHBondContact O-CB 3.42Å; L1550-Q1554 PolarHBondContact O-N 3.18Å; L1550-I1557 HydrophobicContact CD2-CD1 3.93Å; L1550-L1574 HydrophobicContact CB-CD1 4.44Å; L1550-L1574 HydrophobicContact CD1-CD1 3.9Å; L1550-L1574 HydrophobicContact CD2-CD1 4.27Å; L1550-L1574 HydrophobicContact CD2-CD2 4.19Å; L1550-L1574 HydrophobicContact CG-CD1 4.36Å; L1550-L1578 HydrophobicContact CB-CD1 4.3Å; L1550-L1578 HydrophobicContact CB-CD2 4.03Å |
| 1551 | W | 87.4 | Confident | 82 | Confident | 78.6 Ų | 78.6 | 43.9 Ų | 43.9 | 30% | 0.298 | 21% | 0.205 | S | C | . | . | H | α-helix | trans | -67.5 | -48.3 | 177 | -175.4 | -91.9 | 0 | 0 | 0 | 111.7 | H1547 F1548 Y1553 Q1554 L1578 P1583 P1584 | H1547-W1551 WeakPolarHBondContact O-CB 3.32Å; H1547-W1551 PolarHBondContact O-N 3.2Å; F1548-W1551 PolarHBondContact O-N 3.32Å; W1551-Y1553 VanDerWaalsContact C-N 3.28Å; W1551-Y1553 PolarHBondContact O-N 3.16Å; W1551-Q1554 VanDerWaalsContact O-CB 3.29Å; W1551-Q1554 WeakPolarHBondContact O-CB 3.29Å; W1551-Q1554 PolarHBondContact O-N 3.13Å; W1551-L1578 HydrophobicContact CE3-CB 4.14Å; W1551-L1578 HydrophobicContact CE3-CD2 4.43Å; W1551-L1578 HydrophobicContact CZ3-CB 4.29Å; W1551-L1578 VanDerWaalsContact CZ3-O 3.24Å; W1551-L1578 WeakPolarHBondContact CZ3-O 3.28Å; W1551-P1583 VanDerWaalsContact CE2-CA 3.47Å; W1551-P1583 HydrophobicContact CH2-CB 4.46Å; W1551-P1583 HydrophobicContact CZ2-CB 3.76Å; W1551-P1583 HydrophobicContact CZ2-CG 4.36Å; W1551-P1584 HydrophobicContact CB-CG 4.32Å; W1551-P1584 VanDerWaalsContact CD1-CD 3.44Å; W1551-P1584 VanDerWaalsContact CG-CD 3.47Å; W1551-P1584 HydrophobicContact CG-CG 4.35Å |
| 1552 | R | 85.2 | Confident | 82.9 | Confident | 137.4 Ų | 137.4 | 45.7 Ų | 45.7 | 52% | 0.518 | 21% | 0.212 | S | C | . | . | H | α-helix | trans | -60.2 | -36 | -178.5 | -179.6 | 126 | 175.9 | 97.7 | -2.1 | 112.9 | H1296 F1548 | H1296-R1552 PolarHBondContact NE2-NE 3.02Å; F1548-R1552 HydrophobicContact CD1-CB 4.39Å; F1548-R1552 HydrophobicContact CE1-CB 4.38Å; F1548-R1552 HydrophobicContact CE1-CG 4.36Å; F1548-R1552 VanDerWaalsContact O-CB 3.29Å; F1548-R1552 WeakPolarHBondContact O-CB 3.38Å; F1548-R1552 PolarHBondContact O-N 3.06Å |
| 1553 | Y | 87.6 | Confident | 83.4 | Confident | 10.2 Ų | 10.2 | 50.1 Ų | 50.1 | 4% | 0.04 | 24% | 0.239 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -106.1 | 14.6 | -178.9 | -67.8 | -70.6 | 0 | 0 | 0 | 113.6 | V1291 V1292 Q1293 H1296 L1549 W1551 D1555 R1556 I1557 | V1291-Y1553 HydrophobicContact CG1-CD1 3.86Å; V1291-Y1553 HydrophobicContact CG1-CG 4.04Å; V1291-Y1553 HydrophobicContact CG2-CD1 4.48Å; V1291-Y1553 HydrophobicContact CG2-CG 4.2Å; V1291-Y1553 WeakPolarHBondContact O-CE1 3.49Å; V1292-Y1553 HydrophobicContact CB-CE2 4.25Å; V1292-Y1553 HydrophobicContact CG1-CE2 4.11Å; V1292-Y1553 HydrophobicContact CG2-CD2 3.8Å; V1292-Y1553 HydrophobicContact CG2-CE2 3.86Å; V1292-Y1553 HydrophobicContact CG2-CG 4.44Å; Q1293-Y1553 WeakPolarHBondContact CB-OH 3.48Å; Q1293-Y1553 HydrophobicContact CG-CE1 4.26Å; Q1293-Y1553 PolarHBondContact N-OH 3.22Å; Q1293-Y1553 VanDerWaalsContact N-OH 3.1Å; H1296-Y1553 AromaticContact CD2-CE2 3.84Å; H1296-Y1553 AromaticContact CD2-CZ 3.87Å; H1296-Y1553 PolarHBondContact CD2-OH 3.13Å; H1296-Y1553 VanDerWaalsContact CD2-OH 3.26Å; L1549-Y1553 HydrophobicContact CD2-CD2 4.4Å; L1549-Y1553 HydrophobicContact CD2-CE2 4.13Å; L1549-Y1553 WeakPolarHBondContact O-CB 3.39Å; L1549-Y1553 WeakPolarHBondContact O-CD2 3.34Å; L1549-Y1553 PolarHBondContact O-N 3.28Å; L1549-Y1553 VanDerWaalsContact O-N 3.12Å; W1551-Y1553 VanDerWaalsContact C-N 3.28Å; W1551-Y1553 PolarHBondContact O-N 3.16Å; Y1553-D1555 VanDerWaalsContact C-N 3.32Å; Y1553-D1555 PolarHBondContact O-N 3.32Å; Y1553-R1556 PolarHBondContact O-N 3.11Å; Y1553-R1556 VanDerWaalsContact O-N 3.12Å; Y1553-I1557 WeakPolarHBondContact O-CB 3.43Å; Y1553-I1557 VanDerWaalsContact O-CG1 3.27Å; Y1553-I1557 WeakPolarHBondContact O-CG1 3.33Å; Y1553-I1557 PolarHBondContact O-N 3.01Å |
| 1554 | Q | 87.9 | Confident | 83.3 | Confident | 58.8 Ų | 58.8 | 55.5 Ų | 55.5 | 28% | 0.275 | 26% | 0.262 | S | S | . | . | H | α-helix | trans | -51.7 | -47.4 | -173.4 | 179.9 | 179.8 | -34.9 | 0 | 0 | 112.9 | L1550 W1551 R1556 I1557 G1558 L1578 | L1550-Q1554 VanDerWaalsContact O-CA 3.27Å; L1550-Q1554 WeakPolarHBondContact O-CA 3.34Å; L1550-Q1554 WeakPolarHBondContact O-CB 3.42Å; L1550-Q1554 PolarHBondContact O-N 3.18Å; W1551-Q1554 VanDerWaalsContact O-CB 3.29Å; W1551-Q1554 WeakPolarHBondContact O-CB 3.29Å; W1551-Q1554 PolarHBondContact O-N 3.13Å; Q1554-R1556 PolarHBondContact O-N 3.06Å; Q1554-I1557 PolarHBondContact O-N 3.12Å; Q1554-G1558 PolarHBondContact O-N 3.11Å; Q1554-L1578 HydrophobicContact CB-CD1 4.29Å; Q1554-L1578 HydrophobicContact CG-CD1 4.15Å |
| 1555 | D | 84.1 | Confident | 83 | Confident | 120.2 Ų | 120.2 | 60.9 Ų | 60.9 | 64% | 0.643 | 28% | 0.282 | S | S | * | . | H | α-helix | trans | -63.1 | -45.3 | -177.1 | -62.2 | -33.2 | 0 | 0 | 0 | 111.6 | S1039 R1042 Y1553 G1558 E1559 | S1039-D1555 PolarHBondContact OG-OD1 2.98Å; R1042-D1555 IonicContact CZ-OD1 3.27Å; R1042-D1555 IonicContact NH1-OD1 2.7Å; R1042-D1555 PolarHBondContact NH1-OD1 2.96Å; R1042-D1555 IonicContact NH1-OD2 3.18Å; R1042-D1555 PolarHBondContact NH1-OD2 2.94Å; Y1553-D1555 VanDerWaalsContact C-N 3.32Å; Y1553-D1555 PolarHBondContact O-N 3.32Å; D1555-G1558 WeakPolarHBondContact O-CA 3.37Å; D1555-G1558 PolarHBondContact O-N 3.21Å; D1555-E1559 PolarHBondContact O-N 3.2Å |
| 1556 | R | 86 | Confident | 82.5 | Confident | 122.4 Ų | 122.4 | 62.2 Ų | 62.2 | 46% | 0.462 | 29% | 0.29 | S | S | . | . | H | α-helix | trans | -70.4 | -34.2 | 178.5 | -69.8 | -173.3 | 174.7 | -173 | -2.1 | 112.6 | V1291 Y1553 Q1554 G1558 E1559 F1560 | V1291-R1556 HydrophobicContact CB-CB 4.16Å; V1291-R1556 HydrophobicContact CG1-CB 3.49Å; V1291-R1556 HydrophobicContact CG1-CG 4.22Å; V1291-R1556 WeakPolarHBondContact CG1-O 3.31Å; V1291-R1556 HydrophobicContact CG2-CB 4.32Å; Y1553-R1556 PolarHBondContact O-N 3.11Å; Y1553-R1556 VanDerWaalsContact O-N 3.12Å; Q1554-R1556 PolarHBondContact O-N 3.06Å; R1556-G1558 VanDerWaalsContact C-N 3.3Å; R1556-E1559 PolarHBondContact O-N 3.07Å; R1556-F1560 WeakPolarHBondContact O-CB 3.37Å; R1556-F1560 PolarHBondContact O-N 3.01Å |
| 1557 | I | 87.1 | Confident | 82.1 | Confident | 4.8 Ų | 4.8 | 63.8 Ų | 63.8 | 3% | 0.025 | 30% | 0.298 | C | S | . | . | H | α-helix | trans | -64 | -40.9 | 172.1 | -68.3 | 167.4 | 0 | 0 | 0 | 109.6 | A1287 L1288 V1291 L1550 Y1553 Q1554 F1560 F1561 L1574 | A1287-I1557 HydrophobicContact CB-CG1 4.48Å; A1287-I1557 HydrophobicContact CB-CG2 4.17Å; L1288-I1557 HydrophobicContact CD2-CD1 3.94Å; V1291-I1557 HydrophobicContact CB-CG1 4.45Å; V1291-I1557 HydrophobicContact CG1-CG1 4.32Å; V1291-I1557 HydrophobicContact CG2-CG1 4.02Å; L1550-I1557 HydrophobicContact CD2-CD1 3.93Å; Y1553-I1557 WeakPolarHBondContact O-CB 3.43Å; Y1553-I1557 VanDerWaalsContact O-CG1 3.27Å; Y1553-I1557 WeakPolarHBondContact O-CG1 3.33Å; Y1553-I1557 PolarHBondContact O-N 3.01Å; Q1554-I1557 PolarHBondContact O-N 3.12Å; I1557-F1560 WeakPolarHBondContact O-CB 3.37Å; I1557-F1560 PolarHBondContact O-N 3.16Å; I1557-F1561 HydrophobicContact CG2-CD2 3.76Å; I1557-F1561 HydrophobicContact CG2-CE2 3.5Å; I1557-F1561 VanDerWaalsContact CG2-CE2 3.44Å; I1557-F1561 VanDerWaalsContact O-CD2 3.23Å; I1557-F1561 WeakPolarHBondContact O-CD2 3.37Å; I1557-F1561 PolarHBondContact O-N 2.94Å; I1557-L1574 HydrophobicContact CG2-CD2 4.17Å |
| 1558 | G | 83 | Confident | 81.7 | Confident | 19.6 Ų | 19.6 | 67.3 Ų | 67.3 | 20% | 0.202 | 32% | 0.316 | C | S | . | . | H | α-helix | trans | -59.5 | -47 | 172.9 | 0 | 0 | 0 | 0 | 0 | 112.5 | Q1554 D1555 R1556 F1560 F1561 N1562 | Q1554-G1558 PolarHBondContact O-N 3.11Å; D1555-G1558 WeakPolarHBondContact O-CA 3.37Å; D1555-G1558 PolarHBondContact O-N 3.21Å; R1556-G1558 VanDerWaalsContact C-N 3.3Å; G1558-F1560 VanDerWaalsContact C-N 3.33Å; G1558-F1560 PolarHBondContact O-N 3.26Å; G1558-F1561 PolarHBondContact O-N 3.02Å; G1558-N1562 WeakPolarHBondContact O-CB 3.31Å; G1558-N1562 VanDerWaalsContact O-CG 3.27Å; G1558-N1562 PolarHBondContact O-N 3.03Å; G1558-N1562 PolarHBondContact O-ND2 3.14Å |
| 1559 | E | 83.6 | Confident | 81.5 | Confident | 121 Ų | 121 | 74.3 Ų | 74.3 | 57% | 0.565 | 35% | 0.346 | S | S | * | . | H | α-helix | trans | -59.2 | -41.4 | 173.8 | -74.7 | 178.8 | 170.9 | 0 | 0 | 112.4 | Q1038 D1555 R1556 N1562 T1563 | Q1038-E1559 HydrophobicContact CG-CG 4.3Å; Q1038-E1559 PolarHBondContact NE2-OE1 3.38Å; D1555-E1559 PolarHBondContact O-N 3.2Å; R1556-E1559 PolarHBondContact O-N 3.07Å; E1559-N1562 WeakPolarHBondContact O-CB 3.46Å; E1559-N1562 PolarHBondContact O-N 3.15Å; E1559-T1563 WeakPolarHBondContact O-CB 3.31Å; E1559-T1563 PolarHBondContact O-N 3.06Å; E1559-T1563 PolarHBondContact O-OG1 2.99Å; E1559-T1563 VanDerWaalsContact O-OG1 3.06Å |
| 1560 | F | 86.2 | Confident | 81.4 | Confident | 26.6 Ų | 26.6 | 75 Ų | 75 | 12% | 0.117 | 35% | 0.351 | C | S | . | . | H | α-helix | trans | -58.9 | -51.2 | 176.1 | 179.3 | -89.5 | 0 | 0 | 0 | 111.2 | N1286 A1287 H1290 V1291 R1556 I1557 G1558 N1562 T1563 F1564 | N1286-F1560 HydrophobicContact CB-CE1 4.38Å; N1286-F1560 HydrophobicContact CB-CZ 4.39Å; A1287-F1560 HydrophobicContact CB-CB 4.47Å; A1287-F1560 HydrophobicContact CB-CD1 3.51Å; A1287-F1560 VanDerWaalsContact CB-CD1 3.48Å; A1287-F1560 HydrophobicContact CB-CE1 3.84Å; A1287-F1560 HydrophobicContact CB-CG 4.08Å; H1290-F1560 HydrophobicContact CB-CD2 3.99Å; H1290-F1560 HydrophobicContact CB-CE2 3.81Å; H1290-F1560 AromaticContact CD2-CD2 3.79Å; H1290-F1560 AromaticContact CG-CD2 3.9Å; H1290-F1560 AromaticContact CG-CE2 3.94Å; V1291-F1560 HydrophobicContact CG1-CB 4.34Å; V1291-F1560 HydrophobicContact CG2-CB 4.23Å; R1556-F1560 WeakPolarHBondContact O-CB 3.37Å; R1556-F1560 PolarHBondContact O-N 3.01Å; I1557-F1560 WeakPolarHBondContact O-CB 3.37Å; I1557-F1560 PolarHBondContact O-N 3.16Å; G1558-F1560 VanDerWaalsContact C-N 3.33Å; G1558-F1560 PolarHBondContact O-N 3.26Å; F1560-N1562 VanDerWaalsContact C-N 3.32Å; F1560-N1562 PolarHBondContact O-N 3.15Å; F1560-T1563 WeakPolarHBondContact O-CB 3.47Å; F1560-T1563 PolarHBondContact O-N 3.2Å; F1560-T1563 VanDerWaalsContact O-N 3.13Å; F1560-F1564 HydrophobicContact CD1-CD2 4.28Å; F1560-F1564 AromaticContact CD2-CD2 3.69Å; F1560-F1564 HydrophobicContact CD2-CD2 3.79Å; F1560-F1564 AromaticContact CD2-CE2 3.49Å; F1560-F1564 HydrophobicContact CD2-CE2 3.64Å; F1560-F1564 VanDerWaalsContact CD2-CE2 3.46Å; F1560-F1564 HydrophobicContact CE1-CD2 4.11Å; F1560-F1564 AromaticContact CE2-CD2 3.6Å; F1560-F1564 HydrophobicContact CE2-CD2 3.6Å; F1560-F1564 VanDerWaalsContact CE2-CD2 3.48Å; F1560-F1564 AromaticContact CE2-CE2 3.37Å; F1560-F1564 HydrophobicContact CE2-CE2 3.37Å; F1560-F1564 HydrophobicContact CE2-CZ 4.19Å; F1560-F1564 AromaticContact CG-CD2 3.95Å; F1560-F1564 HydrophobicContact CG-CD2 4.04Å; F1560-F1564 HydrophobicContact CG-CE2 4.28Å; F1560-F1564 AromaticContact CZ-CD2 3.76Å; F1560-F1564 HydrophobicContact CZ-CD2 3.76Å; F1560-F1564 AromaticContact CZ-CE2 3.92Å; F1560-F1564 HydrophobicContact CZ-CE2 3.94Å; F1560-F1564 HydrophobicContact CZ-CG 4.48Å; F1560-F1564 VanDerWaalsContact O-CD2 3.28Å; F1560-F1564 WeakPolarHBondContact O-CD2 3.32Å; F1560-F1564 PolarHBondContact O-N 3.17Å; F1560-F1564 VanDerWaalsContact O-N 3.1Å |
| 1561 | F | 84.8 | Confident | 81.1 | Confident | 5.2 Ų | 5.2 | 76 Ų | 76 | 2% | 0.023 | 36% | 0.358 | C | S | . | . | H | α-helix | trans | -63.6 | -36.7 | 178.4 | -75.9 | -60.9 | 0 | 0 | 0 | 113 | P1283 I1284 A1287 I1557 G1558 T1563 F1564 R1565 S1566 H1567 S1571 L1574 | P1283-F1561 HydrophobicContact CB-CE1 3.9Å; P1283-F1561 HydrophobicContact CB-CZ 4.24Å; I1284-F1561 HydrophobicContact CG1-CZ 4.37Å; A1287-F1561 HydrophobicContact CB-CE2 4.26Å; A1287-F1561 HydrophobicContact CB-CZ 4.22Å; I1557-F1561 HydrophobicContact CG2-CD2 3.76Å; I1557-F1561 HydrophobicContact CG2-CE2 3.5Å; I1557-F1561 VanDerWaalsContact CG2-CE2 3.44Å; I1557-F1561 VanDerWaalsContact O-CD2 3.23Å; I1557-F1561 WeakPolarHBondContact O-CD2 3.37Å; I1557-F1561 PolarHBondContact O-N 2.94Å; G1558-F1561 PolarHBondContact O-N 3.02Å; F1561-T1563 VanDerWaalsContact C-N 3.34Å; F1561-T1563 PolarHBondContact O-N 3.29Å; F1561-F1564 CarbonylContact O-C 3.52Å; F1561-F1564 PolarHBondContact O-N 2.87Å; F1561-F1564 VanDerWaalsContact O-N 3.1Å; F1561-R1565 WeakPolarHBondContact O-CA 3.12Å; F1561-R1565 PolarHBondContact O-N 3.08Å; F1561-R1565 VanDerWaalsContact O-N 3.12Å; F1561-S1566 WeakPolarHBondContact CD1-O 3.3Å; F1561-H1567 HydrophobicContact CD1-CB 4.02Å; F1561-H1567 HydrophobicContact CE1-CB 4.22Å; F1561-S1571 WeakPolarHBondContact CD2-OG 3.45Å; F1561-L1574 HydrophobicContact CE2-CD2 4.49Å |
| 1562 | N | 80.8 | Confident | 80.8 | Confident | 98.8 Ų | 98.8 | 79 Ų | 79 | 53% | 0.528 | 37% | 0.369 | S | S | . | . | H | α-helix | trans | -65.4 | -36.3 | 175.8 | -73.7 | -23.2 | 0 | 0 | 0 | 112.5 | V1036 F1037 G1558 E1559 F1560 | V1036-N1562 HydrophobicContact CG1-CB 3.7Å; V1036-N1562 WeakPolarHBondContact CG1-OD1 3.37Å; F1037-N1562 PolarHBondContact O-ND2 3.08Å; F1037-N1562 PolarHBondContact O-OD1 3.44Å; F1037-N1562 VanDerWaalsContact O-OD1 3.09Å; G1558-N1562 WeakPolarHBondContact O-CB 3.31Å; G1558-N1562 VanDerWaalsContact O-CG 3.27Å; G1558-N1562 PolarHBondContact O-N 3.03Å; G1558-N1562 PolarHBondContact O-ND2 3.14Å; E1559-N1562 WeakPolarHBondContact O-CB 3.46Å; E1559-N1562 PolarHBondContact O-N 3.15Å; F1560-N1562 VanDerWaalsContact C-N 3.32Å; F1560-N1562 PolarHBondContact O-N 3.15Å |
| 1563 | T | 79.2 | Confident | 80.7 | Confident | 106 Ų | 106 | 79 Ų | 79 | 65% | 0.65 | 37% | 0.369 | S | S | * | . | H | α-helix | trans | -72 | -44.5 | -179.4 | -53.6 | 0 | 0 | 0 | 0 | 111.5 | E1559 F1560 F1561 R1565 | E1559-T1563 WeakPolarHBondContact O-CB 3.31Å; E1559-T1563 PolarHBondContact O-N 3.06Å; E1559-T1563 PolarHBondContact O-OG1 2.99Å; E1559-T1563 VanDerWaalsContact O-OG1 3.06Å; F1560-T1563 WeakPolarHBondContact O-CB 3.47Å; F1560-T1563 PolarHBondContact O-N 3.2Å; F1560-T1563 VanDerWaalsContact O-N 3.13Å; F1561-T1563 VanDerWaalsContact C-N 3.34Å; F1561-T1563 PolarHBondContact O-N 3.29Å; T1563-R1565 VanDerWaalsContact C-N 3.31Å; T1563-R1565 PolarHBondContact O-N 3.24Å |
| 1564 | F | 71.4 | Confident | 80.6 | Confident | 115.6 Ų | 115.6 | 78.8 Ų | 78.8 | 51% | 0.507 | 37% | 0.369 | S | S | . | . | H | α-helix | trans | -90.8 | 7 | -177.2 | -67.9 | -78.3 | 0 | 0 | 0 | 113.3 | F1560 F1561 S1566 | F1560-F1564 HydrophobicContact CD1-CD2 4.28Å; F1560-F1564 AromaticContact CD2-CD2 3.69Å; F1560-F1564 HydrophobicContact CD2-CD2 3.79Å; F1560-F1564 AromaticContact CD2-CE2 3.49Å; F1560-F1564 HydrophobicContact CD2-CE2 3.64Å; F1560-F1564 VanDerWaalsContact CD2-CE2 3.46Å; F1560-F1564 HydrophobicContact CE1-CD2 4.11Å; F1560-F1564 AromaticContact CE2-CD2 3.6Å; F1560-F1564 HydrophobicContact CE2-CD2 3.6Å; F1560-F1564 VanDerWaalsContact CE2-CD2 3.48Å; F1560-F1564 AromaticContact CE2-CE2 3.37Å; F1560-F1564 HydrophobicContact CE2-CE2 3.37Å; F1560-F1564 HydrophobicContact CE2-CZ 4.19Å; F1560-F1564 AromaticContact CG-CD2 3.95Å; F1560-F1564 HydrophobicContact CG-CD2 4.04Å; F1560-F1564 HydrophobicContact CG-CE2 4.28Å; F1560-F1564 AromaticContact CZ-CD2 3.76Å; F1560-F1564 HydrophobicContact CZ-CD2 3.76Å; F1560-F1564 AromaticContact CZ-CE2 3.92Å; F1560-F1564 HydrophobicContact CZ-CE2 3.94Å; F1560-F1564 HydrophobicContact CZ-CG 4.48Å; F1560-F1564 VanDerWaalsContact O-CD2 3.28Å; F1560-F1564 WeakPolarHBondContact O-CD2 3.32Å; F1560-F1564 PolarHBondContact O-N 3.17Å; F1560-F1564 VanDerWaalsContact O-N 3.1Å; F1561-F1564 CarbonylContact O-C 3.52Å; F1561-F1564 PolarHBondContact O-N 2.87Å; F1561-F1564 VanDerWaalsContact O-N 3.1Å; F1564-S1566 PolarHBondContact O-N 3.21Å; F1564-S1566 VanDerWaalsContact O-N 3.07Å |
| 1565 | R | 65.9 | Low | 80.4 | Confident | 199.4 Ų | 199.4 | 78.1 Ų | 78.1 | 75% | 0.752 | 37% | 0.373 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 31.5 | 25.7 | -178 | -67.1 | -166.7 | 178.3 | -174.9 | 2.5 | 114.4 | T989 H1034 F1561 T1563 H1567 D1568 | T989-R1565 PolarHBondContact O-NH2 3.37Å; H1034-R1565 PolarHBondContact O-NH1 2.86Å; F1561-R1565 WeakPolarHBondContact O-CA 3.12Å; F1561-R1565 PolarHBondContact O-N 3.08Å; F1561-R1565 VanDerWaalsContact O-N 3.12Å; T1563-R1565 VanDerWaalsContact C-N 3.31Å; T1563-R1565 PolarHBondContact O-N 3.24Å; R1565-H1567 PolarHBondContact O-N 2.94Å; R1565-D1568 PolarHBondContact O-N 2.99Å |
| 1566 | S | 65.9 | Low | 80.1 | Confident | 46.8 Ų | 46.8 | 74.5 Ų | 74.5 | 33% | 0.327 | 36% | 0.361 | S | S | . | . | trans | -107.7 | 139.8 | -179 | 61.5 | 0 | 0 | 0 | 0 | 111.1 | F1561 F1564 D1568 | F1561-S1566 WeakPolarHBondContact CD1-O 3.3Å; F1564-S1566 PolarHBondContact O-N 3.21Å; F1564-S1566 VanDerWaalsContact O-N 3.07Å; S1566-D1568 PolarHBondContact O-N 2.92Å | ||
| 1567 | H | 76.2 | Confident | 79.8 | Confident | 35 Ų | 35 | 69.4 Ų | 69.4 | 16% | 0.162 | 34% | 0.342 | C | S | . | . | trans | 64.3 | 33.9 | 175.5 | -48.5 | -59.9 | 0 | 0 | 0 | 116.3 | T1277 D1279 E1281 P1283 F1561 R1565 K1569 V1570 S1571 | T1277-H1567 VanDerWaalsContact CG2-CE1 3.46Å; T1277-H1567 WeakPolarHBondContact CG2-CE1 3.41Å; T1277-H1567 WeakPolarHBondContact CG2-ND1 3.27Å; T1277-H1567 PolarHBondContact OG1-CE1 3.08Å; D1279-H1567 IonicContact OD1-CE1 2.7Å; D1279-H1567 IonicContact OD2-CE1 3.47Å; D1279-H1567 PolarHBondContact OD2-CE1 3.3Å; D1279-H1567 IonicContact OD2-NE2 2.99Å; E1281-H1567 IonicContact OE2-NE2 3.52Å; P1283-H1567 HydrophobicContact CB-CB 4Å; P1283-H1567 HydrophobicContact CG-CB 4.34Å; F1561-H1567 HydrophobicContact CD1-CB 4.02Å; F1561-H1567 HydrophobicContact CE1-CB 4.22Å; R1565-H1567 PolarHBondContact O-N 2.94Å; H1567-K1569 VanDerWaalsContact C-N 3.26Å; H1567-K1569 PolarHBondContact O-N 3.09Å; H1567-K1569 VanDerWaalsContact O-N 3.11Å; H1567-V1570 HydrophobicContact CB-CB 4.28Å; H1567-V1570 HydrophobicContact CB-CG2 4.2Å; H1567-V1570 WeakPolarHBondContact O-CA 3.38Å; H1567-V1570 WeakPolarHBondContact O-CB 3.27Å; H1567-V1570 PolarHBondContact O-N 3.27Å; H1567-S1571 PolarHBondContact O-N 3.16Å; H1567-S1571 VanDerWaalsContact O-N 3.13Å | ||
| 1568 | D | 75.8 | Confident | 79.5 | Confident | 76.6 Ų | 76.6 | 69.3 Ų | 69.3 | 41% | 0.41 | 34% | 0.342 | S | S | . | . | H | α-helix | trans | -53.6 | -34 | -178.7 | -154.7 | 46.6 | 0 | 0 | 0 | 114.7 | R1565 S1566 V1570 S1571 R1572 | R1565-D1568 PolarHBondContact O-N 2.99Å; S1566-D1568 PolarHBondContact O-N 2.92Å; D1568-V1570 VanDerWaalsContact C-N 3.31Å; D1568-V1570 PolarHBondContact O-N 3.28Å; D1568-S1571 PolarHBondContact O-N 3.07Å; D1568-R1572 WeakPolarHBondContact O-CB 3.4Å; D1568-R1572 WeakPolarHBondContact O-CG 3.36Å; D1568-R1572 PolarHBondContact O-N 3.23Å; D1568-R1572 PolarHBondContact O-NE 2.76Å; D1568-R1572 IonicContact OD1-NE 2.76Å; D1568-R1572 IonicContact OD2-CZ 3.33Å; D1568-R1572 VanDerWaalsContact OD2-CZ 3.24Å; D1568-R1572 IonicContact OD2-NE 3.3Å; D1568-R1572 PolarHBondContact OD2-NE 3.25Å; D1568-R1572 VanDerWaalsContact OD2-NE 3.14Å; D1568-R1572 IonicContact OD2-NH2 3.25Å; D1568-R1572 PolarHBondContact OD2-NH2 3.26Å |
| 1569 | K | 79.8 | Confident | 79.1 | Confident | 172.6 Ų | 172.6 | 71.3 Ų | 71.3 | 75% | 0.75 | 36% | 0.356 | S | S | * | . | H | α-helix | trans | -64.2 | -39.2 | 174.2 | -73.1 | -176.5 | 179.9 | 177.9 | 0 | 112.5 | H1567 R1573 | H1567-K1569 VanDerWaalsContact C-N 3.26Å; H1567-K1569 PolarHBondContact O-N 3.09Å; H1567-K1569 VanDerWaalsContact O-N 3.11Å; K1569-R1573 VanDerWaalsContact O-CB 3.3Å; K1569-R1573 WeakPolarHBondContact O-CB 3.3Å; K1569-R1573 WeakPolarHBondContact O-CG 3.38Å; K1569-R1573 PolarHBondContact O-N 3.15Å; K1569-R1573 VanDerWaalsContact O-N 3.13Å |
| 1570 | V | 83 | Confident | 78.4 | Confident | 19 Ų | 19 | 71.7 Ų | 71.7 | 12% | 0.115 | 36% | 0.358 | C | S | . | . | H | α-helix | trans | -69.1 | -44.9 | 178.4 | -179.8 | 0 | 0 | 0 | 0 | 109.3 | L1272 P1283 I1284 H1567 D1568 R1572 R1573 L1574 | L1272-V1570 HydrophobicContact CD1-CG1 4.23Å; L1272-V1570 HydrophobicContact CD2-CG1 4.07Å; L1272-V1570 HydrophobicContact CG-CG1 4.14Å; P1283-V1570 HydrophobicContact CG-CG1 4.39Å; P1283-V1570 HydrophobicContact CG-CG2 4.46Å; I1284-V1570 HydrophobicContact CD1-CG1 3.85Å; I1284-V1570 HydrophobicContact CG1-CG1 3.92Å; H1567-V1570 HydrophobicContact CB-CB 4.28Å; H1567-V1570 HydrophobicContact CB-CG2 4.2Å; H1567-V1570 WeakPolarHBondContact O-CA 3.38Å; H1567-V1570 WeakPolarHBondContact O-CB 3.27Å; H1567-V1570 PolarHBondContact O-N 3.27Å; D1568-V1570 VanDerWaalsContact C-N 3.31Å; D1568-V1570 PolarHBondContact O-N 3.28Å; V1570-R1572 PolarHBondContact O-N 3.13Å; V1570-R1573 PolarHBondContact O-N 3.32Å; V1570-L1574 VanDerWaalsContact O-CB 3.32Å; V1570-L1574 WeakPolarHBondContact O-CB 3.34Å; V1570-L1574 PolarHBondContact O-N 3.15Å |
| 1571 | S | 82.4 | Confident | 77.6 | Confident | 22.2 Ų | 22.2 | 71.7 Ų | 71.7 | 16% | 0.155 | 36% | 0.359 | C | S | . | . | H | α-helix | trans | -56.4 | -51 | 175.9 | 179.2 | 0 | 0 | 0 | 0 | 112.3 | F1561 H1567 D1568 R1573 L1574 A1575 | F1561-S1571 WeakPolarHBondContact CD2-OG 3.45Å; H1567-S1571 PolarHBondContact O-N 3.16Å; H1567-S1571 VanDerWaalsContact O-N 3.13Å; D1568-S1571 PolarHBondContact O-N 3.07Å; S1571-R1573 VanDerWaalsContact C-N 3.34Å; S1571-R1573 PolarHBondContact O-N 3.08Å; S1571-L1574 WeakPolarHBondContact O-CB 3.36Å; S1571-L1574 PolarHBondContact O-N 3.17Å; S1571-A1575 WeakPolarHBondContact O-CB 3.2Å; S1571-A1575 PolarHBondContact O-N 3.15Å |
| 1572 | R | 81.2 | Confident | 76.9 | Confident | 140 Ų | 140 | 72.1 Ų | 72.1 | 53% | 0.528 | 37% | 0.365 | S | S | . | . | H | α-helix | trans | -62.7 | -39.9 | 178.4 | -79 | -173.8 | -80.8 | 158.7 | -11.3 | 113.3 | D1033 D1568 V1570 A1575 A1576 | D1033-R1572 IonicContact OD1-CZ 3.93Å; D1033-R1572 IonicContact OD1-NH1 3.4Å; D1033-R1572 PolarHBondContact OD1-NH1 3.4Å; D1033-R1572 IonicContact OD1-NH2 3.43Å; D1033-R1572 PolarHBondContact OD1-NH2 3.29Å; D1568-R1572 WeakPolarHBondContact O-CB 3.4Å; D1568-R1572 WeakPolarHBondContact O-CG 3.36Å; D1568-R1572 PolarHBondContact O-N 3.23Å; D1568-R1572 PolarHBondContact O-NE 2.76Å; D1568-R1572 IonicContact OD1-NE 2.76Å; D1568-R1572 IonicContact OD2-CZ 3.33Å; D1568-R1572 VanDerWaalsContact OD2-CZ 3.24Å; D1568-R1572 IonicContact OD2-NE 3.3Å; D1568-R1572 PolarHBondContact OD2-NE 3.25Å; D1568-R1572 VanDerWaalsContact OD2-NE 3.14Å; D1568-R1572 IonicContact OD2-NH2 3.25Å; D1568-R1572 PolarHBondContact OD2-NH2 3.26Å; V1570-R1572 PolarHBondContact O-N 3.13Å; R1572-A1575 PolarHBondContact O-N 3.23Å; R1572-A1576 WeakPolarHBondContact O-CB 3.4Å; R1572-A1576 PolarHBondContact O-N 2.99Å |
| 1573 | R | 82.6 | Confident | 76.4 | Confident | 137.6 Ų | 137.6 | 71.2 Ų | 71.2 | 52% | 0.519 | 36% | 0.364 | S | S | . | . | H | α-helix | trans | -69.4 | -38.3 | 178.4 | -149.4 | 154.8 | 153.4 | 171.5 | -3 | 111.6 | E1268 L1272 K1569 V1570 S1571 A1576 L1577 | E1268-R1573 IonicContact OE1-CZ 3.67Å; E1268-R1573 IonicContact OE1-NE 3.68Å; E1268-R1573 PolarHBondContact OE1-NE 3.14Å; E1268-R1573 VanDerWaalsContact OE1-NE 3.09Å; E1268-R1573 IonicContact OE1-NH2 3.66Å; E1268-R1573 PolarHBondContact OE1-NH2 3.32Å; L1272-R1573 HydrophobicContact CD1-CB 4.12Å; L1272-R1573 HydrophobicContact CD1-CG 3.87Å; L1272-R1573 HydrophobicContact CD2-CB 4.4Å; K1569-R1573 VanDerWaalsContact O-CB 3.3Å; K1569-R1573 WeakPolarHBondContact O-CB 3.3Å; K1569-R1573 WeakPolarHBondContact O-CG 3.38Å; K1569-R1573 PolarHBondContact O-N 3.15Å; K1569-R1573 VanDerWaalsContact O-N 3.13Å; V1570-R1573 PolarHBondContact O-N 3.32Å; S1571-R1573 VanDerWaalsContact C-N 3.34Å; S1571-R1573 PolarHBondContact O-N 3.08Å; R1573-A1576 PolarHBondContact O-N 3.18Å; R1573-L1577 HydrophobicContact CG-CD1 4.38Å; R1573-L1577 WeakPolarHBondContact O-CB 3.15Å; R1573-L1577 VanDerWaalsContact O-CG 3.3Å; R1573-L1577 WeakPolarHBondContact O-CG 3.39Å; R1573-L1577 PolarHBondContact O-N 3.02Å |
| 1574 | L | 86 | Confident | 75.8 | Confident | 6.6 Ų | 6.6 | 67.4 Ų | 67.4 | 4% | 0.035 | 34% | 0.341 | C | S | . | . | H | α-helix | trans | -61.1 | -48.7 | 172.1 | 175.7 | 62.1 | 0 | 0 | 0 | 111 | L1269 L1272 I1284 L1550 I1557 F1561 V1570 S1571 A1576 L1577 L1578 | L1269-L1574 HydrophobicContact CD1-CD1 4.04Å; L1269-L1574 HydrophobicContact CD2-CD1 3.81Å; L1272-L1574 HydrophobicContact CD2-CB 3.72Å; L1272-L1574 HydrophobicContact CD2-CD1 4.27Å; L1272-L1574 HydrophobicContact CD2-CG 4.45Å; I1284-L1574 HydrophobicContact CD1-CD1 4.48Å; I1284-L1574 HydrophobicContact CD1-CD2 4.31Å; L1550-L1574 HydrophobicContact CB-CD1 4.44Å; L1550-L1574 HydrophobicContact CD1-CD1 3.9Å; L1550-L1574 HydrophobicContact CD2-CD1 4.27Å; L1550-L1574 HydrophobicContact CD2-CD2 4.19Å; L1550-L1574 HydrophobicContact CG-CD1 4.36Å; I1557-L1574 HydrophobicContact CG2-CD2 4.17Å; F1561-L1574 HydrophobicContact CE2-CD2 4.49Å; V1570-L1574 VanDerWaalsContact O-CB 3.32Å; V1570-L1574 WeakPolarHBondContact O-CB 3.34Å; V1570-L1574 PolarHBondContact O-N 3.15Å; S1571-L1574 WeakPolarHBondContact O-CB 3.36Å; S1571-L1574 PolarHBondContact O-N 3.17Å; L1574-A1576 VanDerWaalsContact C-N 3.32Å; L1574-A1576 PolarHBondContact O-N 3.22Å; L1574-L1577 PolarHBondContact O-N 3.24Å; L1574-L1578 HydrophobicContact CD1-CD1 3.98Å; L1574-L1578 HydrophobicContact CD1-CD2 4.5Å; L1574-L1578 HydrophobicContact CD1-CG 4.04Å; L1574-L1578 HydrophobicContact CG-CD1 4.02Å; L1574-L1578 HydrophobicContact CG-CG 4.44Å; L1574-L1578 WeakPolarHBondContact O-CB 3.37Å; L1574-L1578 WeakPolarHBondContact O-CG 3.38Å; L1574-L1578 PolarHBondContact O-N 3.08Å |
| 1575 | A | 82.8 | Confident | 75.1 | Confident | 43.2 Ų | 43.2 | 67.8 Ų | 67.8 | 36% | 0.357 | 35% | 0.349 | S | S | . | . | H | α-helix | trans | -60.6 | -40.8 | 178.4 | 0 | 0 | 0 | 0 | 0 | 112.1 | I1041 S1571 R1572 A1579 | I1041-A1575 HydrophobicContact CD1-CB 3.93Å; I1041-A1575 VanDerWaalsContact CD1-O 3.3Å; I1041-A1575 WeakPolarHBondContact CD1-O 3.46Å; S1571-A1575 WeakPolarHBondContact O-CB 3.2Å; S1571-A1575 PolarHBondContact O-N 3.15Å; R1572-A1575 PolarHBondContact O-N 3.23Å; A1575-A1579 VanDerWaalsContact O-CB 3.28Å; A1575-A1579 WeakPolarHBondContact O-CB 3.22Å; A1575-A1579 PolarHBondContact O-N 3.03Å |
| 1576 | A | 78.8 | Confident | 74.2 | Confident | 46.2 Ų | 46.2 | 60.3 Ų | 60.3 | 38% | 0.382 | 33% | 0.334 | S | S | . | . | H | α-helix | trans | -65 | -43.6 | 175.9 | 0 | 0 | 0 | 0 | 0 | 112.5 | I1041 R1572 R1573 L1574 A1579 Q1580 | I1041-A1576 HydrophobicContact CD1-CB 4.28Å; R1572-A1576 WeakPolarHBondContact O-CB 3.4Å; R1572-A1576 PolarHBondContact O-N 2.99Å; R1573-A1576 PolarHBondContact O-N 3.18Å; L1574-A1576 VanDerWaalsContact C-N 3.32Å; L1574-A1576 PolarHBondContact O-N 3.22Å; A1576-A1579 PolarHBondContact O-N 3.21Å; A1576-Q1580 WeakPolarHBondContact O-CB 3.45Å; A1576-Q1580 VanDerWaalsContact O-CG 3.31Å; A1576-Q1580 WeakPolarHBondContact O-CG 3.31Å; A1576-Q1580 PolarHBondContact O-N 3.19Å; A1576-Q1580 VanDerWaalsContact O-N 3.09Å |
| 1577 | L | 80.1 | Confident | 73.3 | Confident | 15 Ų | 15 | 63.1 Ų | 63.1 | 8% | 0.079 | 35% | 0.345 | C | S | . | . | H | α-helix | trans | -63.8 | -45.8 | 176.8 | -79.3 | 165.6 | 0 | 0 | 0 | 111.8 | M1265 E1268 L1269 L1272 R1573 L1574 A1579 Q1580 L1581 | M1265-L1577 HydrophobicContact CE-CB 4.4Å; M1265-L1577 HydrophobicContact CE-CD2 4.25Å; M1265-L1577 WeakPolarHBondContact CE-O 3.11Å; M1265-L1577 HydrophobicContact CG-CD2 4.46Å; E1268-L1577 HydrophobicContact CB-CD1 4.23Å; E1268-L1577 HydrophobicContact CB-CD2 4.34Å; E1268-L1577 HydrophobicContact CG-CD1 4.02Å; E1268-L1577 HydrophobicContact CG-CD2 4.22Å; E1268-L1577 HydrophobicContact CG-CG 4.46Å; L1269-L1577 HydrophobicContact CD1-CB 4.45Å; L1269-L1577 HydrophobicContact CD2-CB 3.95Å; L1269-L1577 HydrophobicContact CD2-CD1 4.09Å; L1272-L1577 HydrophobicContact CD1-CD1 3.84Å; L1272-L1577 HydrophobicContact CD2-CD1 4.36Å; R1573-L1577 HydrophobicContact CG-CD1 4.38Å; R1573-L1577 WeakPolarHBondContact O-CB 3.15Å; R1573-L1577 VanDerWaalsContact O-CG 3.3Å; R1573-L1577 WeakPolarHBondContact O-CG 3.39Å; R1573-L1577 PolarHBondContact O-N 3.02Å; L1574-L1577 PolarHBondContact O-N 3.24Å; L1577-A1579 VanDerWaalsContact C-N 3.32Å; L1577-A1579 PolarHBondContact O-N 3.11Å; L1577-Q1580 PolarHBondContact O-N 3.25Å; L1577-L1581 WeakPolarHBondContact O-CB 3.23Å; L1577-L1581 WeakPolarHBondContact O-CG 3.31Å; L1577-L1581 PolarHBondContact O-N 3.21Å |
| 1578 | L | 81.1 | Confident | 71.8 | Confident | 2.4 Ų | 2.4 | 63.9 Ų | 63.9 | 1% | 0.013 | 35% | 0.35 | C | S | . | . | H | α-helix | trans | -62 | -41.6 | 175.9 | -69.9 | 175.6 | 0 | 0 | 0 | 111.2 | L1269 L1550 W1551 Q1554 L1574 Q1580 L1581 G1582 | L1269-L1578 HydrophobicContact CD1-CD2 4.48Å; L1269-L1578 HydrophobicContact CD2-CD2 4.49Å; L1550-L1578 HydrophobicContact CB-CD1 4.3Å; L1550-L1578 HydrophobicContact CB-CD2 4.03Å; W1551-L1578 HydrophobicContact CE3-CB 4.14Å; W1551-L1578 HydrophobicContact CE3-CD2 4.43Å; W1551-L1578 HydrophobicContact CZ3-CB 4.29Å; W1551-L1578 VanDerWaalsContact CZ3-O 3.24Å; W1551-L1578 WeakPolarHBondContact CZ3-O 3.28Å; Q1554-L1578 HydrophobicContact CB-CD1 4.29Å; Q1554-L1578 HydrophobicContact CG-CD1 4.15Å; L1574-L1578 HydrophobicContact CD1-CD1 3.98Å; L1574-L1578 HydrophobicContact CD1-CD2 4.5Å; L1574-L1578 HydrophobicContact CD1-CG 4.04Å; L1574-L1578 HydrophobicContact CG-CD1 4.02Å; L1574-L1578 HydrophobicContact CG-CG 4.44Å; L1574-L1578 WeakPolarHBondContact O-CB 3.37Å; L1574-L1578 WeakPolarHBondContact O-CG 3.38Å; L1574-L1578 PolarHBondContact O-N 3.08Å; L1578-Q1580 VanDerWaalsContact C-N 3.27Å; L1578-Q1580 PolarHBondContact O-N 3Å; L1578-L1581 PolarHBondContact O-N 3.09Å; L1578-G1582 PolarHBondContact O-N 3.08Å |
| 1579 | A | 73.3 | Confident | 70 | Confident | 61.4 Ų | 61.4 | 64.6 Ų | 64.6 | 51% | 0.507 | 35% | 0.351 | S | S | . | . | H | α-helix | trans | -63.7 | -32.7 | 178.1 | 0 | 0 | 0 | 0 | 0 | 113.3 | I1041 P1101 Q1103 A1575 A1576 L1577 | I1041-A1579 HydrophobicContact CD1-CB 3.74Å; I1041-A1579 HydrophobicContact CG2-CB 3.93Å; P1101-A1579 HydrophobicContact CG-CB 3.8Å; Q1103-A1579 HydrophobicContact CG-CB 4.5Å; Q1103-A1579 PolarHBondContact NE2-O 2.84Å; A1575-A1579 VanDerWaalsContact O-CB 3.28Å; A1575-A1579 WeakPolarHBondContact O-CB 3.22Å; A1575-A1579 PolarHBondContact O-N 3.03Å; A1576-A1579 PolarHBondContact O-N 3.21Å; L1577-A1579 VanDerWaalsContact C-N 3.32Å; L1577-A1579 PolarHBondContact O-N 3.11Å |
| 1580 | Q | 69.7 | Low | 68.1 | Low | 128.8 Ų | 128.8 | 57.5 Ų | 57.5 | 60% | 0.602 | 32% | 0.324 | S | S | * | . | H | α-helix | trans | -78.5 | -41.3 | 175.8 | -71.9 | 174.7 | -10.1 | 0 | 0 | 112.4 | P1101 K1118 M1265 A1576 L1577 L1578 G1582 | P1101-Q1580 HydrophobicContact CB-CG 4.06Å; K1118-Q1580 PolarHBondContact NZ-O 3.23Å; M1265-Q1580 HydrophobicContact CE-CB 3.24Å; M1265-Q1580 HydrophobicContact CE-CG 4.23Å; M1265-Q1580 HydrophobicContact SD-CB 4.06Å; A1576-Q1580 WeakPolarHBondContact O-CB 3.45Å; A1576-Q1580 VanDerWaalsContact O-CG 3.31Å; A1576-Q1580 WeakPolarHBondContact O-CG 3.31Å; A1576-Q1580 PolarHBondContact O-N 3.19Å; A1576-Q1580 VanDerWaalsContact O-N 3.09Å; L1577-Q1580 PolarHBondContact O-N 3.25Å; L1578-Q1580 VanDerWaalsContact C-N 3.27Å; L1578-Q1580 PolarHBondContact O-N 3Å; Q1580-G1582 VanDerWaalsContact C-N 3.32Å; Q1580-G1582 PolarHBondContact O-N 2.88Å |
| 1581 | L | 69.8 | Low | 66.1 | Low | 28 Ų | 28 | 62.8 Ų | 62.8 | 15% | 0.147 | 35% | 0.346 | C | S | . | . | H | α-helix | trans | -67.7 | -31.8 | 177 | -79 | 163.3 | 0 | 0 | 0 | 112.6 | M1265 F1266 L1269 L1577 L1578 | M1265-L1581 HydrophobicContact CB-CD1 4.35Å; M1265-L1581 HydrophobicContact CB-CD2 3.89Å; M1265-L1581 HydrophobicContact CB-CG 4.25Å; M1265-L1581 HydrophobicContact CE-CB 4.43Å; M1265-L1581 HydrophobicContact CE-CD1 4.31Å; M1265-L1581 HydrophobicContact CE-CD2 4.38Å; M1265-L1581 HydrophobicContact CE-CG 4.09Å; M1265-L1581 HydrophobicContact SD-CD2 4.35Å; M1265-L1581 HydrophobicContact SD-CG 4.12Å; F1266-L1581 HydrophobicContact CE1-CD2 4.31Å; F1266-L1581 HydrophobicContact CE2-CD2 4.31Å; F1266-L1581 HydrophobicContact CZ-CD2 4.12Å; L1269-L1581 HydrophobicContact CD1-CD1 4.06Å; L1269-L1581 HydrophobicContact CD2-CD1 4.48Å; L1269-L1581 HydrophobicContact CG-CD1 4.01Å; L1577-L1581 WeakPolarHBondContact O-CB 3.23Å; L1577-L1581 WeakPolarHBondContact O-CG 3.31Å; L1577-L1581 PolarHBondContact O-N 3.21Å; L1578-L1581 PolarHBondContact O-N 3.09Å |
| 1582 | G | 69.3 | Low | 64 | Low | 13.2 Ų | 13.2 | 65.3 Ų | 65.3 | 14% | 0.136 | 36% | 0.355 | C | S | . | . | trans | 72.3 | -174 | -177.1 | 0 | 0 | 0 | 0 | 0 | 113.6 | H1547 L1578 Q1580 | H1547-G1582 PolarHBondContact CE1-O 3.02Å; H1547-G1582 PolarHBondContact NE2-O 3.23Å; H1547-G1582 VanDerWaalsContact NE2-O 3.11Å; L1578-G1582 PolarHBondContact O-N 3.08Å; Q1580-G1582 VanDerWaalsContact C-N 3.32Å; Q1580-G1582 PolarHBondContact O-N 2.88Å | ||
| 1583 | P | 70 | Confident | 61.9 | Low | 79 Ų | 79 | 61.9 Ų | 61.9 | 51% | 0.513 | 34% | 0.342 | S | S | . | . | S | Bend | trans | -66.1 | 142.3 | 179.7 | 26.4 | -32.6 | 0 | 0 | 0 | 111.8 | W1551 | W1551-P1583 VanDerWaalsContact CE2-CA 3.47Å; W1551-P1583 HydrophobicContact CH2-CB 4.46Å; W1551-P1583 HydrophobicContact CZ2-CB 3.76Å; W1551-P1583 HydrophobicContact CZ2-CG 4.36Å |
| 1584 | P | 67.4 | Low | 59.9 | Low | 26.6 Ų | 26.6 | 58.6 Ų | 58.6 | 17% | 0.173 | 34% | 0.338 | C | S | . | . | trans | -66 | 144.6 | 176.5 | 28 | -35.3 | 0 | 0 | 0 | 112.1 | Y1544 F1548 W1551 G1586 | Y1544-P1584 HydrophobicContact CE2-CB 4.46Å; F1548-P1584 HydrophobicContact CB-CB 4.31Å; F1548-P1584 HydrophobicContact CB-CG 4.23Å; F1548-P1584 HydrophobicContact CD2-CB 4.39Å; F1548-P1584 HydrophobicContact CD2-CG 3.84Å; F1548-P1584 HydrophobicContact CG-CG 4.38Å; W1551-P1584 HydrophobicContact CB-CG 4.32Å; W1551-P1584 VanDerWaalsContact CD1-CD 3.44Å; W1551-P1584 VanDerWaalsContact CG-CD 3.47Å; W1551-P1584 HydrophobicContact CG-CG 4.35Å; P1584-G1586 PolarHBondContact O-N 3.06Å | ||
| 1585 | D | 55.2 | Low | 57.8 | Low | 123.4 Ų | 123.4 | 60.4 Ų | 60.4 | 66% | 0.66 | 35% | 0.347 | S | S | * | . | S | Bend | trans | -66.2 | 102 | 179.5 | -74.6 | -38.5 | 0 | 0 | 0 | 112.9 | V1111 Y1544 D1587 | V1111-D1585 WeakPolarHBondContact CG2-OD1 3.48Å; Y1544-D1585 PolarHBondContact OH-N 2.82Å; Y1544-D1585 VanDerWaalsContact OH-N 3.12Å; Y1544-D1585 PolarHBondContact OH-O 2.79Å; D1585-D1587 VanDerWaalsContact C-N 3.3Å; D1585-D1587 PolarHBondContact O-N 2.99Å |
| 1586 | G | 48.7 | Very low | 55.7 | Low | 42.2 Ų | 42.2 | 62.2 Ų | 62.2 | 44% | 0.435 | 35% | 0.354 | S | S | . | . | S | Bend | trans | 36.2 | 135.2 | -175.5 | 0 | 0 | 0 | 0 | 0 | 116.2 | P1584 L1588 | P1584-G1586 PolarHBondContact O-N 3.06Å; G1586-L1588 VanDerWaalsContact C-N 3.28Å; G1586-L1588 PolarHBondContact O-N 3.16Å |
| 1587 | D | 46.2 | Very low | 53.9 | Low | 105.2 Ų | 105.2 | 61.5 Ų | 61.5 | 56% | 0.563 | 35% | 0.351 | S | S | * | . | trans | -80.5 | 62 | -176.4 | -77.3 | -25.6 | 0 | 0 | 0 | 112.4 | F1548 D1585 E1589 A1590 | F1548-D1587 WeakPolarHBondContact CE2-OD1 3.33Å; F1548-D1587 VanDerWaalsContact CZ-OD1 3.3Å; F1548-D1587 WeakPolarHBondContact CZ-OD1 3.35Å; D1585-D1587 VanDerWaalsContact C-N 3.3Å; D1585-D1587 PolarHBondContact O-N 2.99Å; D1587-E1589 VanDerWaalsContact C-N 3.28Å; D1587-E1589 PolarHBondContact O-N 3.16Å; D1587-E1589 VanDerWaalsContact O-N 3.13Å; D1587-A1590 WeakPolarHBondContact O-CB 3.29Å; D1587-A1590 PolarHBondContact O-N 3.41Å | ||
| 1588 | L | 43.8 | Very low | 52.4 | Low | 53.4 Ų | 53.4 | 62.8 Ų | 62.8 | 28% | 0.28 | 36% | 0.356 | S | S | . | . | trans | -72.5 | 11.4 | 179.1 | -90.3 | 135.7 | 0 | 0 | 0 | 113.1 | Y1544 F1548 G1586 A1590 K1591 Q1592 | Y1544-L1588 HydrophobicContact CD1-CD1 3.98Å; Y1544-L1588 HydrophobicContact CE1-CD1 3.84Å; Y1544-L1588 HydrophobicContact CG-CD1 4.31Å; Y1544-L1588 WeakPolarHBondContact O-CD1 3.37Å; F1548-L1588 HydrophobicContact CB-CB 4.26Å; F1548-L1588 HydrophobicContact CB-CD1 3.93Å; F1548-L1588 HydrophobicContact CD1-CB 4.35Å; F1548-L1588 HydrophobicContact CD2-CB 4.37Å; F1548-L1588 HydrophobicContact CD2-CD1 4.4Å; F1548-L1588 HydrophobicContact CG-CB 4.07Å; F1548-L1588 HydrophobicContact CG-CD1 4.11Å; G1586-L1588 VanDerWaalsContact C-N 3.28Å; G1586-L1588 PolarHBondContact O-N 3.16Å; L1588-A1590 VanDerWaalsContact C-N 3.25Å; L1588-A1590 PolarHBondContact O-N 3.22Å; L1588-A1590 VanDerWaalsContact O-N 3.1Å; L1588-K1591 HydrophobicContact CD2-CB 4.33Å; L1588-K1591 HydrophobicContact CD2-CD 4.45Å; L1588-K1591 PolarHBondContact O-N 3.17Å; L1588-Q1592 VanDerWaalsContact CD2-CD 3.48Å; L1588-Q1592 HydrophobicContact CD2-CG 4.45Å; L1588-Q1592 VanDerWaalsContact CD2-OE1 3.28Å; L1588-Q1592 PolarHBondContact O-N 3.42Å | ||
| 1589 | E | 39.6 | Very low | 51.2 | Low | 90.2 Ų | 90.2 | 65.8 Ų | 65.8 | 42% | 0.421 | 37% | 0.374 | S | S | . | . | H | α-helix | trans | -53.3 | 5.6 | 170.4 | -70.9 | -166.5 | 152.1 | 0 | 0 | 110.7 | H1296 F1548 D1587 K1591 Q1592 W1593 | H1296-E1589 VanDerWaalsContact CE1-CD 3.43Å; H1296-E1589 IonicContact CE1-OE1 3.45Å; H1296-E1589 PolarHBondContact CE1-OE1 3.21Å; H1296-E1589 IonicContact CE1-OE2 3.31Å; H1296-E1589 PolarHBondContact CE1-OE2 3.21Å; H1296-E1589 IonicContact CG-OE1 2.93Å; H1296-E1589 VanDerWaalsContact ND1-CD 3.34Å; H1296-E1589 IonicContact ND1-OE1 2.78Å; H1296-E1589 PolarHBondContact ND1-OE1 2.95Å; H1296-E1589 IonicContact ND1-OE2 3.26Å; H1296-E1589 PolarHBondContact ND1-OE2 3.34Å; F1548-E1589 HydrophobicContact CE1-CG 4.27Å; D1587-E1589 VanDerWaalsContact C-N 3.28Å; D1587-E1589 PolarHBondContact O-N 3.16Å; D1587-E1589 VanDerWaalsContact O-N 3.13Å; E1589-K1591 HydrophobicContact CB-CB 4.44Å; E1589-K1591 HydrophobicContact CB-CG 4.44Å; E1589-K1591 PolarHBondContact O-N 3.08Å; E1589-K1591 IonicContact OE1-NZ 3.58Å; E1589-K1591 PolarHBondContact OE1-NZ 3.14Å; E1589-K1591 VanDerWaalsContact OE2-CD 3.32Å; E1589-K1591 WeakPolarHBondContact OE2-CD 3.32Å; E1589-K1591 WeakPolarHBondContact OE2-CE 3.38Å; E1589-K1591 IonicContact OE2-NZ 2.7Å; E1589-K1591 PolarHBondContact OE2-NZ 3.14Å; E1589-Q1592 PolarHBondContact O-N 3.49Å; E1589-Q1592 VanDerWaalsContact O-N 3.07Å; E1589-W1593 WeakPolarHBondContact O-CB 3.45Å; E1589-W1593 PolarHBondContact O-N 3.09Å; E1589-W1593 PolarHBondContact O-NE1 3.27Å |
| 1590 | A | 38.7 | Very low | 50.5 | Low | 23.2 Ų | 23.2 | 64.3 Ų | 64.3 | 19% | 0.192 | 36% | 0.36 | C | S | . | . | H | α-helix | trans | -49.8 | -36.5 | 173.9 | 0 | 0 | 0 | 0 | 0 | 115.2 | D1033 D1587 L1588 Q1592 W1593 V1594 | D1033-A1590 HydrophobicContact CB-CB 3.4Å; D1587-A1590 WeakPolarHBondContact O-CB 3.29Å; D1587-A1590 PolarHBondContact O-N 3.41Å; L1588-A1590 VanDerWaalsContact C-N 3.25Å; L1588-A1590 PolarHBondContact O-N 3.22Å; L1588-A1590 VanDerWaalsContact O-N 3.1Å; A1590-Q1592 VanDerWaalsContact C-N 3.31Å; A1590-Q1592 PolarHBondContact O-N 3.23Å; A1590-W1593 PolarHBondContact O-N 2.98Å; A1590-V1594 VanDerWaalsContact O-CG2 3.31Å; A1590-V1594 WeakPolarHBondContact O-CG2 3.46Å; A1590-V1594 PolarHBondContact O-N 3.5Å |
| 1591 | K | 40.5 | Very low | 50.2 | Low | 132 Ų | 132 | 60.9 Ų | 60.9 | 57% | 0.574 | 35% | 0.35 | S | S | * | . | H | α-helix | trans | -67.8 | -27.2 | -174.8 | -68.3 | -178.9 | -177.1 | 163.6 | 0 | 113.8 | L1588 E1589 W1593 N1595 | L1588-K1591 HydrophobicContact CD2-CB 4.33Å; L1588-K1591 HydrophobicContact CD2-CD 4.45Å; L1588-K1591 PolarHBondContact O-N 3.17Å; E1589-K1591 HydrophobicContact CB-CB 4.44Å; E1589-K1591 HydrophobicContact CB-CG 4.44Å; E1589-K1591 PolarHBondContact O-N 3.08Å; E1589-K1591 IonicContact OE1-NZ 3.58Å; E1589-K1591 PolarHBondContact OE1-NZ 3.14Å; E1589-K1591 VanDerWaalsContact OE2-CD 3.32Å; E1589-K1591 WeakPolarHBondContact OE2-CD 3.32Å; E1589-K1591 WeakPolarHBondContact OE2-CE 3.38Å; E1589-K1591 IonicContact OE2-NZ 2.7Å; E1589-K1591 PolarHBondContact OE2-NZ 3.14Å; K1591-W1593 VanDerWaalsContact C-N 3.33Å; K1591-W1593 PolarHBondContact O-N 3.01Å; K1591-N1595 PolarHBondContact O-ND2 3.32Å |
| 1592 | Q | 39.7 | Very low | 50 | Low | 73 Ų | 73 | 65.7 Ų | 65.7 | 34% | 0.341 | 37% | 0.367 | S | S | . | . | H | α-helix | trans | -86 | -26.8 | -179.8 | -90.5 | -175 | 10.4 | 0 | 0 | 114.2 | T1541 L1588 E1589 A1590 V1594 N1595 R1729 | T1541-Q1592 HydrophobicContact CG2-CG 4.3Å; L1588-Q1592 VanDerWaalsContact CD2-CD 3.48Å; L1588-Q1592 HydrophobicContact CD2-CG 4.45Å; L1588-Q1592 VanDerWaalsContact CD2-OE1 3.28Å; L1588-Q1592 PolarHBondContact O-N 3.42Å; E1589-Q1592 PolarHBondContact O-N 3.49Å; E1589-Q1592 VanDerWaalsContact O-N 3.07Å; A1590-Q1592 VanDerWaalsContact C-N 3.31Å; A1590-Q1592 PolarHBondContact O-N 3.23Å; Q1592-V1594 PolarHBondContact O-N 3.27Å; Q1592-V1594 VanDerWaalsContact O-N 3.12Å; Q1592-N1595 PolarHBondContact O-N 3.26Å; Q1592-R1729 VanDerWaalsContact NE2-NH1 3.19Å |
| 1593 | W | 37.3 | Very low | 50.1 | Low | 70 Ų | 70 | 65.4 Ų | 65.4 | 27% | 0.265 | 36% | 0.362 | S | S | . | . | H | α-helix | trans | -77.3 | -20.5 | -170.1 | -70.4 | 53.6 | 0 | 0 | 0 | 113.7 | R987 D1298 A1545 F1548 L1549 E1589 A1590 K1591 N1595 V1596 | R987-W1593 HydrophobicContact CG-CE3 4.45Å; R987-W1593 VanDerWaalsContact NH2-CH2 3.28Å; D1298-W1593 HydrophobicContact CB-CH2 4.02Å; A1545-W1593 VanDerWaalsContact C-CH2 3.47Å; A1545-W1593 HydrophobicContact CB-CD2 4.18Å; A1545-W1593 HydrophobicContact CB-CE3 3.98Å; A1545-W1593 HydrophobicContact CB-CH2 3.78Å; A1545-W1593 HydrophobicContact CB-CZ2 4.2Å; A1545-W1593 HydrophobicContact CB-CZ3 3.66Å; A1545-W1593 VanDerWaalsContact CB-CZ3 3.4Å; A1545-W1593 WeakPolarHBondContact O-CH2 3.36Å; A1545-W1593 VanDerWaalsContact O-CZ3 3.26Å; A1545-W1593 WeakPolarHBondContact O-CZ3 3.18Å; F1548-W1593 HydrophobicContact CB-CH2 3.51Å; F1548-W1593 VanDerWaalsContact CB-CH2 3.49Å; F1548-W1593 HydrophobicContact CB-CZ2 3.4Å; F1548-W1593 VanDerWaalsContact CB-CZ2 3.41Å; F1548-W1593 AromaticContact CD1-CH2 3.08Å; F1548-W1593 HydrophobicContact CD1-CH2 3.08Å; F1548-W1593 AromaticContact CD1-CZ2 3.22Å; F1548-W1593 HydrophobicContact CD1-CZ2 3.22Å; F1548-W1593 HydrophobicContact CD1-CZ3 4.09Å; F1548-W1593 AromaticContact CD2-CZ2 3.96Å; F1548-W1593 HydrophobicContact CD2-CZ2 4.04Å; F1548-W1593 AromaticContact CE1-CH2 3.83Å; F1548-W1593 HydrophobicContact CE1-CH2 3.93Å; F1548-W1593 AromaticContact CE1-CZ2 3.79Å; F1548-W1593 HydrophobicContact CE1-CZ2 3.92Å; F1548-W1593 AromaticContact CG-CH2 3.51Å; F1548-W1593 HydrophobicContact CG-CH2 3.51Å; F1548-W1593 VanDerWaalsContact CG-CH2 3.49Å; F1548-W1593 AromaticContact CG-CZ2 3.27Å; F1548-W1593 HydrophobicContact CG-CZ2 3.27Å; F1548-W1593 HydrophobicContact CZ-CZ2 4.43Å; L1549-W1593 HydrophobicContact CD1-CZ3 3.96Å; L1549-W1593 HydrophobicContact CD2-CH2 4.17Å; L1549-W1593 HydrophobicContact CD2-CZ3 4.04Å; L1549-W1593 HydrophobicContact CG-CH2 3.9Å; L1549-W1593 HydrophobicContact CG-CZ3 3.65Å; E1589-W1593 WeakPolarHBondContact O-CB 3.45Å; E1589-W1593 PolarHBondContact O-N 3.09Å; E1589-W1593 PolarHBondContact O-NE1 3.27Å; A1590-W1593 PolarHBondContact O-N 2.98Å; K1591-W1593 VanDerWaalsContact C-N 3.33Å; K1591-W1593 PolarHBondContact O-N 3.01Å; W1593-N1595 PolarHBondContact O-N 3.47Å; W1593-N1595 VanDerWaalsContact O-N 3.15Å; W1593-V1596 PolarHBondContact O-N 3.45Å |
| 1594 | V | 40.2 | Very low | 50.3 | Low | 68.6 Ų | 68.6 | 63.1 Ų | 63.1 | 42% | 0.416 | 34% | 0.344 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -75.4 | -25.9 | 178.1 | -178.1 | 0 | 0 | 0 | 0 | 111.4 | A1590 Q1592 V1596 F1598 | A1590-V1594 VanDerWaalsContact O-CG2 3.31Å; A1590-V1594 WeakPolarHBondContact O-CG2 3.46Å; A1590-V1594 PolarHBondContact O-N 3.5Å; Q1592-V1594 PolarHBondContact O-N 3.27Å; Q1592-V1594 VanDerWaalsContact O-N 3.12Å; V1594-V1596 PolarHBondContact O-N 3.2Å; V1594-F1598 HydrophobicContact CB-CD2 4.44Å; V1594-F1598 HydrophobicContact CG1-CD2 3.83Å; V1594-F1598 VanDerWaalsContact CG1-CD2 3.48Å; V1594-F1598 HydrophobicContact CG1-CE2 3.78Å; V1594-F1598 HydrophobicContact CG1-CG 4.22Å; V1594-F1598 HydrophobicContact CG1-CZ 4.31Å; V1594-F1598 WeakPolarHBondContact O-CB 3.41Å; V1594-F1598 WeakPolarHBondContact O-CD2 3.37Å; V1594-F1598 PolarHBondContact O-N 3.24Å |
| 1595 | N | 40.6 | Very low | 50.4 | Low | 43.6 Ų | 43.6 | 66.3 Ų | 66.3 | 23% | 0.233 | 36% | 0.357 | C | S | . | . | G | 310 helix | trans | -91.2 | 1 | -165.6 | -79.4 | -15.6 | 0 | 0 | 0 | 115.8 | K1591 Q1592 W1593 G1597 F1598 S1694 K1695 V1698 | K1591-N1595 PolarHBondContact O-ND2 3.32Å; Q1592-N1595 PolarHBondContact O-N 3.26Å; W1593-N1595 PolarHBondContact O-N 3.47Å; W1593-N1595 VanDerWaalsContact O-N 3.15Å; N1595-G1597 VanDerWaalsContact C-N 3.32Å; N1595-G1597 PolarHBondContact O-N 3.2Å; N1595-F1598 HydrophobicContact CB-CD2 3.89Å; N1595-F1598 HydrophobicContact CB-CE2 3.6Å; N1595-F1598 HydrophobicContact CB-CZ 4.45Å; N1595-F1598 WeakPolarHBondContact ND2-CE2 3.48Å; N1595-F1598 WeakPolarHBondContact O-CD2 3.32Å; N1595-F1598 PolarHBondContact O-N 3.09Å; N1595-S1694 PolarHBondContact ND2-OG 2.95Å; N1595-K1695 WeakPolarHBondContact OD1-CG 3.38Å; N1595-V1698 HydrophobicContact CB-CB 4.36Å; N1595-V1698 HydrophobicContact CB-CG1 4.09Å; N1595-V1698 HydrophobicContact CB-CG2 3.99Å; N1595-V1698 VanDerWaalsContact O-CG1 3.27Å; N1595-V1698 WeakPolarHBondContact O-CG1 3.41Å |
| 1596 | V | 39.8 | Very low | 51.2 | Low | 81.6 Ų | 81.6 | 63.2 Ų | 63.2 | 50% | 0.495 | 34% | 0.34 | S | S | . | . | G | 310 helix | trans | -86.8 | 1.3 | 176.1 | -169.5 | 0 | 0 | 0 | 0 | 112.2 | R1302 Y1537 W1593 V1594 | R1302-V1596 VanDerWaalsContact NH1-CG2 3.33Å; Y1537-V1596 HydrophobicContact CD1-CG1 4.44Å; Y1537-V1596 HydrophobicContact CE1-CG1 3.71Å; W1593-V1596 PolarHBondContact O-N 3.45Å; V1594-V1596 PolarHBondContact O-N 3.2Å |
| 1597 | G | 40.7 | Very low | 52.4 | Low | 31.4 Ų | 31.4 | 61.5 Ų | 61.5 | 32% | 0.324 | 32% | 0.32 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -114.5 | 6.9 | 174 | 0 | 0 | 0 | 0 | 0 | 114.7 | N1595 T1599 R1602 | N1595-G1597 VanDerWaalsContact C-N 3.32Å; N1595-G1597 PolarHBondContact O-N 3.2Å; G1597-T1599 PolarHBondContact O-N 3.21Å; G1597-T1599 VanDerWaalsContact O-N 3.12Å; G1597-R1602 WeakPolarHBondContact O-CD 3.46Å; G1597-R1602 PolarHBondContact O-NH1 3.41Å |
| 1598 | F | 49.7 | Very low | 53.8 | Low | 41 Ų | 41 | 61.8 Ų | 61.8 | 18% | 0.18 | 32% | 0.318 | C | S | . | . | trans | -83.1 | 92.3 | 176.8 | -93.5 | -88.6 | 0 | 0 | 0 | 110 | V1594 N1595 R1602 F1603 L1606 V1698 | V1594-F1598 HydrophobicContact CB-CD2 4.44Å; V1594-F1598 HydrophobicContact CG1-CD2 3.83Å; V1594-F1598 VanDerWaalsContact CG1-CD2 3.48Å; V1594-F1598 HydrophobicContact CG1-CE2 3.78Å; V1594-F1598 HydrophobicContact CG1-CG 4.22Å; V1594-F1598 HydrophobicContact CG1-CZ 4.31Å; V1594-F1598 WeakPolarHBondContact O-CB 3.41Å; V1594-F1598 WeakPolarHBondContact O-CD2 3.37Å; V1594-F1598 PolarHBondContact O-N 3.24Å; N1595-F1598 HydrophobicContact CB-CD2 3.89Å; N1595-F1598 HydrophobicContact CB-CE2 3.6Å; N1595-F1598 HydrophobicContact CB-CZ 4.45Å; N1595-F1598 WeakPolarHBondContact ND2-CE2 3.48Å; N1595-F1598 WeakPolarHBondContact O-CD2 3.32Å; N1595-F1598 PolarHBondContact O-N 3.09Å; F1598-R1602 HydrophobicContact CD1-CB 3.91Å; F1598-R1602 HydrophobicContact CD1-CG 4Å; F1598-R1602 HydrophobicContact CE1-CB 4.3Å; F1598-R1602 HydrophobicContact CE1-CG 3.95Å; F1598-F1603 VanDerWaalsContact CD1-CA 3.49Å; F1598-F1603 HydrophobicContact CD1-CB 3.8Å; F1598-F1603 AromaticContact CD1-CD2 3.8Å; F1598-F1603 HydrophobicContact CD1-CD2 3.93Å; F1598-F1603 HydrophobicContact CD1-CG 4.33Å; F1598-F1603 VanDerWaalsContact CD1-N 3.31Å; F1598-F1603 HydrophobicContact CE1-CB 4.2Å; F1598-F1603 AromaticContact CE1-CD2 3.77Å; F1598-F1603 HydrophobicContact CE1-CD2 3.92Å; F1598-F1603 HydrophobicContact CE1-CG 4.32Å; F1598-F1603 HydrophobicContact CG-CB 4.29Å; F1598-L1606 HydrophobicContact CE1-CB 4.44Å; F1598-L1606 HydrophobicContact CE1-CD1 4.38Å; F1598-L1606 HydrophobicContact CZ-CD1 4.01Å; F1598-V1698 WeakPolarHBondContact O-CG1 3.3Å | ||
| 1599 | T | 54.7 | Low | 55 | Low | 65.4 Ų | 65.4 | 66.1 Ų | 66.1 | 40% | 0.401 | 34% | 0.335 | S | S | . | . | trans | -70 | 154.3 | 156.1 | 51.5 | 0 | 0 | 0 | 0 | 109.2 | G1597 S1601 R1602 F1603 | G1597-T1599 PolarHBondContact O-N 3.21Å; G1597-T1599 VanDerWaalsContact O-N 3.12Å; T1599-S1601 PolarHBondContact O-N 3.04Å; T1599-S1601 VanDerWaalsContact O-N 3.12Å; T1599-S1601 PolarHBondContact OG1-OG 3.25Å; T1599-S1601 VanDerWaalsContact OG1-OG 3.04Å; T1599-R1602 PolarHBondContact O-N 3.04Å; T1599-R1602 PolarHBondContact OG1-N 2.96Å; T1599-F1603 PolarHBondContact O-N 3.14Å; T1599-F1603 VanDerWaalsContact O-N 3.1Å | ||
| 1600 | C | 58.5 | Low | 56.4 | Low | 31 Ų | 31 | 63.9 Ų | 63.9 | 21% | 0.209 | 33% | 0.325 | C | S | . | . | H | α-helix | trans | -44.9 | -43.4 | 174.3 | -171.1 | 0 | 0 | 0 | 0 | 112.1 | R1602 F1603 E1604 V1699 | C1600-R1602 PolarHBondContact O-N 2.92Å; C1600-F1603 PolarHBondContact O-N 3.34Å; C1600-E1604 WeakPolarHBondContact O-CB 3.33Å; C1600-E1604 PolarHBondContact O-N 3.2Å; C1600-V1699 WeakPolarHBondContact CA-O 3.39Å; C1600-V1699 VanDerWaalsContact CB-O 3.27Å; C1600-V1699 WeakPolarHBondContact CB-O 3.29Å; C1600-V1699 PolarHBondContact SG-O 3.12Å; C1600-V1699 VanDerWaalsContact SG-O 3.36Å |
| 1601 | S | 64.6 | Low | 57.8 | Low | 57.4 Ų | 57.4 | 64.6 Ų | 64.6 | 40% | 0.401 | 33% | 0.328 | S | S | . | . | H | α-helix | trans | -61.6 | -43.2 | 179.9 | 50.5 | 0 | 0 | 0 | 0 | 113.5 | T1599 F1603 E1604 E1605 | T1599-S1601 PolarHBondContact O-N 3.04Å; T1599-S1601 VanDerWaalsContact O-N 3.12Å; T1599-S1601 PolarHBondContact OG1-OG 3.25Å; T1599-S1601 VanDerWaalsContact OG1-OG 3.04Å; S1601-F1603 VanDerWaalsContact C-N 3.34Å; S1601-F1603 PolarHBondContact O-N 2.91Å; S1601-E1604 PolarHBondContact O-N 3.18Å; S1601-E1605 VanDerWaalsContact O-CB 3.27Å; S1601-E1605 WeakPolarHBondContact O-CB 3.3Å; S1601-E1605 PolarHBondContact O-N 3.26Å |
| 1602 | R | 65.7 | Low | 59.1 | Low | 129.2 Ų | 129.2 | 60.2 Ų | 60.2 | 49% | 0.488 | 32% | 0.316 | S | S | . | . | H | α-helix | trans | -72.3 | -34.4 | -179.1 | -161.1 | 176 | -174.2 | 173.4 | 1.2 | 112.1 | G1597 F1598 T1599 C1600 L1606 | G1597-R1602 WeakPolarHBondContact O-CD 3.46Å; G1597-R1602 PolarHBondContact O-NH1 3.41Å; F1598-R1602 HydrophobicContact CD1-CB 3.91Å; F1598-R1602 HydrophobicContact CD1-CG 4Å; F1598-R1602 HydrophobicContact CE1-CB 4.3Å; F1598-R1602 HydrophobicContact CE1-CG 3.95Å; T1599-R1602 PolarHBondContact O-N 3.04Å; T1599-R1602 PolarHBondContact OG1-N 2.96Å; C1600-R1602 PolarHBondContact O-N 2.92Å; R1602-L1606 VanDerWaalsContact O-CB 3.25Å; R1602-L1606 WeakPolarHBondContact O-CB 3.33Å; R1602-L1606 PolarHBondContact O-N 2.98Å; R1602-L1606 VanDerWaalsContact O-N 3.12Å |
| 1603 | F | 71.3 | Confident | 60.3 | Low | 6.6 Ų | 6.6 | 59.4 Ų | 59.4 | 3% | 0.029 | 32% | 0.322 | C | S | . | . | H | α-helix | trans | -65.2 | -46.6 | 173.3 | -176.2 | -95.3 | 0 | 0 | 0 | 110.7 | F1598 T1599 C1600 S1601 E1605 L1606 M1607 N1655 I1658 Y1659 I1662 V1699 | F1598-F1603 VanDerWaalsContact CD1-CA 3.49Å; F1598-F1603 HydrophobicContact CD1-CB 3.8Å; F1598-F1603 AromaticContact CD1-CD2 3.8Å; F1598-F1603 HydrophobicContact CD1-CD2 3.93Å; F1598-F1603 HydrophobicContact CD1-CG 4.33Å; F1598-F1603 VanDerWaalsContact CD1-N 3.31Å; F1598-F1603 HydrophobicContact CE1-CB 4.2Å; F1598-F1603 AromaticContact CE1-CD2 3.77Å; F1598-F1603 HydrophobicContact CE1-CD2 3.92Å; F1598-F1603 HydrophobicContact CE1-CG 4.32Å; F1598-F1603 HydrophobicContact CG-CB 4.29Å; T1599-F1603 PolarHBondContact O-N 3.14Å; T1599-F1603 VanDerWaalsContact O-N 3.1Å; C1600-F1603 PolarHBondContact O-N 3.34Å; S1601-F1603 VanDerWaalsContact C-N 3.34Å; S1601-F1603 PolarHBondContact O-N 2.91Å; F1603-E1605 PolarHBondContact O-N 3.18Å; F1603-L1606 PolarHBondContact O-N 3.09Å; F1603-M1607 HydrophobicContact CD1-CG 3.99Å; F1603-M1607 HydrophobicContact CD2-CE 4.46Å; F1603-M1607 HydrophobicContact CD2-CG 4.38Å; F1603-M1607 HydrophobicContact CE1-CE 4.03Å; F1603-M1607 HydrophobicContact CE1-CG 3.6Å; F1603-M1607 VanDerWaalsContact CE1-CG 3.45Å; F1603-M1607 HydrophobicContact CE1-SD 4.3Å; F1603-M1607 HydrophobicContact CE2-CE 3.96Å; F1603-M1607 HydrophobicContact CE2-CG 4.11Å; F1603-M1607 HydrophobicContact CE2-SD 4.23Å; F1603-M1607 HydrophobicContact CG-CG 4.31Å; F1603-M1607 HydrophobicContact CZ-CE 4Å; F1603-M1607 HydrophobicContact CZ-CG 3.73Å; F1603-M1607 HydrophobicContact CZ-SD 3.98Å; F1603-M1607 WeakPolarHBondContact O-CB 3.41Å; F1603-M1607 VanDerWaalsContact O-CG 3.31Å; F1603-M1607 WeakPolarHBondContact O-CG 3.26Å; F1603-M1607 PolarHBondContact O-N 3.16Å; F1603-N1655 HydrophobicContact CE2-CB 4.42Å; F1603-N1655 HydrophobicContact CZ-CB 4.26Å; F1603-I1658 HydrophobicContact CD1-CG2 4.34Å; F1603-I1658 HydrophobicContact CE1-CB 4.16Å; F1603-I1658 HydrophobicContact CE1-CG2 3.6Å; F1603-I1658 HydrophobicContact CZ-CB 4.09Å; F1603-I1658 HydrophobicContact CZ-CG2 3.88Å; F1603-Y1659 HydrophobicContact CE1-CD2 4.5Å; F1603-I1662 HydrophobicContact CD1-CD1 3.79Å; F1603-I1662 HydrophobicContact CE1-CD1 4.03Å; F1603-V1699 HydrophobicContact CB-CG1 3.77Å; F1603-V1699 HydrophobicContact CB-CG2 4.36Å; F1603-V1699 HydrophobicContact CD1-CG1 3.57Å; F1603-V1699 VanDerWaalsContact CD1-CG1 3.46Å; F1603-V1699 HydrophobicContact CD2-CG1 4.28Å; F1603-V1699 HydrophobicContact CD2-CG2 4.13Å; F1603-V1699 HydrophobicContact CE1-CG1 4.21Å; F1603-V1699 HydrophobicContact CG-CB 4.48Å; F1603-V1699 HydrophobicContact CG-CG1 3.6Å; F1603-V1699 HydrophobicContact CG-CG2 4.21Å |
| 1604 | E | 72.5 | Confident | 62 | Low | 30.4 Ų | 30.4 | 59.6 Ų | 59.6 | 14% | 0.142 | 33% | 0.328 | C | S | . | . | H | α-helix | trans | -61.2 | -47.6 | 179.7 | -165.6 | 175.7 | -163.6 | 0 | 0 | 111.6 | C1600 S1601 L1606 M1607 E1608 Y1659 I1662 K1666 | C1600-E1604 WeakPolarHBondContact O-CB 3.33Å; C1600-E1604 PolarHBondContact O-N 3.2Å; S1601-E1604 PolarHBondContact O-N 3.18Å; E1604-L1606 VanDerWaalsContact C-N 3.33Å; E1604-L1606 PolarHBondContact O-N 3.05Å; E1604-M1607 PolarHBondContact O-N 3.15Å; E1604-M1607 VanDerWaalsContact O-N 3.11Å; E1604-E1608 WeakPolarHBondContact O-CB 3.34Å; E1604-E1608 WeakPolarHBondContact O-CG 3.46Å; E1604-E1608 PolarHBondContact O-N 2.97Å; E1604-Y1659 HydrophobicContact CG-CE2 4.17Å; E1604-I1662 HydrophobicContact CG-CG2 4.37Å; E1604-K1666 VanDerWaalsContact OE1-CD 3.29Å; E1604-K1666 WeakPolarHBondContact OE1-CD 3.33Å; E1604-K1666 WeakPolarHBondContact OE1-CE 3.39Å; E1604-K1666 IonicContact OE1-NZ 3.43Å; E1604-K1666 PolarHBondContact OE1-NZ 3.01Å; E1604-K1666 IonicContact OE2-NZ 3.28Å; E1604-K1666 PolarHBondContact OE2-NZ 2.96Å |
| 1605 | E | 71.1 | Confident | 63.7 | Low | 94.4 Ų | 94.4 | 61.7 Ų | 61.7 | 44% | 0.441 | 33% | 0.332 | S | S | . | . | H | α-helix | trans | -60.6 | -38.2 | 177.9 | -164.9 | -164.1 | 156 | 0 | 0 | 112.3 | S1601 F1603 K1609 | S1601-E1605 VanDerWaalsContact O-CB 3.27Å; S1601-E1605 WeakPolarHBondContact O-CB 3.3Å; S1601-E1605 PolarHBondContact O-N 3.26Å; F1603-E1605 PolarHBondContact O-N 3.18Å; E1605-K1609 HydrophobicContact CG-CD 4.32Å; E1605-K1609 VanDerWaalsContact O-CB 3.31Å; E1605-K1609 WeakPolarHBondContact O-CB 3.33Å; E1605-K1609 VanDerWaalsContact O-CG 3.26Å; E1605-K1609 WeakPolarHBondContact O-CG 3.3Å; E1605-K1609 PolarHBondContact O-N 3.24Å; E1605-K1609 WeakPolarHBondContact OE1-CE 3.37Å; E1605-K1609 IonicContact OE1-NZ 3.07Å; E1605-K1609 PolarHBondContact OE1-NZ 2.97Å |
| 1606 | L | 70.1 | Confident | 65.5 | Low | 58 Ų | 58 | 65.6 Ų | 65.6 | 30% | 0.304 | 35% | 0.352 | S | S | . | . | H | α-helix | trans | -69.3 | -41.7 | 178.2 | -166.9 | 150 | 0 | 0 | 0 | 111.4 | V1036 F1598 R1602 F1603 E1604 K1609 Q1610 | V1036-L1606 HydrophobicContact CG1-CD2 4.41Å; F1598-L1606 HydrophobicContact CE1-CB 4.44Å; F1598-L1606 HydrophobicContact CE1-CD1 4.38Å; F1598-L1606 HydrophobicContact CZ-CD1 4.01Å; R1602-L1606 VanDerWaalsContact O-CB 3.25Å; R1602-L1606 WeakPolarHBondContact O-CB 3.33Å; R1602-L1606 PolarHBondContact O-N 2.98Å; R1602-L1606 VanDerWaalsContact O-N 3.12Å; F1603-L1606 PolarHBondContact O-N 3.09Å; E1604-L1606 VanDerWaalsContact C-N 3.33Å; E1604-L1606 PolarHBondContact O-N 3.05Å; L1606-K1609 PolarHBondContact O-N 3.11Å; L1606-Q1610 HydrophobicContact CD2-CG 4.31Å; L1606-Q1610 WeakPolarHBondContact O-CB 3.38Å; L1606-Q1610 VanDerWaalsContact O-CG 3.29Å; L1606-Q1610 WeakPolarHBondContact O-CG 3.27Å; L1606-Q1610 PolarHBondContact O-N 3.25Å; L1606-Q1610 VanDerWaalsContact O-N 3.1Å |
| 1607 | M | 74.6 | Confident | 67.2 | Low | 5.2 Ų | 5.2 | 63.8 Ų | 63.8 | 3% | 0.026 | 34% | 0.339 | C | S | . | . | H | α-helix | trans | -71.5 | -33 | 177.9 | -67.7 | -61.5 | 163.1 | 0 | 0 | 112.6 | F1603 E1604 K1609 Q1610 S1611 A1612 N1655 M1656 Y1659 | F1603-M1607 HydrophobicContact CD1-CG 3.99Å; F1603-M1607 HydrophobicContact CD2-CE 4.46Å; F1603-M1607 HydrophobicContact CD2-CG 4.38Å; F1603-M1607 HydrophobicContact CE1-CE 4.03Å; F1603-M1607 HydrophobicContact CE1-CG 3.6Å; F1603-M1607 VanDerWaalsContact CE1-CG 3.45Å; F1603-M1607 HydrophobicContact CE1-SD 4.3Å; F1603-M1607 HydrophobicContact CE2-CE 3.96Å; F1603-M1607 HydrophobicContact CE2-CG 4.11Å; F1603-M1607 HydrophobicContact CE2-SD 4.23Å; F1603-M1607 HydrophobicContact CG-CG 4.31Å; F1603-M1607 HydrophobicContact CZ-CE 4Å; F1603-M1607 HydrophobicContact CZ-CG 3.73Å; F1603-M1607 HydrophobicContact CZ-SD 3.98Å; F1603-M1607 WeakPolarHBondContact O-CB 3.41Å; F1603-M1607 VanDerWaalsContact O-CG 3.31Å; F1603-M1607 WeakPolarHBondContact O-CG 3.26Å; F1603-M1607 PolarHBondContact O-N 3.16Å; E1604-M1607 PolarHBondContact O-N 3.15Å; E1604-M1607 VanDerWaalsContact O-N 3.11Å; M1607-K1609 VanDerWaalsContact C-N 3.35Å; M1607-Q1610 HydrophobicContact CE-CB 4.23Å; M1607-Q1610 PolarHBondContact O-N 3.23Å; M1607-S1611 VanDerWaalsContact O-CB 3.25Å; M1607-S1611 WeakPolarHBondContact O-CB 3.47Å; M1607-S1611 PolarHBondContact O-N 3.31Å; M1607-S1611 PolarHBondContact O-OG 3.2Å; M1607-A1612 HydrophobicContact CB-CB 4.09Å; M1607-A1612 HydrophobicContact CE-CB 4.07Å; M1607-A1612 WeakPolarHBondContact O-CB 3.35Å; M1607-A1612 PolarHBondContact O-N 3.01Å; M1607-A1612 VanDerWaalsContact O-N 3.15Å; M1607-A1612 HydrophobicContact SD-CB 4.23Å; M1607-N1655 HydrophobicContact CE-CB 4.09Å; M1607-N1655 WeakPolarHBondContact CE-O 3.32Å; M1607-N1655 HydrophobicContact SD-CB 3.86Å; M1607-M1656 HydrophobicContact CE-CE 4.03Å; M1607-M1656 HydrophobicContact CE-CG 4.07Å; M1607-M1656 HydrophobicContact CE-SD 3.5Å; M1607-M1656 WeakPolarHBondContact CE-SD 3.36Å; M1607-Y1659 HydrophobicContact CB-CD1 4.2Å; M1607-Y1659 HydrophobicContact CB-CD2 3.39Å; M1607-Y1659 VanDerWaalsContact CB-CD2 3.42Å; M1607-Y1659 HydrophobicContact CB-CE1 4.33Å; M1607-Y1659 HydrophobicContact CB-CE2 3.66Å; M1607-Y1659 VanDerWaalsContact CB-CE2 3.46Å; M1607-Y1659 HydrophobicContact CB-CG 3.68Å; M1607-Y1659 HydrophobicContact CE-CD1 4.34Å; M1607-Y1659 HydrophobicContact CE-CG 3.98Å; M1607-Y1659 HydrophobicContact CG-CD2 4.03Å; M1607-Y1659 HydrophobicContact CG-CE2 4.29Å; M1607-Y1659 HydrophobicContact CG-CG 4.14Å |
| 1608 | E | 75.5 | Confident | 69.3 | Low | 112.6 Ų | 112.6 | 64.1 Ų | 64.1 | 53% | 0.526 | 33% | 0.33 | S | S | . | . | H | α-helix | trans | -62.7 | -45.8 | 172.6 | -137.5 | 178.4 | -176.3 | 0 | 0 | 111 | E1604 Q1610 S1611 A1612 Y1659 | E1604-E1608 WeakPolarHBondContact O-CB 3.34Å; E1604-E1608 WeakPolarHBondContact O-CG 3.46Å; E1604-E1608 PolarHBondContact O-N 2.97Å; E1608-Q1610 VanDerWaalsContact C-N 3.34Å; E1608-Q1610 PolarHBondContact O-N 3.16Å; E1608-Q1610 VanDerWaalsContact O-N 3.09Å; E1608-S1611 PolarHBondContact O-N 3.1Å; E1608-S1611 PolarHBondContact O-OG 3Å; E1608-A1612 WeakPolarHBondContact O-CB 3.31Å; E1608-A1612 PolarHBondContact O-N 3.11Å; E1608-A1612 VanDerWaalsContact O-N 3.15Å; E1608-Y1659 WeakPolarHBondContact CA-OH 3.46Å; E1608-Y1659 WeakPolarHBondContact CG-OH 3.35Å |
| 1609 | K | 70.2 | Confident | 71 | Confident | 142.6 Ų | 142.6 | 67.3 Ų | 67.3 | 62% | 0.62 | 34% | 0.344 | S | S | * | . | H | α-helix | trans | -62 | -34.8 | 174.7 | -73.5 | 173.1 | -176.6 | 164.8 | 0 | 112.7 | E1605 L1606 M1607 S1611 A1613 | E1605-K1609 HydrophobicContact CG-CD 4.32Å; E1605-K1609 VanDerWaalsContact O-CB 3.31Å; E1605-K1609 WeakPolarHBondContact O-CB 3.33Å; E1605-K1609 VanDerWaalsContact O-CG 3.26Å; E1605-K1609 WeakPolarHBondContact O-CG 3.3Å; E1605-K1609 PolarHBondContact O-N 3.24Å; E1605-K1609 WeakPolarHBondContact OE1-CE 3.37Å; E1605-K1609 IonicContact OE1-NZ 3.07Å; E1605-K1609 PolarHBondContact OE1-NZ 2.97Å; L1606-K1609 PolarHBondContact O-N 3.11Å; M1607-K1609 VanDerWaalsContact C-N 3.35Å; K1609-S1611 VanDerWaalsContact C-N 3.33Å; K1609-A1613 PolarHBondContact O-N 2.89Å |
| 1610 | Q | 67.2 | Low | 72.5 | Confident | 45.6 Ų | 45.6 | 68.5 Ų | 68.5 | 21% | 0.213 | 34% | 0.344 | C | S | . | . | H | α-helix | trans | -80.4 | -24.1 | -179.9 | -134.5 | 178.5 | -4.2 | 0 | 0 | 113.3 | Q1038 L1606 M1607 E1608 A1612 A1613 D1614 K1615 M1656 | Q1038-Q1610 VanDerWaalsContact CA-NE2 3.32Å; Q1038-Q1610 HydrophobicContact CB-CG 4.34Å; Q1038-Q1610 HydrophobicContact CG-CG 4.05Å; Q1038-Q1610 PolarHBondContact O-NE2 2.98Å; L1606-Q1610 HydrophobicContact CD2-CG 4.31Å; L1606-Q1610 WeakPolarHBondContact O-CB 3.38Å; L1606-Q1610 VanDerWaalsContact O-CG 3.29Å; L1606-Q1610 WeakPolarHBondContact O-CG 3.27Å; L1606-Q1610 PolarHBondContact O-N 3.25Å; L1606-Q1610 VanDerWaalsContact O-N 3.1Å; M1607-Q1610 HydrophobicContact CE-CB 4.23Å; M1607-Q1610 PolarHBondContact O-N 3.23Å; E1608-Q1610 VanDerWaalsContact C-N 3.34Å; E1608-Q1610 PolarHBondContact O-N 3.16Å; E1608-Q1610 VanDerWaalsContact O-N 3.09Å; Q1610-A1612 VanDerWaalsContact C-N 3.27Å; Q1610-A1612 PolarHBondContact O-N 3Å; Q1610-A1613 WeakPolarHBondContact O-CA 3.27Å; Q1610-A1613 WeakPolarHBondContact O-CB 3.38Å; Q1610-A1613 PolarHBondContact O-N 3.28Å; Q1610-D1614 PolarHBondContact O-N 3.24Å; Q1610-K1615 WeakPolarHBondContact O-CE 3.48Å; Q1610-K1615 PolarHBondContact O-NZ 3.43Å; Q1610-M1656 HydrophobicContact CB-CE 4.3Å; Q1610-M1656 HydrophobicContact CG-CE 3.72Å |
| 1611 | S | 69.8 | Low | 73.8 | Confident | 37 Ų | 37 | 67 Ų | 67 | 26% | 0.259 | 33% | 0.334 | S | S | . | . | H | α-helix | trans | -26.5 | -1.5 | -179.2 | 21.1 | 0 | 0 | 0 | 0 | 112.2 | M1607 E1608 K1609 A1613 D1614 K1615 Y1659 | M1607-S1611 VanDerWaalsContact O-CB 3.25Å; M1607-S1611 WeakPolarHBondContact O-CB 3.47Å; M1607-S1611 PolarHBondContact O-N 3.31Å; M1607-S1611 PolarHBondContact O-OG 3.2Å; E1608-S1611 PolarHBondContact O-N 3.1Å; E1608-S1611 PolarHBondContact O-OG 3Å; K1609-S1611 VanDerWaalsContact C-N 3.33Å; S1611-A1613 VanDerWaalsContact C-N 3.29Å; S1611-A1613 PolarHBondContact O-N 3.33Å; S1611-A1613 VanDerWaalsContact O-N 3.13Å; S1611-D1614 CarbonylContact O-C 3.44Å; S1611-D1614 PolarHBondContact O-N 3.02Å; S1611-K1615 WeakPolarHBondContact O-CG 3.36Å; S1611-K1615 PolarHBondContact O-N 3.04Å; S1611-Y1659 WeakPolarHBondContact OG-CE1 3.22Å |
| 1612 | A | 67.1 | Low | 74.9 | Confident | 38.6 Ų | 38.6 | 70.2 Ų | 70.2 | 32% | 0.319 | 34% | 0.341 | S | S | . | . | H | α-helix | trans | -63.5 | -31.5 | 177.2 | 0 | 0 | 0 | 0 | 0 | 112.8 | M1607 E1608 Q1610 D1614 K1615 Y1618 M1656 Y1659 | M1607-A1612 HydrophobicContact CB-CB 4.09Å; M1607-A1612 HydrophobicContact CE-CB 4.07Å; M1607-A1612 WeakPolarHBondContact O-CB 3.35Å; M1607-A1612 PolarHBondContact O-N 3.01Å; M1607-A1612 VanDerWaalsContact O-N 3.15Å; M1607-A1612 HydrophobicContact SD-CB 4.23Å; E1608-A1612 WeakPolarHBondContact O-CB 3.31Å; E1608-A1612 PolarHBondContact O-N 3.11Å; E1608-A1612 VanDerWaalsContact O-N 3.15Å; Q1610-A1612 VanDerWaalsContact C-N 3.27Å; Q1610-A1612 PolarHBondContact O-N 3Å; A1612-D1614 VanDerWaalsContact C-N 3.28Å; A1612-D1614 PolarHBondContact O-N 2.96Å; A1612-K1615 WeakPolarHBondContact O-CB 3.32Å; A1612-K1615 PolarHBondContact O-N 2.92Å; A1612-Y1618 VanDerWaalsContact O-CB 3.26Å; A1612-Y1618 WeakPolarHBondContact O-CB 3.48Å; A1612-M1656 HydrophobicContact CB-CE 4.14Å; A1612-M1656 HydrophobicContact CB-SD 4.02Å; A1612-Y1659 HydrophobicContact CB-CD1 4.05Å; A1612-Y1659 HydrophobicContact CB-CE1 3.89Å |
| 1613 | A | 65.3 | Low | 76.1 | Confident | 56.4 Ų | 56.4 | 70.1 Ų | 70.1 | 47% | 0.466 | 35% | 0.346 | S | S | . | . | H | α-helix | trans | -74.3 | -34.9 | 177.8 | 0 | 0 | 0 | 0 | 0 | 113.1 | K1609 Q1610 S1611 K1615 Y1618 Y1659 | K1609-A1613 PolarHBondContact O-N 2.89Å; Q1610-A1613 WeakPolarHBondContact O-CA 3.27Å; Q1610-A1613 WeakPolarHBondContact O-CB 3.38Å; Q1610-A1613 PolarHBondContact O-N 3.28Å; S1611-A1613 VanDerWaalsContact C-N 3.29Å; S1611-A1613 PolarHBondContact O-N 3.33Å; S1611-A1613 VanDerWaalsContact O-N 3.13Å; A1613-K1615 VanDerWaalsContact C-N 3.3Å; A1613-Y1618 HydrophobicContact CB-CD1 4.32Å; A1613-Y1618 HydrophobicContact CB-CE1 4.34Å; A1613-Y1618 WeakPolarHBondContact O-CD1 3.37Å; A1613-Y1659 HydrophobicContact CB-CE1 4.36Å |
| 1614 | D | 71.7 | Confident | 76.9 | Confident | 76 Ų | 76 | 71.6 Ų | 71.6 | 41% | 0.406 | 36% | 0.355 | S | S | . | . | trans | -103.4 | 37.7 | -178.4 | -98.8 | -29.2 | 0 | 0 | 0 | 112.1 | R1042 Q1610 S1611 A1612 D1616 E1617 Y1618 M1656 | R1042-D1614 IonicContact NH1-OD1 2.75Å; R1042-D1614 IonicContact NH1-OD2 3.25Å; R1042-D1614 PolarHBondContact NH1-OD2 3.37Å; R1042-D1614 VanDerWaalsContact NH1-OD2 3.15Å; Q1610-D1614 PolarHBondContact O-N 3.24Å; S1611-D1614 CarbonylContact O-C 3.44Å; S1611-D1614 PolarHBondContact O-N 3.02Å; A1612-D1614 VanDerWaalsContact C-N 3.28Å; A1612-D1614 PolarHBondContact O-N 2.96Å; D1614-D1616 VanDerWaalsContact C-N 3.29Å; D1614-D1616 PolarHBondContact O-N 3.05Å; D1614-E1617 HydrophobicContact CB-CB 4.31Å; D1614-E1617 VanDerWaalsContact CG-CB 3.45Å; D1614-E1617 PolarHBondContact O-N 3.28Å; D1614-E1617 VanDerWaalsContact OD1-CB 3.31Å; D1614-E1617 WeakPolarHBondContact OD1-CB 3.36Å; D1614-E1617 PolarHBondContact OD1-N 3.32Å; D1614-E1617 VanDerWaalsContact OD1-N 3.14Å; D1614-Y1618 PolarHBondContact O-N 3.07Å; D1614-M1656 HydrophobicContact CB-CE 4.33Å | ||
| 1615 | K | 76.2 | Confident | 77.9 | Confident | 111.8 Ų | 111.8 | 73.7 Ų | 73.7 | 49% | 0.486 | 37% | 0.367 | S | S | . | . | H | α-helix | trans | -67.9 | -26 | -177.7 | -69.7 | -176.8 | -178.9 | 174.2 | 0 | 112.4 | Q1610 S1611 A1612 A1613 E1617 Y1618 K1619 M1656 | Q1610-K1615 WeakPolarHBondContact O-CE 3.48Å; Q1610-K1615 PolarHBondContact O-NZ 3.43Å; S1611-K1615 WeakPolarHBondContact O-CG 3.36Å; S1611-K1615 PolarHBondContact O-N 3.04Å; A1612-K1615 WeakPolarHBondContact O-CB 3.32Å; A1612-K1615 PolarHBondContact O-N 2.92Å; A1613-K1615 VanDerWaalsContact C-N 3.3Å; K1615-E1617 PolarHBondContact O-N 2.87Å; K1615-Y1618 WeakPolarHBondContact O-CB 3.29Å; K1615-Y1618 PolarHBondContact O-N 2.9Å; K1615-K1619 VanDerWaalsContact O-CB 3.31Å; K1615-K1619 WeakPolarHBondContact O-CB 3.4Å; K1615-K1619 PolarHBondContact O-N 3.28Å; K1615-K1619 VanDerWaalsContact O-N 3.14Å; K1615-M1656 HydrophobicContact CD-CE 3.97Å |
| 1616 | D | 78.2 | Confident | 79 | Confident | 124.8 Ų | 124.8 | 69.2 Ų | 69.2 | 67% | 0.667 | 35% | 0.346 | S | S | * | . | H | α-helix | trans | -67.4 | -35.5 | -179 | -64.3 | -34.9 | 0 | 0 | 0 | 111.7 | D1614 Y1618 K1619 F1620 | D1614-D1616 VanDerWaalsContact C-N 3.29Å; D1614-D1616 PolarHBondContact O-N 3.05Å; D1616-Y1618 VanDerWaalsContact C-N 3.29Å; D1616-Y1618 PolarHBondContact O-N 2.75Å; D1616-K1619 PolarHBondContact O-N 3.02Å; D1616-K1619 IonicContact OD1-NZ 2.78Å; D1616-K1619 PolarHBondContact OD1-NZ 2.86Å; D1616-F1620 WeakPolarHBondContact O-CB 3.39Å; D1616-F1620 PolarHBondContact O-N 3.01Å |
| 1617 | E | 76.7 | Confident | 80.2 | Confident | 43.8 Ų | 43.8 | 66.9 Ų | 66.9 | 21% | 0.205 | 33% | 0.334 | C | S | . | . | H | α-helix | trans | -63.2 | -42.9 | 174.3 | -132 | -179.8 | -148.8 | 0 | 0 | 112 | R1042 D1614 K1615 K1619 F1620 V1621 N1653 M1656 | R1042-E1617 IonicContact CZ-OE1 2.7Å; R1042-E1617 IonicContact NE-OE1 2.84Å; R1042-E1617 IonicContact NH1-OE1 2.56Å; R1042-E1617 PolarHBondContact NH1-OE1 3.25Å; R1042-E1617 IonicContact NH2-OE1 3.72Å; D1614-E1617 HydrophobicContact CB-CB 4.31Å; D1614-E1617 VanDerWaalsContact CG-CB 3.45Å; D1614-E1617 PolarHBondContact O-N 3.28Å; D1614-E1617 VanDerWaalsContact OD1-CB 3.31Å; D1614-E1617 WeakPolarHBondContact OD1-CB 3.36Å; D1614-E1617 PolarHBondContact OD1-N 3.32Å; D1614-E1617 VanDerWaalsContact OD1-N 3.14Å; K1615-E1617 PolarHBondContact O-N 2.87Å; E1617-K1619 VanDerWaalsContact C-N 3.32Å; E1617-K1619 PolarHBondContact O-N 2.9Å; E1617-F1620 WeakPolarHBondContact O-CB 3.21Å; E1617-F1620 PolarHBondContact O-N 3.21Å; E1617-V1621 VanDerWaalsContact O-CG2 3.27Å; E1617-V1621 WeakPolarHBondContact O-CG2 3.32Å; E1617-V1621 PolarHBondContact O-N 3.12Å; E1617-V1621 VanDerWaalsContact O-N 3.08Å; E1617-N1653 HydrophobicContact CG-CB 4.33Å; E1617-N1653 WeakPolarHBondContact OE1-CB 3.41Å; E1617-N1653 PolarHBondContact OE1-ND2 2.93Å; E1617-N1653 PolarHBondContact OE2-ND2 3.28Å; E1617-M1656 HydrophobicContact CB-CG 4.28Å |
| 1618 | Y | 83.6 | Confident | 81.1 | Confident | 38 Ų | 38 | 68 Ų | 68 | 15% | 0.149 | 34% | 0.338 | C | S | . | . | H | α-helix | trans | -65.7 | -39.8 | 176.6 | -179 | -100 | 0 | 0 | 0 | 111.6 | A1612 A1613 D1614 K1615 D1616 F1620 V1621 K1622 M1656 Y1659 H1660 L1663 | A1612-Y1618 VanDerWaalsContact O-CB 3.26Å; A1612-Y1618 WeakPolarHBondContact O-CB 3.48Å; A1613-Y1618 HydrophobicContact CB-CD1 4.32Å; A1613-Y1618 HydrophobicContact CB-CE1 4.34Å; A1613-Y1618 WeakPolarHBondContact O-CD1 3.37Å; D1614-Y1618 PolarHBondContact O-N 3.07Å; K1615-Y1618 WeakPolarHBondContact O-CB 3.29Å; K1615-Y1618 PolarHBondContact O-N 2.9Å; D1616-Y1618 VanDerWaalsContact C-N 3.29Å; D1616-Y1618 PolarHBondContact O-N 2.75Å; Y1618-F1620 VanDerWaalsContact C-N 3.31Å; Y1618-F1620 PolarHBondContact O-N 3.27Å; Y1618-V1621 PolarHBondContact O-N 3.17Å; Y1618-K1622 HydrophobicContact CE1-CD 4.4Å; Y1618-K1622 WeakPolarHBondContact O-CB 3.47Å; Y1618-K1622 PolarHBondContact O-N 2.97Å; Y1618-K1622 VanDerWaalsContact O-N 3.09Å; Y1618-M1656 HydrophobicContact CD2-SD 4.29Å; Y1618-Y1659 AromaticContact CD2-CD1 3.86Å; Y1618-Y1659 HydrophobicContact CD2-CD1 4.03Å; Y1618-Y1659 HydrophobicContact CD2-CE1 4.45Å; Y1618-Y1659 AromaticContact CE2-CD1 3.74Å; Y1618-Y1659 HydrophobicContact CE2-CD1 3.74Å; Y1618-Y1659 HydrophobicContact CE2-CE1 4.19Å; Y1618-H1660 HydrophobicContact CD2-CB 4.47Å; Y1618-H1660 HydrophobicContact CE2-CB 3.83Å; Y1618-H1660 AromaticContact CZ-ND1 3.79Å; Y1618-H1660 PolarHBondContact OH-ND1 2.93Å; Y1618-L1663 HydrophobicContact CE2-CD1 4.36Å; Y1618-L1663 VanDerWaalsContact OH-CD1 3.28Å; Y1618-L1663 WeakPolarHBondContact OH-CD1 3.31Å |
| 1619 | K | 86.1 | Confident | 82 | Confident | 109.4 Ų | 109.4 | 65.9 Ų | 65.9 | 48% | 0.476 | 33% | 0.328 | S | S | . | . | H | α-helix | trans | -61.6 | -43.6 | 174.6 | -136.1 | 178.2 | 177.9 | 176.1 | 0 | 111.4 | K1615 D1616 E1617 V1621 K1622 E1623 | K1615-K1619 VanDerWaalsContact O-CB 3.31Å; K1615-K1619 WeakPolarHBondContact O-CB 3.4Å; K1615-K1619 PolarHBondContact O-N 3.28Å; K1615-K1619 VanDerWaalsContact O-N 3.14Å; D1616-K1619 PolarHBondContact O-N 3.02Å; D1616-K1619 IonicContact OD1-NZ 2.78Å; D1616-K1619 PolarHBondContact OD1-NZ 2.86Å; E1617-K1619 VanDerWaalsContact C-N 3.32Å; E1617-K1619 PolarHBondContact O-N 2.9Å; K1619-V1621 PolarHBondContact O-N 3.02Å; K1619-K1622 WeakPolarHBondContact O-CB 3.31Å; K1619-K1622 PolarHBondContact O-N 3.18Å; K1619-K1622 VanDerWaalsContact O-N 3.14Å; K1619-E1623 WeakPolarHBondContact CE-OE1 3.4Å; K1619-E1623 HydrophobicContact CG-CG 4.4Å; K1619-E1623 IonicContact NZ-OE1 2.91Å; K1619-E1623 WeakPolarHBondContact O-CB 3.34Å; K1619-E1623 WeakPolarHBondContact O-CG 3.4Å; K1619-E1623 PolarHBondContact O-N 3.17Å |
| 1620 | F | 85.6 | Confident | 83.1 | Confident | 89.6 Ų | 89.6 | 63.2 Ų | 63.2 | 39% | 0.393 | 32% | 0.315 | S | S | . | . | H | α-helix | trans | -58.8 | -45.7 | 174.9 | 176.7 | -101.5 | 0 | 0 | 0 | 112.3 | D1616 E1617 Y1618 K1622 E1623 T1624 V1652 | D1616-F1620 WeakPolarHBondContact O-CB 3.39Å; D1616-F1620 PolarHBondContact O-N 3.01Å; E1617-F1620 WeakPolarHBondContact O-CB 3.21Å; E1617-F1620 PolarHBondContact O-N 3.21Å; Y1618-F1620 VanDerWaalsContact C-N 3.31Å; Y1618-F1620 PolarHBondContact O-N 3.27Å; F1620-K1622 VanDerWaalsContact C-N 3.29Å; F1620-K1622 PolarHBondContact O-N 3.08Å; F1620-E1623 PolarHBondContact O-N 3.1Å; F1620-T1624 HydrophobicContact CD1-CG2 4.34Å; F1620-T1624 HydrophobicContact CD2-CG2 4.44Å; F1620-T1624 HydrophobicContact CE1-CG2 4.11Å; F1620-T1624 HydrophobicContact CE2-CG2 4.13Å; F1620-T1624 HydrophobicContact CZ-CG2 3.9Å; F1620-T1624 WeakPolarHBondContact O-CB 3.44Å; F1620-T1624 VanDerWaalsContact O-CG2 3.29Å; F1620-T1624 WeakPolarHBondContact O-CG2 3.4Å; F1620-T1624 PolarHBondContact O-N 3.13Å; F1620-T1624 PolarHBondContact O-OG1 3.14Å; F1620-V1652 HydrophobicContact CE1-CG2 4.29Å |
| 1621 | V | 86.7 | Confident | 84.3 | Confident | 0.4 Ų | 0.4 | 61.9 Ų | 61.9 | 0% | 0.002 | 31% | 0.313 | C | S | . | . | H | α-helix | trans | -61.1 | -38.7 | 176.1 | 173.9 | 0 | 0 | 0 | 0 | 111.8 | E1617 Y1618 K1619 T1624 V1652 M1656 L1657 H1660 | E1617-V1621 VanDerWaalsContact O-CG2 3.27Å; E1617-V1621 WeakPolarHBondContact O-CG2 3.32Å; E1617-V1621 PolarHBondContact O-N 3.12Å; E1617-V1621 VanDerWaalsContact O-N 3.08Å; Y1618-V1621 PolarHBondContact O-N 3.17Å; K1619-V1621 PolarHBondContact O-N 3.02Å; V1621-T1624 WeakPolarHBondContact CA-OG1 3.4Å; V1621-T1624 PolarHBondContact O-OG1 3.07Å; V1621-V1652 HydrophobicContact CG2-CG1 3.98Å; V1621-M1656 HydrophobicContact CG2-CB 4.02Å; V1621-L1657 HydrophobicContact CG1-CB 4.35Å; V1621-L1657 HydrophobicContact CG1-CD1 4.17Å; V1621-H1660 HydrophobicContact CG1-CB 4.25Å |
| 1622 | K | 87.4 | Confident | 85.4 | Confident | 122.8 Ų | 122.8 | 63.1 Ų | 63.1 | 53% | 0.534 | 32% | 0.32 | S | S | . | . | H | α-helix | trans | -69.5 | -43.5 | 177.5 | -172.3 | 178.5 | 178.5 | -178.2 | 0 | 111.9 | Y1618 K1619 F1620 T1624 N1625 | Y1618-K1622 HydrophobicContact CE1-CD 4.4Å; Y1618-K1622 WeakPolarHBondContact O-CB 3.47Å; Y1618-K1622 PolarHBondContact O-N 2.97Å; Y1618-K1622 VanDerWaalsContact O-N 3.09Å; K1619-K1622 WeakPolarHBondContact O-CB 3.31Å; K1619-K1622 PolarHBondContact O-N 3.18Å; K1619-K1622 VanDerWaalsContact O-N 3.14Å; F1620-K1622 VanDerWaalsContact C-N 3.29Å; F1620-K1622 PolarHBondContact O-N 3.08Å; K1622-T1624 VanDerWaalsContact C-N 3.32Å; K1622-T1624 PolarHBondContact O-N 3.2Å; K1622-N1625 PolarHBondContact O-N 3.28Å |
| 1623 | E | 90.3 | Very high | 86.6 | Confident | 129 Ų | 129 | 61.5 Ų | 61.5 | 60% | 0.603 | 31% | 0.306 | S | S | * | . | H | α-helix | trans | -70.5 | -31.4 | -179 | -73.9 | 175.7 | 178.4 | 0 | 0 | 113.1 | K1619 F1620 N1625 | K1619-E1623 WeakPolarHBondContact CE-OE1 3.4Å; K1619-E1623 HydrophobicContact CG-CG 4.4Å; K1619-E1623 IonicContact NZ-OE1 2.91Å; K1619-E1623 WeakPolarHBondContact O-CB 3.34Å; K1619-E1623 WeakPolarHBondContact O-CG 3.4Å; K1619-E1623 PolarHBondContact O-N 3.17Å; F1620-E1623 PolarHBondContact O-N 3.1Å; E1623-N1625 PolarHBondContact O-N 3.02Å; E1623-N1625 VanDerWaalsContact O-N 3.14Å; E1623-N1625 PolarHBondContact O-ND2 3.04Å |
| 1624 | T | 89.2 | Confident | 87.9 | Confident | 36.2 Ų | 36.2 | 65.8 Ų | 65.8 | 22% | 0.222 | 31% | 0.31 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -63.9 | -15 | 173.4 | 25.9 | 0 | 0 | 0 | 0 | 112.7 | F1620 V1621 K1622 I1626 R1646 | F1620-T1624 HydrophobicContact CD1-CG2 4.34Å; F1620-T1624 HydrophobicContact CD2-CG2 4.44Å; F1620-T1624 HydrophobicContact CE1-CG2 4.11Å; F1620-T1624 HydrophobicContact CE2-CG2 4.13Å; F1620-T1624 HydrophobicContact CZ-CG2 3.9Å; F1620-T1624 WeakPolarHBondContact O-CB 3.44Å; F1620-T1624 VanDerWaalsContact O-CG2 3.29Å; F1620-T1624 WeakPolarHBondContact O-CG2 3.4Å; F1620-T1624 PolarHBondContact O-N 3.13Å; F1620-T1624 PolarHBondContact O-OG1 3.14Å; V1621-T1624 WeakPolarHBondContact CA-OG1 3.4Å; V1621-T1624 PolarHBondContact O-OG1 3.07Å; K1622-T1624 VanDerWaalsContact C-N 3.32Å; K1622-T1624 PolarHBondContact O-N 3.2Å; T1624-I1626 VanDerWaalsContact C-N 3.29Å; T1624-I1626 HydrophobicContact CG2-CD1 3.98Å; T1624-I1626 HydrophobicContact CG2-CG1 3.67Å; T1624-I1626 PolarHBondContact O-N 3.18Å; T1624-R1646 HydrophobicContact CG2-CB 4.26Å; T1624-R1646 VanDerWaalsContact O-CD 3.28Å; T1624-R1646 WeakPolarHBondContact O-CD 3.36Å; T1624-R1646 PolarHBondContact O-NH1 3.42Å |
| 1625 | N | 92.6 | Very high | 88.8 | Confident | 74.6 Ų | 74.6 | 65.8 Ų | 65.8 | 40% | 0.399 | 32% | 0.321 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 51.4 | 47.2 | 176.1 | -70.9 | -68.1 | 0 | 0 | 0 | 112.2 | K1622 E1623 Y1628 R1646 | K1622-N1625 PolarHBondContact O-N 3.28Å; E1623-N1625 PolarHBondContact O-N 3.02Å; E1623-N1625 VanDerWaalsContact O-N 3.14Å; E1623-N1625 PolarHBondContact O-ND2 3.04Å; N1625-Y1628 HydrophobicContact CB-CD1 4.1Å; N1625-Y1628 HydrophobicContact CB-CE1 4.37Å; N1625-Y1628 WeakPolarHBondContact O-CD1 3.5Å; N1625-Y1628 WeakPolarHBondContact O-CE1 3.29Å; N1625-R1646 VanDerWaalsContact CB-NH1 3.28Å; N1625-R1646 PolarHBondContact O-NH1 3.22Å |
| 1626 | I | 94.3 | Very high | 89.5 | Confident | 0.2 Ų | 0.2 | 62.9 Ų | 62.9 | 0% | 0.001 | 32% | 0.323 | C | S | . | . | S | Bend | trans | -72.3 | -41.5 | 175 | -58.7 | 171.2 | 0 | 0 | 0 | 110 | T1624 F1642 I1643 R1646 F1647 V1652 L1657 | T1624-I1626 VanDerWaalsContact C-N 3.29Å; T1624-I1626 HydrophobicContact CG2-CD1 3.98Å; T1624-I1626 HydrophobicContact CG2-CG1 3.67Å; T1624-I1626 PolarHBondContact O-N 3.18Å; I1626-F1642 HydrophobicContact CG2-CD2 4.3Å; I1626-F1642 HydrophobicContact CG2-CE2 3.81Å; I1626-F1642 HydrophobicContact CG2-CZ 4.35Å; I1626-F1642 CarbonylContact O-C 3.54Å; I1626-F1642 WeakPolarHBondContact O-CA 3.29Å; I1626-I1643 PolarHBondContact O-N 3.04Å; I1626-R1646 HydrophobicContact CG1-CB 3.92Å; I1626-F1647 HydrophobicContact CD1-CB 4.39Å; I1626-F1647 HydrophobicContact CD1-CD2 4.45Å; I1626-F1647 HydrophobicContact CG2-CB 4.32Å; I1626-V1652 HydrophobicContact CD1-CB 4.45Å; I1626-V1652 HydrophobicContact CD1-CG1 3.76Å; I1626-V1652 HydrophobicContact CD1-CG2 4.05Å; I1626-L1657 HydrophobicContact CB-CD1 4.04Å; I1626-L1657 HydrophobicContact CD1-CD1 4.41Å; I1626-L1657 HydrophobicContact CG2-CD1 3.88Å; I1626-L1657 HydrophobicContact CG2-CD2 4.2Å |
| 1627 | F | 95.2 | Very high | 90.1 | Very high | 10.6 Ų | 10.6 | 58.1 Ų | 58.1 | 5% | 0.046 | 30% | 0.297 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -131.7 | 130.7 | 175.4 | -173.1 | -95.1 | 0 | 0 | 0 | 110.7 | F1640 Y1641 F1642 H1660 V1661 T1664 L1665 L1675 | F1627-F1640 HydrophobicContact CE1-CB 4.45Å; F1627-F1640 AromaticContact CE1-CD1 3.74Å; F1627-F1640 HydrophobicContact CE1-CD1 3.74Å; F1627-F1640 HydrophobicContact CE1-CE1 4.48Å; F1627-F1640 HydrophobicContact CE1-CG 4.45Å; F1627-F1640 HydrophobicContact CE2-CB 4.03Å; F1627-F1640 HydrophobicContact CZ-CB 3.71Å; F1627-F1640 AromaticContact CZ-CD1 3.68Å; F1627-F1640 HydrophobicContact CZ-CD1 3.68Å; F1627-F1640 AromaticContact CZ-CG 3.94Å; F1627-F1640 HydrophobicContact CZ-CG 3.94Å; F1627-Y1641 VanDerWaalsContact CA-O 3.27Å; F1627-Y1641 WeakPolarHBondContact CA-O 3.35Å; F1627-Y1641 WeakPolarHBondContact CD2-O 3.4Å; F1627-F1642 HydrophobicContact CB-CD2 4.45Å; F1627-F1642 HydrophobicContact CD2-CB 4.09Å; F1627-F1642 HydrophobicContact CD2-CD2 4.12Å; F1627-H1660 PolarHBondContact O-NE2 3.21Å; F1627-V1661 HydrophobicContact CB-CG2 3.75Å; F1627-V1661 HydrophobicContact CD1-CB 4.25Å; F1627-V1661 HydrophobicContact CD1-CG1 4.29Å; F1627-V1661 HydrophobicContact CD1-CG2 3.68Å; F1627-V1661 HydrophobicContact CD2-CG2 4.02Å; F1627-V1661 HydrophobicContact CE1-CB 4.39Å; F1627-V1661 HydrophobicContact CE1-CG1 3.98Å; F1627-V1661 HydrophobicContact CE1-CG2 4.23Å; F1627-V1661 HydrophobicContact CE2-CG1 4.35Å; F1627-V1661 HydrophobicContact CE2-CG2 4.48Å; F1627-V1661 HydrophobicContact CG-CG2 3.55Å; F1627-V1661 HydrophobicContact CZ-CG1 4.01Å; F1627-T1664 HydrophobicContact CD1-CG2 4.19Å; F1627-T1664 HydrophobicContact CE1-CG2 3.94Å; F1627-L1665 HydrophobicContact CE1-CD2 4.47Å; F1627-L1665 HydrophobicContact CE1-CG 4.34Å; F1627-L1665 HydrophobicContact CZ-CD1 4.47Å; F1627-L1665 HydrophobicContact CZ-CD2 4.18Å; F1627-L1665 HydrophobicContact CZ-CG 4.25Å; F1627-L1675 HydrophobicContact CE2-CD1 3.83Å; F1627-L1675 HydrophobicContact CZ-CD1 4.48Å |
| 1628 | Y | 94.9 | Very high | 91 | Very high | 27 Ų | 27 | 56.6 Ų | 56.6 | 11% | 0.106 | 29% | 0.291 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -155.7 | 158.8 | 179.2 | 54.9 | -87.7 | 0 | 0 | 0 | 111.8 | N1625 F1640 Y1641 I1643 R1759 | N1625-Y1628 HydrophobicContact CB-CD1 4.1Å; N1625-Y1628 HydrophobicContact CB-CE1 4.37Å; N1625-Y1628 WeakPolarHBondContact O-CD1 3.5Å; N1625-Y1628 WeakPolarHBondContact O-CE1 3.29Å; Y1628-F1640 CarbonylContact O-C 3.47Å; Y1628-F1640 WeakPolarHBondContact O-CA 3.36Å; Y1628-Y1641 HydrophobicContact CD2-CD2 4.18Å; Y1628-Y1641 HydrophobicContact CD2-CG 4.43Å; Y1628-Y1641 AromaticContact CE2-CD2 3.73Å; Y1628-Y1641 HydrophobicContact CE2-CD2 3.73Å; Y1628-Y1641 AromaticContact CE2-CG 3.75Å; Y1628-Y1641 HydrophobicContact CE2-CG 3.75Å; Y1628-Y1641 AromaticContact CZ-CG 3.96Å; Y1628-Y1641 PolarHBondContact N-O 3.12Å; Y1628-Y1641 VanDerWaalsContact N-O 3.12Å; Y1628-Y1641 PolarHBondContact O-N 3.27Å; Y1628-I1643 HydrophobicContact CE1-CD1 4.46Å; Y1628-I1643 HydrophobicContact CE1-CG1 3.87Å; Y1628-R1759 HydrophobicContact CE2-CB 4.41Å; Y1628-R1759 HydrophobicContact CE2-CG 4.33Å; Y1628-R1759 PolarHBondContact OH-O 3.14Å |
| 1629 | Q | 93.8 | Very high | 91.5 | Very high | 68.6 Ų | 68.6 | 54.8 Ų | 54.8 | 32% | 0.321 | 28% | 0.284 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -97.5 | 134.5 | 172.6 | -171.4 | -81.6 | -42.6 | 0 | 0 | 109.5 | G1631 F1640 T1664 F1668 | Q1629-G1631 PolarHBondContact NE2-O 3.17Å; Q1629-G1631 VanDerWaalsContact NE2-O 3.16Å; Q1629-F1640 HydrophobicContact CB-CD1 3.74Å; Q1629-F1640 HydrophobicContact CB-CE1 3.63Å; Q1629-F1640 HydrophobicContact CB-CZ 4.41Å; Q1629-F1640 HydrophobicContact CG-CD1 4Å; Q1629-F1640 HydrophobicContact CG-CE1 3.66Å; Q1629-F1640 HydrophobicContact CG-CE2 4.43Å; Q1629-F1640 HydrophobicContact CG-CG 4.48Å; Q1629-F1640 HydrophobicContact CG-CZ 3.95Å; Q1629-T1664 HydrophobicContact CB-CG2 4.42Å; Q1629-F1668 HydrophobicContact CB-CE2 4.49Å; Q1629-F1668 HydrophobicContact CG-CE2 4.09Å; Q1629-F1668 HydrophobicContact CG-CZ 4.07Å |
| 1630 | Y | 93.9 | Very high | 91.9 | Very high | 87 Ų | 87 | 49.7 Ų | 49.7 | 34% | 0.341 | 26% | 0.262 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -157.3 | 135.7 | 172.1 | -170.9 | -92.3 | 0 | 0 | 0 | 111.7 | V1639 Y1641 R1759 | Y1630-V1639 PolarHBondContact N-O 3.1Å; Y1630-Y1641 WeakPolarHBondContact O-CE2 3.34Å; Y1630-R1759 HydrophobicContact CD1-CB 3.32Å; Y1630-R1759 HydrophobicContact CD1-CG 4.27Å; Y1630-R1759 HydrophobicContact CD2-CB 4.4Å; Y1630-R1759 VanDerWaalsContact CD2-CD 3.47Å; Y1630-R1759 HydrophobicContact CE1-CB 3.71Å; Y1630-R1759 HydrophobicContact CE1-CG 4.47Å; Y1630-R1759 HydrophobicContact CG-CB 3.68Å; Y1630-R1759 HydrophobicContact CG-CG 4.3Å |
| 1631 | G | 91.7 | Very high | 92.4 | Very high | 17.6 Ų | 17.6 | 45.4 Ų | 45.4 | 18% | 0.181 | 24% | 0.243 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | 69.8 | 177.6 | 174 | 0 | 0 | 0 | 0 | 0 | 114.9 | Q1629 V1639 | Q1629-G1631 PolarHBondContact NE2-O 3.17Å; Q1629-G1631 VanDerWaalsContact NE2-O 3.16Å; G1631-V1639 PolarHBondContact O-N 3.3Å |
| 1632 | T | 92.8 | Very high | 92.9 | Very high | 63 Ų | 63 | 46.9 Ų | 46.9 | 39% | 0.387 | 25% | 0.25 | S | C | . | . | E | Extended strand (participates in β ladder) | trans | -127.6 | 143.7 | 176.2 | 51.4 | 0 | 0 | 0 | 0 | 110.4 | N1637 N1757 | T1632-N1637 CarbonylContact C-O 3.52Å; T1632-N1637 VanDerWaalsContact CA-O 3.29Å; T1632-N1637 WeakPolarHBondContact CA-O 3.35Å; T1632-N1757 WeakPolarHBondContact O-CB 3.36Å; T1632-N1757 PolarHBondContact O-ND2 3.22Å; T1632-N1757 PolarHBondContact OG1-ND2 3.13Å |
| 1633 | S | 93.5 | Very high | 93.3 | Very high | 5.6 Ų | 5.6 | 41 Ų | 41 | 4% | 0.039 | 22% | 0.224 | C | C | . | . | trans | -69.4 | 169.1 | 174.8 | 77.4 | 0 | 0 | 0 | 0 | 110.9 | A1635 G1636 N1637 E1674 | S1633-A1635 PolarHBondContact O-N 3.17Å; S1633-A1635 PolarHBondContact OG-N 3.07Å; S1633-G1636 PolarHBondContact O-N 3.19Å; S1633-N1637 PolarHBondContact N-O 3.14Å; S1633-N1637 PolarHBondContact OG-N 3.11Å; S1633-E1674 VanDerWaalsContact CB-OE1 3.24Å; S1633-E1674 WeakPolarHBondContact CB-OE1 3.35Å; S1633-E1674 WeakPolarHBondContact CB-OE2 3.36Å; S1633-E1674 VanDerWaalsContact OG-CD 3.27Å; S1633-E1674 PolarHBondContact OG-OE1 3.23Å; S1633-E1674 PolarHBondContact OG-OE2 3.01Å | ||
| 1634 | R | 92.5 | Very high | 93.5 | Very high | 145 Ų | 145 | 35.2 Ų | 35.2 | 55% | 0.547 | 20% | 0.198 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -62.2 | -21.7 | 172.7 | -69.9 | 178.1 | -176.1 | -82.6 | 1.5 | 112.9 | G1636 N1750 E1751 F1752 C1754 | R1634-G1636 VanDerWaalsContact C-N 3.26Å; R1634-N1750 PolarHBondContact NE-O 3.43Å; R1634-N1750 PolarHBondContact NH2-O 3.14Å; R1634-E1751 VanDerWaalsContact CD-O 3.27Å; R1634-E1751 WeakPolarHBondContact CD-O 3.41Å; R1634-E1751 PolarHBondContact NE-O 3.19Å; R1634-F1752 WeakPolarHBondContact CB-O 3.27Å; R1634-F1752 VanDerWaalsContact CG-O 3.32Å; R1634-F1752 WeakPolarHBondContact CG-O 3.36Å; R1634-F1752 PolarHBondContact N-O 3.15Å; R1634-C1754 PolarHBondContact NH1-SG 3.2Å |
| 1635 | A | 90 | Very high | 93.6 | Very high | 75.8 Ų | 75.8 | 34.8 Ų | 34.8 | 63% | 0.626 | 20% | 0.195 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -83.3 | -0.2 | 173.4 | 0 | 0 | 0 | 0 | 0 | 113.2 | S1633 N1637 | S1633-A1635 PolarHBondContact O-N 3.17Å; S1633-A1635 PolarHBondContact OG-N 3.07Å; A1635-N1637 VanDerWaalsContact C-N 3.33Å |
| 1636 | G | 90.1 | Very high | 93.6 | Very high | 52.6 Ų | 52.6 | 35.5 Ų | 35.5 | 54% | 0.542 | 19% | 0.192 | S | C | . | . | S | Bend | trans | 82.5 | 7 | -179.4 | 0 | 0 | 0 | 0 | 0 | 114.5 | S1633 R1634 | S1633-G1636 PolarHBondContact O-N 3.19Å; R1634-G1636 VanDerWaalsContact C-N 3.26Å |
| 1637 | N | 92.4 | Very high | 93.5 | Very high | 22.6 Ų | 22.6 | 35.8 Ų | 35.8 | 12% | 0.121 | 19% | 0.193 | C | C | . | . | P | Polyproline II helix | trans | -82.6 | 141.5 | -179.4 | -57.7 | -41.9 | 0 | 0 | 0 | 110.6 | T1632 S1633 A1635 V1639 P1672 E1674 | T1632-N1637 CarbonylContact C-O 3.52Å; T1632-N1637 VanDerWaalsContact CA-O 3.29Å; T1632-N1637 WeakPolarHBondContact CA-O 3.35Å; S1633-N1637 PolarHBondContact N-O 3.14Å; S1633-N1637 PolarHBondContact OG-N 3.11Å; A1635-N1637 VanDerWaalsContact C-N 3.33Å; N1637-V1639 PolarHBondContact O-N 3.22Å; N1637-P1672 WeakPolarHBondContact CB-O 3.42Å; N1637-P1672 VanDerWaalsContact OD1-CG 3.32Å; N1637-P1672 WeakPolarHBondContact OD1-CG 3.43Å; N1637-P1672 PolarHBondContact OD1-O 2.97Å; N1637-E1674 HydrophobicContact CB-CG 4.02Å; N1637-E1674 PolarHBondContact ND2-OE1 3.2Å |
| 1638 | P | 93.9 | Very high | 93 | Very high | 12.4 Ų | 12.4 | 37.9 Ų | 37.9 | 8% | 0.081 | 20% | 0.202 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -60.7 | 136 | 170.1 | 25.2 | -34.7 | 0 | 0 | 0 | 111.1 | F1640 F1668 P1672 C1673 E1674 | P1638-F1640 HydrophobicContact CB-CE2 4.27Å; P1638-F1640 HydrophobicContact CG-CE2 4.4Å; P1638-F1668 HydrophobicContact CB-CD1 4.11Å; P1638-F1668 HydrophobicContact CB-CE1 4.23Å; P1638-F1668 HydrophobicContact CG-CD1 3.98Å; P1638-F1668 HydrophobicContact CG-CE1 4.36Å; P1638-F1668 HydrophobicContact CG-CG 4.49Å; P1638-P1672 WeakPolarHBondContact CD-O 3.27Å; P1638-C1673 HydrophobicContact CG-CB 4.14Å; P1638-E1674 PolarHBondContact O-N 3.12Å |
| 1639 | V | 94.5 | Very high | 92.3 | Very high | 0 Ų | 0 | 38.5 Ų | 38.5 | 0% | 0 | 21% | 0.209 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -104 | 132.2 | -179.9 | -176.7 | 0 | 0 | 0 | 0 | 110.6 | Y1630 G1631 N1637 Y1641 E1674 V1676 I1753 | Y1630-V1639 PolarHBondContact N-O 3.1Å; G1631-V1639 PolarHBondContact O-N 3.3Å; N1637-V1639 PolarHBondContact O-N 3.22Å; V1639-Y1641 HydrophobicContact CB-CE2 4.37Å; V1639-Y1641 HydrophobicContact CG1-CD2 4.33Å; V1639-Y1641 HydrophobicContact CG1-CE2 3.72Å; V1639-E1674 WeakPolarHBondContact CA-O 3.41Å; V1639-E1674 HydrophobicContact CG2-CB 4.47Å; V1639-V1676 HydrophobicContact CG1-CG2 3.72Å; V1639-I1753 HydrophobicContact CB-CD1 4.39Å; V1639-I1753 HydrophobicContact CG1-CD1 3.73Å; V1639-I1753 HydrophobicContact CG2-CD1 3.84Å; V1639-I1753 HydrophobicContact CG2-CG1 4.26Å |
| 1640 | F | 95.3 | Very high | 91.2 | Very high | 2.8 Ų | 2.8 | 37.3 Ų | 37.3 | 1% | 0.012 | 22% | 0.215 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -109 | 146.5 | 173.2 | -62.5 | -92 | 0 | 0 | 0 | 110.3 | F1627 Y1628 Q1629 P1638 T1664 L1665 F1668 C1673 E1674 L1675 V1676 | F1627-F1640 HydrophobicContact CE1-CB 4.45Å; F1627-F1640 AromaticContact CE1-CD1 3.74Å; F1627-F1640 HydrophobicContact CE1-CD1 3.74Å; F1627-F1640 HydrophobicContact CE1-CE1 4.48Å; F1627-F1640 HydrophobicContact CE1-CG 4.45Å; F1627-F1640 HydrophobicContact CE2-CB 4.03Å; F1627-F1640 HydrophobicContact CZ-CB 3.71Å; F1627-F1640 AromaticContact CZ-CD1 3.68Å; F1627-F1640 HydrophobicContact CZ-CD1 3.68Å; F1627-F1640 AromaticContact CZ-CG 3.94Å; F1627-F1640 HydrophobicContact CZ-CG 3.94Å; Y1628-F1640 CarbonylContact O-C 3.47Å; Y1628-F1640 WeakPolarHBondContact O-CA 3.36Å; Q1629-F1640 HydrophobicContact CB-CD1 3.74Å; Q1629-F1640 HydrophobicContact CB-CE1 3.63Å; Q1629-F1640 HydrophobicContact CB-CZ 4.41Å; Q1629-F1640 HydrophobicContact CG-CD1 4Å; Q1629-F1640 HydrophobicContact CG-CE1 3.66Å; Q1629-F1640 HydrophobicContact CG-CE2 4.43Å; Q1629-F1640 HydrophobicContact CG-CG 4.48Å; Q1629-F1640 HydrophobicContact CG-CZ 3.95Å; P1638-F1640 HydrophobicContact CB-CE2 4.27Å; P1638-F1640 HydrophobicContact CG-CE2 4.4Å; F1640-T1664 HydrophobicContact CD1-CG2 4.33Å; F1640-T1664 HydrophobicContact CE1-CG2 4.06Å; F1640-L1665 HydrophobicContact CD1-CD2 4.02Å; F1640-L1665 HydrophobicContact CD2-CD2 4.19Å; F1640-L1665 HydrophobicContact CE1-CD2 3.8Å; F1640-L1665 HydrophobicContact CE2-CD2 4Å; F1640-L1665 HydrophobicContact CG-CD2 4.21Å; F1640-L1665 HydrophobicContact CZ-CD2 3.79Å; F1640-F1668 HydrophobicContact CE1-CD2 4.06Å; F1640-F1668 HydrophobicContact CE1-CE2 4.35Å; F1640-F1668 HydrophobicContact CZ-CB 4.1Å; F1640-F1668 HydrophobicContact CZ-CD1 4.49Å; F1640-F1668 AromaticContact CZ-CD2 3.55Å; F1640-F1668 HydrophobicContact CZ-CD2 3.55Å; F1640-F1668 HydrophobicContact CZ-CE2 4.12Å; F1640-F1668 AromaticContact CZ-CG 3.87Å; F1640-F1668 HydrophobicContact CZ-CG 3.87Å; F1640-C1673 HydrophobicContact CD2-CB 4.04Å; F1640-C1673 HydrophobicContact CE2-CB 3.64Å; F1640-E1674 PolarHBondContact N-O 2.9Å; F1640-L1675 HydrophobicContact CB-CD1 3.91Å; F1640-L1675 CarbonylContact O-C 3.56Å; F1640-L1675 WeakPolarHBondContact O-CA 3.35Å; F1640-V1676 PolarHBondContact O-N 3.24Å |
| 1641 | Y | 96.4 | Very high | 90.6 | Very high | 0 Ų | 0 | 38.7 Ų | 38.7 | 0% | 0 | 23% | 0.225 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -118.1 | 133.9 | 178.3 | -69.8 | -94.4 | 0 | 0 | 0 | 109.9 | F1627 Y1628 Y1630 V1639 V1676 Q1758 R1759 L1760 | F1627-Y1641 VanDerWaalsContact CA-O 3.27Å; F1627-Y1641 WeakPolarHBondContact CA-O 3.35Å; F1627-Y1641 WeakPolarHBondContact CD2-O 3.4Å; Y1628-Y1641 HydrophobicContact CD2-CD2 4.18Å; Y1628-Y1641 HydrophobicContact CD2-CG 4.43Å; Y1628-Y1641 AromaticContact CE2-CD2 3.73Å; Y1628-Y1641 HydrophobicContact CE2-CD2 3.73Å; Y1628-Y1641 AromaticContact CE2-CG 3.75Å; Y1628-Y1641 HydrophobicContact CE2-CG 3.75Å; Y1628-Y1641 AromaticContact CZ-CG 3.96Å; Y1628-Y1641 PolarHBondContact N-O 3.12Å; Y1628-Y1641 VanDerWaalsContact N-O 3.12Å; Y1628-Y1641 PolarHBondContact O-N 3.27Å; Y1630-Y1641 WeakPolarHBondContact O-CE2 3.34Å; V1639-Y1641 HydrophobicContact CB-CE2 4.37Å; V1639-Y1641 HydrophobicContact CG1-CD2 4.33Å; V1639-Y1641 HydrophobicContact CG1-CE2 3.72Å; Y1641-V1676 CarbonylContact C-O 3.54Å; Y1641-V1676 WeakPolarHBondContact CA-O 3.38Å; Y1641-V1676 HydrophobicContact CD1-CB 3.72Å; Y1641-V1676 HydrophobicContact CD1-CG1 3.88Å; Y1641-V1676 HydrophobicContact CD1-CG2 4.36Å; Y1641-V1676 HydrophobicContact CE1-CB 3.79Å; Y1641-V1676 HydrophobicContact CE1-CG1 3.86Å; Y1641-V1676 HydrophobicContact CE1-CG2 3.96Å; Y1641-V1676 HydrophobicContact CG-CB 4.41Å; Y1641-Q1758 WeakPolarHBondContact OH-CA 3.4Å; Y1641-R1759 PolarHBondContact OH-N 3.05Å; Y1641-L1760 HydrophobicContact CD1-CD2 3.94Å; Y1641-L1760 HydrophobicContact CD1-CG 4.48Å; Y1641-L1760 HydrophobicContact CE1-CD2 3.95Å; Y1641-L1760 HydrophobicContact CE1-CG 4.1Å |
| 1642 | F | 96.1 | Very high | 90 | Very high | 30.8 Ų | 30.8 | 38.3 Ų | 38.3 | 14% | 0.135 | 22% | 0.219 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -120.4 | 115.5 | 169.3 | -178.4 | -99 | 0 | 0 | 0 | 109.4 | I1626 F1627 A1644 L1657 L1675 V1676 V1677 D1678 F1688 | I1626-F1642 HydrophobicContact CG2-CD2 4.3Å; I1626-F1642 HydrophobicContact CG2-CE2 3.81Å; I1626-F1642 HydrophobicContact CG2-CZ 4.35Å; I1626-F1642 CarbonylContact O-C 3.54Å; I1626-F1642 WeakPolarHBondContact O-CA 3.29Å; F1627-F1642 HydrophobicContact CB-CD2 4.45Å; F1627-F1642 HydrophobicContact CD2-CB 4.09Å; F1627-F1642 HydrophobicContact CD2-CD2 4.12Å; F1642-A1644 HydrophobicContact CD1-CB 4.38Å; F1642-A1644 HydrophobicContact CE1-CB 3.94Å; F1642-L1657 HydrophobicContact CE2-CD2 4.4Å; F1642-L1675 HydrophobicContact CB-CD1 4.43Å; F1642-V1676 PolarHBondContact N-O 3Å; F1642-V1677 HydrophobicContact CB-CG2 4.43Å; F1642-V1677 HydrophobicContact CD1-CG1 4.09Å; F1642-D1678 PolarHBondContact O-N 3.27Å; F1642-F1688 HydrophobicContact CE2-CZ 4.24Å; F1642-F1688 HydrophobicContact CZ-CE2 4.18Å; F1642-F1688 AromaticContact CZ-CZ 3.65Å; F1642-F1688 HydrophobicContact CZ-CZ 3.65Å |
| 1643 | I | 96.1 | Very high | 89.5 | Confident | 0 Ų | 0 | 37 Ų | 37 | 0% | 0 | 21% | 0.209 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -102.9 | 98.9 | -177.7 | -48.1 | -54.5 | 0 | 0 | 0 | 108.9 | I1626 Y1628 N1645 R1646 D1678 P1761 | I1626-I1643 PolarHBondContact O-N 3.04Å; Y1628-I1643 HydrophobicContact CE1-CD1 4.46Å; Y1628-I1643 HydrophobicContact CE1-CG1 3.87Å; I1643-N1645 VanDerWaalsContact CG2-OD1 3.31Å; I1643-N1645 WeakPolarHBondContact CG2-OD1 3.35Å; I1643-N1645 PolarHBondContact O-N 3.28Å; I1643-R1646 HydrophobicContact CB-CG 4.3Å; I1643-R1646 HydrophobicContact CG2-CB 4.49Å; I1643-R1646 HydrophobicContact CG2-CG 3.8Å; I1643-R1646 PolarHBondContact O-N 3.39Å; I1643-D1678 HydrophobicContact CD1-CB 3.71Å; I1643-P1761 HydrophobicContact CD1-CG 3.73Å; I1643-P1761 HydrophobicContact CG1-CG 4.01Å; I1643-P1761 HydrophobicContact CG2-CG 3.8Å |
| 1644 | A | 94.2 | Very high | 89 | Confident | 6.8 Ų | 6.8 | 37.2 Ų | 37.2 | 6% | 0.056 | 21% | 0.212 | C | C | . | . | G | 310 helix | trans | -65.1 | -39.4 | -168.8 | 0 | 0 | 0 | 0 | 0 | 113 | F1642 R1646 F1647 D1678 L1679 T1682 | F1642-A1644 HydrophobicContact CD1-CB 4.38Å; F1642-A1644 HydrophobicContact CE1-CB 3.94Å; A1644-R1646 PolarHBondContact O-N 3.12Å; A1644-R1646 VanDerWaalsContact O-N 3.14Å; A1644-F1647 PolarHBondContact O-N 3.31Å; A1644-F1647 VanDerWaalsContact O-N 3.1Å; A1644-D1678 WeakPolarHBondContact CB-O 3.24Å; A1644-D1678 PolarHBondContact N-O 3Å; A1644-L1679 HydrophobicContact CB-CD2 4.11Å; A1644-T1682 HydrophobicContact CB-CG2 4.07Å; A1644-T1682 WeakPolarHBondContact CB-OG1 3.34Å |
| 1645 | N | 91 | Very high | 88.5 | Confident | 28.6 Ų | 28.6 | 32.1 Ų | 32.1 | 15% | 0.153 | 20% | 0.196 | C | C | . | . | G | 310 helix | trans | -67.8 | -14.1 | -175.6 | 70.4 | 10.7 | 0 | 0 | 0 | 114.9 | I1643 T1680 N1686 | I1643-N1645 VanDerWaalsContact CG2-OD1 3.31Å; I1643-N1645 WeakPolarHBondContact CG2-OD1 3.35Å; I1643-N1645 PolarHBondContact O-N 3.28Å; N1645-T1680 WeakPolarHBondContact CB-O 3.42Å; N1645-T1680 PolarHBondContact ND2-O 3.26Å; N1645-T1680 VanDerWaalsContact ND2-O 3.08Å; N1645-N1686 VanDerWaalsContact C-ND2 3.33Å; N1645-N1686 WeakPolarHBondContact CA-ND2 3.32Å; N1645-N1686 PolarHBondContact O-ND2 2.98Å |
| 1646 | R | 92.1 | Very high | 88.2 | Confident | 88.4 Ų | 88.4 | 28.6 Ų | 28.6 | 33% | 0.334 | 17% | 0.167 | S | C | . | . | G | 310 helix | trans | -83.9 | -17 | 175.8 | -65.5 | -174.9 | 180 | 178.5 | -6.5 | 113.1 | T1624 N1625 I1626 I1643 A1644 K1648 | T1624-R1646 HydrophobicContact CG2-CB 4.26Å; T1624-R1646 VanDerWaalsContact O-CD 3.28Å; T1624-R1646 WeakPolarHBondContact O-CD 3.36Å; T1624-R1646 PolarHBondContact O-NH1 3.42Å; N1625-R1646 VanDerWaalsContact CB-NH1 3.28Å; N1625-R1646 PolarHBondContact O-NH1 3.22Å; I1626-R1646 HydrophobicContact CG1-CB 3.92Å; I1643-R1646 HydrophobicContact CB-CG 4.3Å; I1643-R1646 HydrophobicContact CG2-CB 4.49Å; I1643-R1646 HydrophobicContact CG2-CG 3.8Å; I1643-R1646 PolarHBondContact O-N 3.39Å; A1644-R1646 PolarHBondContact O-N 3.12Å; A1644-R1646 VanDerWaalsContact O-N 3.14Å; R1646-K1648 PolarHBondContact O-N 3.47Å |
| 1647 | F | 92.4 | Very high | 88.2 | Confident | 6.2 Ų | 6.2 | 26.1 Ų | 26.1 | 3% | 0.027 | 14% | 0.141 | C | C | . | . | trans | -80.2 | 120.6 | 170.3 | 177.6 | -97.6 | 0 | 0 | 0 | 109 | I1626 A1644 V1652 L1657 N1686 F1688 L1692 | I1626-F1647 HydrophobicContact CD1-CB 4.39Å; I1626-F1647 HydrophobicContact CD1-CD2 4.45Å; I1626-F1647 HydrophobicContact CG2-CB 4.32Å; A1644-F1647 PolarHBondContact O-N 3.31Å; A1644-F1647 VanDerWaalsContact O-N 3.1Å; F1647-V1652 HydrophobicContact CD2-CB 3.82Å; F1647-V1652 HydrophobicContact CD2-CG1 3.85Å; F1647-V1652 HydrophobicContact CD2-CG2 4.44Å; F1647-V1652 HydrophobicContact CE2-CB 3.85Å; F1647-V1652 HydrophobicContact CE2-CG1 3.98Å; F1647-L1657 HydrophobicContact CD2-CD2 3.71Å; F1647-L1657 HydrophobicContact CE2-CD2 4.11Å; F1647-L1657 HydrophobicContact CG-CD2 4.4Å; F1647-N1686 WeakPolarHBondContact CD1-O 3.34Å; F1647-N1686 VanDerWaalsContact O-CA 3.27Å; F1647-N1686 WeakPolarHBondContact O-CA 3.4Å; F1647-N1686 WeakPolarHBondContact O-CB 3.39Å; F1647-N1686 PolarHBondContact O-ND2 3.13Å; F1647-F1688 AromaticContact CD1-CD1 3.83Å; F1647-F1688 HydrophobicContact CD1-CD1 3.83Å; F1647-F1688 AromaticContact CD1-CE1 3.6Å; F1647-F1688 HydrophobicContact CD1-CE1 3.6Å; F1647-F1688 AromaticContact CD2-CE1 3.96Å; F1647-F1688 HydrophobicContact CD2-CE1 3.97Å; F1647-F1688 AromaticContact CE1-CD1 3.44Å; F1647-F1688 HydrophobicContact CE1-CD1 3.44Å; F1647-F1688 VanDerWaalsContact CE1-CD1 3.44Å; F1647-F1688 AromaticContact CE1-CE1 3.6Å; F1647-F1688 HydrophobicContact CE1-CE1 3.6Å; F1647-F1688 HydrophobicContact CE2-CD1 4.38Å; F1647-F1688 AromaticContact CE2-CE1 3.93Å; F1647-F1688 HydrophobicContact CE2-CE1 3.95Å; F1647-F1688 HydrophobicContact CG-CD1 4.46Å; F1647-F1688 AromaticContact CG-CE1 3.8Å; F1647-F1688 HydrophobicContact CG-CE1 3.8Å; F1647-F1688 AromaticContact CZ-CD1 3.74Å; F1647-F1688 HydrophobicContact CZ-CD1 3.74Å; F1647-F1688 AromaticContact CZ-CE1 3.77Å; F1647-F1688 HydrophobicContact CZ-CE1 3.77Å; F1647-L1692 HydrophobicContact CE2-CD2 4.45Å; F1647-L1692 HydrophobicContact CZ-CD2 3.99Å | ||
| 1648 | K | 85.6 | Confident | 88 | Confident | 54.6 Ų | 54.6 | 25 Ų | 25 | 24% | 0.237 | 14% | 0.135 | C | C | . | . | trans | -114.2 | 123.5 | 175.8 | -67.9 | -67.3 | -176.1 | 178.4 | 0 | 110 | R1646 G1650 E1651 V1652 E1685 | R1646-K1648 PolarHBondContact O-N 3.47Å; K1648-G1650 PolarHBondContact O-N 3.17Å; K1648-G1650 VanDerWaalsContact O-N 3.15Å; K1648-E1651 HydrophobicContact CB-CB 4.1Å; K1648-E1651 HydrophobicContact CB-CG 4.28Å; K1648-E1651 WeakPolarHBondContact CB-OE2 3.45Å; K1648-E1651 PolarHBondContact O-N 3.22Å; K1648-E1651 VanDerWaalsContact O-N 3.16Å; K1648-V1652 PolarHBondContact O-N 3.3Å; K1648-V1652 VanDerWaalsContact O-N 3.14Å; K1648-E1685 HydrophobicContact CD-CB 4.23Å; K1648-E1685 IonicContact NZ-OE2 2.81Å; K1648-E1685 PolarHBondContact NZ-OE2 3.2Å | ||
| 1649 | T | 79.3 | Confident | 87.7 | Confident | 39.6 Ų | 39.6 | 25 Ų | 25 | 24% | 0.243 | 13% | 0.134 | C | C | . | . | B | Isolated β-bridge | trans | -64.4 | 117.6 | -176.2 | -53.6 | 0 | 0 | 0 | 0 | 110.1 | E1685 R1687 R1689 | T1649-E1685 VanDerWaalsContact CB-O 3.31Å; T1649-E1685 WeakPolarHBondContact CB-O 3.33Å; T1649-E1685 PolarHBondContact N-O 3.1Å; T1649-E1685 PolarHBondContact OG1-O 3.19Å; T1649-R1687 PolarHBondContact OG1-N 3.41Å; T1649-R1687 PolarHBondContact OG1-O 3.22Å; T1649-R1689 HydrophobicContact CG2-CG 4.32Å |
| 1650 | G | 72 | Confident | 87.5 | Confident | 43.2 Ų | 43.2 | 25.6 Ų | 25.6 | 45% | 0.445 | 14% | 0.136 | S | C | . | . | T | Hydrogen-bonded Turn | trans | 97.5 | -23.1 | -179.8 | 0 | 0 | 0 | 0 | 0 | 114.4 | I1041 Q1103 K1648 | I1041-G1650 WeakPolarHBondContact CD1-O 3.29Å; Q1103-G1650 PolarHBondContact NE2-O 2.95Å; K1648-G1650 PolarHBondContact O-N 3.17Å; K1648-G1650 VanDerWaalsContact O-N 3.15Å |
| 1651 | E | 79.8 | Confident | 87.3 | Confident | 117.2 Ų | 117.2 | 25.8 Ų | 25.8 | 55% | 0.548 | 14% | 0.137 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -89.6 | -42.5 | 173.8 | -65.7 | -177.7 | 175.4 | 0 | 0 | 111.7 | K1648 | K1648-E1651 HydrophobicContact CB-CB 4.1Å; K1648-E1651 HydrophobicContact CB-CG 4.28Å; K1648-E1651 WeakPolarHBondContact CB-OE2 3.45Å; K1648-E1651 PolarHBondContact O-N 3.22Å; K1648-E1651 VanDerWaalsContact O-N 3.16Å |
| 1652 | V | 80.8 | Confident | 86.8 | Confident | 9.4 Ų | 9.4 | 26.5 Ų | 26.5 | 6% | 0.057 | 14% | 0.141 | C | C | . | . | B | Isolated β-bridge | trans | -96.1 | 123.7 | -179.2 | -176.3 | 0 | 0 | 0 | 0 | 109.8 | F1620 V1621 I1626 F1647 K1648 G1654 | F1620-V1652 HydrophobicContact CE1-CG2 4.29Å; V1621-V1652 HydrophobicContact CG2-CG1 3.98Å; I1626-V1652 HydrophobicContact CD1-CB 4.45Å; I1626-V1652 HydrophobicContact CD1-CG1 3.76Å; I1626-V1652 HydrophobicContact CD1-CG2 4.05Å; F1647-V1652 HydrophobicContact CD2-CB 3.82Å; F1647-V1652 HydrophobicContact CD2-CG1 3.85Å; F1647-V1652 HydrophobicContact CD2-CG2 4.44Å; F1647-V1652 HydrophobicContact CE2-CB 3.85Å; F1647-V1652 HydrophobicContact CE2-CG1 3.98Å; K1648-V1652 PolarHBondContact O-N 3.3Å; K1648-V1652 VanDerWaalsContact O-N 3.14Å; V1652-G1654 PolarHBondContact O-N 3.12Å; V1652-G1654 VanDerWaalsContact O-N 3.11Å |
| 1653 | N | 80.9 | Confident | 86.4 | Confident | 35 Ų | 35 | 27.3 Ų | 27.3 | 19% | 0.187 | 15% | 0.146 | C | C | . | . | trans | -67.8 | 109.2 | 174.4 | -174.4 | -23.1 | 0 | 0 | 0 | 110.7 | Q1038 E1617 N1655 M1656 L1657 | Q1038-N1653 PolarHBondContact O-ND2 3.33Å; E1617-N1653 HydrophobicContact CG-CB 4.33Å; E1617-N1653 WeakPolarHBondContact OE1-CB 3.41Å; E1617-N1653 PolarHBondContact OE1-ND2 2.93Å; E1617-N1653 PolarHBondContact OE2-ND2 3.28Å; N1653-N1655 VanDerWaalsContact C-N 3.28Å; N1653-N1655 PolarHBondContact O-N 3.19Å; N1653-N1655 PolarHBondContact OD1-N 2.9Å; N1653-N1655 VanDerWaalsContact OD1-N 3.1Å; N1653-M1656 HydrophobicContact CB-CB 4.11Å; N1653-M1656 HydrophobicContact CB-CG 3.99Å; N1653-M1656 WeakPolarHBondContact O-CB 3.35Å; N1653-M1656 PolarHBondContact O-N 3.17Å; N1653-M1656 VanDerWaalsContact O-N 3.12Å; N1653-M1656 PolarHBondContact OD1-N 3.28Å; N1653-L1657 PolarHBondContact O-N 2.99Å; N1653-L1657 VanDerWaalsContact O-N 3.1Å | ||
| 1654 | G | 82.8 | Confident | 86 | Confident | 10.4 Ų | 10.4 | 28.4 Ų | 28.4 | 11% | 0.107 | 15% | 0.153 | C | C | . | . | H | α-helix | trans | -60.3 | -32 | -177.3 | 0 | 0 | 0 | 0 | 0 | 114.5 | V1652 L1657 I1658 | V1652-G1654 PolarHBondContact O-N 3.12Å; V1652-G1654 VanDerWaalsContact O-N 3.11Å; G1654-L1657 PolarHBondContact O-N 3.16Å; G1654-I1658 WeakPolarHBondContact O-CG1 3.29Å; G1654-I1658 PolarHBondContact O-N 3.24Å; G1654-I1658 VanDerWaalsContact O-N 3.08Å |
| 1655 | N | 82 | Confident | 85.7 | Confident | 38 Ų | 38 | 29.1 Ų | 29.1 | 20% | 0.203 | 16% | 0.156 | C | C | . | . | H | α-helix | trans | -70.4 | -38.8 | 176.9 | -62.9 | -40.2 | 0 | 0 | 0 | 110.9 | F1603 M1607 N1653 L1657 I1658 Y1659 K1695 | F1603-N1655 HydrophobicContact CE2-CB 4.42Å; F1603-N1655 HydrophobicContact CZ-CB 4.26Å; M1607-N1655 HydrophobicContact CE-CB 4.09Å; M1607-N1655 WeakPolarHBondContact CE-O 3.32Å; M1607-N1655 HydrophobicContact SD-CB 3.86Å; N1653-N1655 VanDerWaalsContact C-N 3.28Å; N1653-N1655 PolarHBondContact O-N 3.19Å; N1653-N1655 PolarHBondContact OD1-N 2.9Å; N1653-N1655 VanDerWaalsContact OD1-N 3.1Å; N1655-L1657 VanDerWaalsContact C-N 3.31Å; N1655-L1657 PolarHBondContact O-N 3.33Å; N1655-I1658 PolarHBondContact O-N 3.16Å; N1655-Y1659 WeakPolarHBondContact O-CB 3.4Å; N1655-Y1659 PolarHBondContact O-N 3.09Å; N1655-K1695 PolarHBondContact OD1-NZ 3.29Å |
| 1656 | M | 85.2 | Confident | 85.3 | Confident | 2.2 Ų | 2.2 | 32.6 Ų | 32.6 | 1% | 0.011 | 17% | 0.17 | C | C | . | . | H | α-helix | trans | -64.9 | -36.3 | 174.8 | -69.3 | -62.9 | 176.3 | 0 | 0 | 111.6 | M1607 Q1610 A1612 D1614 K1615 E1617 Y1618 V1621 N1653 Y1659 H1660 | M1607-M1656 HydrophobicContact CE-CE 4.03Å; M1607-M1656 HydrophobicContact CE-CG 4.07Å; M1607-M1656 HydrophobicContact CE-SD 3.5Å; M1607-M1656 WeakPolarHBondContact CE-SD 3.36Å; Q1610-M1656 HydrophobicContact CB-CE 4.3Å; Q1610-M1656 HydrophobicContact CG-CE 3.72Å; A1612-M1656 HydrophobicContact CB-CE 4.14Å; A1612-M1656 HydrophobicContact CB-SD 4.02Å; D1614-M1656 HydrophobicContact CB-CE 4.33Å; K1615-M1656 HydrophobicContact CD-CE 3.97Å; E1617-M1656 HydrophobicContact CB-CG 4.28Å; Y1618-M1656 HydrophobicContact CD2-SD 4.29Å; V1621-M1656 HydrophobicContact CG2-CB 4.02Å; N1653-M1656 HydrophobicContact CB-CB 4.11Å; N1653-M1656 HydrophobicContact CB-CG 3.99Å; N1653-M1656 WeakPolarHBondContact O-CB 3.35Å; N1653-M1656 PolarHBondContact O-N 3.17Å; N1653-M1656 VanDerWaalsContact O-N 3.12Å; N1653-M1656 PolarHBondContact OD1-N 3.28Å; M1656-Y1659 PolarHBondContact O-N 3.29Å; M1656-H1660 WeakPolarHBondContact O-CB 3.41Å; M1656-H1660 PolarHBondContact O-N 3.08Å |
| 1657 | L | 90.2 | Very high | 84.7 | Confident | 0 Ų | 0 | 35.8 Ų | 35.8 | 0% | 0 | 19% | 0.189 | C | C | . | . | H | α-helix | trans | -62.6 | -48.1 | 172.6 | 179.2 | 62.2 | 0 | 0 | 0 | 111.7 | V1621 I1626 F1642 F1647 N1653 G1654 N1655 Y1659 H1660 V1661 F1688 W1696 | V1621-L1657 HydrophobicContact CG1-CB 4.35Å; V1621-L1657 HydrophobicContact CG1-CD1 4.17Å; I1626-L1657 HydrophobicContact CB-CD1 4.04Å; I1626-L1657 HydrophobicContact CD1-CD1 4.41Å; I1626-L1657 HydrophobicContact CG2-CD1 3.88Å; I1626-L1657 HydrophobicContact CG2-CD2 4.2Å; F1642-L1657 HydrophobicContact CE2-CD2 4.4Å; F1647-L1657 HydrophobicContact CD2-CD2 3.71Å; F1647-L1657 HydrophobicContact CE2-CD2 4.11Å; F1647-L1657 HydrophobicContact CG-CD2 4.4Å; N1653-L1657 PolarHBondContact O-N 2.99Å; N1653-L1657 VanDerWaalsContact O-N 3.1Å; G1654-L1657 PolarHBondContact O-N 3.16Å; N1655-L1657 VanDerWaalsContact C-N 3.31Å; N1655-L1657 PolarHBondContact O-N 3.33Å; L1657-Y1659 VanDerWaalsContact C-N 3.28Å; L1657-Y1659 PolarHBondContact O-N 3.08Å; L1657-H1660 PolarHBondContact O-N 3.18Å; L1657-V1661 HydrophobicContact CD1-CG2 4.42Å; L1657-V1661 WeakPolarHBondContact O-CG2 3.3Å; L1657-V1661 PolarHBondContact O-N 3.01Å; L1657-F1688 HydrophobicContact CD2-CE1 4.13Å; L1657-F1688 HydrophobicContact CD2-CZ 4.13Å; L1657-W1696 HydrophobicContact CD2-CZ2 4.2Å; L1657-W1696 HydrophobicContact CG-CH2 4.43Å; L1657-W1696 HydrophobicContact CG-CZ2 4.13Å |
| 1658 | I | 88.2 | Confident | 84 | Confident | 0 Ų | 0 | 37.6 Ų | 37.6 | 0% | 0 | 20% | 0.196 | C | C | . | . | H | α-helix | trans | -57.4 | -45.3 | 175.7 | -68.6 | 170.7 | 0 | 0 | 0 | 110.3 | F1603 G1654 N1655 H1660 V1661 I1662 L1692 K1695 W1696 V1699 | F1603-I1658 HydrophobicContact CD1-CG2 4.34Å; F1603-I1658 HydrophobicContact CE1-CB 4.16Å; F1603-I1658 HydrophobicContact CE1-CG2 3.6Å; F1603-I1658 HydrophobicContact CZ-CB 4.09Å; F1603-I1658 HydrophobicContact CZ-CG2 3.88Å; G1654-I1658 WeakPolarHBondContact O-CG1 3.29Å; G1654-I1658 PolarHBondContact O-N 3.24Å; G1654-I1658 VanDerWaalsContact O-N 3.08Å; N1655-I1658 PolarHBondContact O-N 3.16Å; I1658-H1660 PolarHBondContact O-N 2.91Å; I1658-V1661 PolarHBondContact O-N 3.08Å; I1658-I1662 HydrophobicContact CG2-CD1 3.78Å; I1658-I1662 HydrophobicContact CG2-CG1 4.4Å; I1658-I1662 VanDerWaalsContact O-CG1 3.32Å; I1658-I1662 WeakPolarHBondContact O-CG1 3.29Å; I1658-I1662 PolarHBondContact O-N 3.08Å; I1658-L1692 HydrophobicContact CD1-CD1 3.69Å; I1658-L1692 HydrophobicContact CG1-CD1 4.43Å; I1658-K1695 HydrophobicContact CD1-CB 4.02Å; I1658-W1696 HydrophobicContact CB-CH2 4.39Å; I1658-W1696 HydrophobicContact CB-CZ2 4.47Å; I1658-W1696 HydrophobicContact CB-CZ3 4.5Å; I1658-W1696 HydrophobicContact CD1-CD2 4.24Å; I1658-W1696 HydrophobicContact CD1-CG 4.37Å; I1658-W1696 HydrophobicContact CG1-CD2 3.81Å; I1658-W1696 VanDerWaalsContact CG1-CE2 3.46Å; I1658-W1696 HydrophobicContact CG1-CE3 4.1Å; I1658-W1696 HydrophobicContact CG1-CG 4.42Å; I1658-W1696 HydrophobicContact CG1-CH2 3.82Å; I1658-W1696 HydrophobicContact CG1-CZ2 3.52Å; I1658-W1696 VanDerWaalsContact CG1-CZ2 3.49Å; I1658-W1696 HydrophobicContact CG1-CZ3 4.11Å; I1658-V1699 HydrophobicContact CG2-CB 4.44Å; I1658-V1699 HydrophobicContact CG2-CG1 3.98Å |
| 1659 | Y | 87 | Confident | 83.1 | Confident | 12.8 Ų | 12.8 | 37.5 Ų | 37.5 | 5% | 0.05 | 20% | 0.203 | C | C | . | . | H | α-helix | trans | -62.1 | -44.4 | 178.6 | -176.7 | -120.5 | 0 | 0 | 0 | 112.7 | F1603 E1604 M1607 E1608 S1611 A1612 A1613 Y1618 N1655 M1656 L1657 V1661 I1662 L1663 | F1603-Y1659 HydrophobicContact CE1-CD2 4.5Å; E1604-Y1659 HydrophobicContact CG-CE2 4.17Å; M1607-Y1659 HydrophobicContact CB-CD1 4.2Å; M1607-Y1659 HydrophobicContact CB-CD2 3.39Å; M1607-Y1659 VanDerWaalsContact CB-CD2 3.42Å; M1607-Y1659 HydrophobicContact CB-CE1 4.33Å; M1607-Y1659 HydrophobicContact CB-CE2 3.66Å; M1607-Y1659 VanDerWaalsContact CB-CE2 3.46Å; M1607-Y1659 HydrophobicContact CB-CG 3.68Å; M1607-Y1659 HydrophobicContact CE-CD1 4.34Å; M1607-Y1659 HydrophobicContact CE-CG 3.98Å; M1607-Y1659 HydrophobicContact CG-CD2 4.03Å; M1607-Y1659 HydrophobicContact CG-CE2 4.29Å; M1607-Y1659 HydrophobicContact CG-CG 4.14Å; E1608-Y1659 WeakPolarHBondContact CA-OH 3.46Å; E1608-Y1659 WeakPolarHBondContact CG-OH 3.35Å; S1611-Y1659 WeakPolarHBondContact OG-CE1 3.22Å; A1612-Y1659 HydrophobicContact CB-CD1 4.05Å; A1612-Y1659 HydrophobicContact CB-CE1 3.89Å; A1613-Y1659 HydrophobicContact CB-CE1 4.36Å; Y1618-Y1659 AromaticContact CD2-CD1 3.86Å; Y1618-Y1659 HydrophobicContact CD2-CD1 4.03Å; Y1618-Y1659 HydrophobicContact CD2-CE1 4.45Å; Y1618-Y1659 AromaticContact CE2-CD1 3.74Å; Y1618-Y1659 HydrophobicContact CE2-CD1 3.74Å; Y1618-Y1659 HydrophobicContact CE2-CE1 4.19Å; N1655-Y1659 WeakPolarHBondContact O-CB 3.4Å; N1655-Y1659 PolarHBondContact O-N 3.09Å; M1656-Y1659 PolarHBondContact O-N 3.29Å; L1657-Y1659 VanDerWaalsContact C-N 3.28Å; L1657-Y1659 PolarHBondContact O-N 3.08Å; Y1659-V1661 VanDerWaalsContact C-N 3.32Å; Y1659-V1661 PolarHBondContact O-N 3.26Å; Y1659-I1662 PolarHBondContact O-N 3.17Å; Y1659-L1663 HydrophobicContact CD1-CD1 3.97Å; Y1659-L1663 HydrophobicContact CD2-CD1 4.49Å; Y1659-L1663 HydrophobicContact CD2-CG 4.39Å; Y1659-L1663 HydrophobicContact CE1-CD1 3.45Å; Y1659-L1663 VanDerWaalsContact CE1-CD1 3.45Å; Y1659-L1663 HydrophobicContact CE1-CG 4.27Å; Y1659-L1663 HydrophobicContact CE2-CD1 4.08Å; Y1659-L1663 HydrophobicContact CE2-CD2 4.25Å; Y1659-L1663 HydrophobicContact CE2-CG 4.02Å; Y1659-L1663 HydrophobicContact CG-CD1 4.48Å; Y1659-L1663 VanDerWaalsContact CZ-CD1 3.47Å; Y1659-L1663 WeakPolarHBondContact O-CG 3.35Å; Y1659-L1663 PolarHBondContact O-N 3.12Å |
| 1660 | H | 90.3 | Very high | 82.9 | Confident | 12 Ų | 12 | 42.8 Ų | 42.8 | 6% | 0.056 | 23% | 0.229 | C | C | . | . | H | α-helix | trans | -58.4 | -42.8 | 174 | 175.6 | 61.6 | 0 | 0 | 0 | 111.9 | Y1618 V1621 F1627 M1656 L1657 I1658 L1663 T1664 | Y1618-H1660 HydrophobicContact CD2-CB 4.47Å; Y1618-H1660 HydrophobicContact CE2-CB 3.83Å; Y1618-H1660 AromaticContact CZ-ND1 3.79Å; Y1618-H1660 PolarHBondContact OH-ND1 2.93Å; V1621-H1660 HydrophobicContact CG1-CB 4.25Å; F1627-H1660 PolarHBondContact O-NE2 3.21Å; M1656-H1660 WeakPolarHBondContact O-CB 3.41Å; M1656-H1660 PolarHBondContact O-N 3.08Å; L1657-H1660 PolarHBondContact O-N 3.18Å; I1658-H1660 PolarHBondContact O-N 2.91Å; H1660-L1663 PolarHBondContact O-N 2.98Å; H1660-T1664 PolarHBondContact CE1-OG1 3.24Å; H1660-T1664 VanDerWaalsContact O-CB 3.31Å; H1660-T1664 WeakPolarHBondContact O-CB 3.23Å; H1660-T1664 PolarHBondContact O-N 3.26Å; H1660-T1664 PolarHBondContact O-OG1 3.17Å |
| 1661 | V | 90.6 | Very high | 83.5 | Confident | 5.6 Ų | 5.6 | 45.3 Ų | 45.3 | 3% | 0.034 | 23% | 0.23 | C | C | . | . | H | α-helix | trans | -63.9 | -45 | 176.2 | 173.6 | 0 | 0 | 0 | 0 | 111.6 | F1627 L1657 I1658 Y1659 T1664 L1665 W1696 I1700 | F1627-V1661 HydrophobicContact CB-CG2 3.75Å; F1627-V1661 HydrophobicContact CD1-CB 4.25Å; F1627-V1661 HydrophobicContact CD1-CG1 4.29Å; F1627-V1661 HydrophobicContact CD1-CG2 3.68Å; F1627-V1661 HydrophobicContact CD2-CG2 4.02Å; F1627-V1661 HydrophobicContact CE1-CB 4.39Å; F1627-V1661 HydrophobicContact CE1-CG1 3.98Å; F1627-V1661 HydrophobicContact CE1-CG2 4.23Å; F1627-V1661 HydrophobicContact CE2-CG1 4.35Å; F1627-V1661 HydrophobicContact CE2-CG2 4.48Å; F1627-V1661 HydrophobicContact CG-CG2 3.55Å; F1627-V1661 HydrophobicContact CZ-CG1 4.01Å; L1657-V1661 HydrophobicContact CD1-CG2 4.42Å; L1657-V1661 WeakPolarHBondContact O-CG2 3.3Å; L1657-V1661 PolarHBondContact O-N 3.01Å; I1658-V1661 PolarHBondContact O-N 3.08Å; Y1659-V1661 VanDerWaalsContact C-N 3.32Å; Y1659-V1661 PolarHBondContact O-N 3.26Å; V1661-T1664 PolarHBondContact O-N 3.09Å; V1661-L1665 HydrophobicContact CG1-CD1 3.59Å; V1661-L1665 HydrophobicContact CG1-CG 4.24Å; V1661-L1665 WeakPolarHBondContact O-CB 3.33Å; V1661-L1665 VanDerWaalsContact O-CG 3.31Å; V1661-L1665 WeakPolarHBondContact O-CG 3.29Å; V1661-L1665 PolarHBondContact O-N 3.27Å; V1661-W1696 HydrophobicContact CB-CH2 3.96Å; V1661-W1696 HydrophobicContact CB-CZ3 4.07Å; V1661-W1696 HydrophobicContact CG1-CH2 4.29Å; V1661-W1696 HydrophobicContact CG1-CZ3 3.97Å; V1661-W1696 HydrophobicContact CG2-CH2 3.66Å; V1661-W1696 HydrophobicContact CG2-CZ3 4.2Å; V1661-I1700 HydrophobicContact CG1-CD1 4.5Å |
| 1662 | I | 86.2 | Confident | 83.9 | Confident | 16 Ų | 16 | 42.9 Ų | 42.9 | 8% | 0.082 | 22% | 0.224 | C | C | . | . | H | α-helix | trans | -59.4 | -50.1 | 177.5 | -68.5 | 166.2 | 0 | 0 | 0 | 110.7 | F1603 E1604 I1658 Y1659 T1664 L1665 K1666 V1699 I1700 | F1603-I1662 HydrophobicContact CD1-CD1 3.79Å; F1603-I1662 HydrophobicContact CE1-CD1 4.03Å; E1604-I1662 HydrophobicContact CG-CG2 4.37Å; I1658-I1662 HydrophobicContact CG2-CD1 3.78Å; I1658-I1662 HydrophobicContact CG2-CG1 4.4Å; I1658-I1662 VanDerWaalsContact O-CG1 3.32Å; I1658-I1662 WeakPolarHBondContact O-CG1 3.29Å; I1658-I1662 PolarHBondContact O-N 3.08Å; Y1659-I1662 PolarHBondContact O-N 3.17Å; I1662-T1664 VanDerWaalsContact C-N 3.3Å; I1662-T1664 PolarHBondContact O-N 3.14Å; I1662-L1665 PolarHBondContact O-N 3.14Å; I1662-K1666 VanDerWaalsContact O-CB 3.28Å; I1662-K1666 WeakPolarHBondContact O-CB 3.33Å; I1662-K1666 PolarHBondContact O-N 3.06Å; I1662-V1699 HydrophobicContact CD1-CG1 3.65Å; I1662-I1700 HydrophobicContact CG1-CD1 4.27Å |
| 1663 | L | 87.2 | Confident | 84.5 | Confident | 46.4 Ų | 46.4 | 42.6 Ų | 42.6 | 24% | 0.243 | 22% | 0.223 | C | C | . | . | H | α-helix | trans | -60.8 | -40.1 | 179.4 | -73.5 | 178.8 | 0 | 0 | 0 | 112.4 | Y1618 Y1659 H1660 | Y1618-L1663 HydrophobicContact CE2-CD1 4.36Å; Y1618-L1663 VanDerWaalsContact OH-CD1 3.28Å; Y1618-L1663 WeakPolarHBondContact OH-CD1 3.31Å; Y1659-L1663 HydrophobicContact CD1-CD1 3.97Å; Y1659-L1663 HydrophobicContact CD2-CD1 4.49Å; Y1659-L1663 HydrophobicContact CD2-CG 4.39Å; Y1659-L1663 HydrophobicContact CE1-CD1 3.45Å; Y1659-L1663 VanDerWaalsContact CE1-CD1 3.45Å; Y1659-L1663 HydrophobicContact CE1-CG 4.27Å; Y1659-L1663 HydrophobicContact CE2-CD1 4.08Å; Y1659-L1663 HydrophobicContact CE2-CD2 4.25Å; Y1659-L1663 HydrophobicContact CE2-CG 4.02Å; Y1659-L1663 HydrophobicContact CG-CD1 4.48Å; Y1659-L1663 VanDerWaalsContact CZ-CD1 3.47Å; Y1659-L1663 WeakPolarHBondContact O-CG 3.35Å; Y1659-L1663 PolarHBondContact O-N 3.12Å; H1660-L1663 PolarHBondContact O-N 2.98Å |
| 1664 | T | 89.1 | Confident | 85.1 | Confident | 23.2 Ų | 23.2 | 41.3 Ų | 41.3 | 14% | 0.142 | 22% | 0.215 | C | C | . | . | H | α-helix | trans | -68 | -39.5 | 178.8 | -54.2 | 0 | 0 | 0 | 0 | 111.3 | F1627 Q1629 F1640 H1660 V1661 I1662 F1668 | F1627-T1664 HydrophobicContact CD1-CG2 4.19Å; F1627-T1664 HydrophobicContact CE1-CG2 3.94Å; Q1629-T1664 HydrophobicContact CB-CG2 4.42Å; F1640-T1664 HydrophobicContact CD1-CG2 4.33Å; F1640-T1664 HydrophobicContact CE1-CG2 4.06Å; H1660-T1664 PolarHBondContact CE1-OG1 3.24Å; H1660-T1664 VanDerWaalsContact O-CB 3.31Å; H1660-T1664 WeakPolarHBondContact O-CB 3.23Å; H1660-T1664 PolarHBondContact O-N 3.26Å; H1660-T1664 PolarHBondContact O-OG1 3.17Å; V1661-T1664 PolarHBondContact O-N 3.09Å; I1662-T1664 VanDerWaalsContact C-N 3.3Å; I1662-T1664 PolarHBondContact O-N 3.14Å; T1664-F1668 WeakPolarHBondContact O-CD2 3.38Å |
| 1665 | L | 86.7 | Confident | 85.7 | Confident | 22.8 Ų | 22.8 | 42.7 Ų | 42.7 | 12% | 0.119 | 22% | 0.22 | C | C | . | . | H | α-helix | trans | -76.3 | -29.4 | 178 | -71 | 172.1 | 0 | 0 | 0 | 113.2 | F1627 F1640 V1661 I1662 Q1667 F1668 S1669 V1704 | F1627-L1665 HydrophobicContact CE1-CD2 4.47Å; F1627-L1665 HydrophobicContact CE1-CG 4.34Å; F1627-L1665 HydrophobicContact CZ-CD1 4.47Å; F1627-L1665 HydrophobicContact CZ-CD2 4.18Å; F1627-L1665 HydrophobicContact CZ-CG 4.25Å; F1640-L1665 HydrophobicContact CD1-CD2 4.02Å; F1640-L1665 HydrophobicContact CD2-CD2 4.19Å; F1640-L1665 HydrophobicContact CE1-CD2 3.8Å; F1640-L1665 HydrophobicContact CE2-CD2 4Å; F1640-L1665 HydrophobicContact CG-CD2 4.21Å; F1640-L1665 HydrophobicContact CZ-CD2 3.79Å; V1661-L1665 HydrophobicContact CG1-CD1 3.59Å; V1661-L1665 HydrophobicContact CG1-CG 4.24Å; V1661-L1665 WeakPolarHBondContact O-CB 3.33Å; V1661-L1665 VanDerWaalsContact O-CG 3.31Å; V1661-L1665 WeakPolarHBondContact O-CG 3.29Å; V1661-L1665 PolarHBondContact O-N 3.27Å; I1662-L1665 PolarHBondContact O-N 3.14Å; L1665-Q1667 PolarHBondContact O-N 3.39Å; L1665-Q1667 VanDerWaalsContact O-N 3.16Å; L1665-F1668 CarbonylContact O-C 3.54Å; L1665-F1668 VanDerWaalsContact O-C 3.28Å; L1665-F1668 WeakPolarHBondContact O-CA 3.33Å; L1665-F1668 PolarHBondContact O-N 3.09Å; L1665-S1669 PolarHBondContact O-N 3.13Å; L1665-S1669 VanDerWaalsContact O-N 3.12Å; L1665-V1704 HydrophobicContact CD1-CG1 3.81Å |
| 1666 | K | 82 | Confident | 86.3 | Confident | 100.6 Ų | 100.6 | 40.9 Ų | 40.9 | 44% | 0.437 | 21% | 0.21 | S | C | . | . | H | α-helix | trans | -58 | -35.4 | -177.2 | -165.7 | 171 | -175.1 | 169.6 | 0 | 112.4 | E1604 I1662 F1668 S1669 | E1604-K1666 VanDerWaalsContact OE1-CD 3.29Å; E1604-K1666 WeakPolarHBondContact OE1-CD 3.33Å; E1604-K1666 WeakPolarHBondContact OE1-CE 3.39Å; E1604-K1666 IonicContact OE1-NZ 3.43Å; E1604-K1666 PolarHBondContact OE1-NZ 3.01Å; E1604-K1666 IonicContact OE2-NZ 3.28Å; E1604-K1666 PolarHBondContact OE2-NZ 2.96Å; I1662-K1666 VanDerWaalsContact O-CB 3.28Å; I1662-K1666 WeakPolarHBondContact O-CB 3.33Å; I1662-K1666 PolarHBondContact O-N 3.06Å; K1666-F1668 PolarHBondContact O-N 3.31Å; K1666-F1668 VanDerWaalsContact O-N 3.13Å; K1666-S1669 WeakPolarHBondContact O-CB 3.39Å; K1666-S1669 PolarHBondContact O-N 3.14Å; K1666-S1669 VanDerWaalsContact O-N 3.13Å; K1666-S1669 PolarHBondContact O-OG 2.96Å |
| 1667 | Q | 79.7 | Confident | 86.9 | Confident | 156.6 Ų | 156.6 | 41.6 Ų | 41.6 | 73% | 0.732 | 22% | 0.215 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -62.1 | -20.8 | 175.4 | -62.6 | -177.4 | -0.1 | 0 | 0 | 113.5 | L1665 | L1665-Q1667 PolarHBondContact O-N 3.39Å; L1665-Q1667 VanDerWaalsContact O-N 3.16Å |
| 1668 | F | 79.2 | Confident | 87.1 | Confident | 43.6 Ų | 43.6 | 41.6 Ų | 41.6 | 19% | 0.191 | 22% | 0.215 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -121 | 16 | -177.8 | -55.7 | -89 | 0 | 0 | 0 | 112.3 | Q1629 P1638 F1640 T1664 L1665 K1666 N1670 Q1671 | Q1629-F1668 HydrophobicContact CB-CE2 4.49Å; Q1629-F1668 HydrophobicContact CG-CE2 4.09Å; Q1629-F1668 HydrophobicContact CG-CZ 4.07Å; P1638-F1668 HydrophobicContact CB-CD1 4.11Å; P1638-F1668 HydrophobicContact CB-CE1 4.23Å; P1638-F1668 HydrophobicContact CG-CD1 3.98Å; P1638-F1668 HydrophobicContact CG-CE1 4.36Å; P1638-F1668 HydrophobicContact CG-CG 4.49Å; F1640-F1668 HydrophobicContact CE1-CD2 4.06Å; F1640-F1668 HydrophobicContact CE1-CE2 4.35Å; F1640-F1668 HydrophobicContact CZ-CB 4.1Å; F1640-F1668 HydrophobicContact CZ-CD1 4.49Å; F1640-F1668 AromaticContact CZ-CD2 3.55Å; F1640-F1668 HydrophobicContact CZ-CD2 3.55Å; F1640-F1668 HydrophobicContact CZ-CE2 4.12Å; F1640-F1668 AromaticContact CZ-CG 3.87Å; F1640-F1668 HydrophobicContact CZ-CG 3.87Å; T1664-F1668 WeakPolarHBondContact O-CD2 3.38Å; L1665-F1668 CarbonylContact O-C 3.54Å; L1665-F1668 VanDerWaalsContact O-C 3.28Å; L1665-F1668 WeakPolarHBondContact O-CA 3.33Å; L1665-F1668 PolarHBondContact O-N 3.09Å; K1666-F1668 PolarHBondContact O-N 3.31Å; K1666-F1668 VanDerWaalsContact O-N 3.13Å; F1668-N1670 PolarHBondContact O-N 3.16Å; F1668-Q1671 HydrophobicContact CB-CG 3.99Å; F1668-Q1671 WeakPolarHBondContact O-CB 3.37Å; F1668-Q1671 WeakPolarHBondContact O-CG 3.3Å; F1668-Q1671 PolarHBondContact O-N 3.3Å |
| 1669 | S | 67.1 | Low | 87.4 | Confident | 53.2 Ų | 53.2 | 42.4 Ų | 42.4 | 37% | 0.372 | 22% | 0.219 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -59.4 | 96.2 | -176.4 | 54.2 | 0 | 0 | 0 | 0 | 112.7 | L1665 K1666 Q1671 | L1665-S1669 PolarHBondContact O-N 3.13Å; L1665-S1669 VanDerWaalsContact O-N 3.12Å; K1666-S1669 WeakPolarHBondContact O-CB 3.39Å; K1666-S1669 PolarHBondContact O-N 3.14Å; K1666-S1669 VanDerWaalsContact O-N 3.13Å; K1666-S1669 PolarHBondContact O-OG 2.96Å; S1669-Q1671 VanDerWaalsContact C-N 3.33Å; S1669-Q1671 PolarHBondContact O-N 2.88Å |
| 1670 | N | 73.8 | Confident | 87.7 | Confident | 150 Ų | 150 | 41.8 Ų | 41.8 | 80% | 0.802 | 22% | 0.217 | S | C | * | . | T | Hydrogen-bonded Turn | trans | 96.1 | 8.1 | -177.7 | -57.8 | -29.6 | 0 | 0 | 0 | 116.1 | F1668 | F1668-N1670 PolarHBondContact O-N 3.16Š|
| 1671 | Q | 84.1 | Confident | 87.7 | Confident | 97.2 Ų | 97.2 | 42.3 Ų | 42.3 | 45% | 0.454 | 22% | 0.219 | S | C | . | . | S | Bend | trans | -109.8 | 143.9 | 173.4 | -45.7 | -177.9 | -5.3 | 0 | 0 | 110.6 | F1668 S1669 C1673 S1707 | F1668-Q1671 HydrophobicContact CB-CG 3.99Å; F1668-Q1671 WeakPolarHBondContact O-CB 3.37Å; F1668-Q1671 WeakPolarHBondContact O-CG 3.3Å; F1668-Q1671 PolarHBondContact O-N 3.3Å; S1669-Q1671 VanDerWaalsContact C-N 3.33Å; S1669-Q1671 PolarHBondContact O-N 2.88Å; Q1671-C1673 PolarHBondContact O-N 3.06Å; Q1671-S1707 WeakPolarHBondContact O-CB 3.4Å |
| 1672 | P | 89.5 | Confident | 87.8 | Confident | 65.8 Ų | 65.8 | 42.3 Ų | 42.3 | 43% | 0.427 | 22% | 0.219 | S | C | . | . | trans | -59.4 | 130.7 | 171.9 | 23.7 | -31.3 | 0 | 0 | 0 | 110.1 | N1637 P1638 S1707 V1709 | N1637-P1672 WeakPolarHBondContact CB-O 3.42Å; N1637-P1672 VanDerWaalsContact OD1-CG 3.32Å; N1637-P1672 WeakPolarHBondContact OD1-CG 3.43Å; N1637-P1672 PolarHBondContact OD1-O 2.97Å; P1638-P1672 WeakPolarHBondContact CD-O 3.27Å; P1672-S1707 CarbonylContact C-O 3.56Å; P1672-S1707 WeakPolarHBondContact CA-O 3.36Å; P1672-V1709 HydrophobicContact CB-CG2 3.43Å; P1672-V1709 VanDerWaalsContact CB-CG2 3.45Å | ||
| 1673 | C | 92 | Very high | 87.8 | Confident | 3.6 Ų | 3.6 | 42.9 Ų | 42.9 | 2% | 0.024 | 22% | 0.223 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -130.6 | 161.3 | 179.8 | 62.6 | 0 | 0 | 0 | 0 | 112.5 | P1638 F1640 Q1671 S1707 V1708 V1709 | P1638-C1673 HydrophobicContact CG-CB 4.14Å; F1640-C1673 HydrophobicContact CD2-CB 4.04Å; F1640-C1673 HydrophobicContact CE2-CB 3.64Å; Q1671-C1673 PolarHBondContact O-N 3.06Å; C1673-S1707 PolarHBondContact N-O 3.15Å; C1673-V1708 CarbonylContact O-C 3.45Å; C1673-V1708 WeakPolarHBondContact O-CA 3.33Å; C1673-V1709 PolarHBondContact O-N 3.15Å |
| 1674 | E | 94.7 | Very high | 87.6 | Confident | 7.4 Ų | 7.4 | 42.8 Ų | 42.8 | 4% | 0.035 | 22% | 0.224 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -123.4 | 146.6 | 178 | -66.7 | 177.6 | -144.6 | 0 | 0 | 110.4 | S1633 N1637 P1638 V1639 F1640 A1710 Y1712 | S1633-E1674 VanDerWaalsContact CB-OE1 3.24Å; S1633-E1674 WeakPolarHBondContact CB-OE1 3.35Å; S1633-E1674 WeakPolarHBondContact CB-OE2 3.36Å; S1633-E1674 VanDerWaalsContact OG-CD 3.27Å; S1633-E1674 PolarHBondContact OG-OE1 3.23Å; S1633-E1674 PolarHBondContact OG-OE2 3.01Å; N1637-E1674 HydrophobicContact CB-CG 4.02Å; N1637-E1674 PolarHBondContact ND2-OE1 3.2Å; P1638-E1674 PolarHBondContact O-N 3.12Å; V1639-E1674 WeakPolarHBondContact CA-O 3.41Å; V1639-E1674 HydrophobicContact CG2-CB 4.47Å; F1640-E1674 PolarHBondContact N-O 2.9Å; E1674-A1710 WeakPolarHBondContact CA-O 3.44Å; E1674-A1710 HydrophobicContact CG-CB 4.23Å; E1674-Y1712 HydrophobicContact CB-CE2 4.14Å; E1674-Y1712 HydrophobicContact CG-CE2 4.47Å; E1674-Y1712 WeakPolarHBondContact OE2-CE2 3.38Å; E1674-Y1712 PolarHBondContact OE2-OH 3.26Å |
| 1675 | L | 94.5 | Very high | 87.2 | Confident | 39.2 Ų | 39.2 | 45.7 Ų | 45.7 | 21% | 0.205 | 24% | 0.236 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -122.7 | 129.5 | -176.6 | 177.9 | 65.1 | 0 | 0 | 0 | 110.7 | F1627 F1640 F1642 V1677 V1708 A1710 V1711 Y1712 | F1627-L1675 HydrophobicContact CE2-CD1 3.83Å; F1627-L1675 HydrophobicContact CZ-CD1 4.48Å; F1640-L1675 HydrophobicContact CB-CD1 3.91Å; F1640-L1675 CarbonylContact O-C 3.56Å; F1640-L1675 WeakPolarHBondContact O-CA 3.35Å; F1642-L1675 HydrophobicContact CB-CD1 4.43Å; L1675-V1677 HydrophobicContact CD2-CG2 3.9Å; L1675-V1677 HydrophobicContact CG-CG2 3.89Å; L1675-V1708 HydrophobicContact CB-CG1 4.48Å; L1675-A1710 PolarHBondContact N-O 3.22Å; L1675-V1711 HydrophobicContact CB-CG1 4.36Å; L1675-V1711 HydrophobicContact CB-CG2 4.31Å; L1675-V1711 HydrophobicContact CD2-CG1 4.15Å; L1675-V1711 HydrophobicContact CD2-CG2 4.47Å; L1675-V1711 HydrophobicContact CG-CG1 4.32Å; L1675-V1711 CarbonylContact O-C 3.54Å; L1675-V1711 VanDerWaalsContact O-CA 3.24Å; L1675-V1711 WeakPolarHBondContact O-CA 3.24Å; L1675-Y1712 PolarHBondContact O-N 3.13Å |
| 1676 | V | 96.2 | Very high | 87.3 | Confident | 0.4 Ų | 0.4 | 45 Ų | 45 | 0% | 0.002 | 23% | 0.232 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -106.2 | 122.9 | 170.5 | -179.1 | 0 | 0 | 0 | 0 | 108.3 | V1639 F1640 Y1641 F1642 Y1712 L1749 I1753 L1760 | V1639-V1676 HydrophobicContact CG1-CG2 3.72Å; F1640-V1676 PolarHBondContact O-N 3.24Å; Y1641-V1676 CarbonylContact C-O 3.54Å; Y1641-V1676 WeakPolarHBondContact CA-O 3.38Å; Y1641-V1676 HydrophobicContact CD1-CB 3.72Å; Y1641-V1676 HydrophobicContact CD1-CG1 3.88Å; Y1641-V1676 HydrophobicContact CD1-CG2 4.36Å; Y1641-V1676 HydrophobicContact CE1-CB 3.79Å; Y1641-V1676 HydrophobicContact CE1-CG1 3.86Å; Y1641-V1676 HydrophobicContact CE1-CG2 3.96Å; Y1641-V1676 HydrophobicContact CG-CB 4.41Å; F1642-V1676 PolarHBondContact N-O 3Å; V1676-Y1712 CarbonylContact C-O 3.53Å; V1676-Y1712 WeakPolarHBondContact CA-O 3.24Å; V1676-Y1712 HydrophobicContact CG2-CD2 3.97Å; V1676-L1749 HydrophobicContact CG1-CD1 4.49Å; V1676-L1749 HydrophobicContact CG1-CD2 4.28Å; V1676-L1749 HydrophobicContact CG2-CD1 4.08Å; V1676-L1749 HydrophobicContact CG2-CD2 4.45Å; V1676-I1753 HydrophobicContact CG2-CD1 3.84Å; V1676-L1760 HydrophobicContact CG1-CD2 4.04Å |
| 1677 | V | 96.1 | Very high | 87.5 | Confident | 17.6 Ų | 17.6 | 43.3 Ų | 43.3 | 11% | 0.107 | 22% | 0.223 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -111.8 | 111.3 | 178.6 | -180 | 0 | 0 | 0 | 0 | 108.3 | F1642 L1675 L1679 V1711 Y1712 L1713 C1714 | F1642-V1677 HydrophobicContact CB-CG2 4.43Å; F1642-V1677 HydrophobicContact CD1-CG1 4.09Å; L1675-V1677 HydrophobicContact CD2-CG2 3.9Å; L1675-V1677 HydrophobicContact CG-CG2 3.89Å; V1677-L1679 HydrophobicContact CG1-CD2 3.85Å; V1677-L1679 HydrophobicContact CG1-CG 4.03Å; V1677-V1711 HydrophobicContact CG2-CG1 3.95Å; V1677-Y1712 PolarHBondContact N-O 3.19Å; V1677-L1713 HydrophobicContact CB-CD2 3.89Å; V1677-L1713 HydrophobicContact CB-CG 4.45Å; V1677-L1713 HydrophobicContact CG1-CD2 3.97Å; V1677-L1713 HydrophobicContact CG2-CD2 4.34Å; V1677-C1714 PolarHBondContact O-N 3.29Å |
| 1678 | D | 95.5 | Very high | 87.9 | Confident | 0.4 Ų | 0.4 | 37.3 Ų | 37.3 | 0% | 0.002 | 20% | 0.195 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -89.9 | 110 | 175.9 | -173.1 | 8.3 | 0 | 0 | 0 | 110 | F1642 I1643 A1644 T1680 L1760 T1764 | F1642-D1678 PolarHBondContact O-N 3.27Å; I1643-D1678 HydrophobicContact CD1-CB 3.71Å; A1644-D1678 WeakPolarHBondContact CB-O 3.24Å; A1644-D1678 PolarHBondContact N-O 3Å; D1678-T1680 WeakPolarHBondContact OD1-CB 3.27Å; D1678-T1680 PolarHBondContact OD1-N 3.03Å; D1678-T1680 PolarHBondContact OD1-OG1 3.17Å; D1678-L1760 HydrophobicContact CB-CD2 4.25Å; D1678-T1764 WeakPolarHBondContact OD2-CG2 3.46Å; D1678-T1764 PolarHBondContact OD2-OG1 3.28Å |
| 1679 | L | 95.1 | Very high | 87.8 | Confident | 16.4 Ų | 16.4 | 41.4 Ų | 41.4 | 9% | 0.086 | 21% | 0.209 | C | C | . | . | trans | -99 | 11.5 | 178.7 | -59.6 | 169 | 0 | 0 | 0 | 112.7 | A1644 V1677 H1681 T1682 L1713 C1714 C1716 V1720 | A1644-L1679 HydrophobicContact CB-CD2 4.11Å; V1677-L1679 HydrophobicContact CG1-CD2 3.85Å; V1677-L1679 HydrophobicContact CG1-CG 4.03Å; L1679-H1681 PolarHBondContact O-N 3.1Å; L1679-T1682 VanDerWaalsContact CA-OG1 3.22Å; L1679-T1682 WeakPolarHBondContact CA-OG1 3.26Å; L1679-T1682 WeakPolarHBondContact O-CB 3.35Å; L1679-T1682 PolarHBondContact O-N 3.2Å; L1679-T1682 VanDerWaalsContact O-N 3.13Å; L1679-T1682 PolarHBondContact O-OG1 3.13Å; L1679-L1713 HydrophobicContact CD1-CD2 3.89Å; L1679-C1714 WeakPolarHBondContact CB-O 3.35Å; L1679-C1714 PolarHBondContact N-O 3.14Å; L1679-C1714 VanDerWaalsContact N-O 3.09Å; L1679-C1716 HydrophobicContact CD1-CB 4.22Å; L1679-V1720 HydrophobicContact CB-CG2 4.42Å; L1679-V1720 HydrophobicContact CD1-CG1 4.07Å; L1679-V1720 HydrophobicContact CD1-CG2 4.26Å; L1679-V1720 HydrophobicContact CD2-CG2 4.17Å | ||
| 1680 | T | 92.7 | Very high | 88.2 | Confident | 0.2 Ų | 0.2 | 42.2 Ų | 42.2 | 0% | 0.001 | 21% | 0.211 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -55.2 | 123.9 | 177.5 | -58.3 | 0 | 0 | 0 | 0 | 110.9 | N1645 D1678 T1682 N1715 T1764 L1767 | N1645-T1680 WeakPolarHBondContact CB-O 3.42Å; N1645-T1680 PolarHBondContact ND2-O 3.26Å; N1645-T1680 VanDerWaalsContact ND2-O 3.08Å; D1678-T1680 WeakPolarHBondContact OD1-CB 3.27Å; D1678-T1680 PolarHBondContact OD1-N 3.03Å; D1678-T1680 PolarHBondContact OD1-OG1 3.17Å; T1680-T1682 VanDerWaalsContact C-N 3.27Å; T1680-T1682 PolarHBondContact O-N 2.99Å; T1680-N1715 PolarHBondContact OG1-ND2 3.19Å; T1680-T1764 HydrophobicContact CG2-CG2 4.44Å; T1680-T1764 VanDerWaalsContact OG1-CG2 3.29Å; T1680-T1764 WeakPolarHBondContact OG1-CG2 3.35Å; T1680-L1767 HydrophobicContact CG2-CD1 3.39Å; T1680-L1767 VanDerWaalsContact CG2-CD1 3.45Å |
| 1681 | H | 90.8 | Very high | 87.8 | Confident | 21.4 Ų | 21.4 | 38.6 Ų | 38.6 | 10% | 0.099 | 19% | 0.193 | C | C | . | . | T | Hydrogen-bonded Turn | trans | 58.2 | 32.9 | 179.8 | -164.6 | -105.4 | 0 | 0 | 0 | 114.1 | L1679 N1683 N1686 V1816 Y1818 E1821 | L1679-H1681 PolarHBondContact O-N 3.1Å; H1681-N1683 PolarHBondContact O-N 2.72Å; H1681-N1686 PolarHBondContact O-OD1 3.31Å; H1681-V1816 PolarHBondContact CD2-O 3.26Å; H1681-V1816 VanDerWaalsContact CD2-O 3.29Å; H1681-Y1818 HydrophobicContact CB-CD2 4.38Å; H1681-Y1818 HydrophobicContact CB-CE2 3.65Å; H1681-Y1818 AromaticContact CD2-CD2 3.47Å; H1681-Y1818 VanDerWaalsContact CD2-CD2 3.45Å; H1681-Y1818 WeakPolarHBondContact CD2-CD2 3.29Å; H1681-Y1818 AromaticContact CD2-CE2 3.65Å; H1681-Y1818 AromaticContact CE1-CD2 3.7Å; H1681-Y1818 AromaticContact CE1-CE2 3.9Å; H1681-Y1818 AromaticContact CG-CD2 3.6Å; H1681-Y1818 AromaticContact CG-CE2 3.3Å; H1681-Y1818 AromaticContact ND1-CD2 3.73Å; H1681-Y1818 AromaticContact ND1-CE2 3.52Å; H1681-Y1818 WeakPolarHBondContact ND1-CE2 3.33Å; H1681-Y1818 AromaticContact NE2-CD2 3.55Å; H1681-Y1818 WeakPolarHBondContact NE2-CD2 3.42Å; H1681-Y1818 AromaticContact NE2-CE2 3.99Å; H1681-E1821 IonicContact CD2-OE1 3.96Å; H1681-E1821 IonicContact CD2-OE2 3.04Å; H1681-E1821 IonicContact CE1-OE1 3.18Å; H1681-E1821 PolarHBondContact CE1-OE1 3.06Å; H1681-E1821 IonicContact CE1-OE2 3.4Å; H1681-E1821 IonicContact NE2-OE1 3.47Å; H1681-E1821 PolarHBondContact NE2-OE1 3.23Å; H1681-E1821 IonicContact NE2-OE2 2.92Å; H1681-E1821 PolarHBondContact NE2-OE2 3.19Å |
| 1682 | T | 91 | Very high | 87.6 | Confident | 7.2 Ų | 7.2 | 34.8 Ų | 34.8 | 4% | 0.044 | 18% | 0.175 | C | C | . | . | trans | -79.8 | 121.9 | 175.2 | -47.1 | 0 | 0 | 0 | 0 | 110.6 | A1644 L1679 T1680 N1686 N1717 W1719 V1720 | A1644-T1682 HydrophobicContact CB-CG2 4.07Å; A1644-T1682 WeakPolarHBondContact CB-OG1 3.34Å; L1679-T1682 VanDerWaalsContact CA-OG1 3.22Å; L1679-T1682 WeakPolarHBondContact CA-OG1 3.26Å; L1679-T1682 WeakPolarHBondContact O-CB 3.35Å; L1679-T1682 PolarHBondContact O-N 3.2Å; L1679-T1682 VanDerWaalsContact O-N 3.13Å; L1679-T1682 PolarHBondContact O-OG1 3.13Å; T1680-T1682 VanDerWaalsContact C-N 3.27Å; T1680-T1682 PolarHBondContact O-N 2.99Å; T1682-N1686 HydrophobicContact CG2-CB 3.97Å; T1682-N1717 PolarHBondContact O-ND2 2.96Å; T1682-W1719 HydrophobicContact CG2-CE3 4Å; T1682-W1719 HydrophobicContact CG2-CZ3 3.67Å; T1682-V1720 HydrophobicContact CG2-CG2 4.36Å | ||
| 1683 | N | 86.6 | Confident | 87.3 | Confident | 27.8 Ų | 27.8 | 32 Ų | 32 | 15% | 0.149 | 16% | 0.157 | C | C | . | . | trans | -134.6 | -166.6 | -179.9 | 67.6 | 26.9 | 0 | 0 | 0 | 112.2 | H1681 E1685 N1686 W1719 | H1681-N1683 PolarHBondContact O-N 2.72Å; N1683-E1685 PolarHBondContact O-N 3.12Å; N1683-E1685 VanDerWaalsContact OD1-CB 3.29Å; N1683-E1685 WeakPolarHBondContact OD1-CB 3.28Å; N1683-E1685 PolarHBondContact OD1-N 3.33Å; N1683-N1686 PolarHBondContact N-OD1 3.18Å; N1683-N1686 VanDerWaalsContact N-OD1 3.16Å; N1683-N1686 PolarHBondContact O-N 3.13Å; N1683-N1686 VanDerWaalsContact O-N 3.09Å; N1683-N1686 PolarHBondContact OD1-OD1 3.1Å; N1683-N1686 VanDerWaalsContact OD1-OD1 3.14Å; N1683-W1719 VanDerWaalsContact C-CE2 3.46Å; N1683-W1719 WeakPolarHBondContact O-CH2 3.34Å; N1683-W1719 VanDerWaalsContact O-CZ2 3.31Å; N1683-W1719 WeakPolarHBondContact O-CZ2 3.37Å | ||
| 1684 | T | 82.8 | Confident | 86.5 | Confident | 43.8 Ų | 43.8 | 33.2 Ų | 33.2 | 27% | 0.269 | 17% | 0.165 | S | C | . | . | G | 310 helix | trans | -57.6 | -29.5 | -179.5 | 36 | 0 | 0 | 0 | 0 | 114 | E1253 N1686 R1687 W1719 | E1253-T1684 VanDerWaalsContact OE1-CG2 3.27Å; E1253-T1684 WeakPolarHBondContact OE1-CG2 3.34Å; E1253-T1684 PolarHBondContact OE1-OG1 3.08Å; T1684-N1686 VanDerWaalsContact C-N 3.28Å; T1684-N1686 PolarHBondContact O-N 3.33Å; T1684-R1687 VanDerWaalsContact O-CD 3.28Å; T1684-R1687 WeakPolarHBondContact O-CD 3.41Å; T1684-R1687 VanDerWaalsContact O-CG 3.26Å; T1684-R1687 WeakPolarHBondContact O-CG 3.32Å; T1684-R1687 PolarHBondContact O-N 2.92Å; T1684-R1687 PolarHBondContact O-NH1 3.16Å; T1684-W1719 HydrophobicContact CG2-CZ2 4.47Å; T1684-W1719 VanDerWaalsContact CG2-NE1 3.27Å |
| 1685 | E | 81.6 | Confident | 85.6 | Confident | 85 Ų | 85 | 35 Ų | 35 | 40% | 0.397 | 17% | 0.173 | S | C | . | . | G | 310 helix | trans | -70.3 | -26.2 | 178.5 | -58.5 | -175.5 | 167.3 | 0 | 0 | 112.2 | K1648 T1649 N1683 | K1648-E1685 HydrophobicContact CD-CB 4.23Å; K1648-E1685 IonicContact NZ-OE2 2.81Å; K1648-E1685 PolarHBondContact NZ-OE2 3.2Å; T1649-E1685 VanDerWaalsContact CB-O 3.31Å; T1649-E1685 WeakPolarHBondContact CB-O 3.33Å; T1649-E1685 PolarHBondContact N-O 3.1Å; T1649-E1685 PolarHBondContact OG1-O 3.19Å; N1683-E1685 PolarHBondContact O-N 3.12Å; N1683-E1685 VanDerWaalsContact OD1-CB 3.29Å; N1683-E1685 WeakPolarHBondContact OD1-CB 3.28Å; N1683-E1685 PolarHBondContact OD1-N 3.33Å |
| 1686 | N | 88.3 | Confident | 85 | Confident | 8.6 Ų | 8.6 | 34.8 Ų | 34.8 | 5% | 0.046 | 17% | 0.169 | C | C | . | . | G | 310 helix | trans | -95.9 | 7.3 | -175.3 | -49.4 | 115.5 | 0 | 0 | 0 | 114 | N1645 F1647 H1681 T1682 N1683 T1684 | N1645-N1686 VanDerWaalsContact C-ND2 3.33Å; N1645-N1686 WeakPolarHBondContact CA-ND2 3.32Å; N1645-N1686 PolarHBondContact O-ND2 2.98Å; F1647-N1686 WeakPolarHBondContact CD1-O 3.34Å; F1647-N1686 VanDerWaalsContact O-CA 3.27Å; F1647-N1686 WeakPolarHBondContact O-CA 3.4Å; F1647-N1686 WeakPolarHBondContact O-CB 3.39Å; F1647-N1686 PolarHBondContact O-ND2 3.13Å; H1681-N1686 PolarHBondContact O-OD1 3.31Å; T1682-N1686 HydrophobicContact CG2-CB 3.97Å; N1683-N1686 PolarHBondContact N-OD1 3.18Å; N1683-N1686 VanDerWaalsContact N-OD1 3.16Å; N1683-N1686 PolarHBondContact O-N 3.13Å; N1683-N1686 VanDerWaalsContact O-N 3.09Å; N1683-N1686 PolarHBondContact OD1-OD1 3.1Å; N1683-N1686 VanDerWaalsContact OD1-OD1 3.14Å; T1684-N1686 VanDerWaalsContact C-N 3.28Å; T1684-N1686 PolarHBondContact O-N 3.33Å |
| 1687 | R | 85.7 | Confident | 84.1 | Confident | 63.8 Ų | 63.8 | 37.7 Ų | 37.7 | 24% | 0.241 | 18% | 0.182 | C | C | . | . | P | Polyproline II helix | trans | -74.6 | 140.9 | -171.2 | 76.5 | -171.6 | 177.3 | -151.3 | -2 | 112.9 | E1251 T1649 T1684 R1689 W1719 Y1723 | E1251-R1687 IonicContact OE1-CZ 2.99Å; E1251-R1687 IonicContact OE1-NH1 3.79Å; E1251-R1687 PolarHBondContact OE1-NH1 3.22Å; E1251-R1687 VanDerWaalsContact OE1-NH1 3.15Å; E1251-R1687 IonicContact OE1-NH2 3.3Å; E1251-R1687 PolarHBondContact OE1-NH2 3Å; E1251-R1687 IonicContact OE2-CZ 2.9Å; E1251-R1687 IonicContact OE2-NH1 2.79Å; E1251-R1687 PolarHBondContact OE2-NH1 2.84Å; E1251-R1687 IonicContact OE2-NH2 3.87Å; E1251-R1687 PolarHBondContact OE2-NH2 3.3Å; T1649-R1687 PolarHBondContact OG1-N 3.41Å; T1649-R1687 PolarHBondContact OG1-O 3.22Å; T1684-R1687 VanDerWaalsContact O-CD 3.28Å; T1684-R1687 WeakPolarHBondContact O-CD 3.41Å; T1684-R1687 VanDerWaalsContact O-CG 3.26Å; T1684-R1687 WeakPolarHBondContact O-CG 3.32Å; T1684-R1687 PolarHBondContact O-N 2.92Å; T1684-R1687 PolarHBondContact O-NH1 3.16Å; R1687-R1689 PolarHBondContact O-N 2.97Å; R1687-W1719 HydrophobicContact CB-CH2 3.56Å; R1687-W1719 VanDerWaalsContact CB-CH2 3.49Å; R1687-W1719 HydrophobicContact CB-CZ2 3.68Å; R1687-Y1723 HydrophobicContact CB-CD2 4.44Å; R1687-Y1723 HydrophobicContact CB-CE2 4.05Å |
| 1688 | F | 87.7 | Confident | 83 | Confident | 30.8 Ų | 30.8 | 40 Ų | 40 | 14% | 0.135 | 20% | 0.196 | C | C | . | . | P | Polyproline II helix | trans | -76 | 125.3 | 158.7 | -61.3 | -32.5 | 0 | 0 | 0 | 109.2 | F1642 F1647 L1657 L1692 L1693 W1696 Y1723 | F1642-F1688 HydrophobicContact CE2-CZ 4.24Å; F1642-F1688 HydrophobicContact CZ-CE2 4.18Å; F1642-F1688 AromaticContact CZ-CZ 3.65Å; F1642-F1688 HydrophobicContact CZ-CZ 3.65Å; F1647-F1688 AromaticContact CD1-CD1 3.83Å; F1647-F1688 HydrophobicContact CD1-CD1 3.83Å; F1647-F1688 AromaticContact CD1-CE1 3.6Å; F1647-F1688 HydrophobicContact CD1-CE1 3.6Å; F1647-F1688 AromaticContact CD2-CE1 3.96Å; F1647-F1688 HydrophobicContact CD2-CE1 3.97Å; F1647-F1688 AromaticContact CE1-CD1 3.44Å; F1647-F1688 HydrophobicContact CE1-CD1 3.44Å; F1647-F1688 VanDerWaalsContact CE1-CD1 3.44Å; F1647-F1688 AromaticContact CE1-CE1 3.6Å; F1647-F1688 HydrophobicContact CE1-CE1 3.6Å; F1647-F1688 HydrophobicContact CE2-CD1 4.38Å; F1647-F1688 AromaticContact CE2-CE1 3.93Å; F1647-F1688 HydrophobicContact CE2-CE1 3.95Å; F1647-F1688 HydrophobicContact CG-CD1 4.46Å; F1647-F1688 AromaticContact CG-CE1 3.8Å; F1647-F1688 HydrophobicContact CG-CE1 3.8Å; F1647-F1688 AromaticContact CZ-CD1 3.74Å; F1647-F1688 HydrophobicContact CZ-CD1 3.74Å; F1647-F1688 AromaticContact CZ-CE1 3.77Å; F1647-F1688 HydrophobicContact CZ-CE1 3.77Å; L1657-F1688 HydrophobicContact CD2-CE1 4.13Å; L1657-F1688 HydrophobicContact CD2-CZ 4.13Å; F1688-L1692 HydrophobicContact CB-CD2 4.4Å; F1688-L1692 HydrophobicContact CD1-CD2 3.66Å; F1688-L1692 HydrophobicContact CD1-CG 4.47Å; F1688-L1692 HydrophobicContact CE1-CD2 4.22Å; F1688-L1692 HydrophobicContact CG-CD2 4.22Å; F1688-L1693 HydrophobicContact CB-CB 4.12Å; F1688-L1693 HydrophobicContact CD2-CD1 4.3Å; F1688-W1696 AromaticContact CD2-CD1 3.97Å; F1688-W1696 AromaticContact CD2-NE1 3.78Å; F1688-W1696 HydrophobicContact CE2-CZ2 4.45Å; F1688-W1696 AromaticContact CE2-NE1 3.49Å; F1688-W1696 HydrophobicContact CZ-CZ2 4.23Å; F1688-W1696 AromaticContact CZ-NE1 3.78Å; F1688-Y1723 WeakPolarHBondContact CB-OH 3.33Å; F1688-Y1723 PolarHBondContact O-OH 3Å |
| 1689 | R | 78.9 | Confident | 82 | Confident | 129 Ų | 129 | 40.1 Ų | 40.1 | 49% | 0.487 | 20% | 0.196 | S | C | . | . | P | Polyproline II helix | trans | -63.8 | 154.5 | 168.1 | -68.2 | -177 | 178.5 | 165 | -1.1 | 109.5 | T1649 R1687 D1691 L1692 L1693 | T1649-R1689 HydrophobicContact CG2-CG 4.32Å; R1687-R1689 PolarHBondContact O-N 2.97Å; R1689-D1691 WeakPolarHBondContact CB-OD1 3.2Å; R1689-D1691 PolarHBondContact O-N 3.15Å; R1689-D1691 VanDerWaalsContact O-N 3.16Å; R1689-L1692 PolarHBondContact O-N 3.22Å; R1689-L1692 VanDerWaalsContact O-N 3.09Å; R1689-L1693 PolarHBondContact O-N 3.3Å |
| 1690 | T | 74 | Confident | 81.1 | Confident | 69.6 Ų | 69.6 | 40.9 Ų | 40.9 | 43% | 0.427 | 20% | 0.2 | S | C | . | . | H | α-helix | trans | -55.9 | -36.1 | -172 | -46.1 | 0 | 0 | 0 | 0 | 113 | S1694 H1727 L1730 | T1690-S1694 VanDerWaalsContact O-CB 3.32Å; T1690-S1694 WeakPolarHBondContact O-CB 3.31Å; T1690-S1694 PolarHBondContact O-N 2.98Å; T1690-S1694 PolarHBondContact O-OG 2.95Å; T1690-H1727 PolarHBondContact OG1-NE2 3.25Å; T1690-L1730 HydrophobicContact CG2-CD1 4.41Å |
| 1691 | D | 66.7 | Low | 80 | Confident | 76.2 Ų | 76.2 | 42.4 Ų | 42.4 | 41% | 0.407 | 21% | 0.211 | S | C | . | . | H | α-helix | trans | -62.6 | -51.3 | 175.8 | 63.7 | -49.1 | 0 | 0 | 0 | 111.5 | R1689 S1694 K1695 | R1689-D1691 WeakPolarHBondContact CB-OD1 3.2Å; R1689-D1691 PolarHBondContact O-N 3.15Å; R1689-D1691 VanDerWaalsContact O-N 3.16Å; D1691-S1694 PolarHBondContact O-N 3.18Å; D1691-S1694 PolarHBondContact O-OG 3.09Å; D1691-K1695 WeakPolarHBondContact O-CG 3.08Å; D1691-K1695 PolarHBondContact O-N 3.21Å; D1691-K1695 VanDerWaalsContact O-N 3.1Å |
| 1692 | L | 79.2 | Confident | 79.1 | Confident | 16 Ų | 16 | 47.1 Ų | 47.1 | 8% | 0.084 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -65.8 | -42.4 | 178 | -176.8 | 64.2 | 0 | 0 | 0 | 111.6 | F1647 I1658 F1688 R1689 S1694 K1695 W1696 | F1647-L1692 HydrophobicContact CE2-CD2 4.45Å; F1647-L1692 HydrophobicContact CZ-CD2 3.99Å; I1658-L1692 HydrophobicContact CD1-CD1 3.69Å; I1658-L1692 HydrophobicContact CG1-CD1 4.43Å; F1688-L1692 HydrophobicContact CB-CD2 4.4Å; F1688-L1692 HydrophobicContact CD1-CD2 3.66Å; F1688-L1692 HydrophobicContact CD1-CG 4.47Å; F1688-L1692 HydrophobicContact CE1-CD2 4.22Å; F1688-L1692 HydrophobicContact CG-CD2 4.22Å; R1689-L1692 PolarHBondContact O-N 3.22Å; R1689-L1692 VanDerWaalsContact O-N 3.09Å; L1692-S1694 VanDerWaalsContact C-N 3.32Å; L1692-S1694 PolarHBondContact O-N 3.14Å; L1692-K1695 WeakPolarHBondContact O-CB 3.29Å; L1692-K1695 PolarHBondContact O-N 2.98Å; L1692-K1695 VanDerWaalsContact O-N 3.15Å; L1692-W1696 VanDerWaalsContact O-CD1 3.24Å; L1692-W1696 PolarHBondContact O-N 3.05Å; L1692-W1696 VanDerWaalsContact O-N 3.15Å |
| 1693 | L | 83.4 | Confident | 78.2 | Confident | 7.6 Ų | 7.6 | 49.7 Ų | 49.7 | 4% | 0.04 | 25% | 0.251 | C | S | . | . | H | α-helix | trans | -59.9 | -43.3 | 177.4 | -176.4 | 64.3 | 0 | 0 | 0 | 111.1 | F1688 R1689 K1695 W1696 F1697 Y1723 H1727 L1730 F1731 | F1688-L1693 HydrophobicContact CB-CB 4.12Å; F1688-L1693 HydrophobicContact CD2-CD1 4.3Å; R1689-L1693 PolarHBondContact O-N 3.3Å; L1693-K1695 VanDerWaalsContact C-N 3.3Å; L1693-K1695 PolarHBondContact O-N 3.14Å; L1693-W1696 WeakPolarHBondContact O-CB 3.34Å; L1693-W1696 PolarHBondContact O-N 3.17Å; L1693-F1697 HydrophobicContact CD1-CE2 4.12Å; L1693-F1697 HydrophobicContact CG-CE2 4.21Å; L1693-F1697 VanDerWaalsContact O-CD2 3.31Å; L1693-F1697 WeakPolarHBondContact O-CD2 3.35Å; L1693-Y1723 HydrophobicContact CD2-CE1 4.41Å; L1693-H1727 HydrophobicContact CD2-CB 3.94Å; L1693-L1730 HydrophobicContact CB-CD1 4.33Å; L1693-L1730 HydrophobicContact CD2-CB 4.46Å; L1693-L1730 HydrophobicContact CD2-CD1 3.62Å; L1693-L1730 HydrophobicContact CG-CD1 3.86Å; L1693-F1731 HydrophobicContact CD1-CZ 3.96Å; L1693-F1731 HydrophobicContact CD2-CE2 3.91Å; L1693-F1731 HydrophobicContact CD2-CZ 4.11Å |
| 1694 | S | 74.1 | Confident | 77.7 | Confident | 28.4 Ų | 28.4 | 49.6 Ų | 49.6 | 20% | 0.199 | 25% | 0.251 | C | S | . | . | H | α-helix | trans | -63 | -35.6 | 177.6 | 74.2 | 0 | 0 | 0 | 0 | 112.8 | N1595 T1690 D1691 L1692 W1696 F1697 V1698 | N1595-S1694 PolarHBondContact ND2-OG 2.95Å; T1690-S1694 VanDerWaalsContact O-CB 3.32Å; T1690-S1694 WeakPolarHBondContact O-CB 3.31Å; T1690-S1694 PolarHBondContact O-N 2.98Å; T1690-S1694 PolarHBondContact O-OG 2.95Å; D1691-S1694 PolarHBondContact O-N 3.18Å; D1691-S1694 PolarHBondContact O-OG 3.09Å; L1692-S1694 VanDerWaalsContact C-N 3.32Å; L1692-S1694 PolarHBondContact O-N 3.14Å; S1694-W1696 VanDerWaalsContact C-N 3.34Å; S1694-W1696 PolarHBondContact O-N 3.09Å; S1694-F1697 PolarHBondContact O-N 3.11Å; S1694-V1698 WeakPolarHBondContact O-CG2 3.17Å; S1694-V1698 PolarHBondContact O-N 2.86Å |
| 1695 | K | 76.4 | Confident | 77.5 | Confident | 45.4 Ų | 45.4 | 51.8 Ų | 51.8 | 20% | 0.197 | 26% | 0.259 | C | S | . | . | H | α-helix | trans | -62.1 | -38.7 | 176.2 | -74.6 | 174.2 | 175.2 | 174.3 | 0 | 112.3 | N1595 N1655 I1658 D1691 L1692 L1693 F1697 V1698 V1699 | N1595-K1695 WeakPolarHBondContact OD1-CG 3.38Å; N1655-K1695 PolarHBondContact OD1-NZ 3.29Å; I1658-K1695 HydrophobicContact CD1-CB 4.02Å; D1691-K1695 WeakPolarHBondContact O-CG 3.08Å; D1691-K1695 PolarHBondContact O-N 3.21Å; D1691-K1695 VanDerWaalsContact O-N 3.1Å; L1692-K1695 WeakPolarHBondContact O-CB 3.29Å; L1692-K1695 PolarHBondContact O-N 2.98Å; L1692-K1695 VanDerWaalsContact O-N 3.15Å; L1693-K1695 VanDerWaalsContact C-N 3.3Å; L1693-K1695 PolarHBondContact O-N 3.14Å; K1695-F1697 VanDerWaalsContact C-N 3.26Å; K1695-F1697 PolarHBondContact O-N 3.05Å; K1695-V1698 PolarHBondContact O-N 3.11Å; K1695-V1698 VanDerWaalsContact O-N 3.1Å; K1695-V1699 HydrophobicContact CB-CG2 4.41Å; K1695-V1699 WeakPolarHBondContact O-CB 3.43Å; K1695-V1699 VanDerWaalsContact O-CG2 3.29Å; K1695-V1699 WeakPolarHBondContact O-CG2 3.37Å; K1695-V1699 PolarHBondContact O-N 3.05Å |
| 1696 | W | 83.2 | Confident | 77.4 | Confident | 35 Ų | 35 | 54.1 Ų | 54.1 | 13% | 0.133 | 27% | 0.269 | C | S | . | . | H | α-helix | trans | -55.8 | -40.4 | 177.7 | -78.3 | 103 | 0 | 0 | 0 | 112.8 | L1657 I1658 V1661 F1688 L1692 L1693 S1694 V1698 I1700 | L1657-W1696 HydrophobicContact CD2-CZ2 4.2Å; L1657-W1696 HydrophobicContact CG-CH2 4.43Å; L1657-W1696 HydrophobicContact CG-CZ2 4.13Å; I1658-W1696 HydrophobicContact CB-CH2 4.39Å; I1658-W1696 HydrophobicContact CB-CZ2 4.47Å; I1658-W1696 HydrophobicContact CB-CZ3 4.5Å; I1658-W1696 HydrophobicContact CD1-CD2 4.24Å; I1658-W1696 HydrophobicContact CD1-CG 4.37Å; I1658-W1696 HydrophobicContact CG1-CD2 3.81Å; I1658-W1696 VanDerWaalsContact CG1-CE2 3.46Å; I1658-W1696 HydrophobicContact CG1-CE3 4.1Å; I1658-W1696 HydrophobicContact CG1-CG 4.42Å; I1658-W1696 HydrophobicContact CG1-CH2 3.82Å; I1658-W1696 HydrophobicContact CG1-CZ2 3.52Å; I1658-W1696 VanDerWaalsContact CG1-CZ2 3.49Å; I1658-W1696 HydrophobicContact CG1-CZ3 4.11Å; V1661-W1696 HydrophobicContact CB-CH2 3.96Å; V1661-W1696 HydrophobicContact CB-CZ3 4.07Å; V1661-W1696 HydrophobicContact CG1-CH2 4.29Å; V1661-W1696 HydrophobicContact CG1-CZ3 3.97Å; V1661-W1696 HydrophobicContact CG2-CH2 3.66Å; V1661-W1696 HydrophobicContact CG2-CZ3 4.2Å; F1688-W1696 AromaticContact CD2-CD1 3.97Å; F1688-W1696 AromaticContact CD2-NE1 3.78Å; F1688-W1696 HydrophobicContact CE2-CZ2 4.45Å; F1688-W1696 AromaticContact CE2-NE1 3.49Å; F1688-W1696 HydrophobicContact CZ-CZ2 4.23Å; F1688-W1696 AromaticContact CZ-NE1 3.78Å; L1692-W1696 VanDerWaalsContact O-CD1 3.24Å; L1692-W1696 PolarHBondContact O-N 3.05Å; L1692-W1696 VanDerWaalsContact O-N 3.15Å; L1693-W1696 WeakPolarHBondContact O-CB 3.34Å; L1693-W1696 PolarHBondContact O-N 3.17Å; S1694-W1696 VanDerWaalsContact C-N 3.34Å; S1694-W1696 PolarHBondContact O-N 3.09Å; W1696-V1698 VanDerWaalsContact C-N 3.32Å; W1696-V1698 PolarHBondContact O-N 3.22Å; W1696-I1700 HydrophobicContact CE3-CD1 3.67Å; W1696-I1700 VanDerWaalsContact CE3-CD1 3.5Å; W1696-I1700 HydrophobicContact CE3-CG1 4.14Å; W1696-I1700 HydrophobicContact CZ3-CD1 3.93Å; W1696-I1700 HydrophobicContact CZ3-CG1 4.43Å; W1696-I1700 WeakPolarHBondContact O-CB 3.39Å; W1696-I1700 VanDerWaalsContact O-CG1 3.26Å; W1696-I1700 WeakPolarHBondContact O-CG1 3.43Å; W1696-I1700 PolarHBondContact O-N 3.18Å |
| 1697 | F | 77.1 | Confident | 77.2 | Confident | 61.4 Ų | 61.4 | 54.5 Ų | 54.5 | 27% | 0.269 | 27% | 0.273 | S | S | . | . | H | α-helix | trans | -74 | -22.5 | -179.9 | -71.2 | -80.6 | 0 | 0 | 0 | 114 | L1693 S1694 K1695 L1730 F1731 L1734 | L1693-F1697 HydrophobicContact CD1-CE2 4.12Å; L1693-F1697 HydrophobicContact CG-CE2 4.21Å; L1693-F1697 VanDerWaalsContact O-CD2 3.31Å; L1693-F1697 WeakPolarHBondContact O-CD2 3.35Å; S1694-F1697 PolarHBondContact O-N 3.11Å; K1695-F1697 VanDerWaalsContact C-N 3.26Å; K1695-F1697 PolarHBondContact O-N 3.05Å; F1697-L1730 HydrophobicContact CD2-CB 4.33Å; F1697-L1730 HydrophobicContact CD2-CD2 4.45Å; F1697-L1730 WeakPolarHBondContact CE1-O 3.34Å; F1697-L1730 HydrophobicContact CE2-CB 3.88Å; F1697-L1730 HydrophobicContact CZ-CB 4.41Å; F1697-L1730 VanDerWaalsContact CZ-O 3.25Å; F1697-L1730 WeakPolarHBondContact CZ-O 3.37Å; F1697-F1731 AromaticContact CZ-CD1 3.92Å; F1697-F1731 HydrophobicContact CZ-CD1 3.99Å; F1697-F1731 AromaticContact CZ-CE1 3.97Å; F1697-F1731 HydrophobicContact CZ-CE1 4.08Å; F1697-L1734 HydrophobicContact CE1-CD1 4.33Å; F1697-L1734 HydrophobicContact CZ-CD1 4.12Å |
| 1698 | V | 72.3 | Confident | 77.4 | Confident | 65.4 Ų | 65.4 | 52.8 Ų | 52.8 | 40% | 0.396 | 27% | 0.27 | S | S | . | . | H | α-helix | trans | -96.8 | -41.2 | -176.2 | 177 | 0 | 0 | 0 | 0 | 111.7 | N1595 F1598 S1694 K1695 W1696 | N1595-V1698 HydrophobicContact CB-CB 4.36Å; N1595-V1698 HydrophobicContact CB-CG1 4.09Å; N1595-V1698 HydrophobicContact CB-CG2 3.99Å; N1595-V1698 VanDerWaalsContact O-CG1 3.27Å; N1595-V1698 WeakPolarHBondContact O-CG1 3.41Å; F1598-V1698 WeakPolarHBondContact O-CG1 3.3Å; S1694-V1698 WeakPolarHBondContact O-CG2 3.17Å; S1694-V1698 PolarHBondContact O-N 2.86Å; K1695-V1698 PolarHBondContact O-N 3.11Å; K1695-V1698 VanDerWaalsContact O-N 3.1Å; W1696-V1698 VanDerWaalsContact C-N 3.32Å; W1696-V1698 PolarHBondContact O-N 3.22Å |
| 1699 | V | 74.9 | Confident | 77.6 | Confident | 2.2 Ų | 2.2 | 54.6 Ų | 54.6 | 1% | 0.013 | 28% | 0.283 | C | S | . | . | H | α-helix | trans | -79.4 | -37.9 | -173.2 | 179 | 0 | 0 | 0 | 0 | 111.7 | C1600 F1603 I1658 I1662 K1695 S1701 | C1600-V1699 WeakPolarHBondContact CA-O 3.39Å; C1600-V1699 VanDerWaalsContact CB-O 3.27Å; C1600-V1699 WeakPolarHBondContact CB-O 3.29Å; C1600-V1699 PolarHBondContact SG-O 3.12Å; C1600-V1699 VanDerWaalsContact SG-O 3.36Å; F1603-V1699 HydrophobicContact CB-CG1 3.77Å; F1603-V1699 HydrophobicContact CB-CG2 4.36Å; F1603-V1699 HydrophobicContact CD1-CG1 3.57Å; F1603-V1699 VanDerWaalsContact CD1-CG1 3.46Å; F1603-V1699 HydrophobicContact CD2-CG1 4.28Å; F1603-V1699 HydrophobicContact CD2-CG2 4.13Å; F1603-V1699 HydrophobicContact CE1-CG1 4.21Å; F1603-V1699 HydrophobicContact CG-CB 4.48Å; F1603-V1699 HydrophobicContact CG-CG1 3.6Å; F1603-V1699 HydrophobicContact CG-CG2 4.21Å; I1658-V1699 HydrophobicContact CG2-CB 4.44Å; I1658-V1699 HydrophobicContact CG2-CG1 3.98Å; I1662-V1699 HydrophobicContact CD1-CG1 3.65Å; K1695-V1699 HydrophobicContact CB-CG2 4.41Å; K1695-V1699 WeakPolarHBondContact O-CB 3.43Å; K1695-V1699 VanDerWaalsContact O-CG2 3.29Å; K1695-V1699 WeakPolarHBondContact O-CG2 3.37Å; K1695-V1699 PolarHBondContact O-N 3.05Å; V1699-S1701 PolarHBondContact O-N 2.94Å |
| 1700 | I | 76.6 | Confident | 78.3 | Confident | 34.2 Ų | 34.2 | 48.8 Ų | 48.8 | 18% | 0.175 | 26% | 0.263 | C | S | . | . | S | Bend | trans | -69.2 | 121.2 | 177.8 | -64.7 | -158.6 | 0 | 0 | 0 | 109.3 | V1661 I1662 W1696 V1704 Q1705 | V1661-I1700 HydrophobicContact CG1-CD1 4.5Å; I1662-I1700 HydrophobicContact CG1-CD1 4.27Å; W1696-I1700 HydrophobicContact CE3-CD1 3.67Å; W1696-I1700 VanDerWaalsContact CE3-CD1 3.5Å; W1696-I1700 HydrophobicContact CE3-CG1 4.14Å; W1696-I1700 HydrophobicContact CZ3-CD1 3.93Å; W1696-I1700 HydrophobicContact CZ3-CG1 4.43Å; W1696-I1700 WeakPolarHBondContact O-CB 3.39Å; W1696-I1700 VanDerWaalsContact O-CG1 3.26Å; W1696-I1700 WeakPolarHBondContact O-CG1 3.43Å; W1696-I1700 PolarHBondContact O-N 3.18Å; I1700-V1704 HydrophobicContact CG2-CB 3.95Å; I1700-V1704 HydrophobicContact CG2-CG1 3.82Å; I1700-Q1705 HydrophobicContact CG2-CG 3.91Å; I1700-Q1705 PolarHBondContact O-NE2 3.09Å |
| 1701 | S | 69.7 | Low | 79.3 | Confident | 30.8 Ų | 30.8 | 46.4 Ų | 46.4 | 22% | 0.215 | 25% | 0.248 | C | C | . | . | trans | -61.2 | 149.5 | -179.8 | 74 | 0 | 0 | 0 | 0 | 112.3 | V1699 S1703 V1704 Q1705 | V1699-S1701 PolarHBondContact O-N 2.94Å; S1701-S1703 WeakPolarHBondContact CB-OG 3.43Å; S1701-S1703 PolarHBondContact O-N 2.99Å; S1701-S1703 PolarHBondContact OG-OG 3.09Å; S1701-V1704 PolarHBondContact O-N 3.32Å; S1701-V1704 VanDerWaalsContact O-N 3.13Å; S1701-V1704 WeakPolarHBondContact OG-CG2 3.39Å; S1701-V1704 PolarHBondContact OG-N 2.91Å; S1701-Q1705 PolarHBondContact O-N 3.02Å; S1701-Q1705 VanDerWaalsContact O-N 3.15Å | ||
| 1702 | Q | 71.9 | Confident | 80.7 | Confident | 120 Ų | 120 | 43.3 Ų | 43.3 | 56% | 0.561 | 23% | 0.231 | S | C | * | . | H | α-helix | trans | -61.7 | -28.8 | 177 | -160.7 | 174.2 | 10.1 | 0 | 0 | 112.2 | Q1705 Q1706 | Q1702-Q1705 PolarHBondContact O-N 3.18Å; Q1702-Q1706 VanDerWaalsContact O-CG 3.32Å; Q1702-Q1706 WeakPolarHBondContact O-CG 3.29Å; Q1702-Q1706 PolarHBondContact O-N 3.1Å; Q1702-Q1706 VanDerWaalsContact O-N 3.08Å |
| 1703 | S | 71 | Confident | 81.4 | Confident | 62.8 Ų | 62.8 | 43.5 Ų | 43.5 | 44% | 0.439 | 23% | 0.232 | S | C | . | . | H | α-helix | trans | -63.8 | -43 | 174.5 | 51.6 | 0 | 0 | 0 | 0 | 112.4 | S1701 Q1705 Q1706 S1707 | S1701-S1703 WeakPolarHBondContact CB-OG 3.43Å; S1701-S1703 PolarHBondContact O-N 2.99Å; S1701-S1703 PolarHBondContact OG-OG 3.09Å; S1703-Q1705 VanDerWaalsContact C-N 3.35Å; S1703-Q1706 PolarHBondContact O-N 3.14Å; S1703-S1707 PolarHBondContact O-N 3.27Å; S1703-S1707 VanDerWaalsContact O-N 3.08Å |
| 1704 | V | 77.2 | Confident | 81.9 | Confident | 24.8 Ų | 24.8 | 43.1 Ų | 43.1 | 15% | 0.15 | 23% | 0.23 | C | C | . | . | H | α-helix | trans | -66.3 | -40.3 | 176 | 171.9 | 0 | 0 | 0 | 0 | 110.8 | L1665 I1700 S1701 Q1706 S1707 V1708 | L1665-V1704 HydrophobicContact CD1-CG1 3.81Å; I1700-V1704 HydrophobicContact CG2-CB 3.95Å; I1700-V1704 HydrophobicContact CG2-CG1 3.82Å; S1701-V1704 PolarHBondContact O-N 3.32Å; S1701-V1704 VanDerWaalsContact O-N 3.13Å; S1701-V1704 WeakPolarHBondContact OG-CG2 3.39Å; S1701-V1704 PolarHBondContact OG-N 2.91Å; V1704-Q1706 VanDerWaalsContact C-N 3.26Å; V1704-Q1706 PolarHBondContact O-N 3.02Å; V1704-S1707 WeakPolarHBondContact CA-OG 3.39Å; V1704-S1707 PolarHBondContact O-N 3.15Å; V1704-S1707 VanDerWaalsContact O-N 3.09Å; V1704-S1707 PolarHBondContact O-OG 3.18Å; V1704-V1708 PolarHBondContact O-N 3.04Å |
| 1705 | Q | 77.3 | Confident | 82.8 | Confident | 90.8 Ų | 90.8 | 42.3 Ų | 42.3 | 42% | 0.424 | 22% | 0.223 | S | C | . | . | H | α-helix | trans | -62.6 | -34 | 175.5 | -63.9 | 177.5 | 7.2 | 0 | 0 | 112.5 | I1700 S1701 Q1702 S1703 | I1700-Q1705 HydrophobicContact CG2-CG 3.91Å; I1700-Q1705 PolarHBondContact O-NE2 3.09Å; S1701-Q1705 PolarHBondContact O-N 3.02Å; S1701-Q1705 VanDerWaalsContact O-N 3.15Å; Q1702-Q1705 PolarHBondContact O-N 3.18Å; S1703-Q1705 VanDerWaalsContact C-N 3.35Å |
| 1706 | Q | 80.4 | Confident | 83.6 | Confident | 132.4 Ų | 132.4 | 40.4 Ų | 40.4 | 62% | 0.619 | 22% | 0.215 | S | C | * | . | H | α-helix | trans | -74 | -34.1 | 176.5 | -74.6 | 176.2 | -5.3 | 0 | 0 | 112.5 | Q1702 S1703 V1704 V1708 K1739 | Q1702-Q1706 VanDerWaalsContact O-CG 3.32Å; Q1702-Q1706 WeakPolarHBondContact O-CG 3.29Å; Q1702-Q1706 PolarHBondContact O-N 3.1Å; Q1702-Q1706 VanDerWaalsContact O-N 3.08Å; S1703-Q1706 PolarHBondContact O-N 3.14Å; V1704-Q1706 VanDerWaalsContact C-N 3.26Å; V1704-Q1706 PolarHBondContact O-N 3.02Å; Q1706-V1708 VanDerWaalsContact C-N 3.29Å; Q1706-V1708 PolarHBondContact O-N 2.97Å; Q1706-K1739 PolarHBondContact O-NZ 3.2Å |
| 1707 | S | 84.7 | Confident | 84 | Confident | 18.4 Ų | 18.4 | 39.1 Ų | 39.1 | 13% | 0.129 | 21% | 0.211 | C | C | . | . | H | α-helix | trans | -67.7 | -26.4 | 179.1 | 72.4 | 0 | 0 | 0 | 0 | 113.6 | Q1671 P1672 C1673 S1703 V1704 V1709 | Q1671-S1707 WeakPolarHBondContact O-CB 3.4Å; P1672-S1707 CarbonylContact C-O 3.56Å; P1672-S1707 WeakPolarHBondContact CA-O 3.36Å; C1673-S1707 PolarHBondContact N-O 3.15Å; S1703-S1707 PolarHBondContact O-N 3.27Å; S1703-S1707 VanDerWaalsContact O-N 3.08Å; V1704-S1707 WeakPolarHBondContact CA-OG 3.39Å; V1704-S1707 PolarHBondContact O-N 3.15Å; V1704-S1707 VanDerWaalsContact O-N 3.09Å; V1704-S1707 PolarHBondContact O-OG 3.18Å; S1707-V1709 WeakPolarHBondContact O-CG2 3.44Å; S1707-V1709 PolarHBondContact O-N 3.18Å; S1707-V1709 VanDerWaalsContact O-N 3.14Å |
| 1708 | V | 88.3 | Confident | 84.6 | Confident | 27.2 Ų | 27.2 | 37.6 Ų | 37.6 | 17% | 0.165 | 21% | 0.208 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -70 | 111.9 | 174.2 | -179.7 | 0 | 0 | 0 | 0 | 109.7 | C1673 L1675 V1704 Q1706 V1711 K1739 | C1673-V1708 CarbonylContact O-C 3.45Å; C1673-V1708 WeakPolarHBondContact O-CA 3.33Å; L1675-V1708 HydrophobicContact CB-CG1 4.48Å; V1704-V1708 PolarHBondContact O-N 3.04Å; Q1706-V1708 VanDerWaalsContact C-N 3.29Å; Q1706-V1708 PolarHBondContact O-N 2.97Å; V1708-V1711 HydrophobicContact CG1-CG2 3.64Å; V1708-K1739 WeakPolarHBondContact O-CD 3.3Å; V1708-K1739 WeakPolarHBondContact O-CE 3.35Å; V1708-K1739 PolarHBondContact O-NZ 3.05Å |
| 1709 | V | 91.8 | Very high | 85.5 | Confident | 69.8 Ų | 69.8 | 37.2 Ų | 37.2 | 42% | 0.423 | 20% | 0.2 | S | C | . | . | E | Extended strand (participates in β ladder) | trans | -86.2 | -42.5 | -177.2 | -173.2 | 0 | 0 | 0 | 0 | 111.4 | P1672 C1673 S1707 K1739 | P1672-V1709 HydrophobicContact CB-CG2 3.43Å; P1672-V1709 VanDerWaalsContact CB-CG2 3.45Å; C1673-V1709 PolarHBondContact O-N 3.15Å; S1707-V1709 WeakPolarHBondContact O-CG2 3.44Å; S1707-V1709 PolarHBondContact O-N 3.18Å; S1707-V1709 VanDerWaalsContact O-N 3.14Å; V1709-K1739 WeakPolarHBondContact O-CG 3.38Å |
| 1710 | A | 93.8 | Very high | 86.3 | Confident | 6.6 Ų | 6.6 | 37.8 Ų | 37.8 | 6% | 0.055 | 20% | 0.203 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -143 | 146.8 | -179.4 | 0 | 0 | 0 | 0 | 0 | 111.5 | E1674 L1675 Y1712 | E1674-A1710 WeakPolarHBondContact CA-O 3.44Å; E1674-A1710 HydrophobicContact CG-CB 4.23Å; L1675-A1710 PolarHBondContact N-O 3.22Å; A1710-Y1712 HydrophobicContact CB-CE1 4.33Å; A1710-Y1712 HydrophobicContact CB-CE2 4.22Å |
| 1711 | V | 94.9 | Very high | 87 | Confident | 19.2 Ų | 19.2 | 39 Ų | 39 | 12% | 0.116 | 21% | 0.206 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -126.1 | 117.7 | 174.5 | -175.1 | 0 | 0 | 0 | 0 | 109.1 | L1675 V1677 V1708 L1713 K1739 L1740 H1741 | L1675-V1711 HydrophobicContact CB-CG1 4.36Å; L1675-V1711 HydrophobicContact CB-CG2 4.31Å; L1675-V1711 HydrophobicContact CD2-CG1 4.15Å; L1675-V1711 HydrophobicContact CD2-CG2 4.47Å; L1675-V1711 HydrophobicContact CG-CG1 4.32Å; L1675-V1711 CarbonylContact O-C 3.54Å; L1675-V1711 VanDerWaalsContact O-CA 3.24Å; L1675-V1711 WeakPolarHBondContact O-CA 3.24Å; V1677-V1711 HydrophobicContact CG2-CG1 3.95Å; V1708-V1711 HydrophobicContact CG1-CG2 3.64Å; V1711-L1713 HydrophobicContact CG1-CG 4.44Å; V1711-K1739 PolarHBondContact N-O 3.16Å; V1711-L1740 HydrophobicContact CB-CD2 3.81Å; V1711-L1740 HydrophobicContact CG1-CD2 4.2Å; V1711-L1740 HydrophobicContact CG2-CD2 4.14Å; V1711-H1741 PolarHBondContact O-N 3.13Å |
| 1712 | Y | 95.9 | Very high | 87.7 | Confident | 10.2 Ų | 10.2 | 41.2 Ų | 41.2 | 4% | 0.04 | 21% | 0.212 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -98.7 | 116.3 | 178.6 | -50.8 | -74.4 | 0 | 0 | 0 | 110 | E1674 L1675 V1676 V1677 A1710 H1741 L1743 L1749 F1752 | E1674-Y1712 HydrophobicContact CB-CE2 4.14Å; E1674-Y1712 HydrophobicContact CG-CE2 4.47Å; E1674-Y1712 WeakPolarHBondContact OE2-CE2 3.38Å; E1674-Y1712 PolarHBondContact OE2-OH 3.26Å; L1675-Y1712 PolarHBondContact O-N 3.13Å; V1676-Y1712 CarbonylContact C-O 3.53Å; V1676-Y1712 WeakPolarHBondContact CA-O 3.24Å; V1676-Y1712 HydrophobicContact CG2-CD2 3.97Å; V1677-Y1712 PolarHBondContact N-O 3.19Å; A1710-Y1712 HydrophobicContact CB-CE1 4.33Å; A1710-Y1712 HydrophobicContact CB-CE2 4.22Å; Y1712-H1741 CarbonylContact C-O 3.51Å; Y1712-H1741 WeakPolarHBondContact CA-O 3.32Å; Y1712-H1741 HydrophobicContact CD1-CB 3.75Å; Y1712-H1741 HydrophobicContact CE1-CB 4.21Å; Y1712-L1743 HydrophobicContact CD1-CD2 4.46Å; Y1712-L1749 HydrophobicContact CD2-CD1 4.2Å; Y1712-L1749 HydrophobicContact CG-CD1 4.03Å; Y1712-F1752 AromaticContact CD1-CD2 3.98Å; Y1712-F1752 HydrophobicContact CD1-CD2 4.04Å; Y1712-F1752 HydrophobicContact CD1-CE2 4.42Å; Y1712-F1752 HydrophobicContact CD1-CG 4.2Å; Y1712-F1752 HydrophobicContact CE1-CB 3.81Å; Y1712-F1752 AromaticContact CE1-CD1 3.63Å; Y1712-F1752 HydrophobicContact CE1-CD1 3.63Å; Y1712-F1752 AromaticContact CE1-CD2 3.67Å; Y1712-F1752 HydrophobicContact CE1-CD2 3.67Å; Y1712-F1752 HydrophobicContact CE1-CE1 4.1Å; Y1712-F1752 HydrophobicContact CE1-CE2 4.14Å; Y1712-F1752 AromaticContact CE1-CG 3.4Å; Y1712-F1752 HydrophobicContact CE1-CG 3.4Å; Y1712-F1752 VanDerWaalsContact CE1-CG 3.41Å; Y1712-F1752 HydrophobicContact CE1-CZ 4.34Å; Y1712-F1752 HydrophobicContact CE2-CB 4.35Å; Y1712-F1752 AromaticContact CZ-CD1 3.96Å; Y1712-F1752 AromaticContact CZ-CG 3.75Å |
| 1713 | L | 95.2 | Very high | 88.5 | Confident | 20 Ų | 20 | 37 Ų | 37 | 11% | 0.105 | 19% | 0.192 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -100.7 | 112.7 | -179.9 | -69.5 | 144.2 | 0 | 0 | 0 | 109.1 | V1677 L1679 V1711 L1740 H1741 F1742 L1743 | V1677-L1713 HydrophobicContact CB-CD2 3.89Å; V1677-L1713 HydrophobicContact CB-CG 4.45Å; V1677-L1713 HydrophobicContact CG1-CD2 3.97Å; V1677-L1713 HydrophobicContact CG2-CD2 4.34Å; L1679-L1713 HydrophobicContact CD1-CD2 3.89Å; V1711-L1713 HydrophobicContact CG1-CG 4.44Å; L1713-L1740 HydrophobicContact CD1-CB 4.34Å; L1713-L1740 HydrophobicContact CD1-CD2 4.35Å; L1713-H1741 PolarHBondContact N-O 2.98Å; L1713-F1742 HydrophobicContact CB-CD1 3.87Å; L1713-F1742 HydrophobicContact CB-CE1 4.18Å; L1713-F1742 HydrophobicContact CB-CG 4.37Å; L1713-F1742 HydrophobicContact CD1-CD1 3.98Å; L1713-F1742 HydrophobicContact CD1-CD2 4.17Å; L1713-F1742 HydrophobicContact CD1-CE1 3.65Å; L1713-F1742 HydrophobicContact CD1-CE2 3.83Å; L1713-F1742 HydrophobicContact CD1-CG 4.25Å; L1713-F1742 HydrophobicContact CD1-CZ 3.58Å; L1713-F1742 VanDerWaalsContact CD1-CZ 3.45Å; L1713-F1742 HydrophobicContact CD2-CE1 4.41Å; L1713-F1742 HydrophobicContact CG-CD1 4.49Å; L1713-F1742 HydrophobicContact CG-CE1 4.4Å; L1713-L1743 PolarHBondContact O-N 3.1Å |
| 1714 | C | 93.5 | Very high | 89.3 | Confident | 0.6 Ų | 0.6 | 34.6 Ų | 34.6 | 0% | 0.004 | 17% | 0.174 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -95.5 | 140.9 | 179.1 | -56.6 | 0 | 0 | 0 | 0 | 110.6 | V1677 L1679 C1716 | V1677-C1714 PolarHBondContact O-N 3.29Å; L1679-C1714 WeakPolarHBondContact CB-O 3.35Å; L1679-C1714 PolarHBondContact N-O 3.14Å; L1679-C1714 VanDerWaalsContact N-O 3.09Å; C1714-C1716 PolarHBondContact O-N 3.19Å |
| 1715 | N | 92.2 | Very high | 89.6 | Confident | 11.8 Ų | 11.8 | 40.8 Ų | 40.8 | 6% | 0.063 | 20% | 0.195 | C | C | . | . | S | Bend | trans | 50.8 | 48.3 | 171.7 | -69.1 | -28.1 | 0 | 0 | 0 | 114.6 | T1680 N1717 N1814 | T1680-N1715 PolarHBondContact OG1-ND2 3.19Å; N1715-N1717 PolarHBondContact O-N 3.05Å; N1715-N1814 PolarHBondContact OD1-ND2 3.21Å; N1715-N1814 VanDerWaalsContact OD1-ND2 3.15Å |
| 1716 | C | 94 | Very high | 89.6 | Confident | 4 Ų | 4 | 42.1 Ų | 42.1 | 3% | 0.027 | 20% | 0.199 | C | C | . | . | trans | -61.7 | 131.2 | 173 | -171.1 | 0 | 0 | 0 | 0 | 110.1 | L1679 C1714 F1742 V1811 L1813 N1814 | L1679-C1716 HydrophobicContact CD1-CB 4.22Å; C1714-C1716 PolarHBondContact O-N 3.19Å; C1716-F1742 HydrophobicContact CB-CD1 4.12Å; C1716-F1742 HydrophobicContact CB-CE1 4.33Å; C1716-V1811 HydrophobicContact CB-CG1 4.21Å; C1716-L1813 CarbonylContact O-C 3.56Å; C1716-L1813 VanDerWaalsContact O-CA 3.26Å; C1716-L1813 WeakPolarHBondContact O-CA 3.37Å; C1716-N1814 PolarHBondContact O-N 3.39Å | ||
| 1717 | N | 92.6 | Very high | 89.4 | Confident | 8.2 Ų | 8.2 | 36.5 Ų | 36.5 | 4% | 0.044 | 17% | 0.173 | C | C | . | . | trans | -118.8 | 174.2 | -173.3 | 70.5 | 24 | 0 | 0 | 0 | 112.3 | T1682 N1715 W1719 V1720 R1721 N1814 D1815 | T1682-N1717 PolarHBondContact O-ND2 2.96Å; N1715-N1717 PolarHBondContact O-N 3.05Å; N1717-W1719 VanDerWaalsContact C-N 3.29Å; N1717-W1719 PolarHBondContact O-N 3.01Å; N1717-W1719 WeakPolarHBondContact OD1-CA 3.18Å; N1717-W1719 WeakPolarHBondContact OD1-CB 3.39Å; N1717-W1719 PolarHBondContact OD1-N 2.96Å; N1717-W1719 VanDerWaalsContact OD1-N 3.08Å; N1717-V1720 PolarHBondContact O-N 3.13Å; N1717-V1720 VanDerWaalsContact OD1-CG2 3.3Å; N1717-V1720 WeakPolarHBondContact OD1-CG2 3.38Å; N1717-V1720 PolarHBondContact OD1-N 3.24Å; N1717-R1721 PolarHBondContact O-N 3.16Å; N1717-R1721 VanDerWaalsContact O-N 3.15Å; N1717-N1814 VanDerWaalsContact CB-O 3.23Å; N1717-N1814 WeakPolarHBondContact CB-O 3.23Å; N1717-D1815 WeakPolarHBondContact CB-OD1 3.21Å | ||
| 1718 | S | 89.5 | Confident | 89.1 | Confident | 30.2 Ų | 30.2 | 38.5 Ų | 38.5 | 21% | 0.211 | 18% | 0.183 | C | C | . | . | H | α-helix | trans | -60.7 | -37.4 | -179.4 | -63.4 | 0 | 0 | 0 | 0 | 112.6 | R1721 E1722 D1815 | S1718-R1721 WeakPolarHBondContact O-CB 3.35Å; S1718-R1721 PolarHBondContact O-N 3.18Å; S1718-E1722 PolarHBondContact O-N 3.27Å; S1718-E1722 VanDerWaalsContact O-N 3.11Å; S1718-D1815 WeakPolarHBondContact CB-OD1 3.23Å; S1718-D1815 WeakPolarHBondContact CB-OD2 3.28Å; S1718-D1815 PolarHBondContact N-OD1 2.84Å; S1718-D1815 VanDerWaalsContact OG-CG 3.3Å; S1718-D1815 PolarHBondContact OG-OD1 3.18Å; S1718-D1815 VanDerWaalsContact OG-OD1 3.08Å; S1718-D1815 PolarHBondContact OG-OD2 3.14Å |
| 1719 | W | 90.3 | Very high | 88.2 | Confident | 58 Ų | 58 | 42.7 Ų | 42.7 | 22% | 0.22 | 20% | 0.196 | C | C | . | . | H | α-helix | trans | -64.4 | -45 | 177.4 | -177.2 | 89.1 | 0 | 0 | 0 | 111.9 | T1682 N1683 T1684 R1687 N1717 R1721 E1722 Y1723 | T1682-W1719 HydrophobicContact CG2-CE3 4Å; T1682-W1719 HydrophobicContact CG2-CZ3 3.67Å; N1683-W1719 VanDerWaalsContact C-CE2 3.46Å; N1683-W1719 WeakPolarHBondContact O-CH2 3.34Å; N1683-W1719 VanDerWaalsContact O-CZ2 3.31Å; N1683-W1719 WeakPolarHBondContact O-CZ2 3.37Å; T1684-W1719 HydrophobicContact CG2-CZ2 4.47Å; T1684-W1719 VanDerWaalsContact CG2-NE1 3.27Å; R1687-W1719 HydrophobicContact CB-CH2 3.56Å; R1687-W1719 VanDerWaalsContact CB-CH2 3.49Å; R1687-W1719 HydrophobicContact CB-CZ2 3.68Å; N1717-W1719 VanDerWaalsContact C-N 3.29Å; N1717-W1719 PolarHBondContact O-N 3.01Å; N1717-W1719 WeakPolarHBondContact OD1-CA 3.18Å; N1717-W1719 WeakPolarHBondContact OD1-CB 3.39Å; N1717-W1719 PolarHBondContact OD1-N 2.96Å; N1717-W1719 VanDerWaalsContact OD1-N 3.08Å; W1719-R1721 VanDerWaalsContact C-N 3.3Å; W1719-R1721 PolarHBondContact O-N 3.25Å; W1719-E1722 PolarHBondContact O-N 3.1Å; W1719-E1722 VanDerWaalsContact O-N 3.12Å; W1719-Y1723 HydrophobicContact CH2-CD1 4.45Å; W1719-Y1723 AromaticContact CH2-CD2 3.6Å; W1719-Y1723 HydrophobicContact CH2-CD2 3.6Å; W1719-Y1723 HydrophobicContact CH2-CE2 4.17Å; W1719-Y1723 AromaticContact CH2-CG 3.78Å; W1719-Y1723 HydrophobicContact CH2-CG 3.78Å; W1719-Y1723 AromaticContact CZ2-CD2 3.87Å; W1719-Y1723 HydrophobicContact CZ2-CD2 3.87Å; W1719-Y1723 HydrophobicContact CZ2-CG 4.28Å; W1719-Y1723 HydrophobicContact CZ3-CD2 4.36Å; W1719-Y1723 HydrophobicContact CZ3-CG 4.08Å; W1719-Y1723 WeakPolarHBondContact O-CB 3.4Å; W1719-Y1723 PolarHBondContact O-N 3.08Å |
| 1720 | V | 92 | Very high | 87.5 | Confident | 13 Ų | 13 | 41.4 Ų | 41.4 | 8% | 0.079 | 19% | 0.186 | C | C | . | . | H | α-helix | trans | -61.9 | -38.3 | 176.8 | 171.9 | 0 | 0 | 0 | 0 | 111.3 | L1679 T1682 N1717 E1722 Y1723 T1724 | L1679-V1720 HydrophobicContact CB-CG2 4.42Å; L1679-V1720 HydrophobicContact CD1-CG1 4.07Å; L1679-V1720 HydrophobicContact CD1-CG2 4.26Å; L1679-V1720 HydrophobicContact CD2-CG2 4.17Å; T1682-V1720 HydrophobicContact CG2-CG2 4.36Å; N1717-V1720 PolarHBondContact O-N 3.13Å; N1717-V1720 VanDerWaalsContact OD1-CG2 3.3Å; N1717-V1720 WeakPolarHBondContact OD1-CG2 3.38Å; N1717-V1720 PolarHBondContact OD1-N 3.24Å; V1720-E1722 VanDerWaalsContact C-N 3.34Å; V1720-E1722 PolarHBondContact O-N 3.07Å; V1720-Y1723 PolarHBondContact O-N 3.14Å; V1720-T1724 HydrophobicContact CG1-CG2 4.26Å; V1720-T1724 WeakPolarHBondContact O-CB 3.35Å; V1720-T1724 WeakPolarHBondContact O-CG2 3.37Å; V1720-T1724 PolarHBondContact O-N 3.19Å; V1720-T1724 PolarHBondContact O-OG1 3.31Å |
| 1721 | R | 90.7 | Very high | 87 | Confident | 60.8 Ų | 60.8 | 42.4 Ų | 42.4 | 23% | 0.229 | 19% | 0.189 | C | C | . | . | H | α-helix | trans | -59.6 | -46.7 | 173.6 | 179.4 | -170 | 107.6 | -149.9 | -7.9 | 111.1 | N1717 S1718 W1719 T1724 R1725 V1806 L1813 | N1717-R1721 PolarHBondContact O-N 3.16Å; N1717-R1721 VanDerWaalsContact O-N 3.15Å; S1718-R1721 WeakPolarHBondContact O-CB 3.35Å; S1718-R1721 PolarHBondContact O-N 3.18Å; W1719-R1721 VanDerWaalsContact C-N 3.3Å; W1719-R1721 PolarHBondContact O-N 3.25Å; R1721-T1724 PolarHBondContact O-OG1 3.19Å; R1721-R1725 VanDerWaalsContact O-CB 3.3Å; R1721-R1725 WeakPolarHBondContact O-CB 3.26Å; R1721-R1725 PolarHBondContact O-N 3.11Å; R1721-V1806 HydrophobicContact CB-CG2 4.09Å; R1721-V1806 HydrophobicContact CG-CG2 4.05Å; R1721-L1813 HydrophobicContact CB-CD1 4.49Å; R1721-L1813 HydrophobicContact CB-CD2 4.46Å |
| 1722 | E | 85.8 | Confident | 86.2 | Confident | 75.4 Ų | 75.4 | 44.1 Ų | 44.1 | 35% | 0.352 | 20% | 0.202 | S | C | . | . | H | α-helix | trans | -70.2 | -38.7 | -179.9 | -148.3 | 60.7 | -141.3 | 0 | 0 | 111.7 | S1718 W1719 V1720 T1724 R1725 F1726 | S1718-E1722 PolarHBondContact O-N 3.27Å; S1718-E1722 VanDerWaalsContact O-N 3.11Å; W1719-E1722 PolarHBondContact O-N 3.1Å; W1719-E1722 VanDerWaalsContact O-N 3.12Å; V1720-E1722 VanDerWaalsContact C-N 3.34Å; V1720-E1722 PolarHBondContact O-N 3.07Å; E1722-T1724 PolarHBondContact O-N 3.2Å; E1722-R1725 VanDerWaalsContact CD-NH1 3.29Å; E1722-R1725 WeakPolarHBondContact O-CB 3.22Å; E1722-R1725 PolarHBondContact O-N 3.15Å; E1722-R1725 WeakPolarHBondContact OE1-CD 3.39Å; E1722-R1725 IonicContact OE1-CZ 3.77Å; E1722-R1725 IonicContact OE1-NH1 3.27Å; E1722-R1725 PolarHBondContact OE1-NH1 3.06Å; E1722-R1725 VanDerWaalsContact OE1-NH1 3.14Å; E1722-R1725 IonicContact OE2-CZ 3.52Å; E1722-R1725 IonicContact OE2-NH1 3.24Å; E1722-R1725 PolarHBondContact OE2-NH1 3.3Å; E1722-F1726 WeakPolarHBondContact O-CB 3.31Å; E1722-F1726 PolarHBondContact O-N 3.09Å |
| 1723 | Y | 87.3 | Confident | 85.4 | Confident | 32.8 Ų | 32.8 | 48.5 Ų | 48.5 | 13% | 0.129 | 23% | 0.23 | C | C | . | . | H | α-helix | trans | -61.4 | -44.4 | 175.3 | 179.1 | -96.8 | 0 | 0 | 0 | 112.7 | R1687 F1688 L1693 W1719 V1720 R1725 F1726 H1727 F1731 | R1687-Y1723 HydrophobicContact CB-CD2 4.44Å; R1687-Y1723 HydrophobicContact CB-CE2 4.05Å; F1688-Y1723 WeakPolarHBondContact CB-OH 3.33Å; F1688-Y1723 PolarHBondContact O-OH 3Å; L1693-Y1723 HydrophobicContact CD2-CE1 4.41Å; W1719-Y1723 HydrophobicContact CH2-CD1 4.45Å; W1719-Y1723 AromaticContact CH2-CD2 3.6Å; W1719-Y1723 HydrophobicContact CH2-CD2 3.6Å; W1719-Y1723 HydrophobicContact CH2-CE2 4.17Å; W1719-Y1723 AromaticContact CH2-CG 3.78Å; W1719-Y1723 HydrophobicContact CH2-CG 3.78Å; W1719-Y1723 AromaticContact CZ2-CD2 3.87Å; W1719-Y1723 HydrophobicContact CZ2-CD2 3.87Å; W1719-Y1723 HydrophobicContact CZ2-CG 4.28Å; W1719-Y1723 HydrophobicContact CZ3-CD2 4.36Å; W1719-Y1723 HydrophobicContact CZ3-CG 4.08Å; W1719-Y1723 WeakPolarHBondContact O-CB 3.4Å; W1719-Y1723 PolarHBondContact O-N 3.08Å; V1720-Y1723 PolarHBondContact O-N 3.14Å; Y1723-R1725 VanDerWaalsContact C-N 3.33Å; Y1723-F1726 PolarHBondContact O-N 3.12Å; Y1723-H1727 AromaticContact CD2-CE1 3.8Å; Y1723-H1727 AromaticContact CD2-ND1 3.74Å; Y1723-H1727 AromaticContact CE1-ND1 3.94Å; Y1723-H1727 AromaticContact CE2-CE1 3.29Å; Y1723-H1727 WeakPolarHBondContact CE2-CE1 3.41Å; Y1723-H1727 AromaticContact CE2-ND1 3.5Å; Y1723-H1727 WeakPolarHBondContact CE2-ND1 3.44Å; Y1723-H1727 AromaticContact CZ-CE1 3.68Å; Y1723-H1727 AromaticContact CZ-ND1 3.62Å; Y1723-H1727 PolarHBondContact O-N 3.17Å; Y1723-H1727 VanDerWaalsContact O-N 3.12Å; Y1723-H1727 PolarHBondContact O-ND1 3.23Å; Y1723-H1727 VanDerWaalsContact O-ND1 3.13Å; Y1723-F1731 HydrophobicContact CD1-CE2 4.4Å; Y1723-F1731 HydrophobicContact CE1-CE2 4.07Å; Y1723-F1731 HydrophobicContact CE1-CZ 4.23Å |
| 1724 | T | 88.4 | Confident | 84.8 | Confident | 12.6 Ų | 12.6 | 50 Ų | 50 | 8% | 0.077 | 24% | 0.238 | C | C | . | . | H | α-helix | trans | -69 | -33.4 | 176.3 | 51.4 | 0 | 0 | 0 | 0 | 112 | V1720 R1721 E1722 H1727 D1728 F1731 L1807 | V1720-T1724 HydrophobicContact CG1-CG2 4.26Å; V1720-T1724 WeakPolarHBondContact O-CB 3.35Å; V1720-T1724 WeakPolarHBondContact O-CG2 3.37Å; V1720-T1724 PolarHBondContact O-N 3.19Å; V1720-T1724 PolarHBondContact O-OG1 3.31Å; R1721-T1724 PolarHBondContact O-OG1 3.19Å; E1722-T1724 PolarHBondContact O-N 3.2Å; T1724-H1727 CarbonylContact O-C 3.57Å; T1724-H1727 VanDerWaalsContact O-C 3.3Å; T1724-H1727 PolarHBondContact O-N 3.19Å; T1724-D1728 VanDerWaalsContact O-CA 3.31Å; T1724-D1728 WeakPolarHBondContact O-CA 3.24Å; T1724-D1728 PolarHBondContact O-N 3.32Å; T1724-D1728 VanDerWaalsContact O-N 3.08Å; T1724-F1731 HydrophobicContact CG2-CD2 4.22Å; T1724-F1731 HydrophobicContact CG2-CE2 4.14Å; T1724-F1731 HydrophobicContact CG2-CZ 4.49Å; T1724-L1807 HydrophobicContact CG2-CD2 4.19Å; T1724-L1807 HydrophobicContact CG2-CG 4.35Å |
| 1725 | R | 82.9 | Confident | 84.4 | Confident | 154 Ų | 154 | 55 Ų | 55 | 58% | 0.581 | 26% | 0.259 | S | S | * | . | H | α-helix | trans | -67.1 | -42.8 | 173.2 | -170.7 | -172.6 | -136.3 | 167.7 | 0.7 | 112.1 | R1721 E1722 Y1723 H1727 D1728 | R1721-R1725 VanDerWaalsContact O-CB 3.3Å; R1721-R1725 WeakPolarHBondContact O-CB 3.26Å; R1721-R1725 PolarHBondContact O-N 3.11Å; E1722-R1725 VanDerWaalsContact CD-NH1 3.29Å; E1722-R1725 WeakPolarHBondContact O-CB 3.22Å; E1722-R1725 PolarHBondContact O-N 3.15Å; E1722-R1725 WeakPolarHBondContact OE1-CD 3.39Å; E1722-R1725 IonicContact OE1-CZ 3.77Å; E1722-R1725 IonicContact OE1-NH1 3.27Å; E1722-R1725 PolarHBondContact OE1-NH1 3.06Å; E1722-R1725 VanDerWaalsContact OE1-NH1 3.14Å; E1722-R1725 IonicContact OE2-CZ 3.52Å; E1722-R1725 IonicContact OE2-NH1 3.24Å; E1722-R1725 PolarHBondContact OE2-NH1 3.3Å; Y1723-R1725 VanDerWaalsContact C-N 3.33Å; R1725-H1727 VanDerWaalsContact C-N 3.27Å; R1725-H1727 PolarHBondContact O-N 3.1Å; R1725-D1728 WeakPolarHBondContact O-CB 3.35Å; R1725-D1728 PolarHBondContact O-N 3.05Å |
| 1726 | F | 76.7 | Confident | 84.1 | Confident | 118.4 Ų | 118.4 | 56.5 Ų | 56.5 | 52% | 0.519 | 28% | 0.278 | S | S | . | . | H | α-helix | trans | -60.9 | -39.4 | 175.7 | -177.1 | -89.5 | 0 | 0 | 0 | 111.1 | L1255 E1722 Y1723 | L1255-F1726 HydrophobicContact CD2-CE2 3.91Å; L1255-F1726 HydrophobicContact CD2-CZ 4.21Å; E1722-F1726 WeakPolarHBondContact O-CB 3.31Å; E1722-F1726 PolarHBondContact O-N 3.09Å; Y1723-F1726 PolarHBondContact O-N 3.12Å |
| 1727 | H | 78 | Confident | 83.8 | Confident | 15 Ų | 15 | 58.8 Ų | 58.8 | 7% | 0.069 | 29% | 0.29 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -98.7 | 27.1 | 178.2 | -61 | 102.1 | 0 | 0 | 0 | 114.1 | T1690 L1693 Y1723 T1724 R1725 R1729 L1730 F1731 | T1690-H1727 PolarHBondContact OG1-NE2 3.25Å; L1693-H1727 HydrophobicContact CD2-CB 3.94Å; Y1723-H1727 AromaticContact CD2-CE1 3.8Å; Y1723-H1727 AromaticContact CD2-ND1 3.74Å; Y1723-H1727 AromaticContact CE1-ND1 3.94Å; Y1723-H1727 AromaticContact CE2-CE1 3.29Å; Y1723-H1727 WeakPolarHBondContact CE2-CE1 3.41Å; Y1723-H1727 AromaticContact CE2-ND1 3.5Å; Y1723-H1727 WeakPolarHBondContact CE2-ND1 3.44Å; Y1723-H1727 AromaticContact CZ-CE1 3.68Å; Y1723-H1727 AromaticContact CZ-ND1 3.62Å; Y1723-H1727 PolarHBondContact O-N 3.17Å; Y1723-H1727 VanDerWaalsContact O-N 3.12Å; Y1723-H1727 PolarHBondContact O-ND1 3.23Å; Y1723-H1727 VanDerWaalsContact O-ND1 3.13Å; T1724-H1727 CarbonylContact O-C 3.57Å; T1724-H1727 VanDerWaalsContact O-C 3.3Å; T1724-H1727 PolarHBondContact O-N 3.19Å; R1725-H1727 VanDerWaalsContact C-N 3.27Å; R1725-H1727 PolarHBondContact O-N 3.1Å; H1727-R1729 PolarHBondContact O-N 3.04Å; H1727-L1730 PolarHBondContact O-N 3.24Å; H1727-F1731 HydrophobicContact CB-CD2 3.74Å; H1727-F1731 HydrophobicContact CB-CE2 3.78Å; H1727-F1731 WeakPolarHBondContact O-CD2 3.29Å; H1727-F1731 PolarHBondContact O-N 3.18Å; H1727-F1731 VanDerWaalsContact O-N 3.14Å |
| 1728 | D | 77.7 | Confident | 83.6 | Confident | 61.4 Ų | 61.4 | 69.2 Ų | 69.2 | 33% | 0.328 | 33% | 0.329 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -54.9 | -28.6 | -173.8 | -168.3 | 57.8 | 0 | 0 | 0 | 112.6 | T1724 R1725 F1731 S1732 K1735 | T1724-D1728 VanDerWaalsContact O-CA 3.31Å; T1724-D1728 WeakPolarHBondContact O-CA 3.24Å; T1724-D1728 PolarHBondContact O-N 3.32Å; T1724-D1728 VanDerWaalsContact O-N 3.08Å; R1725-D1728 WeakPolarHBondContact O-CB 3.35Å; R1725-D1728 PolarHBondContact O-N 3.05Å; D1728-F1731 CarbonylContact O-C 3.58Å; D1728-S1732 WeakPolarHBondContact O-CA 3.39Å; D1728-S1732 VanDerWaalsContact O-CB 3.3Å; D1728-S1732 WeakPolarHBondContact O-CB 3.39Å; D1728-S1732 PolarHBondContact O-N 3.14Å; D1728-K1735 VanDerWaalsContact CG-NZ 3.31Å; D1728-K1735 IonicContact OD1-NZ 3.62Å; D1728-K1735 PolarHBondContact OD1-NZ 3.1Å; D1728-K1735 IonicContact OD2-NZ 3.56Å; D1728-K1735 PolarHBondContact OD2-NZ 3.31Å |
| 1729 | R | 70 | Confident | 83.7 | Confident | 115 Ų | 115 | 71.2 Ų | 71.2 | 43% | 0.434 | 33% | 0.334 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -63.4 | -47.3 | 175 | -106.8 | -176.7 | 176.2 | -176.6 | -2.6 | 112.9 | T1541 Q1592 H1727 F1731 S1732 | T1541-R1729 VanDerWaalsContact CG2-NH1 3.29Å; T1541-R1729 WeakPolarHBondContact OG1-CD 3.46Å; T1541-R1729 PolarHBondContact OG1-NE 3.46Å; T1541-R1729 PolarHBondContact OG1-NH1 3.16Å; Q1592-R1729 VanDerWaalsContact NE2-NH1 3.19Å; H1727-R1729 PolarHBondContact O-N 3.04Å; R1729-F1731 VanDerWaalsContact C-N 3.34Å; R1729-S1732 VanDerWaalsContact O-CB 3.3Å; R1729-S1732 WeakPolarHBondContact O-CB 3.42Å; R1729-S1732 PolarHBondContact O-N 2.84Å; R1729-S1732 PolarHBondContact O-OG 3.19Å |
| 1730 | L | 75.6 | Confident | 83.9 | Confident | 42.6 Ų | 42.6 | 69.3 Ų | 69.3 | 22% | 0.223 | 33% | 0.328 | C | S | . | . | G | 310 helix | trans | -71.4 | -38.3 | -179.7 | -68.5 | 173.5 | 0 | 0 | 0 | 110.7 | T1690 L1693 F1697 H1727 S1732 | T1690-L1730 HydrophobicContact CG2-CD1 4.41Å; L1693-L1730 HydrophobicContact CB-CD1 4.33Å; L1693-L1730 HydrophobicContact CD2-CB 4.46Å; L1693-L1730 HydrophobicContact CD2-CD1 3.62Å; L1693-L1730 HydrophobicContact CG-CD1 3.86Å; F1697-L1730 HydrophobicContact CD2-CB 4.33Å; F1697-L1730 HydrophobicContact CD2-CD2 4.45Å; F1697-L1730 WeakPolarHBondContact CE1-O 3.34Å; F1697-L1730 HydrophobicContact CE2-CB 3.88Å; F1697-L1730 HydrophobicContact CZ-CB 4.41Å; F1697-L1730 VanDerWaalsContact CZ-O 3.25Å; F1697-L1730 WeakPolarHBondContact CZ-O 3.37Å; H1727-L1730 PolarHBondContact O-N 3.24Å; L1730-S1732 VanDerWaalsContact C-N 3.3Å; L1730-S1732 PolarHBondContact O-N 3.27Å |
| 1731 | F | 84.1 | Confident | 83.9 | Confident | 26.6 Ų | 26.6 | 71.9 Ų | 71.9 | 12% | 0.117 | 34% | 0.339 | C | S | . | . | G | 310 helix | trans | -83.2 | 0.1 | 178.4 | -68.5 | -66.1 | 0 | 0 | 0 | 114.6 | L1693 F1697 Y1723 T1724 H1727 D1728 R1729 T1733 L1734 K1735 L1807 | L1693-F1731 HydrophobicContact CD1-CZ 3.96Å; L1693-F1731 HydrophobicContact CD2-CE2 3.91Å; L1693-F1731 HydrophobicContact CD2-CZ 4.11Å; F1697-F1731 AromaticContact CZ-CD1 3.92Å; F1697-F1731 HydrophobicContact CZ-CD1 3.99Å; F1697-F1731 AromaticContact CZ-CE1 3.97Å; F1697-F1731 HydrophobicContact CZ-CE1 4.08Å; Y1723-F1731 HydrophobicContact CD1-CE2 4.4Å; Y1723-F1731 HydrophobicContact CE1-CE2 4.07Å; Y1723-F1731 HydrophobicContact CE1-CZ 4.23Å; T1724-F1731 HydrophobicContact CG2-CD2 4.22Å; T1724-F1731 HydrophobicContact CG2-CE2 4.14Å; T1724-F1731 HydrophobicContact CG2-CZ 4.49Å; H1727-F1731 HydrophobicContact CB-CD2 3.74Å; H1727-F1731 HydrophobicContact CB-CE2 3.78Å; H1727-F1731 WeakPolarHBondContact O-CD2 3.29Å; H1727-F1731 PolarHBondContact O-N 3.18Å; H1727-F1731 VanDerWaalsContact O-N 3.14Å; D1728-F1731 CarbonylContact O-C 3.58Å; R1729-F1731 VanDerWaalsContact C-N 3.34Å; F1731-T1733 PolarHBondContact O-N 3.08Å; F1731-T1733 VanDerWaalsContact O-N 3.15Å; F1731-L1734 HydrophobicContact CD1-CD1 4Å; F1731-L1734 HydrophobicContact CE1-CD1 4.41Å; F1731-L1734 WeakPolarHBondContact O-CA 3.31Å; F1731-L1734 WeakPolarHBondContact O-CB 3.48Å; F1731-L1734 PolarHBondContact O-N 3.1Å; F1731-K1735 PolarHBondContact O-N 3.06Å; F1731-K1735 VanDerWaalsContact O-N 3.13Å; F1731-L1807 HydrophobicContact CB-CD2 3.6Å; F1731-L1807 HydrophobicContact CD1-CD2 4.46Å; F1731-L1807 HydrophobicContact CG-CD2 4.09Å |
| 1732 | S | 78.4 | Confident | 84 | Confident | 55.8 Ų | 55.8 | 70.3 Ų | 70.3 | 39% | 0.39 | 33% | 0.334 | S | S | . | . | G | 310 helix | trans | -56.8 | -35.1 | -176.8 | 60.4 | 0 | 0 | 0 | 0 | 113 | D1728 R1729 L1730 L1734 K1735 | D1728-S1732 WeakPolarHBondContact O-CA 3.39Å; D1728-S1732 VanDerWaalsContact O-CB 3.3Å; D1728-S1732 WeakPolarHBondContact O-CB 3.39Å; D1728-S1732 PolarHBondContact O-N 3.14Å; R1729-S1732 VanDerWaalsContact O-CB 3.3Å; R1729-S1732 WeakPolarHBondContact O-CB 3.42Å; R1729-S1732 PolarHBondContact O-N 2.84Å; R1729-S1732 PolarHBondContact O-OG 3.19Å; L1730-S1732 VanDerWaalsContact C-N 3.3Å; L1730-S1732 PolarHBondContact O-N 3.27Å; S1732-L1734 VanDerWaalsContact C-N 3.29Å; S1732-L1734 PolarHBondContact O-N 3.1Å; S1732-K1735 WeakPolarHBondContact O-CB 3.31Å; S1732-K1735 PolarHBondContact O-N 3.09Å |
| 1733 | T | 78.1 | Confident | 84.3 | Confident | 102 Ų | 102 | 67.2 Ų | 67.2 | 63% | 0.626 | 32% | 0.319 | S | S | * | . | G | 310 helix | trans | -71.2 | -21.5 | 177.1 | 57.2 | 0 | 0 | 0 | 0 | 113.5 | F1731 | F1731-T1733 PolarHBondContact O-N 3.08Å; F1731-T1733 VanDerWaalsContact O-N 3.15Å |
| 1734 | L | 83.8 | Confident | 84.2 | Confident | 52.8 Ų | 52.8 | 68.6 Ų | 68.6 | 28% | 0.276 | 33% | 0.329 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -94.7 | -11.9 | 178 | -61.1 | -175.8 | 0 | 0 | 0 | 112.5 | F1697 F1731 S1732 G1736 N1737 L1740 | F1697-L1734 HydrophobicContact CE1-CD1 4.33Å; F1697-L1734 HydrophobicContact CZ-CD1 4.12Å; F1731-L1734 HydrophobicContact CD1-CD1 4Å; F1731-L1734 HydrophobicContact CE1-CD1 4.41Å; F1731-L1734 WeakPolarHBondContact O-CA 3.31Å; F1731-L1734 WeakPolarHBondContact O-CB 3.48Å; F1731-L1734 PolarHBondContact O-N 3.1Å; S1732-L1734 VanDerWaalsContact C-N 3.29Å; S1732-L1734 PolarHBondContact O-N 3.1Å; L1734-G1736 PolarHBondContact O-N 3.3Å; L1734-N1737 VanDerWaalsContact O-CB 3.24Å; L1734-N1737 WeakPolarHBondContact O-CB 3.37Å; L1734-N1737 PolarHBondContact O-N 2.93Å; L1734-N1737 VanDerWaalsContact O-N 3.11Å; L1734-L1740 HydrophobicContact CB-CD1 4.37Å; L1734-L1740 WeakPolarHBondContact O-CD1 3.37Å |
| 1735 | K | 84.4 | Confident | 84 | Confident | 103.6 Ų | 103.6 | 69.6 Ų | 69.6 | 45% | 0.45 | 34% | 0.337 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -66.1 | 119.9 | -176.5 | -161.3 | 169.8 | -172.1 | 161 | 0 | 110.7 | D1728 F1731 S1732 N1737 L1807 | D1728-K1735 VanDerWaalsContact CG-NZ 3.31Å; D1728-K1735 IonicContact OD1-NZ 3.62Å; D1728-K1735 PolarHBondContact OD1-NZ 3.1Å; D1728-K1735 IonicContact OD2-NZ 3.56Å; D1728-K1735 PolarHBondContact OD2-NZ 3.31Å; F1731-K1735 PolarHBondContact O-N 3.06Å; F1731-K1735 VanDerWaalsContact O-N 3.13Å; S1732-K1735 WeakPolarHBondContact O-CB 3.31Å; S1732-K1735 PolarHBondContact O-N 3.09Å; K1735-N1737 VanDerWaalsContact C-N 3.27Å; K1735-N1737 PolarHBondContact O-N 3.1Å; K1735-L1807 CarbonylContact C-O 3.56Å; K1735-L1807 VanDerWaalsContact CA-O 3.31Å; K1735-L1807 WeakPolarHBondContact CA-O 3.31Å |
| 1736 | G | 85 | Confident | 84.2 | Confident | 44.2 Ų | 44.2 | 62.8 Ų | 62.8 | 46% | 0.456 | 31% | 0.312 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 73.8 | 10.6 | -177 | 0 | 0 | 0 | 0 | 0 | 114.6 | L1734 R1738 L1807 | L1734-G1736 PolarHBondContact O-N 3.3Å; G1736-R1738 PolarHBondContact O-N 3.09Å; G1736-L1807 PolarHBondContact N-O 2.97Å |
| 1737 | N | 88 | Confident | 84.6 | Confident | 53.4 Ų | 53.4 | 65.2 Ų | 65.2 | 29% | 0.286 | 32% | 0.318 | S | S | . | . | trans | -67.4 | 124.6 | 179 | -170.3 | -22.7 | 0 | 0 | 0 | 110.5 | L1734 K1735 K1739 L1740 H1809 | L1734-N1737 VanDerWaalsContact O-CB 3.24Å; L1734-N1737 WeakPolarHBondContact O-CB 3.37Å; L1734-N1737 PolarHBondContact O-N 2.93Å; L1734-N1737 VanDerWaalsContact O-N 3.11Å; K1735-N1737 VanDerWaalsContact C-N 3.27Å; K1735-N1737 PolarHBondContact O-N 3.1Å; N1737-K1739 PolarHBondContact O-N 2.95Å; N1737-K1739 VanDerWaalsContact O-N 3.1Å; N1737-K1739 WeakPolarHBondContact OD1-CB 3.2Å; N1737-K1739 WeakPolarHBondContact OD1-CG 3.32Å; N1737-K1739 PolarHBondContact OD1-N 3.15Å; N1737-K1739 VanDerWaalsContact OD1-N 3.08Å; N1737-L1740 HydrophobicContact CB-CD1 4.44Å; N1737-L1740 HydrophobicContact CB-CG 4.35Å; N1737-L1740 PolarHBondContact O-N 3.17Å; N1737-L1740 VanDerWaalsContact O-N 3.08Å; N1737-H1809 PolarHBondContact O-CE1 3.17Å; N1737-H1809 PolarHBondContact O-NE2 3.29Å | ||
| 1738 | R | 89.7 | Confident | 85.2 | Confident | 226.2 Ų | 226.2 | 68.4 Ų | 68.4 | 85% | 0.854 | 33% | 0.329 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -68.5 | -16.3 | -177.1 | -64.6 | -175.9 | -179.1 | -179.1 | 0.3 | 114 | G1736 L1740 | G1736-R1738 PolarHBondContact O-N 3.09Å; R1738-L1740 PolarHBondContact O-N 3.02Å |
| 1739 | K | 91.3 | Very high | 85.8 | Confident | 71.2 Ų | 71.2 | 65.5 Ų | 65.5 | 31% | 0.31 | 31% | 0.314 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -71.1 | -16.6 | 175.2 | -61.8 | -174.1 | 174.2 | -169.4 | 0 | 113.1 | Q1706 V1708 V1709 V1711 N1737 H1741 | Q1706-K1739 PolarHBondContact O-NZ 3.2Å; V1708-K1739 WeakPolarHBondContact O-CD 3.3Å; V1708-K1739 WeakPolarHBondContact O-CE 3.35Å; V1708-K1739 PolarHBondContact O-NZ 3.05Å; V1709-K1739 WeakPolarHBondContact O-CG 3.38Å; V1711-K1739 PolarHBondContact N-O 3.16Å; N1737-K1739 PolarHBondContact O-N 2.95Å; N1737-K1739 VanDerWaalsContact O-N 3.1Å; N1737-K1739 WeakPolarHBondContact OD1-CB 3.2Å; N1737-K1739 WeakPolarHBondContact OD1-CG 3.32Å; N1737-K1739 PolarHBondContact OD1-N 3.15Å; N1737-K1739 VanDerWaalsContact OD1-N 3.08Å; K1739-H1741 PolarHBondContact O-CD2 3.13Å; K1739-H1741 VanDerWaalsContact O-CD2 3.29Å |
| 1740 | L | 93.1 | Very high | 86.8 | Confident | 17.8 Ų | 17.8 | 62.8 Ų | 62.8 | 9% | 0.093 | 31% | 0.308 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -87.2 | 117.7 | -179.2 | -58 | -179 | 0 | 0 | 0 | 110.4 | V1711 L1713 L1734 N1737 R1738 F1742 L1807 | V1711-L1740 HydrophobicContact CB-CD2 3.81Å; V1711-L1740 HydrophobicContact CG1-CD2 4.2Å; V1711-L1740 HydrophobicContact CG2-CD2 4.14Å; L1713-L1740 HydrophobicContact CD1-CB 4.34Å; L1713-L1740 HydrophobicContact CD1-CD2 4.35Å; L1734-L1740 HydrophobicContact CB-CD1 4.37Å; L1734-L1740 WeakPolarHBondContact O-CD1 3.37Å; N1737-L1740 HydrophobicContact CB-CD1 4.44Å; N1737-L1740 HydrophobicContact CB-CG 4.35Å; N1737-L1740 PolarHBondContact O-N 3.17Å; N1737-L1740 VanDerWaalsContact O-N 3.08Å; R1738-L1740 PolarHBondContact O-N 3.02Å; L1740-F1742 HydrophobicContact CB-CE2 4.29Å; L1740-L1807 HydrophobicContact CD1-CD1 4.05Å |
| 1741 | H | 93.3 | Very high | 87.5 | Confident | 68.8 Ų | 68.8 | 65.9 Ų | 65.9 | 32% | 0.319 | 32% | 0.321 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -112.2 | 103 | 177 | -63.4 | -83.1 | 0 | 0 | 0 | 109.3 | V1711 Y1712 L1713 K1739 | V1711-H1741 PolarHBondContact O-N 3.13Å; Y1712-H1741 CarbonylContact C-O 3.51Å; Y1712-H1741 WeakPolarHBondContact CA-O 3.32Å; Y1712-H1741 HydrophobicContact CD1-CB 3.75Å; Y1712-H1741 HydrophobicContact CE1-CB 4.21Å; L1713-H1741 PolarHBondContact N-O 2.98Å; K1739-H1741 PolarHBondContact O-CD2 3.13Å; K1739-H1741 VanDerWaalsContact O-CD2 3.29Å |
| 1742 | F | 93.2 | Very high | 87.9 | Confident | 26.6 Ų | 26.6 | 67.2 Ų | 67.2 | 12% | 0.117 | 33% | 0.327 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -79.6 | 122.3 | 171.6 | -70.1 | -95 | 0 | 0 | 0 | 109.5 | L1713 C1716 L1740 V1806 L1807 H1809 V1811 | L1713-F1742 HydrophobicContact CB-CD1 3.87Å; L1713-F1742 HydrophobicContact CB-CE1 4.18Å; L1713-F1742 HydrophobicContact CB-CG 4.37Å; L1713-F1742 HydrophobicContact CD1-CD1 3.98Å; L1713-F1742 HydrophobicContact CD1-CD2 4.17Å; L1713-F1742 HydrophobicContact CD1-CE1 3.65Å; L1713-F1742 HydrophobicContact CD1-CE2 3.83Å; L1713-F1742 HydrophobicContact CD1-CG 4.25Å; L1713-F1742 HydrophobicContact CD1-CZ 3.58Å; L1713-F1742 VanDerWaalsContact CD1-CZ 3.45Å; L1713-F1742 HydrophobicContact CD2-CE1 4.41Å; L1713-F1742 HydrophobicContact CG-CD1 4.49Å; L1713-F1742 HydrophobicContact CG-CE1 4.4Å; C1716-F1742 HydrophobicContact CB-CD1 4.12Å; C1716-F1742 HydrophobicContact CB-CE1 4.33Å; L1740-F1742 HydrophobicContact CB-CE2 4.29Å; F1742-V1806 HydrophobicContact CE1-CB 4.28Å; F1742-V1806 HydrophobicContact CE1-CG1 3.93Å; F1742-V1806 HydrophobicContact CZ-CB 4.28Å; F1742-V1806 HydrophobicContact CZ-CG1 3.96Å; F1742-L1807 HydrophobicContact CZ-CB 4.44Å; F1742-L1807 HydrophobicContact CZ-CD1 4.41Å; F1742-H1809 HydrophobicContact CD2-CB 3.88Å; F1742-H1809 HydrophobicContact CE2-CB 3.9Å; F1742-H1809 AromaticContact CE2-CD2 3.77Å; F1742-H1809 AromaticContact CE2-CG 3.99Å; F1742-V1811 HydrophobicContact CB-CB 4.4Å; F1742-V1811 HydrophobicContact CB-CG1 3.86Å; F1742-V1811 HydrophobicContact CB-CG2 3.67Å; F1742-V1811 HydrophobicContact CD1-CB 4.33Å; F1742-V1811 HydrophobicContact CD1-CG1 3.78Å; F1742-V1811 HydrophobicContact CD1-CG2 3.6Å; F1742-V1811 HydrophobicContact CD2-CG2 3.78Å; F1742-V1811 HydrophobicContact CE1-CG2 4.1Å; F1742-V1811 HydrophobicContact CE2-CG2 4.27Å; F1742-V1811 HydrophobicContact CG-CB 4.41Å; F1742-V1811 HydrophobicContact CG-CG1 4.06Å; F1742-V1811 HydrophobicContact CG-CG2 3.4Å; F1742-V1811 VanDerWaalsContact CG-CG2 3.42Å; F1742-V1811 HydrophobicContact CZ-CG2 4.4Å |
| 1743 | L | 91.5 | Very high | 88.6 | Confident | 9.8 Ų | 9.8 | 64.5 Ų | 64.5 | 5% | 0.051 | 31% | 0.308 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -93.3 | 124.3 | -178.2 | -57.4 | -175.2 | 0 | 0 | 0 | 110.3 | Y1712 L1713 S1745 R1748 L1749 F1752 | Y1712-L1743 HydrophobicContact CD1-CD2 4.46Å; L1713-L1743 PolarHBondContact O-N 3.1Å; L1743-S1745 VanDerWaalsContact C-N 3.27Å; L1743-S1745 PolarHBondContact O-N 3.15Å; L1743-R1748 HydrophobicContact CD2-CB 4.33Å; L1743-L1749 HydrophobicContact CD1-CB 3.96Å; L1743-L1749 HydrophobicContact CD1-CD1 3.86Å; L1743-L1749 HydrophobicContact CD1-CG 4.44Å; L1743-F1752 HydrophobicContact CD2-CD2 4.47Å; L1743-F1752 HydrophobicContact CD2-CE2 4.11Å |
| 1744 | D | 84.6 | Confident | 89.1 | Confident | 63 Ų | 63 | 61.6 Ų | 61.6 | 34% | 0.337 | 29% | 0.292 | S | S | . | . | S | Bend | trans | -71.3 | -24.2 | 177.3 | -53.3 | -62.4 | 0 | 0 | 0 | 112.6 | R1748 K1803 | D1744-R1748 IonicContact OD2-CZ 3.87Å; D1744-R1748 IonicContact OD2-NH1 3.26Å; D1744-R1748 PolarHBondContact OD2-NH1 3.32Å; D1744-K1803 IonicContact OD1-NZ 3.42Å; D1744-K1803 IonicContact OD2-NZ 3.39Å |
| 1745 | S | 84.4 | Confident | 89.4 | Confident | 33.4 Ų | 33.4 | 62.8 Ų | 62.8 | 23% | 0.234 | 30% | 0.303 | C | S | . | . | S | Bend | trans | -147 | 144.5 | 174.1 | 168.6 | 0 | 0 | 0 | 0 | 108.8 | L1743 R1747 R1748 | L1743-S1745 VanDerWaalsContact C-N 3.27Å; L1743-S1745 PolarHBondContact O-N 3.15Å; S1745-R1747 PolarHBondContact O-N 3.16Å; S1745-R1747 VanDerWaalsContact O-N 3.14Å; S1745-R1747 PolarHBondContact OG-N 2.98Å; S1745-R1748 WeakPolarHBondContact O-CB 3.4Å; S1745-R1748 PolarHBondContact O-N 3.39Å |
| 1746 | V | 86.4 | Confident | 89.6 | Confident | 11 Ų | 11 | 66.1 Ų | 66.1 | 7% | 0.067 | 32% | 0.32 | C | S | . | . | G | 310 helix | trans | -55.3 | -32 | 176.3 | -177.2 | 0 | 0 | 0 | 0 | 111.4 | R1748 L1749 L1760 T1764 L1765 | V1746-R1748 PolarHBondContact O-N 2.94Å; V1746-L1749 WeakPolarHBondContact O-CB 3.39Å; V1746-L1749 PolarHBondContact O-N 3.06Å; V1746-L1760 HydrophobicContact CG1-CD1 3.37Å; V1746-T1764 HydrophobicContact CG2-CG2 4.29Å; V1746-L1765 HydrophobicContact CG1-CD2 4.26Å |
| 1747 | R | 86.4 | Confident | 89.8 | Confident | 168 Ų | 168 | 66.4 Ų | 66.4 | 63% | 0.634 | 31% | 0.311 | S | S | * | . | G | 310 helix | trans | -62.9 | -25.3 | 177.9 | -63.9 | -175.1 | -178.2 | 175.5 | 2 | 113.7 | S1745 L1749 N1750 | S1745-R1747 PolarHBondContact O-N 3.16Å; S1745-R1747 VanDerWaalsContact O-N 3.14Å; S1745-R1747 PolarHBondContact OG-N 2.98Å; R1747-L1749 PolarHBondContact O-N 3.32Å; R1747-N1750 WeakPolarHBondContact O-CB 3.37Å; R1747-N1750 VanDerWaalsContact O-CG 3.23Å; R1747-N1750 PolarHBondContact O-N 3.08Å; R1747-N1750 VanDerWaalsContact O-N 3.09Å; R1747-N1750 PolarHBondContact O-ND2 3.22Å |
| 1748 | R | 89.4 | Confident | 90 | Very high | 84.2 Ų | 84.2 | 65.4 Ų | 65.4 | 32% | 0.318 | 31% | 0.305 | S | S | . | . | G | 310 helix | trans | -66.4 | -17.5 | 175.3 | -67.6 | -168.7 | 64.5 | -153.2 | -13.1 | 112.4 | L1743 D1744 S1745 V1746 N1750 E1751 | L1743-R1748 HydrophobicContact CD2-CB 4.33Å; D1744-R1748 IonicContact OD2-CZ 3.87Å; D1744-R1748 IonicContact OD2-NH1 3.26Å; D1744-R1748 PolarHBondContact OD2-NH1 3.32Å; S1745-R1748 WeakPolarHBondContact O-CB 3.4Å; S1745-R1748 PolarHBondContact O-N 3.39Å; V1746-R1748 PolarHBondContact O-N 2.94Å; R1748-N1750 PolarHBondContact O-N 3.1Å; R1748-N1750 VanDerWaalsContact O-N 3.15Å; R1748-E1751 IonicContact CZ-OE1 3.66Å; R1748-E1751 IonicContact CZ-OE2 3.68Å; R1748-E1751 IonicContact NE-OE1 2.92Å; R1748-E1751 PolarHBondContact NE-OE1 3.19Å; R1748-E1751 VanDerWaalsContact NE-OE1 3.13Å; R1748-E1751 IonicContact NE-OE2 3.23Å; R1748-E1751 IonicContact NH2-OE1 3.61Å; R1748-E1751 IonicContact NH2-OE2 3.74Å; R1748-E1751 PolarHBondContact NH2-OE2 3.09Å; R1748-E1751 VanDerWaalsContact NH2-OE2 3.11Å; R1748-E1751 VanDerWaalsContact O-CB 3.25Å; R1748-E1751 WeakPolarHBondContact O-CB 3.4Å; R1748-E1751 WeakPolarHBondContact O-CG 3.39Å; R1748-E1751 PolarHBondContact O-N 3.11Å |
| 1749 | L | 91.2 | Very high | 90.1 | Very high | 0 Ų | 0 | 61.4 Ų | 61.4 | 0% | 0 | 29% | 0.289 | C | S | . | . | G | 310 helix | trans | -58.9 | -27 | 171.5 | -166.6 | 64 | 0 | 0 | 0 | 111.7 | V1676 Y1712 L1743 V1746 R1747 E1751 F1752 I1753 Q1758 L1760 | V1676-L1749 HydrophobicContact CG1-CD1 4.49Å; V1676-L1749 HydrophobicContact CG1-CD2 4.28Å; V1676-L1749 HydrophobicContact CG2-CD1 4.08Å; V1676-L1749 HydrophobicContact CG2-CD2 4.45Å; Y1712-L1749 HydrophobicContact CD2-CD1 4.2Å; Y1712-L1749 HydrophobicContact CG-CD1 4.03Å; L1743-L1749 HydrophobicContact CD1-CB 3.96Å; L1743-L1749 HydrophobicContact CD1-CD1 3.86Å; L1743-L1749 HydrophobicContact CD1-CG 4.44Å; V1746-L1749 WeakPolarHBondContact O-CB 3.39Å; V1746-L1749 PolarHBondContact O-N 3.06Å; R1747-L1749 PolarHBondContact O-N 3.32Å; L1749-E1751 PolarHBondContact O-N 3.05Å; L1749-F1752 PolarHBondContact O-N 3.31Å; L1749-I1753 HydrophobicContact CD1-CD1 3.85Å; L1749-I1753 HydrophobicContact CD1-CG1 4.35Å; L1749-I1753 HydrophobicContact CD2-CD1 4.46Å; L1749-I1753 HydrophobicContact CG-CD1 4.15Å; L1749-I1753 PolarHBondContact O-N 3.08Å; L1749-Q1758 HydrophobicContact CD2-CG 4.21Å; L1749-Q1758 HydrophobicContact CG-CG 4.49Å; L1749-L1760 HydrophobicContact CD2-CD1 3.89Å; L1749-L1760 HydrophobicContact CD2-CG 4.45Å |
| 1750 | N | 90.6 | Very high | 90.1 | Very high | 58.8 Ų | 58.8 | 58.6 Ų | 58.6 | 31% | 0.314 | 28% | 0.278 | S | S | . | . | G | 310 helix | trans | -60.4 | -24.3 | 175.2 | -62.5 | -16.4 | 0 | 0 | 0 | 113.5 | R1634 R1747 R1748 F1752 I1753 Q1758 | R1634-N1750 PolarHBondContact NE-O 3.43Å; R1634-N1750 PolarHBondContact NH2-O 3.14Å; R1747-N1750 WeakPolarHBondContact O-CB 3.37Å; R1747-N1750 VanDerWaalsContact O-CG 3.23Å; R1747-N1750 PolarHBondContact O-N 3.08Å; R1747-N1750 VanDerWaalsContact O-N 3.09Å; R1747-N1750 PolarHBondContact O-ND2 3.22Å; R1748-N1750 PolarHBondContact O-N 3.1Å; R1748-N1750 VanDerWaalsContact O-N 3.15Å; N1750-F1752 VanDerWaalsContact C-N 3.26Å; N1750-F1752 PolarHBondContact O-N 3.09Å; N1750-I1753 WeakPolarHBondContact CA-O 3.34Å; N1750-Q1758 PolarHBondContact OD1-NE2 3.25Å; N1750-Q1758 PolarHBondContact OD1-OE1 3.26Å |
| 1751 | E | 90.6 | Very high | 90 | Very high | 107.2 Ų | 107.2 | 58.4 Ų | 58.4 | 50% | 0.501 | 28% | 0.277 | S | S | . | . | G | 310 helix | trans | -66.2 | -30.3 | 175.4 | -63.5 | 169.1 | -160.2 | 0 | 0 | 111.2 | R1634 R1748 L1749 | R1634-E1751 VanDerWaalsContact CD-O 3.27Å; R1634-E1751 WeakPolarHBondContact CD-O 3.41Å; R1634-E1751 PolarHBondContact NE-O 3.19Å; R1748-E1751 IonicContact CZ-OE1 3.66Å; R1748-E1751 IonicContact CZ-OE2 3.68Å; R1748-E1751 IonicContact NE-OE1 2.92Å; R1748-E1751 PolarHBondContact NE-OE1 3.19Å; R1748-E1751 VanDerWaalsContact NE-OE1 3.13Å; R1748-E1751 IonicContact NE-OE2 3.23Å; R1748-E1751 IonicContact NH2-OE1 3.61Å; R1748-E1751 IonicContact NH2-OE2 3.74Å; R1748-E1751 PolarHBondContact NH2-OE2 3.09Å; R1748-E1751 VanDerWaalsContact NH2-OE2 3.11Å; R1748-E1751 VanDerWaalsContact O-CB 3.25Å; R1748-E1751 WeakPolarHBondContact O-CB 3.4Å; R1748-E1751 WeakPolarHBondContact O-CG 3.39Å; R1748-E1751 PolarHBondContact O-N 3.11Å; L1749-E1751 PolarHBondContact O-N 3.05Å |
| 1752 | F | 91.5 | Very high | 89.7 | Confident | 53.2 Ų | 53.2 | 58.3 Ų | 58.3 | 23% | 0.233 | 29% | 0.289 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -108.9 | -32 | -172.8 | -55.8 | -78.3 | 0 | 0 | 0 | 113.3 | R1634 Y1712 L1743 L1749 N1750 | R1634-F1752 WeakPolarHBondContact CB-O 3.27Å; R1634-F1752 VanDerWaalsContact CG-O 3.32Å; R1634-F1752 WeakPolarHBondContact CG-O 3.36Å; R1634-F1752 PolarHBondContact N-O 3.15Å; Y1712-F1752 AromaticContact CD1-CD2 3.98Å; Y1712-F1752 HydrophobicContact CD1-CD2 4.04Å; Y1712-F1752 HydrophobicContact CD1-CE2 4.42Å; Y1712-F1752 HydrophobicContact CD1-CG 4.2Å; Y1712-F1752 HydrophobicContact CE1-CB 3.81Å; Y1712-F1752 AromaticContact CE1-CD1 3.63Å; Y1712-F1752 HydrophobicContact CE1-CD1 3.63Å; Y1712-F1752 AromaticContact CE1-CD2 3.67Å; Y1712-F1752 HydrophobicContact CE1-CD2 3.67Å; Y1712-F1752 HydrophobicContact CE1-CE1 4.1Å; Y1712-F1752 HydrophobicContact CE1-CE2 4.14Å; Y1712-F1752 AromaticContact CE1-CG 3.4Å; Y1712-F1752 HydrophobicContact CE1-CG 3.4Å; Y1712-F1752 VanDerWaalsContact CE1-CG 3.41Å; Y1712-F1752 HydrophobicContact CE1-CZ 4.34Å; Y1712-F1752 HydrophobicContact CE2-CB 4.35Å; Y1712-F1752 AromaticContact CZ-CD1 3.96Å; Y1712-F1752 AromaticContact CZ-CG 3.75Å; L1743-F1752 HydrophobicContact CD2-CD2 4.47Å; L1743-F1752 HydrophobicContact CD2-CE2 4.11Å; L1749-F1752 PolarHBondContact O-N 3.31Å; N1750-F1752 VanDerWaalsContact C-N 3.26Å; N1750-F1752 PolarHBondContact O-N 3.09Å |
| 1753 | I | 93.1 | Very high | 89.3 | Confident | 0 Ų | 0 | 59.4 Ų | 59.4 | 0% | 0 | 30% | 0.303 | C | S | . | . | S | Bend | trans | -131 | 130.6 | -176.4 | -52.3 | 174.5 | 0 | 0 | 0 | 108.4 | V1639 V1676 L1749 N1750 N1757 Q1758 | V1639-I1753 HydrophobicContact CB-CD1 4.39Å; V1639-I1753 HydrophobicContact CG1-CD1 3.73Å; V1639-I1753 HydrophobicContact CG2-CD1 3.84Å; V1639-I1753 HydrophobicContact CG2-CG1 4.26Å; V1676-I1753 HydrophobicContact CG2-CD1 3.84Å; L1749-I1753 HydrophobicContact CD1-CD1 3.85Å; L1749-I1753 HydrophobicContact CD1-CG1 4.35Å; L1749-I1753 HydrophobicContact CD2-CD1 4.46Å; L1749-I1753 HydrophobicContact CG-CD1 4.15Å; L1749-I1753 PolarHBondContact O-N 3.08Å; N1750-I1753 WeakPolarHBondContact CA-O 3.34Å; I1753-N1757 HydrophobicContact CG2-CB 3.93Å; I1753-Q1758 HydrophobicContact CB-CG 3.95Å; I1753-Q1758 HydrophobicContact CG2-CG 3.64Å; I1753-Q1758 PolarHBondContact O-NE2 3.05Å |
| 1754 | C | 90.5 | Very high | 89.2 | Confident | 40.6 Ų | 40.6 | 59.2 Ų | 59.2 | 27% | 0.274 | 30% | 0.301 | S | S | . | . | trans | -60.8 | 140.4 | 175.2 | -68.3 | 0 | 0 | 0 | 0 | 110.6 | R1634 E1756 N1757 Q1758 | R1634-C1754 PolarHBondContact NH1-SG 3.2Å; C1754-E1756 PolarHBondContact O-N 3.09Å; C1754-E1756 VanDerWaalsContact O-N 3.12Å; C1754-N1757 WeakPolarHBondContact O-CA 3.38Å; C1754-N1757 PolarHBondContact O-N 2.99Å; C1754-Q1758 PolarHBondContact O-N 3.31Å | ||
| 1755 | P | 88.1 | Confident | 89.3 | Confident | 78.4 Ų | 78.4 | 60.2 Ų | 60.2 | 51% | 0.509 | 31% | 0.307 | S | S | . | . | G | 310 helix | trans | -53 | -36.3 | -178.3 | -27.4 | 34.1 | 0 | 0 | 0 | 114.2 | N1757 Q1758 | P1755-N1757 PolarHBondContact O-N 3.02Å; P1755-Q1758 PolarHBondContact O-N 3.15Å; P1755-Q1758 VanDerWaalsContact O-N 3.13Å |
| 1756 | E | 89.2 | Confident | 89.4 | Confident | 173 Ų | 173 | 62.7 Ų | 62.7 | 81% | 0.808 | 32% | 0.317 | S | S | * | . | G | 310 helix | trans | -63.9 | -25.7 | 177.1 | -60.3 | 174.4 | -158.7 | 0 | 0 | 113.4 | C1754 | C1754-E1756 PolarHBondContact O-N 3.09Å; C1754-E1756 VanDerWaalsContact O-N 3.12Å |
| 1757 | N | 90.7 | Very high | 89.3 | Confident | 50.2 Ų | 50.2 | 62.8 Ų | 62.8 | 27% | 0.268 | 32% | 0.317 | S | S | . | . | G | 310 helix | trans | -96.7 | 3.7 | 178.6 | -72.5 | -12.6 | 0 | 0 | 0 | 112.7 | T1632 I1753 C1754 P1755 | T1632-N1757 WeakPolarHBondContact O-CB 3.36Å; T1632-N1757 PolarHBondContact O-ND2 3.22Å; T1632-N1757 PolarHBondContact OG1-ND2 3.13Å; I1753-N1757 HydrophobicContact CG2-CB 3.93Å; C1754-N1757 WeakPolarHBondContact O-CA 3.38Å; C1754-N1757 PolarHBondContact O-N 2.99Å; P1755-N1757 PolarHBondContact O-N 3.02Å |
| 1758 | Q | 90.9 | Very high | 89 | Confident | 33 Ų | 33 | 56.7 Ų | 56.7 | 15% | 0.154 | 30% | 0.297 | C | S | . | . | trans | -93.2 | 140 | 178.6 | -67.1 | 177.9 | 27.2 | 0 | 0 | 111.6 | Y1641 L1749 N1750 I1753 C1754 P1755 | Y1641-Q1758 WeakPolarHBondContact OH-CA 3.4Å; L1749-Q1758 HydrophobicContact CD2-CG 4.21Å; L1749-Q1758 HydrophobicContact CG-CG 4.49Å; N1750-Q1758 PolarHBondContact OD1-NE2 3.25Å; N1750-Q1758 PolarHBondContact OD1-OE1 3.26Å; I1753-Q1758 HydrophobicContact CB-CG 3.95Å; I1753-Q1758 HydrophobicContact CG2-CG 3.64Å; I1753-Q1758 PolarHBondContact O-NE2 3.05Å; C1754-Q1758 PolarHBondContact O-N 3.31Å; P1755-Q1758 PolarHBondContact O-N 3.15Å; P1755-Q1758 VanDerWaalsContact O-N 3.13Å | ||
| 1759 | R | 91.6 | Very high | 88.6 | Confident | 141.2 Ų | 141.2 | 57.7 Ų | 57.7 | 53% | 0.533 | 31% | 0.305 | S | S | . | . | trans | -140.7 | 67 | 174.8 | -167.9 | 174.1 | -172.6 | -176.2 | 2.1 | 111.2 | Y1628 Y1630 Y1641 | Y1628-R1759 HydrophobicContact CE2-CB 4.41Å; Y1628-R1759 HydrophobicContact CE2-CG 4.33Å; Y1628-R1759 PolarHBondContact OH-O 3.14Å; Y1630-R1759 HydrophobicContact CD1-CB 3.32Å; Y1630-R1759 HydrophobicContact CD1-CG 4.27Å; Y1630-R1759 HydrophobicContact CD2-CB 4.4Å; Y1630-R1759 VanDerWaalsContact CD2-CD 3.47Å; Y1630-R1759 HydrophobicContact CE1-CB 3.71Å; Y1630-R1759 HydrophobicContact CE1-CG 4.47Å; Y1630-R1759 HydrophobicContact CG-CB 3.68Å; Y1630-R1759 HydrophobicContact CG-CG 4.3Å; Y1641-R1759 PolarHBondContact OH-N 3.05Å | ||
| 1760 | L | 91.2 | Very high | 88.1 | Confident | 12.6 Ų | 12.6 | 65 Ų | 65 | 7% | 0.066 | 34% | 0.344 | C | S | . | . | trans | -79.3 | 156.6 | 167.1 | -72.9 | 170.1 | 0 | 0 | 0 | 110.7 | Y1641 V1676 D1678 V1746 L1749 L1765 | Y1641-L1760 HydrophobicContact CD1-CD2 3.94Å; Y1641-L1760 HydrophobicContact CD1-CG 4.48Å; Y1641-L1760 HydrophobicContact CE1-CD2 3.95Å; Y1641-L1760 HydrophobicContact CE1-CG 4.1Å; V1676-L1760 HydrophobicContact CG1-CD2 4.04Å; D1678-L1760 HydrophobicContact CB-CD2 4.25Å; V1746-L1760 HydrophobicContact CG1-CD1 3.37Å; L1749-L1760 HydrophobicContact CD2-CD1 3.89Å; L1749-L1760 HydrophobicContact CD2-CG 4.45Å; L1760-L1765 HydrophobicContact CB-CD2 4.3Å; L1760-L1765 HydrophobicContact CB-CG 4.3Å; L1760-L1765 HydrophobicContact CD1-CD2 4.41Å | ||
| 1761 | P | 90.5 | Very high | 87.7 | Confident | 12.8 Ų | 12.8 | 63.4 Ų | 63.4 | 8% | 0.083 | 34% | 0.339 | C | S | . | . | trans | -56.6 | 140.1 | 173.6 | -23.1 | 33.6 | 0 | 0 | 0 | 111.6 | I1643 A1763 T1764 L1765 | I1643-P1761 HydrophobicContact CD1-CG 3.73Å; I1643-P1761 HydrophobicContact CG1-CG 4.01Å; I1643-P1761 HydrophobicContact CG2-CG 3.8Å; P1761-A1763 PolarHBondContact O-N 3.02Å; P1761-T1764 WeakPolarHBondContact O-CB 3.32Å; P1761-T1764 PolarHBondContact O-N 3.14Å; P1761-L1765 PolarHBondContact O-N 3.3Å | ||
| 1762 | A | 87.3 | Confident | 87.6 | Confident | 67.8 Ų | 67.8 | 64.2 Ų | 64.2 | 56% | 0.56 | 34% | 0.341 | S | S | * | . | H | α-helix | trans | -56.1 | -39.6 | 177.7 | 0 | 0 | 0 | 0 | 0 | 112 | T1764 L1765 L1766 | A1762-T1764 VanDerWaalsContact C-N 3.26Å; A1762-T1764 PolarHBondContact O-N 3.13Å; A1762-L1765 PolarHBondContact O-N 3.25Å; A1762-L1765 VanDerWaalsContact O-N 3.1Å; A1762-L1766 WeakPolarHBondContact O-CB 3.31Å; A1762-L1766 VanDerWaalsContact O-CG 3.25Å; A1762-L1766 WeakPolarHBondContact O-CG 3.35Å; A1762-L1766 PolarHBondContact O-N 3.13Å |
| 1763 | A | 85.7 | Confident | 87.6 | Confident | 50.2 Ų | 50.2 | 65.2 Ų | 65.2 | 42% | 0.415 | 35% | 0.352 | S | S | . | . | H | α-helix | trans | -55.8 | -37.7 | 175.3 | 0 | 0 | 0 | 0 | 0 | 112.9 | P1761 L1767 | P1761-A1763 PolarHBondContact O-N 3.02Å; A1763-L1767 WeakPolarHBondContact O-CG 3.38Å |
| 1764 | T | 89.2 | Confident | 87.5 | Confident | 3.6 Ų | 3.6 | 65.8 Ų | 65.8 | 2% | 0.022 | 35% | 0.354 | C | S | . | . | H | α-helix | trans | -71.6 | -36.6 | 177.8 | -54.9 | 0 | 0 | 0 | 0 | 112 | D1678 T1680 V1746 P1761 A1762 | D1678-T1764 WeakPolarHBondContact OD2-CG2 3.46Å; D1678-T1764 PolarHBondContact OD2-OG1 3.28Å; T1680-T1764 HydrophobicContact CG2-CG2 4.44Å; T1680-T1764 VanDerWaalsContact OG1-CG2 3.29Å; T1680-T1764 WeakPolarHBondContact OG1-CG2 3.35Å; V1746-T1764 HydrophobicContact CG2-CG2 4.29Å; P1761-T1764 WeakPolarHBondContact O-CB 3.32Å; P1761-T1764 PolarHBondContact O-N 3.14Å; A1762-T1764 VanDerWaalsContact C-N 3.26Å; A1762-T1764 PolarHBondContact O-N 3.13Å |
| 1765 | L | 87.2 | Confident | 87.4 | Confident | 85.8 Ų | 85.8 | 68 Ų | 68 | 45% | 0.449 | 36% | 0.363 | S | S | . | . | H | α-helix | trans | -73.2 | -38.2 | 179.7 | -65.1 | 172.2 | 0 | 0 | 0 | 112.2 | V1746 L1760 P1761 A1762 L1767 | V1746-L1765 HydrophobicContact CG1-CD2 4.26Å; L1760-L1765 HydrophobicContact CB-CD2 4.3Å; L1760-L1765 HydrophobicContact CB-CG 4.3Å; L1760-L1765 HydrophobicContact CD1-CD2 4.41Å; P1761-L1765 PolarHBondContact O-N 3.3Å; A1762-L1765 PolarHBondContact O-N 3.25Å; A1762-L1765 VanDerWaalsContact O-N 3.1Å; L1765-L1767 PolarHBondContact O-N 3.29Å |
| 1766 | L | 86.3 | Confident | 87.4 | Confident | 86 Ų | 86 | 69.5 Ų | 69.5 | 45% | 0.45 | 37% | 0.367 | S | S | . | . | H | α-helix | trans | -68.9 | -14.9 | -179.8 | -69.5 | 170.5 | 0 | 0 | 0 | 113.7 | A1762 D1768 E1769 | A1762-L1766 WeakPolarHBondContact O-CB 3.31Å; A1762-L1766 VanDerWaalsContact O-CG 3.25Å; A1762-L1766 WeakPolarHBondContact O-CG 3.35Å; A1762-L1766 PolarHBondContact O-N 3.13Å; L1766-D1768 VanDerWaalsContact C-N 3.28Å; L1766-D1768 PolarHBondContact O-N 3.16Å; L1766-E1769 VanDerWaalsContact CD2-OE2 3.27Å; L1766-E1769 WeakPolarHBondContact CD2-OE2 3.37Å; L1766-E1769 PolarHBondContact O-N 3Å |
| 1767 | L | 84.7 | Confident | 87.3 | Confident | 12 Ų | 12 | 61.3 Ų | 61.3 | 6% | 0.063 | 33% | 0.329 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -60.8 | -34.9 | -179.1 | -79 | 173.8 | 0 | 0 | 0 | 113.4 | T1680 A1763 L1765 A1795 Q1797 V1816 | T1680-L1767 HydrophobicContact CG2-CD1 3.39Å; T1680-L1767 VanDerWaalsContact CG2-CD1 3.45Å; A1763-L1767 WeakPolarHBondContact O-CG 3.38Å; L1765-L1767 PolarHBondContact O-N 3.29Å; L1767-A1795 HydrophobicContact CD2-CB 3.62Å; L1767-Q1797 HydrophobicContact CD2-CG 4.42Å; L1767-Q1797 PolarHBondContact O-NE2 3.26Å; L1767-V1816 HydrophobicContact CD1-CG1 4.09Å; L1767-V1816 HydrophobicContact CD1-CG2 4.3Å; L1767-V1816 HydrophobicContact CD2-CG1 3.78Å |
| 1768 | D | 79.7 | Confident | 87.2 | Confident | 40.2 Ų | 40.2 | 60.6 Ų | 60.6 | 22% | 0.215 | 33% | 0.326 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -91.6 | -0.1 | -178.9 | -86 | -27.5 | 0 | 0 | 0 | 113.1 | L1766 K1790 | L1766-D1768 VanDerWaalsContact C-N 3.28Å; L1766-D1768 PolarHBondContact O-N 3.16Å; D1768-K1790 IonicContact OD1-NZ 3.01Å; D1768-K1790 PolarHBondContact OD1-NZ 3.02Å; D1768-K1790 IonicContact OD2-NZ 3.03Å |
| 1769 | E | 81.5 | Confident | 87 | Confident | 105.8 Ų | 105.8 | 60.8 Ų | 60.8 | 49% | 0.494 | 33% | 0.326 | S | S | . | . | S | Bend | trans | -86.9 | 135.3 | 177.1 | -65.7 | -171.1 | 173.3 | 0 | 0 | 111.3 | L1766 A1771 P1793 | L1766-E1769 VanDerWaalsContact CD2-OE2 3.27Å; L1766-E1769 WeakPolarHBondContact CD2-OE2 3.37Å; L1766-E1769 PolarHBondContact O-N 3Å; E1769-A1771 PolarHBondContact O-N 3.05Å; E1769-P1793 WeakPolarHBondContact O-CD 3.37Å |
| 1770 | D | 80.1 | Confident | 86.5 | Confident | 152 Ų | 152 | 58 Ų | 58 | 81% | 0.813 | 32% | 0.32 | S | S | * | . | S | Bend | trans | 52.2 | 24.4 | 177.2 | -61.9 | -26.8 | 0 | 0 | 0 | 116.7 | ||
| 1771 | A | 82.5 | Confident | 85.7 | Confident | 24.8 Ų | 24.8 | 60.6 Ų | 60.6 | 21% | 0.205 | 34% | 0.34 | C | S | . | . | trans | -81.1 | 123.9 | -178.2 | 0 | 0 | 0 | 0 | 0 | 113.1 | E1769 T1773 K1790 I1791 | E1769-A1771 PolarHBondContact O-N 3.05Å; A1771-T1773 PolarHBondContact O-N 3.27Å; A1771-K1790 HydrophobicContact CB-CB 4.15Å; A1771-I1791 CarbonylContact C-O 3.47Å; A1771-I1791 VanDerWaalsContact CA-O 3.31Å; A1771-I1791 WeakPolarHBondContact CA-O 3.33Å | ||
| 1772 | K | 89 | Confident | 84.7 | Confident | 124.2 Ų | 124.2 | 69.8 Ų | 69.8 | 54% | 0.54 | 38% | 0.381 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -71.7 | 126.9 | 168.8 | -71.9 | -175.3 | -178.9 | -179.7 | 0 | 109.7 | F1774 K1790 I1791 S1866 | K1772-F1774 HydrophobicContact CB-CE2 4.19Å; K1772-K1790 CarbonylContact O-C 3.56Å; K1772-K1790 WeakPolarHBondContact O-CA 3.4Å; K1772-I1791 HydrophobicContact CB-CB 4.43Å; K1772-I1791 PolarHBondContact N-O 3.17Å; K1772-I1791 PolarHBondContact O-N 3.04Å; K1772-S1866 PolarHBondContact NZ-OG 2.93Å |
| 1773 | T | 90.1 | Very high | 84.1 | Confident | 75.2 Ų | 75.2 | 74.6 Ų | 74.6 | 46% | 0.461 | 39% | 0.39 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -109.8 | 129.7 | -176.1 | 16.1 | 0 | 0 | 0 | 0 | 112 | A1771 F1788 L1789 K1790 | A1771-T1773 PolarHBondContact O-N 3.27Å; T1773-F1788 VanDerWaalsContact CB-CZ 3.47Å; T1773-F1788 HydrophobicContact CG2-CD1 4.45Å; T1773-F1788 HydrophobicContact CG2-CE1 3.98Å; T1773-F1788 HydrophobicContact CG2-CZ 3.69Å; T1773-L1789 CarbonylContact C-O 3.53Å; T1773-L1789 WeakPolarHBondContact CA-O 3.29Å; T1773-K1790 HydrophobicContact CG2-CD 4.34Å; T1773-K1790 HydrophobicContact CG2-CG 4.05Å |
| 1774 | F | 91 | Very high | 83.9 | Confident | 12.6 Ų | 12.6 | 76.1 Ų | 76.1 | 6% | 0.055 | 40% | 0.397 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -115.1 | 128.4 | 173.2 | -56.3 | -92.9 | 0 | 0 | 0 | 109.7 | K1772 V1777 F1788 L1789 I1791 E1859 Q1862 I1863 | K1772-F1774 HydrophobicContact CB-CE2 4.19Å; F1774-V1777 HydrophobicContact CB-CG2 3.99Å; F1774-F1788 WeakPolarHBondContact O-CA 3.29Å; F1774-L1789 HydrophobicContact CB-CB 4.22Å; F1774-L1789 HydrophobicContact CD2-CD2 4.37Å; F1774-L1789 PolarHBondContact N-O 3.11Å; F1774-L1789 PolarHBondContact O-N 3.05Å; F1774-I1791 HydrophobicContact CD2-CD1 4.14Å; F1774-I1791 HydrophobicContact CD2-CG1 4.25Å; F1774-I1791 HydrophobicContact CE2-CD1 3.66Å; F1774-I1791 HydrophobicContact CE2-CG1 4.01Å; F1774-E1859 WeakPolarHBondContact CD1-OE2 3.4Å; F1774-Q1862 HydrophobicContact CE1-CB 4.21Å; F1774-Q1862 HydrophobicContact CZ-CB 4.45Å; F1774-I1863 HydrophobicContact CB-CD1 4.26Å; F1774-I1863 HydrophobicContact CB-CG1 4.49Å; F1774-I1863 HydrophobicContact CD1-CD1 4.16Å; F1774-I1863 HydrophobicContact CD1-CG1 3.74Å; F1774-I1863 HydrophobicContact CD2-CD1 4.5Å; F1774-I1863 HydrophobicContact CD2-CG1 3.91Å; F1774-I1863 HydrophobicContact CE1-CG1 3.81Å; F1774-I1863 HydrophobicContact CE2-CG1 4.01Å; F1774-I1863 HydrophobicContact CG-CD1 4.06Å; F1774-I1863 HydrophobicContact CG-CG1 3.78Å; F1774-I1863 HydrophobicContact CZ-CG1 3.94Å |
| 1775 | N | 89.7 | Confident | 83.7 | Confident | 87.4 Ų | 87.4 | 77.4 Ų | 77.4 | 47% | 0.467 | 40% | 0.403 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -97.5 | 152.8 | -174.6 | -68.6 | -45.1 | 0 | 0 | 0 | 111.4 | V1777 F1788 H1857 | N1775-V1777 VanDerWaalsContact C-N 3.27Å; N1775-V1777 PolarHBondContact O-N 3.29Å; N1775-F1788 HydrophobicContact CB-CD1 4.18Å; N1775-F1788 HydrophobicContact CB-CD2 4.49Å; N1775-F1788 HydrophobicContact CB-CE1 4.06Å; N1775-F1788 WeakPolarHBondContact OD1-CD1 3.33Å; N1775-F1788 WeakPolarHBondContact OD1-CD2 3.3Å; N1775-F1788 WeakPolarHBondContact OD1-CE1 3.34Å; N1775-F1788 WeakPolarHBondContact OD1-CE2 3.42Å; N1775-H1857 PolarHBondContact O-CD2 3.3Å; N1775-H1857 VanDerWaalsContact O-CD2 3.27Å; N1775-H1857 PolarHBondContact O-NE2 3.07Å |
| 1776 | N | 86.7 | Confident | 83.8 | Confident | 109 Ų | 109 | 78.6 Ų | 78.6 | 58% | 0.583 | 41% | 0.405 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | 59.3 | 29.6 | 174.9 | -59.1 | -42.6 | 0 | 0 | 0 | 114.9 | V1778 C1787 | N1776-V1778 PolarHBondContact O-N 2.89Å; N1776-C1787 PolarHBondContact N-O 3.08Å |
| 1777 | V | 88.7 | Confident | 84.1 | Confident | 0.4 Ų | 0.4 | 74.7 Ų | 74.7 | 0% | 0.002 | 39% | 0.385 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -69.5 | 133.8 | 171 | -179.6 | 0 | 0 | 0 | 0 | 108.6 | F1774 N1775 K1786 C1787 L1789 L1855 H1857 I1863 | F1774-V1777 HydrophobicContact CB-CG2 3.99Å; N1775-V1777 VanDerWaalsContact C-N 3.27Å; N1775-V1777 PolarHBondContact O-N 3.29Å; V1777-K1786 CarbonylContact O-C 3.44Å; V1777-K1786 WeakPolarHBondContact O-CA 3.28Å; V1777-C1787 PolarHBondContact N-O 3.19Å; V1777-C1787 WeakPolarHBondContact O-CA 3.16Å; V1777-C1787 PolarHBondContact O-N 3.35Å; V1777-C1787 PolarHBondContact O-SG 3.49Å; V1777-L1789 HydrophobicContact CB-CB 4.41Å; V1777-L1789 HydrophobicContact CG2-CB 3.91Å; V1777-L1855 HydrophobicContact CG1-CB 3.92Å; V1777-L1855 HydrophobicContact CG1-CD1 4.43Å; V1777-L1855 HydrophobicContact CG1-CD2 4.1Å; V1777-L1855 HydrophobicContact CG1-CG 4.41Å; V1777-H1857 HydrophobicContact CG1-CB 4.5Å; V1777-H1857 HydrophobicContact CG2-CB 4.17Å; V1777-H1857 VanDerWaalsContact CG2-CD2 3.5Å; V1777-H1857 WeakPolarHBondContact CG2-CD2 3.48Å; V1777-I1863 HydrophobicContact CG2-CD1 4.32Å |
| 1778 | V | 88.7 | Confident | 84.3 | Confident | 35.2 Ų | 35.2 | 76.8 Ų | 76.8 | 21% | 0.213 | 39% | 0.394 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -102.1 | 115.9 | 176.5 | -178.1 | 0 | 0 | 0 | 0 | 109.2 | N1776 L1780 K1786 L1855 I1856 | N1776-V1778 PolarHBondContact O-N 2.89Å; V1778-L1780 PolarHBondContact O-N 2.87Å; V1778-K1786 HydrophobicContact CG2-CG 4.31Å; V1778-L1855 CarbonylContact O-C 3.48Å; V1778-L1855 WeakPolarHBondContact O-CA 3.39Å; V1778-I1856 HydrophobicContact CB-CB 4.25Å; V1778-I1856 PolarHBondContact N-O 3.02Å; V1778-I1856 PolarHBondContact O-N 3.11Å |
| 1779 | R | 86.6 | Confident | 84.9 | Confident | 38.6 Ų | 38.6 | 75 Ų | 75 | 15% | 0.146 | 38% | 0.384 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -80.8 | 118.4 | 169.3 | -180 | -179.2 | 174.6 | 176.9 | 4 | 109.1 | S1784 I1785 C1787 D1815 L1853 L1855 | R1779-S1784 WeakPolarHBondContact O-CA 3.35Å; R1779-I1785 PolarHBondContact N-O 3.3Å; R1779-I1785 PolarHBondContact O-N 3.29Å; R1779-C1787 VanDerWaalsContact CB-SG 3.58Å; R1779-C1787 PolarHBondContact N-SG 2.96Å; R1779-D1815 IonicContact CZ-OD2 3.47Å; R1779-D1815 IonicContact NH1-OD2 2.86Å; R1779-D1815 PolarHBondContact NH1-OD2 3.08Å; R1779-L1853 HydrophobicContact CG-CD1 3.89Å; R1779-L1853 HydrophobicContact CG-CD2 4.24Å; R1779-L1853 VanDerWaalsContact CZ-CD2 3.48Å; R1779-L1853 VanDerWaalsContact NE-CD1 3.32Å; R1779-L1853 VanDerWaalsContact NE-CD2 3.35Å; R1779-L1853 VanDerWaalsContact NH2-CD2 3.32Å; R1779-L1855 HydrophobicContact CB-CD2 4.02Å; R1779-L1855 HydrophobicContact CG-CD2 4.27Å |
| 1780 | L | 79.8 | Confident | 85.4 | Confident | 80.8 Ų | 80.8 | 72.1 Ų | 72.1 | 42% | 0.423 | 37% | 0.37 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -79.5 | 124.8 | 171.1 | -70.3 | 172.4 | 0 | 0 | 0 | 109.3 | V1778 S1854 I1856 | V1778-L1780 PolarHBondContact O-N 2.87Å; L1780-S1854 PolarHBondContact N-O 3.22Å; L1780-I1856 HydrophobicContact CD1-CD1 3.73Å; L1780-I1856 HydrophobicContact CD1-CG1 3.95Å; L1780-I1856 HydrophobicContact CD2-CD1 3.91Å; L1780-I1856 HydrophobicContact CG-CD1 3.84Å; L1780-I1856 HydrophobicContact CG-CG1 4.15Å |
| 1781 | S | 74.7 | Confident | 85.9 | Confident | 68.6 Ų | 68.6 | 65.2 Ų | 65.2 | 48% | 0.48 | 33% | 0.333 | S | S | . | . | S | Bend | trans | -146.5 | -158.9 | 169.3 | 75.4 | 0 | 0 | 0 | 0 | 107.4 | K1783 | S1781-K1783 PolarHBondContact O-N 3.08Å; S1781-K1783 VanDerWaalsContact O-N 3.13Å; S1781-K1783 PolarHBondContact OG-N 3.05Å; S1781-K1783 PolarHBondContact OG-O 3.25Å |
| 1782 | H | 69.7 | Low | 86.1 | Confident | 205.2 Ų | 205.2 | 64.3 Ų | 64.3 | 95% | 0.95 | 33% | 0.326 | S | S | * | . | S | Bend | trans | -56.2 | -26.5 | 168.6 | -73.8 | -70.1 | 0 | 0 | 0 | 113.4 | ||
| 1783 | K | 74.6 | Confident | 86 | Confident | 169.4 Ų | 169.4 | 61.9 Ų | 61.9 | 74% | 0.737 | 32% | 0.323 | S | S | * | . | S | Bend | trans | -129 | 129 | 167 | -73.4 | -174.7 | 176.6 | -176 | 0 | 108.9 | S1781 I1785 | S1781-K1783 PolarHBondContact O-N 3.08Å; S1781-K1783 VanDerWaalsContact O-N 3.13Å; S1781-K1783 PolarHBondContact OG-N 3.05Å; S1781-K1783 PolarHBondContact OG-O 3.25Å; K1783-I1785 PolarHBondContact O-N 3.04Å |
| 1784 | S | 81.3 | Confident | 85.8 | Confident | 82.2 Ų | 82.2 | 64.6 Ų | 64.6 | 58% | 0.575 | 33% | 0.332 | S | S | * | . | trans | -64.8 | 122.7 | 173.2 | 52 | 0 | 0 | 0 | 0 | 110.1 | R1779 | R1779-S1784 WeakPolarHBondContact O-CA 3.35Š| ||
| 1785 | I | 85 | Confident | 85.7 | Confident | 29.2 Ų | 29.2 | 64.1 Ų | 64.1 | 15% | 0.15 | 33% | 0.33 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -117 | 130.6 | -179.3 | -62.1 | 160.9 | 0 | 0 | 0 | 108.5 | R1779 K1783 C1787 | R1779-I1785 PolarHBondContact N-O 3.3Å; R1779-I1785 PolarHBondContact O-N 3.29Å; K1783-I1785 PolarHBondContact O-N 3.04Å; I1785-C1787 PolarHBondContact O-SG 2.9Å |
| 1786 | K | 90.3 | Very high | 85.8 | Confident | 112.6 Ų | 112.6 | 60 Ų | 60 | 49% | 0.49 | 31% | 0.309 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -77 | 135.6 | 171.6 | -68.4 | -175.9 | 178.2 | -178.3 | 0 | 110.1 | V1777 V1778 L1801 | V1777-K1786 CarbonylContact O-C 3.44Å; V1777-K1786 WeakPolarHBondContact O-CA 3.28Å; V1778-K1786 HydrophobicContact CG2-CG 4.31Å; K1786-L1801 HydrophobicContact CB-CB 4.17Å; K1786-L1801 HydrophobicContact CB-CD1 3.87Å; K1786-L1801 WeakPolarHBondContact O-CB 3.38Å; K1786-L1801 PolarHBondContact O-N 3.11Å |
| 1787 | C | 91 | Very high | 86.1 | Confident | 3.6 Ų | 3.6 | 55 Ų | 55 | 2% | 0.024 | 28% | 0.281 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -139.1 | 160.6 | -173.7 | -43.2 | 0 | 0 | 0 | 0 | 112.1 | N1776 V1777 R1779 I1785 I1798 V1799 L1801 | N1776-C1787 PolarHBondContact N-O 3.08Å; V1777-C1787 PolarHBondContact N-O 3.19Å; V1777-C1787 WeakPolarHBondContact O-CA 3.16Å; V1777-C1787 PolarHBondContact O-N 3.35Å; V1777-C1787 PolarHBondContact O-SG 3.49Å; R1779-C1787 VanDerWaalsContact CB-SG 3.58Å; R1779-C1787 PolarHBondContact N-SG 2.96Å; I1785-C1787 PolarHBondContact O-SG 2.9Å; C1787-I1798 HydrophobicContact CB-CG2 3.81Å; C1787-V1799 CarbonylContact C-O 3.52Å; C1787-V1799 WeakPolarHBondContact CA-O 3.38Å; C1787-V1799 WeakPolarHBondContact CB-O 3.43Å; C1787-L1801 WeakPolarHBondContact O-CD1 3.49Å |
| 1788 | F | 90.4 | Very high | 86.2 | Confident | 56.4 Ų | 56.4 | 55.1 Ų | 55.1 | 25% | 0.247 | 28% | 0.282 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -101.2 | 129.5 | 162.3 | -104.5 | -84.2 | 0 | 0 | 0 | 108.4 | T1773 F1774 N1775 K1790 V1799 L1801 | T1773-F1788 VanDerWaalsContact CB-CZ 3.47Å; T1773-F1788 HydrophobicContact CG2-CD1 4.45Å; T1773-F1788 HydrophobicContact CG2-CE1 3.98Å; T1773-F1788 HydrophobicContact CG2-CZ 3.69Å; F1774-F1788 WeakPolarHBondContact O-CA 3.29Å; N1775-F1788 HydrophobicContact CB-CD1 4.18Å; N1775-F1788 HydrophobicContact CB-CD2 4.49Å; N1775-F1788 HydrophobicContact CB-CE1 4.06Å; N1775-F1788 WeakPolarHBondContact OD1-CD1 3.33Å; N1775-F1788 WeakPolarHBondContact OD1-CD2 3.3Å; N1775-F1788 WeakPolarHBondContact OD1-CE1 3.34Å; N1775-F1788 WeakPolarHBondContact OD1-CE2 3.42Å; F1788-K1790 HydrophobicContact CD1-CD 4.49Å; F1788-K1790 HydrophobicContact CD1-CG 3.84Å; F1788-K1790 HydrophobicContact CE1-CD 4.1Å; F1788-K1790 HydrophobicContact CE1-CG 3.49Å; F1788-K1790 VanDerWaalsContact CE1-CG 3.47Å; F1788-V1799 HydrophobicContact CB-CB 4.29Å; F1788-V1799 PolarHBondContact N-O 3.02Å; F1788-V1799 PolarHBondContact O-N 3.29Å; F1788-L1801 HydrophobicContact CB-CD2 4.28Å; F1788-L1801 HydrophobicContact CB-CG 4.46Å; F1788-L1801 HydrophobicContact CD2-CD1 4.42Å; F1788-L1801 HydrophobicContact CD2-CD2 3.96Å; F1788-L1801 HydrophobicContact CD2-CG 3.89Å; F1788-L1801 HydrophobicContact CE1-CD2 4.21Å; F1788-L1801 HydrophobicContact CE2-CD1 4.27Å; F1788-L1801 HydrophobicContact CE2-CD2 3.21Å; F1788-L1801 HydrophobicContact CE2-CG 3.68Å; F1788-L1801 HydrophobicContact CG-CG 4.48Å; F1788-L1801 HydrophobicContact CZ-CD1 4.4Å; F1788-L1801 HydrophobicContact CZ-CD2 3.37Å; F1788-L1801 HydrophobicContact CZ-CG 4.11Å |
| 1789 | L | 91.6 | Very high | 86.4 | Confident | 1 Ų | 1 | 54.4 Ų | 54.4 | 1% | 0.005 | 28% | 0.278 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -102.8 | 121.2 | 176.7 | -166.6 | 74.1 | 0 | 0 | 0 | 108.9 | T1773 F1774 V1777 I1791 L1796 Q1797 I1798 L1855 I1863 | T1773-L1789 CarbonylContact C-O 3.53Å; T1773-L1789 WeakPolarHBondContact CA-O 3.29Å; F1774-L1789 HydrophobicContact CB-CB 4.22Å; F1774-L1789 HydrophobicContact CD2-CD2 4.37Å; F1774-L1789 PolarHBondContact N-O 3.11Å; F1774-L1789 PolarHBondContact O-N 3.05Å; V1777-L1789 HydrophobicContact CB-CB 4.41Å; V1777-L1789 HydrophobicContact CG2-CB 3.91Å; L1789-I1791 HydrophobicContact CD2-CD1 3.98Å; L1789-I1791 HydrophobicContact CD2-CG1 4.24Å; L1789-I1791 HydrophobicContact CG-CD1 4.38Å; L1789-I1791 HydrophobicContact CG-CG1 4.18Å; L1789-L1796 HydrophobicContact CD1-CD1 3.68Å; L1789-L1796 HydrophobicContact CD1-CD2 4.48Å; L1789-L1796 HydrophobicContact CD1-CG 4.18Å; L1789-L1796 HydrophobicContact CD2-CD1 4.34Å; L1789-L1796 HydrophobicContact CG-CD1 3.96Å; L1789-Q1797 CarbonylContact C-O 3.44Å; L1789-Q1797 WeakPolarHBondContact CA-O 3.39Å; L1789-I1798 HydrophobicContact CD1-CB 4.47Å; L1789-I1798 HydrophobicContact CD1-CD1 4.43Å; L1789-I1798 HydrophobicContact CD1-CG1 3.73Å; L1789-L1855 HydrophobicContact CD1-CD1 4.2Å; L1789-L1855 HydrophobicContact CD2-CD1 4.27Å; L1789-I1863 HydrophobicContact CD2-CB 4.46Å; L1789-I1863 HydrophobicContact CD2-CD1 4.02Å; L1789-I1863 HydrophobicContact CD2-CG1 4.14Å; L1789-I1863 HydrophobicContact CD2-CG2 3.51Å; L1789-I1863 VanDerWaalsContact CD2-CG2 3.48Å |
| 1790 | K | 91.7 | Very high | 86.6 | Confident | 45.6 Ų | 45.6 | 52.9 Ų | 52.9 | 20% | 0.198 | 27% | 0.273 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -111 | 126.5 | 171.1 | -53.8 | 178.8 | 172.3 | 174.2 | 0 | 109.7 | D1768 A1771 K1772 T1773 F1788 Q1797 | D1768-K1790 IonicContact OD1-NZ 3.01Å; D1768-K1790 PolarHBondContact OD1-NZ 3.02Å; D1768-K1790 IonicContact OD2-NZ 3.03Å; A1771-K1790 HydrophobicContact CB-CB 4.15Å; K1772-K1790 CarbonylContact O-C 3.56Å; K1772-K1790 WeakPolarHBondContact O-CA 3.4Å; T1773-K1790 HydrophobicContact CG2-CD 4.34Å; T1773-K1790 HydrophobicContact CG2-CG 4.05Å; F1788-K1790 HydrophobicContact CD1-CD 4.49Å; F1788-K1790 HydrophobicContact CD1-CG 3.84Å; F1788-K1790 HydrophobicContact CE1-CD 4.1Å; F1788-K1790 HydrophobicContact CE1-CG 3.49Å; F1788-K1790 VanDerWaalsContact CE1-CG 3.47Å; K1790-Q1797 HydrophobicContact CB-CB 4.13Å; K1790-Q1797 PolarHBondContact N-O 3.18Å; K1790-Q1797 PolarHBondContact O-N 3.21Å |
| 1791 | I | 90.4 | Very high | 87 | Confident | 7.8 Ų | 7.8 | 52.1 Ų | 52.1 | 4% | 0.04 | 27% | 0.269 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -113.1 | 95.7 | -179.3 | -58 | -171.4 | 0 | 0 | 0 | 107.6 | A1771 K1772 F1774 L1789 L1796 I1863 V1867 I1870 | A1771-I1791 CarbonylContact C-O 3.47Å; A1771-I1791 VanDerWaalsContact CA-O 3.31Å; A1771-I1791 WeakPolarHBondContact CA-O 3.33Å; K1772-I1791 HydrophobicContact CB-CB 4.43Å; K1772-I1791 PolarHBondContact N-O 3.17Å; K1772-I1791 PolarHBondContact O-N 3.04Å; F1774-I1791 HydrophobicContact CD2-CD1 4.14Å; F1774-I1791 HydrophobicContact CD2-CG1 4.25Å; F1774-I1791 HydrophobicContact CE2-CD1 3.66Å; F1774-I1791 HydrophobicContact CE2-CG1 4.01Å; L1789-I1791 HydrophobicContact CD2-CD1 3.98Å; L1789-I1791 HydrophobicContact CD2-CG1 4.24Å; L1789-I1791 HydrophobicContact CG-CD1 4.38Å; L1789-I1791 HydrophobicContact CG-CG1 4.18Å; I1791-L1796 HydrophobicContact CD1-CD1 4.28Å; I1791-L1796 HydrophobicContact CG1-CD1 3.72Å; I1791-I1863 HydrophobicContact CD1-CG2 4.16Å; I1791-V1867 HydrophobicContact CD1-CG2 3.95Å; I1791-I1870 HydrophobicContact CB-CD1 4.45Å; I1791-I1870 HydrophobicContact CG2-CD1 3.18Å; I1791-I1870 HydrophobicContact CG2-CG1 4.19Å |
| 1792 | G | 88.1 | Confident | 87.6 | Confident | 5.8 Ų | 5.8 | 53.8 Ų | 53.8 | 6% | 0.06 | 27% | 0.27 | C | S | . | . | trans | -89.4 | 176.4 | 177.7 | 0 | 0 | 0 | 0 | 0 | 112.6 | M1794 A1795 I1870 | G1792-M1794 VanDerWaalsContact C-N 3.26Å; G1792-M1794 PolarHBondContact O-N 2.97Å; G1792-A1795 PolarHBondContact N-O 3.04Å; G1792-I1870 WeakPolarHBondContact O-CD1 3.42Å; G1792-I1870 WeakPolarHBondContact O-CG1 3.38Å; G1792-I1870 WeakPolarHBondContact O-CG2 3.38Å | ||
| 1793 | P | 86.1 | Confident | 88.6 | Confident | 73.8 Ų | 73.8 | 49.2 Ų | 49.2 | 48% | 0.479 | 25% | 0.246 | S | C | . | . | S | Bend | trans | -68.1 | -20.9 | -177.8 | 25.9 | -33.7 | 0 | 0 | 0 | 114.2 | E1769 I1870 | E1769-P1793 WeakPolarHBondContact O-CD 3.37Å; P1793-I1870 VanDerWaalsContact C-CG2 3.46Å; P1793-I1870 WeakPolarHBondContact O-CG2 3.35Å |
| 1794 | M | 85.4 | Confident | 89.3 | Confident | 131.4 Ų | 131.4 | 42.6 Ų | 42.6 | 65% | 0.647 | 22% | 0.218 | S | C | * | . | S | Bend | trans | -121.7 | -17.1 | -175.1 | -59.7 | -119.7 | 117.7 | 0 | 0 | 114.1 | G1792 A1819 | G1792-M1794 VanDerWaalsContact C-N 3.26Å; G1792-M1794 PolarHBondContact O-N 2.97Å; M1794-A1819 PolarHBondContact O-N 3.14Å |
| 1795 | A | 90.1 | Very high | 89.8 | Confident | 2.4 Ų | 2.4 | 46 Ų | 46 | 2% | 0.02 | 22% | 0.223 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -153.6 | 152.5 | -170.8 | 0 | 0 | 0 | 0 | 0 | 113.1 | L1767 G1792 V1816 Y1817 Y1818 | L1767-A1795 HydrophobicContact CD2-CB 3.62Å; G1792-A1795 PolarHBondContact N-O 3.04Å; A1795-V1816 HydrophobicContact CB-CG1 4.12Å; A1795-Y1817 CarbonylContact C-O 3.49Å; A1795-Y1817 VanDerWaalsContact CA-O 3.26Å; A1795-Y1817 WeakPolarHBondContact CA-O 3.19Å; A1795-Y1817 WeakPolarHBondContact CB-O 3.36Å; A1795-Y1818 HydrophobicContact CB-CD1 3.94Å; A1795-Y1818 HydrophobicContact CB-CE1 4.35Å |
| 1796 | L | 90.7 | Very high | 90.1 | Very high | 2 Ų | 2 | 44.8 Ų | 44.8 | 1% | 0.01 | 22% | 0.217 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -96.5 | 129.1 | 169 | 179.3 | 66.4 | 0 | 0 | 0 | 109.1 | L1789 I1791 Y1817 V1867 | L1789-L1796 HydrophobicContact CD1-CD1 3.68Å; L1789-L1796 HydrophobicContact CD1-CD2 4.48Å; L1789-L1796 HydrophobicContact CD1-CG 4.18Å; L1789-L1796 HydrophobicContact CD2-CD1 4.34Å; L1789-L1796 HydrophobicContact CG-CD1 3.96Å; I1791-L1796 HydrophobicContact CD1-CD1 4.28Å; I1791-L1796 HydrophobicContact CG1-CD1 3.72Å; L1796-Y1817 HydrophobicContact CD2-CD2 4.46Å; L1796-Y1817 PolarHBondContact N-O 3.15Å; L1796-Y1817 PolarHBondContact O-N 3.37Å; L1796-V1867 HydrophobicContact CD1-CG2 4.34Å |
| 1797 | Q | 92.4 | Very high | 90.1 | Very high | 2.2 Ų | 2.2 | 40.4 Ų | 40.4 | 1% | 0.01 | 20% | 0.199 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -118.3 | 131.9 | 174.8 | -54.4 | 178.1 | 63 | 0 | 0 | 111 | L1767 L1789 K1790 N1814 D1815 V1816 | L1767-Q1797 HydrophobicContact CD2-CG 4.42Å; L1767-Q1797 PolarHBondContact O-NE2 3.26Å; L1789-Q1797 CarbonylContact C-O 3.44Å; L1789-Q1797 WeakPolarHBondContact CA-O 3.39Å; K1790-Q1797 HydrophobicContact CB-CB 4.13Å; K1790-Q1797 PolarHBondContact N-O 3.18Å; K1790-Q1797 PolarHBondContact O-N 3.21Å; Q1797-N1814 PolarHBondContact OE1-ND2 3Å; Q1797-N1814 VanDerWaalsContact OE1-ND2 3.08Å; Q1797-D1815 CarbonylContact C-O 3.57Å; Q1797-D1815 VanDerWaalsContact CA-O 3.3Å; Q1797-D1815 WeakPolarHBondContact CA-O 3.3Å; Q1797-V1816 HydrophobicContact CG-CG1 4.36Å; Q1797-V1816 HydrophobicContact CG-CG2 4.17Å |
| 1798 | I | 91.7 | Very high | 89.9 | Confident | 3.4 Ų | 3.4 | 41.9 Ų | 41.9 | 2% | 0.017 | 22% | 0.215 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -115.3 | 104 | 175 | -50.3 | -178 | 0 | 0 | 0 | 108 | C1787 L1789 D1815 Y1817 L1853 L1855 | C1787-I1798 HydrophobicContact CB-CG2 3.81Å; L1789-I1798 HydrophobicContact CD1-CB 4.47Å; L1789-I1798 HydrophobicContact CD1-CD1 4.43Å; L1789-I1798 HydrophobicContact CD1-CG1 3.73Å; I1798-D1815 HydrophobicContact CB-CB 4.3Å; I1798-D1815 PolarHBondContact N-O 3.18Å; I1798-D1815 PolarHBondContact O-N 3.16Å; I1798-Y1817 HydrophobicContact CD1-CD2 4.42Å; I1798-Y1817 HydrophobicContact CD1-CE2 3.92Å; I1798-Y1817 HydrophobicContact CG1-CE2 4.35Å; I1798-L1853 HydrophobicContact CD1-CD1 4.04Å; I1798-L1853 HydrophobicContact CD1-CD2 3.8Å; I1798-L1853 HydrophobicContact CD1-CG 4.15Å; I1798-L1855 HydrophobicContact CD1-CD2 4.4Å |
| 1799 | V | 92.2 | Very high | 90 | Very high | 19.8 Ų | 19.8 | 41.6 Ų | 41.6 | 12% | 0.12 | 21% | 0.214 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -99.9 | 123.9 | -178.9 | -173.9 | 0 | 0 | 0 | 0 | 109.9 | C1787 F1788 L1801 L1813 N1814 | C1787-V1799 CarbonylContact C-O 3.52Å; C1787-V1799 WeakPolarHBondContact CA-O 3.38Å; C1787-V1799 WeakPolarHBondContact CB-O 3.43Å; F1788-V1799 HydrophobicContact CB-CB 4.29Å; F1788-V1799 PolarHBondContact N-O 3.02Å; F1788-V1799 PolarHBondContact O-N 3.29Å; V1799-L1801 PolarHBondContact O-N 3.08Å; V1799-L1813 CarbonylContact C-O 3.55Å; V1799-L1813 VanDerWaalsContact CA-O 3.25Å; V1799-L1813 WeakPolarHBondContact CA-O 3.25Å; V1799-N1814 HydrophobicContact CG2-CB 4.31Å; V1799-N1814 WeakPolarHBondContact CG2-OD1 3.33Å |
| 1800 | S | 91.7 | Very high | 90 | Very high | 7.6 Ų | 7.6 | 46.8 Ų | 46.8 | 5% | 0.053 | 24% | 0.241 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -68.5 | 131.9 | 177.3 | 74 | 0 | 0 | 0 | 0 | 111.4 | E1802 L1813 | S1800-E1802 PolarHBondContact OG-O 3.15Å; S1800-E1802 VanDerWaalsContact OG-O 3.05Å; S1800-L1813 PolarHBondContact N-O 3.07Å; S1800-L1813 PolarHBondContact OG-N 3.18Å |
| 1801 | L | 88.4 | Confident | 90.1 | Very high | 63.2 Ų | 63.2 | 44.8 Ų | 44.8 | 33% | 0.331 | 23% | 0.233 | S | C | . | . | S | Bend | trans | -74.5 | -36 | 171.9 | -85.8 | 157.1 | 0 | 0 | 0 | 111.5 | K1786 C1787 F1788 V1799 | K1786-L1801 HydrophobicContact CB-CB 4.17Å; K1786-L1801 HydrophobicContact CB-CD1 3.87Å; K1786-L1801 WeakPolarHBondContact O-CB 3.38Å; K1786-L1801 PolarHBondContact O-N 3.11Å; C1787-L1801 WeakPolarHBondContact O-CD1 3.49Å; F1788-L1801 HydrophobicContact CB-CD2 4.28Å; F1788-L1801 HydrophobicContact CB-CG 4.46Å; F1788-L1801 HydrophobicContact CD2-CD1 4.42Å; F1788-L1801 HydrophobicContact CD2-CD2 3.96Å; F1788-L1801 HydrophobicContact CD2-CG 3.89Å; F1788-L1801 HydrophobicContact CE1-CD2 4.21Å; F1788-L1801 HydrophobicContact CE2-CD1 4.27Å; F1788-L1801 HydrophobicContact CE2-CD2 3.21Å; F1788-L1801 HydrophobicContact CE2-CG 3.68Å; F1788-L1801 HydrophobicContact CG-CG 4.48Å; F1788-L1801 HydrophobicContact CZ-CD1 4.4Å; F1788-L1801 HydrophobicContact CZ-CD2 3.37Å; F1788-L1801 HydrophobicContact CZ-CG 4.11Å; V1799-L1801 PolarHBondContact O-N 3.08Å |
| 1802 | E | 87.6 | Confident | 90.1 | Very high | 106.2 Ų | 106.2 | 46.4 Ų | 46.4 | 50% | 0.496 | 24% | 0.241 | S | C | . | . | S | Bend | trans | -86.3 | 126.7 | 177.3 | -68.2 | -178.5 | -176 | 0 | 0 | 110.7 | S1800 Q1804 | S1800-E1802 PolarHBondContact OG-O 3.15Å; S1800-E1802 VanDerWaalsContact OG-O 3.05Å; E1802-Q1804 WeakPolarHBondContact O-CG 3.36Å; E1802-Q1804 PolarHBondContact O-N 3.33Å |
| 1803 | K | 89.8 | Confident | 90.4 | Very high | 107 Ų | 107 | 46.3 Ų | 46.3 | 47% | 0.465 | 24% | 0.239 | S | C | . | . | trans | -67.7 | 131.1 | 174.3 | -74.8 | -175.3 | 176.8 | -149.6 | 0 | 110.9 | D1744 L1810 V1811 N1812 | D1744-K1803 IonicContact OD1-NZ 3.42Å; D1744-K1803 IonicContact OD2-NZ 3.39Å; K1803-L1810 HydrophobicContact CB-CB 4Å; K1803-L1810 HydrophobicContact CB-CD2 4.38Å; K1803-L1810 HydrophobicContact CD-CB 4.22Å; K1803-V1811 WeakPolarHBondContact CA-O 3.39Å; K1803-N1812 VanDerWaalsContact CE-OD1 3.28Å; K1803-N1812 WeakPolarHBondContact CE-OD1 3.39Å; K1803-N1812 WeakPolarHBondContact CG-OD1 3.4Å | ||
| 1804 | Q | 90 | Very high | 90.7 | Very high | 31.6 Ų | 31.6 | 43.4 Ų | 43.4 | 15% | 0.148 | 22% | 0.22 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -113.8 | 155 | 179.2 | -60.4 | -173.1 | 3.6 | 0 | 0 | 111.4 | E1802 V1806 L1810 V1811 L1813 | E1802-Q1804 WeakPolarHBondContact O-CG 3.36Å; E1802-Q1804 PolarHBondContact O-N 3.33Å; Q1804-V1806 PolarHBondContact O-N 3.01Å; Q1804-L1810 WeakPolarHBondContact O-CA 3.43Å; Q1804-V1811 PolarHBondContact N-O 2.96Å; Q1804-V1811 PolarHBondContact O-N 3.02Å; Q1804-L1813 HydrophobicContact CB-CD1 4.34Å; Q1804-L1813 HydrophobicContact CB-CG 4.49Å; Q1804-L1813 HydrophobicContact CG-CD1 4.42Å; Q1804-L1813 VanDerWaalsContact OE1-CD1 3.25Å |
| 1805 | K | 91.4 | Very high | 91 | Very high | 154.4 Ų | 154.4 | 37.6 Ų | 37.6 | 67% | 0.671 | 19% | 0.192 | S | C | * | . | E | Extended strand (participates in β ladder) | trans | -81.7 | 112.6 | -176.9 | -120.1 | 177.3 | -176.9 | 176.3 | 0 | 110.9 | G1808 H1809 L1810 | K1805-G1808 WeakPolarHBondContact CE-O 3.48Å; K1805-H1809 CarbonylContact C-O 3.53Å; K1805-H1809 VanDerWaalsContact CA-O 3.28Å; K1805-H1809 WeakPolarHBondContact CA-O 3.31Å; K1805-L1810 HydrophobicContact CB-CD2 4.46Å; K1805-L1810 HydrophobicContact CG-CD2 3.69Å |
| 1806 | V | 91.5 | Very high | 91.1 | Very high | 2.4 Ų | 2.4 | 37.9 Ų | 37.9 | 2% | 0.015 | 19% | 0.193 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -121.2 | 123.6 | 172.3 | -174.3 | 0 | 0 | 0 | 0 | 108.2 | R1721 F1742 Q1804 G1808 H1809 V1811 L1813 | R1721-V1806 HydrophobicContact CB-CG2 4.09Å; R1721-V1806 HydrophobicContact CG-CG2 4.05Å; F1742-V1806 HydrophobicContact CE1-CB 4.28Å; F1742-V1806 HydrophobicContact CE1-CG1 3.93Å; F1742-V1806 HydrophobicContact CZ-CB 4.28Å; F1742-V1806 HydrophobicContact CZ-CG1 3.96Å; Q1804-V1806 PolarHBondContact O-N 3.01Å; V1806-G1808 PolarHBondContact O-N 3.22Å; V1806-H1809 PolarHBondContact N-O 3.03Å; V1806-H1809 PolarHBondContact O-N 3.07Å; V1806-V1811 HydrophobicContact CB-CG2 4.19Å; V1806-V1811 HydrophobicContact CG2-CB 4.3Å; V1806-V1811 HydrophobicContact CG2-CG2 4.42Å; V1806-L1813 HydrophobicContact CG2-CD2 3.89Å |
| 1807 | L | 89.7 | Confident | 91.1 | Very high | 21.6 Ų | 21.6 | 38.7 Ų | 38.7 | 11% | 0.113 | 20% | 0.196 | C | C | . | . | T | Hydrogen-bonded Turn | trans | 47.7 | 32.7 | -175.8 | -60.8 | 179.2 | 0 | 0 | 0 | 114 | T1724 F1731 K1735 G1736 L1740 F1742 H1809 | T1724-L1807 HydrophobicContact CG2-CD2 4.19Å; T1724-L1807 HydrophobicContact CG2-CG 4.35Å; F1731-L1807 HydrophobicContact CB-CD2 3.6Å; F1731-L1807 HydrophobicContact CD1-CD2 4.46Å; F1731-L1807 HydrophobicContact CG-CD2 4.09Å; K1735-L1807 CarbonylContact C-O 3.56Å; K1735-L1807 VanDerWaalsContact CA-O 3.31Å; K1735-L1807 WeakPolarHBondContact CA-O 3.31Å; G1736-L1807 PolarHBondContact N-O 2.97Å; L1740-L1807 HydrophobicContact CD1-CD1 4.05Å; F1742-L1807 HydrophobicContact CZ-CB 4.44Å; F1742-L1807 HydrophobicContact CZ-CD1 4.41Å; L1807-H1809 VanDerWaalsContact C-N 3.33Å; L1807-H1809 PolarHBondContact O-CD2 2.84Å; L1807-H1809 PolarHBondContact O-N 3.02Å |
| 1808 | G | 87.8 | Confident | 90.9 | Very high | 35 Ų | 35 | 40.9 Ų | 40.9 | 36% | 0.361 | 20% | 0.204 | S | C | . | . | T | Hydrogen-bonded Turn | trans | 87.6 | -13.5 | -178.6 | 0 | 0 | 0 | 0 | 0 | 115.9 | K1805 V1806 | K1805-G1808 WeakPolarHBondContact CE-O 3.48Å; V1806-G1808 PolarHBondContact O-N 3.22Å |
| 1809 | H | 91.3 | Very high | 90.6 | Very high | 49.4 Ų | 49.4 | 40.9 Ų | 40.9 | 23% | 0.229 | 21% | 0.205 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -92.6 | 150.7 | 178.3 | -65.1 | -84.4 | 0 | 0 | 0 | 111.7 | N1737 F1742 K1805 V1806 L1807 V1811 | N1737-H1809 PolarHBondContact O-CE1 3.17Å; N1737-H1809 PolarHBondContact O-NE2 3.29Å; F1742-H1809 HydrophobicContact CD2-CB 3.88Å; F1742-H1809 HydrophobicContact CE2-CB 3.9Å; F1742-H1809 AromaticContact CE2-CD2 3.77Å; F1742-H1809 AromaticContact CE2-CG 3.99Å; K1805-H1809 CarbonylContact C-O 3.53Å; K1805-H1809 VanDerWaalsContact CA-O 3.28Å; K1805-H1809 WeakPolarHBondContact CA-O 3.31Å; V1806-H1809 PolarHBondContact N-O 3.03Å; V1806-H1809 PolarHBondContact O-N 3.07Å; L1807-H1809 VanDerWaalsContact C-N 3.33Å; L1807-H1809 PolarHBondContact O-CD2 2.84Å; L1807-H1809 PolarHBondContact O-N 3.02Å; H1809-V1811 HydrophobicContact CB-CG2 4.14Å |
| 1810 | L | 92.6 | Very high | 90.1 | Very high | 110.8 Ų | 110.8 | 42.2 Ų | 42.2 | 58% | 0.58 | 22% | 0.215 | S | C | * | . | E | Extended strand (participates in β ladder) | trans | -91.7 | 113 | 176.5 | -75.8 | 175.7 | 0 | 0 | 0 | 110.2 | K1803 Q1804 K1805 | K1803-L1810 HydrophobicContact CB-CB 4Å; K1803-L1810 HydrophobicContact CB-CD2 4.38Å; K1803-L1810 HydrophobicContact CD-CB 4.22Å; Q1804-L1810 WeakPolarHBondContact O-CA 3.43Å; K1805-L1810 HydrophobicContact CB-CD2 4.46Å; K1805-L1810 HydrophobicContact CG-CD2 3.69Å |
| 1811 | V | 92.5 | Very high | 89.6 | Confident | 3.6 Ų | 3.6 | 43.1 Ų | 43.1 | 2% | 0.022 | 22% | 0.218 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -129.8 | 140.7 | -166.6 | -173.2 | 0 | 0 | 0 | 0 | 110.7 | C1716 F1742 K1803 Q1804 V1806 H1809 | C1716-V1811 HydrophobicContact CB-CG1 4.21Å; F1742-V1811 HydrophobicContact CB-CB 4.4Å; F1742-V1811 HydrophobicContact CB-CG1 3.86Å; F1742-V1811 HydrophobicContact CB-CG2 3.67Å; F1742-V1811 HydrophobicContact CD1-CB 4.33Å; F1742-V1811 HydrophobicContact CD1-CG1 3.78Å; F1742-V1811 HydrophobicContact CD1-CG2 3.6Å; F1742-V1811 HydrophobicContact CD2-CG2 3.78Å; F1742-V1811 HydrophobicContact CE1-CG2 4.1Å; F1742-V1811 HydrophobicContact CE2-CG2 4.27Å; F1742-V1811 HydrophobicContact CG-CB 4.41Å; F1742-V1811 HydrophobicContact CG-CG1 4.06Å; F1742-V1811 HydrophobicContact CG-CG2 3.4Å; F1742-V1811 VanDerWaalsContact CG-CG2 3.42Å; F1742-V1811 HydrophobicContact CZ-CG2 4.4Å; K1803-V1811 WeakPolarHBondContact CA-O 3.39Å; Q1804-V1811 PolarHBondContact N-O 2.96Å; Q1804-V1811 PolarHBondContact O-N 3.02Å; V1806-V1811 HydrophobicContact CB-CG2 4.19Å; V1806-V1811 HydrophobicContact CG2-CB 4.3Å; V1806-V1811 HydrophobicContact CG2-CG2 4.42Å; H1809-V1811 HydrophobicContact CB-CG2 4.14Å |
| 1812 | N | 91.7 | Very high | 89.2 | Confident | 41.2 Ų | 41.2 | 40.4 Ų | 40.4 | 22% | 0.22 | 20% | 0.204 | C | C | . | . | trans | -79.4 | 125.6 | 166 | -70.5 | -4.7 | 0 | 0 | 0 | 108.8 | K1803 | K1803-N1812 VanDerWaalsContact CE-OD1 3.28Å; K1803-N1812 WeakPolarHBondContact CE-OD1 3.39Å; K1803-N1812 WeakPolarHBondContact CG-OD1 3.4Å | ||
| 1813 | L | 93.1 | Very high | 88.1 | Confident | 2.6 Ų | 2.6 | 37.2 Ų | 37.2 | 1% | 0.014 | 19% | 0.191 | C | C | . | . | trans | -85.1 | 138 | 177.7 | -57.5 | 180 | 0 | 0 | 0 | 110.1 | C1716 R1721 V1799 S1800 Q1804 V1806 | C1716-L1813 CarbonylContact O-C 3.56Å; C1716-L1813 VanDerWaalsContact O-CA 3.26Å; C1716-L1813 WeakPolarHBondContact O-CA 3.37Å; R1721-L1813 HydrophobicContact CB-CD1 4.49Å; R1721-L1813 HydrophobicContact CB-CD2 4.46Å; V1799-L1813 CarbonylContact C-O 3.55Å; V1799-L1813 VanDerWaalsContact CA-O 3.25Å; V1799-L1813 WeakPolarHBondContact CA-O 3.25Å; S1800-L1813 PolarHBondContact N-O 3.07Å; S1800-L1813 PolarHBondContact OG-N 3.18Å; Q1804-L1813 HydrophobicContact CB-CD1 4.34Å; Q1804-L1813 HydrophobicContact CB-CG 4.49Å; Q1804-L1813 HydrophobicContact CG-CD1 4.42Å; Q1804-L1813 VanDerWaalsContact OE1-CD1 3.25Å; V1806-L1813 HydrophobicContact CG2-CD2 3.89Å | ||
| 1814 | N | 93.3 | Very high | 86.1 | Confident | 12.8 Ų | 12.8 | 36.2 Ų | 36.2 | 7% | 0.068 | 19% | 0.188 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -121 | 99.7 | 174.6 | -175.1 | 14.6 | 0 | 0 | 0 | 109.8 | N1715 C1716 N1717 Q1797 V1799 | N1715-N1814 PolarHBondContact OD1-ND2 3.21Å; N1715-N1814 VanDerWaalsContact OD1-ND2 3.15Å; C1716-N1814 PolarHBondContact O-N 3.39Å; N1717-N1814 VanDerWaalsContact CB-O 3.23Å; N1717-N1814 WeakPolarHBondContact CB-O 3.23Å; Q1797-N1814 PolarHBondContact OE1-ND2 3Å; Q1797-N1814 VanDerWaalsContact OE1-ND2 3.08Å; V1799-N1814 HydrophobicContact CG2-CB 4.31Å; V1799-N1814 WeakPolarHBondContact CG2-OD1 3.33Å |
| 1815 | D | 91.5 | Very high | 83.7 | Confident | 10.8 Ų | 10.8 | 36.8 Ų | 36.8 | 6% | 0.058 | 20% | 0.198 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -84.1 | 119.1 | 173.7 | -64.7 | -32.9 | 0 | 0 | 0 | 109.2 | N1717 S1718 R1779 Q1797 I1798 Y1817 | N1717-D1815 WeakPolarHBondContact CB-OD1 3.21Å; S1718-D1815 WeakPolarHBondContact CB-OD1 3.23Å; S1718-D1815 WeakPolarHBondContact CB-OD2 3.28Å; S1718-D1815 PolarHBondContact N-OD1 2.84Å; S1718-D1815 VanDerWaalsContact OG-CG 3.3Å; S1718-D1815 PolarHBondContact OG-OD1 3.18Å; S1718-D1815 VanDerWaalsContact OG-OD1 3.08Å; S1718-D1815 PolarHBondContact OG-OD2 3.14Å; R1779-D1815 IonicContact CZ-OD2 3.47Å; R1779-D1815 IonicContact NH1-OD2 2.86Å; R1779-D1815 PolarHBondContact NH1-OD2 3.08Å; Q1797-D1815 CarbonylContact C-O 3.57Å; Q1797-D1815 VanDerWaalsContact CA-O 3.3Å; Q1797-D1815 WeakPolarHBondContact CA-O 3.3Å; I1798-D1815 HydrophobicContact CB-CB 4.3Å; I1798-D1815 PolarHBondContact N-O 3.18Å; I1798-D1815 PolarHBondContact O-N 3.16Å; D1815-Y1817 HydrophobicContact CB-CE2 3.86Å |
| 1816 | V | 91.9 | Very high | 81.1 | Confident | 8 Ų | 8 | 31.4 Ų | 31.4 | 5% | 0.048 | 18% | 0.179 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -111.1 | 129.4 | -178.4 | -175.6 | 0 | 0 | 0 | 0 | 108.7 | H1681 L1767 A1795 Q1797 | H1681-V1816 PolarHBondContact CD2-O 3.26Å; H1681-V1816 VanDerWaalsContact CD2-O 3.29Å; L1767-V1816 HydrophobicContact CD1-CG1 4.09Å; L1767-V1816 HydrophobicContact CD1-CG2 4.3Å; L1767-V1816 HydrophobicContact CD2-CG1 3.78Å; A1795-V1816 HydrophobicContact CB-CG1 4.12Å; Q1797-V1816 HydrophobicContact CG-CG1 4.36Å; Q1797-V1816 HydrophobicContact CG-CG2 4.17Å |
| 1817 | Y | 90.2 | Very high | 78.3 | Confident | 18.2 Ų | 18.2 | 39.4 Ų | 39.4 | 7% | 0.071 | 22% | 0.217 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -127.1 | 125.2 | 177.9 | -56.7 | -76.1 | 0 | 0 | 0 | 109.7 | A1795 L1796 I1798 D1815 I1846 E1849 L1853 | A1795-Y1817 CarbonylContact C-O 3.49Å; A1795-Y1817 VanDerWaalsContact CA-O 3.26Å; A1795-Y1817 WeakPolarHBondContact CA-O 3.19Å; A1795-Y1817 WeakPolarHBondContact CB-O 3.36Å; L1796-Y1817 HydrophobicContact CD2-CD2 4.46Å; L1796-Y1817 PolarHBondContact N-O 3.15Å; L1796-Y1817 PolarHBondContact O-N 3.37Å; I1798-Y1817 HydrophobicContact CD1-CD2 4.42Å; I1798-Y1817 HydrophobicContact CD1-CE2 3.92Å; I1798-Y1817 HydrophobicContact CG1-CE2 4.35Å; D1815-Y1817 HydrophobicContact CB-CE2 3.86Å; Y1817-I1846 HydrophobicContact CD1-CD1 3.45Å; Y1817-I1846 VanDerWaalsContact CD1-CD1 3.41Å; Y1817-I1846 HydrophobicContact CD1-CG1 4.5Å; Y1817-I1846 HydrophobicContact CD1-CG2 3.69Å; Y1817-I1846 HydrophobicContact CD2-CD1 3.58Å; Y1817-I1846 VanDerWaalsContact CD2-CD1 3.47Å; Y1817-I1846 HydrophobicContact CE1-CD1 3.66Å; Y1817-I1846 HydrophobicContact CE1-CG2 4.06Å; Y1817-I1846 HydrophobicContact CE2-CD1 3.8Å; Y1817-I1846 HydrophobicContact CG-CD1 3.39Å; Y1817-I1846 HydrophobicContact CG-CG2 4.42Å; Y1817-E1849 HydrophobicContact CE1-CG 4.35Å; Y1817-E1849 PolarHBondContact OH-OE1 3.12Å; Y1817-L1853 HydrophobicContact CD2-CD1 4.35Å; Y1817-L1853 HydrophobicContact CE1-CD1 4.49Å; Y1817-L1853 HydrophobicContact CE2-CD1 3.78Å; Y1817-L1853 WeakPolarHBondContact OH-CD1 3.35Å |
| 1818 | Y | 89.3 | Confident | 75.6 | Confident | 48.8 Ų | 48.8 | 42.1 Ų | 42.1 | 19% | 0.191 | 23% | 0.234 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -78.6 | 156.2 | 179.8 | -73.7 | -63.9 | 0 | 0 | 0 | 111.8 | H1681 A1795 S1820 E1821 I1822 | H1681-Y1818 HydrophobicContact CB-CD2 4.38Å; H1681-Y1818 HydrophobicContact CB-CE2 3.65Å; H1681-Y1818 AromaticContact CD2-CD2 3.47Å; H1681-Y1818 VanDerWaalsContact CD2-CD2 3.45Å; H1681-Y1818 WeakPolarHBondContact CD2-CD2 3.29Å; H1681-Y1818 AromaticContact CD2-CE2 3.65Å; H1681-Y1818 AromaticContact CE1-CD2 3.7Å; H1681-Y1818 AromaticContact CE1-CE2 3.9Å; H1681-Y1818 AromaticContact CG-CD2 3.6Å; H1681-Y1818 AromaticContact CG-CE2 3.3Å; H1681-Y1818 AromaticContact ND1-CD2 3.73Å; H1681-Y1818 AromaticContact ND1-CE2 3.52Å; H1681-Y1818 WeakPolarHBondContact ND1-CE2 3.33Å; H1681-Y1818 AromaticContact NE2-CD2 3.55Å; H1681-Y1818 WeakPolarHBondContact NE2-CD2 3.42Å; H1681-Y1818 AromaticContact NE2-CE2 3.99Å; A1795-Y1818 HydrophobicContact CB-CD1 3.94Å; A1795-Y1818 HydrophobicContact CB-CE1 4.35Å; Y1818-S1820 PolarHBondContact O-N 3.14Å; Y1818-S1820 VanDerWaalsContact O-N 3.12Å; Y1818-E1821 PolarHBondContact N-OE2 3.18Å; Y1818-E1821 VanDerWaalsContact N-OE2 3.15Å; Y1818-E1821 WeakPolarHBondContact O-CB 3.4Å; Y1818-E1821 PolarHBondContact O-N 2.98Å; Y1818-I1822 PolarHBondContact O-N 3.38Å |
| 1819 | A | 84.9 | Confident | 73 | Confident | 4.2 Ų | 4.2 | 42 Ų | 42 | 4% | 0.035 | 23% | 0.225 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -55.5 | -30.1 | 177.1 | 0 | 0 | 0 | 0 | 0 | 113.7 | M1794 E1821 I1822 I1870 R1871 Y1874 | M1794-A1819 PolarHBondContact O-N 3.14Å; A1819-E1821 VanDerWaalsContact C-N 3.27Å; A1819-E1821 PolarHBondContact O-N 3.19Å; A1819-I1822 PolarHBondContact O-N 2.81Å; A1819-I1870 HydrophobicContact CB-CD1 4.47Å; A1819-I1870 HydrophobicContact CB-CG2 3.81Å; A1819-R1871 VanDerWaalsContact O-CD 3.28Å; A1819-R1871 WeakPolarHBondContact O-CD 3.27Å; A1819-R1871 PolarHBondContact O-NH1 2.98Å; A1819-Y1874 HydrophobicContact CB-CD2 4.21Å; A1819-Y1874 HydrophobicContact CB-CG 3.98Å |
| 1820 | S | 82.8 | Confident | 70.4 | Confident | 46.8 Ų | 46.8 | 42.8 Ų | 42.8 | 33% | 0.327 | 23% | 0.228 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -65.9 | -26.8 | 175.7 | 57.4 | 0 | 0 | 0 | 0 | 113.8 | Y1818 L1847 R1871 Y1874 | Y1818-S1820 PolarHBondContact O-N 3.14Å; Y1818-S1820 VanDerWaalsContact O-N 3.12Å; S1820-L1847 WeakPolarHBondContact O-CD1 3.48Å; S1820-R1871 PolarHBondContact O-NH1 3.18Å; S1820-Y1874 VanDerWaalsContact CB-CZ 3.43Å; S1820-Y1874 VanDerWaalsContact CB-OH 3.31Å; S1820-Y1874 WeakPolarHBondContact CB-OH 3.38Å |
| 1821 | E | 81.3 | Confident | 67.6 | Low | 26.2 Ų | 26.2 | 42.2 Ų | 42.2 | 12% | 0.122 | 23% | 0.225 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -92.3 | -14.7 | -176.1 | -60.7 | -178 | 140 | 0 | 0 | 113.2 | H1681 Y1818 A1819 D1823 I1846 L1847 | H1681-E1821 IonicContact CD2-OE1 3.96Å; H1681-E1821 IonicContact CD2-OE2 3.04Å; H1681-E1821 IonicContact CE1-OE1 3.18Å; H1681-E1821 PolarHBondContact CE1-OE1 3.06Å; H1681-E1821 IonicContact CE1-OE2 3.4Å; H1681-E1821 IonicContact NE2-OE1 3.47Å; H1681-E1821 PolarHBondContact NE2-OE1 3.23Å; H1681-E1821 IonicContact NE2-OE2 2.92Å; H1681-E1821 PolarHBondContact NE2-OE2 3.19Å; Y1818-E1821 PolarHBondContact N-OE2 3.18Å; Y1818-E1821 VanDerWaalsContact N-OE2 3.15Å; Y1818-E1821 WeakPolarHBondContact O-CB 3.4Å; Y1818-E1821 PolarHBondContact O-N 2.98Å; A1819-E1821 VanDerWaalsContact C-N 3.27Å; A1819-E1821 PolarHBondContact O-N 3.19Å; E1821-D1823 PolarHBondContact O-N 3.34Å; E1821-D1823 VanDerWaalsContact O-N 3.12Å; E1821-I1846 HydrophobicContact CB-CG2 4.19Å; E1821-I1846 CarbonylContact O-C 3.39Å; E1821-I1846 WeakPolarHBondContact O-CA 3.22Å; E1821-L1847 HydrophobicContact CB-CB 4.44Å; E1821-L1847 VanDerWaalsContact O-CB 3.31Å; E1821-L1847 WeakPolarHBondContact O-CB 3.32Å; E1821-L1847 WeakPolarHBondContact O-CG 3.39Å; E1821-L1847 PolarHBondContact O-N 3.3Å |
| 1822 | I | 79.3 | Confident | 65 | Low | 5.8 Ų | 5.8 | 46.5 Ų | 46.5 | 3% | 0.03 | 24% | 0.244 | C | C | . | . | B | Isolated β-bridge | trans | -70.8 | 107.3 | 172.5 | -57.7 | 174.5 | 0 | 0 | 0 | 105.5 | Y1818 A1819 E1824 V1844 V1867 I1870 R1871 | Y1818-I1822 PolarHBondContact O-N 3.38Å; A1819-I1822 PolarHBondContact O-N 2.81Å; I1822-E1824 PolarHBondContact O-N 3.27Å; I1822-V1844 HydrophobicContact CG2-CG1 4.26Å; I1822-V1867 HydrophobicContact CD1-CG1 4.11Å; I1822-V1867 HydrophobicContact CG2-CG1 4.34Å; I1822-I1870 HydrophobicContact CD1-CD1 3.99Å; I1822-I1870 HydrophobicContact CD1-CG1 4.48Å; I1822-R1871 VanDerWaalsContact O-CZ 3.31Å; I1822-R1871 PolarHBondContact O-NH1 3.25Å; I1822-R1871 VanDerWaalsContact O-NH1 3.11Å |
| 1823 | D | 64.1 | Low | 63 | Low | 40.6 Ų | 40.6 | 49 Ų | 49 | 22% | 0.217 | 25% | 0.254 | C | S | . | . | trans | -68.8 | 130 | -167.7 | -153.7 | 3.7 | 0 | 0 | 0 | 109.9 | E1821 A1825 T1845 L1847 R1889 | E1821-D1823 PolarHBondContact O-N 3.34Å; E1821-D1823 VanDerWaalsContact O-N 3.12Å; D1823-A1825 PolarHBondContact O-N 3.16Å; D1823-A1825 WeakPolarHBondContact OD1-CA 3.5Å; D1823-A1825 PolarHBondContact OD1-N 3.4Å; D1823-T1845 HydrophobicContact CB-CG2 4.14Å; D1823-T1845 PolarHBondContact N-O 3.17Å; D1823-L1847 HydrophobicContact CB-CD1 4.37Å; D1823-L1847 HydrophobicContact CB-CD2 4.15Å; D1823-L1847 HydrophobicContact CB-CG 3.82Å; D1823-L1847 VanDerWaalsContact CG-CD2 3.46Å; D1823-L1847 VanDerWaalsContact OD1-CD2 3.3Å; D1823-L1847 WeakPolarHBondContact OD1-CD2 3.37Å; D1823-L1847 WeakPolarHBondContact OD1-CG 3.32Å; D1823-L1847 VanDerWaalsContact OD2-CD2 3.27Å; D1823-L1847 WeakPolarHBondContact OD2-CD2 3.42Å; D1823-R1889 IonicContact OD2-CZ 3.71Å; D1823-R1889 IonicContact OD2-NH1 2.69Å; D1823-R1889 PolarHBondContact OD2-NH1 3.47Å; D1823-R1889 VanDerWaalsContact OD2-NH1 3.08Å; D1823-R1889 IonicContact OD2-NH2 3.22Å; D1823-R1889 PolarHBondContact OD2-NH2 3.14Å | ||
| 1824 | E | 48.9 | Very low | 61 | Low | 86 Ų | 86 | 50 Ų | 50 | 40% | 0.402 | 26% | 0.261 | S | S | . | . | trans | -75.1 | 118.7 | 154 | -97.7 | -179.6 | 152.1 | 0 | 0 | 106 | I1822 S1826 N1831 F1832 R1871 E1875 | I1822-E1824 PolarHBondContact O-N 3.27Å; E1824-S1826 VanDerWaalsContact C-N 3.32Å; E1824-S1826 PolarHBondContact O-N 3.16Å; E1824-N1831 WeakPolarHBondContact CA-OD1 3.45Å; E1824-N1831 WeakPolarHBondContact CB-ND2 3.25Å; E1824-F1832 HydrophobicContact CB-CD2 4.49Å; E1824-F1832 HydrophobicContact CB-CE1 4.17Å; E1824-F1832 HydrophobicContact CB-CE2 3.64Å; E1824-F1832 HydrophobicContact CB-CZ 3.54Å; E1824-F1832 HydrophobicContact CG-CD1 4.44Å; E1824-F1832 HydrophobicContact CG-CE1 3.5Å; E1824-F1832 HydrophobicContact CG-CE2 3.91Å; E1824-F1832 HydrophobicContact CG-CZ 3.26Å; E1824-F1832 WeakPolarHBondContact OE1-CE1 3.35Å; E1824-F1832 WeakPolarHBondContact OE1-CZ 3.47Å; E1824-F1832 WeakPolarHBondContact OE2-CZ 3.11Å; E1824-R1871 VanDerWaalsContact CD-NH2 3.35Å; E1824-R1871 HydrophobicContact CG-CG 4.45Å; E1824-R1871 IonicContact OE1-NH2 3.98Å; E1824-R1871 PolarHBondContact OE1-NH2 3.06Å; E1824-R1871 IonicContact OE2-NH2 3.47Å; E1824-R1871 PolarHBondContact OE2-NH2 2.98Å; E1824-E1875 WeakPolarHBondContact CG-OE1 3.37Å; E1824-E1875 VanDerWaalsContact OE1-OE1 3.08Å; E1824-E1875 VanDerWaalsContact OE2-OE1 3.1Å | ||
| 1825 | A | 39.6 | Very low | 59.2 | Low | 42.8 Ų | 42.8 | 51.7 Ų | 51.7 | 35% | 0.354 | 27% | 0.273 | S | S | . | . | trans | -59.8 | 98 | 165.1 | 0 | 0 | 0 | 0 | 0 | 107.7 | D1823 E1827 F1830 N1831 | D1823-A1825 PolarHBondContact O-N 3.16Å; D1823-A1825 WeakPolarHBondContact OD1-CA 3.5Å; D1823-A1825 PolarHBondContact OD1-N 3.4Å; A1825-E1827 PolarHBondContact O-N 3.09Å; A1825-F1830 WeakPolarHBondContact CB-O 3.27Å; A1825-F1830 CarbonylContact O-C 3.55Å; A1825-F1830 VanDerWaalsContact O-O 3.13Å; A1825-N1831 VanDerWaalsContact C-OD1 3.23Å; A1825-N1831 HydrophobicContact CB-CB 4.03Å; A1825-N1831 VanDerWaalsContact CB-O 3.29Å; A1825-N1831 WeakPolarHBondContact CB-O 3.43Å; A1825-N1831 PolarHBondContact N-OD1 2.99Å; A1825-N1831 PolarHBondContact O-OD1 3.35Å | ||
| 1826 | S | 35.5 | Very low | 57.5 | Low | 41.4 Ų | 41.4 | 53.9 Ų | 53.9 | 29% | 0.29 | 29% | 0.287 | S | S | . | . | trans | -0.2 | 131.1 | 169.2 | -171.8 | 0 | 0 | 0 | 0 | 112.8 | E1824 T1828 I1829 N1831 T1886 | E1824-S1826 VanDerWaalsContact C-N 3.32Å; E1824-S1826 PolarHBondContact O-N 3.16Å; S1826-T1828 WeakPolarHBondContact CB-O 3.43Å; S1826-T1828 CarbonylContact O-C 3.56Å; S1826-T1828 WeakPolarHBondContact O-CA 3.28Å; S1826-T1828 PolarHBondContact O-N 3.1Å; S1826-T1828 VanDerWaalsContact OG-C 3.24Å; S1826-T1828 WeakPolarHBondContact OG-CA 3.23Å; S1826-T1828 WeakPolarHBondContact OG-CB 3.36Å; S1826-T1828 PolarHBondContact OG-N 3.23Å; S1826-T1828 VanDerWaalsContact OG-N 3.16Å; S1826-T1828 PolarHBondContact OG-O 3.18Å; S1826-T1828 VanDerWaalsContact OG-O 3.09Å; S1826-T1828 PolarHBondContact OG-OG1 3.2Å; S1826-I1829 PolarHBondContact O-N 3Å; S1826-N1831 VanDerWaalsContact C-ND2 3.27Å; S1826-N1831 PolarHBondContact O-ND2 3.3Å; S1826-T1886 WeakPolarHBondContact OG-CG2 3.17Å | ||
| 1827 | E | 33.7 | Very low | 55.9 | Low | 170 Ų | 170 | 57.5 Ų | 57.5 | 79% | 0.794 | 31% | 0.309 | S | S | * | . | S | Bend | trans | -50.7 | -7.1 | 165.3 | -69.5 | -175.1 | 132.5 | 0 | 0 | 113.6 | A1825 I1829 T1886 | A1825-E1827 PolarHBondContact O-N 3.09Å; E1827-I1829 VanDerWaalsContact C-N 3.32Å; E1827-I1829 PolarHBondContact O-N 3.2Å; E1827-T1886 HydrophobicContact CG-CG2 4.25Å; E1827-T1886 WeakPolarHBondContact OE2-CB 3.4Å; E1827-T1886 WeakPolarHBondContact OE2-CG2 3.21Å; E1827-T1886 PolarHBondContact OE2-OG1 2.82Å |
| 1828 | T | 32.9 | Very low | 54.7 | Low | 79.8 Ų | 79.8 | 61.6 Ų | 61.6 | 49% | 0.49 | 33% | 0.332 | S | S | . | . | S | Bend | trans | -84.9 | 71.3 | 159.3 | -8.7 | 0 | 0 | 0 | 0 | 111.9 | S1826 F1830 | S1826-T1828 WeakPolarHBondContact CB-O 3.43Å; S1826-T1828 CarbonylContact O-C 3.56Å; S1826-T1828 WeakPolarHBondContact O-CA 3.28Å; S1826-T1828 PolarHBondContact O-N 3.1Å; S1826-T1828 VanDerWaalsContact OG-C 3.24Å; S1826-T1828 WeakPolarHBondContact OG-CA 3.23Å; S1826-T1828 WeakPolarHBondContact OG-CB 3.36Å; S1826-T1828 PolarHBondContact OG-N 3.23Å; S1826-T1828 VanDerWaalsContact OG-N 3.16Å; S1826-T1828 PolarHBondContact OG-O 3.18Å; S1826-T1828 VanDerWaalsContact OG-O 3.09Å; S1826-T1828 PolarHBondContact OG-OG1 3.2Å; T1828-F1830 VanDerWaalsContact C-N 3.31Å; T1828-F1830 WeakPolarHBondContact O-CD2 2.82Å; T1828-F1830 PolarHBondContact O-N 3.16Å |
| 1829 | I | 32.9 | Very low | 53.7 | Low | 31.4 Ų | 31.4 | 67.6 Ų | 67.6 | 16% | 0.161 | 36% | 0.361 | C | S | . | . | S | Bend | trans | 62.1 | 33.9 | 146.4 | -43.3 | 179.8 | 0 | 0 | 0 | 117.3 | S1826 E1827 Q1971 A2015 R2018 | S1826-I1829 PolarHBondContact O-N 3Å; E1827-I1829 VanDerWaalsContact C-N 3.32Å; E1827-I1829 PolarHBondContact O-N 3.2Å; I1829-Q1971 VanDerWaalsContact CD1-CD 3.49Å; I1829-Q1971 VanDerWaalsContact CD1-NE2 3.34Å; I1829-A2015 HydrophobicContact CD1-CB 4.35Å; I1829-A2015 HydrophobicContact CG2-CB 3.7Å; I1829-A2015 VanDerWaalsContact CG2-CB 3.5Å; I1829-R2018 VanDerWaalsContact CD1-CZ 3.45Å; I1829-R2018 VanDerWaalsContact CG2-NH2 3.35Å |
| 1830 | F | 36 | Very low | 53.5 | Low | 67 Ų | 67 | 71.4 Ų | 71.4 | 29% | 0.294 | 38% | 0.381 | S | S | . | . | trans | -177.1 | 88.8 | 175.4 | -59.6 | -73.5 | 0 | 0 | 0 | 117 | A1825 T1828 F1832 L1967 E1968 K2012 A2015 | A1825-F1830 WeakPolarHBondContact CB-O 3.27Å; A1825-F1830 CarbonylContact O-C 3.55Å; A1825-F1830 VanDerWaalsContact O-O 3.13Å; T1828-F1830 VanDerWaalsContact C-N 3.31Å; T1828-F1830 WeakPolarHBondContact O-CD2 2.82Å; T1828-F1830 PolarHBondContact O-N 3.16Å; F1830-F1832 PolarHBondContact O-N 3.26Å; F1830-L1967 HydrophobicContact CD1-CD1 3.68Å; F1830-L1967 HydrophobicContact CD2-CB 3.85Å; F1830-L1967 HydrophobicContact CD2-CD1 4.25Å; F1830-L1967 HydrophobicContact CE1-CB 3.94Å; F1830-L1967 HydrophobicContact CE1-CD1 3.21Å; F1830-L1967 HydrophobicContact CE1-CD2 4.37Å; F1830-L1967 HydrophobicContact CE1-CG 4.06Å; F1830-L1967 HydrophobicContact CE2-CB 3.51Å; F1830-L1967 HydrophobicContact CE2-CD1 3.78Å; F1830-L1967 HydrophobicContact CE2-CD2 4.44Å; F1830-L1967 HydrophobicContact CE2-CG 3.98Å; F1830-L1967 HydrophobicContact CG-CD1 4.23Å; F1830-L1967 HydrophobicContact CZ-CB 3.23Å; F1830-L1967 HydrophobicContact CZ-CD1 3.45Å; F1830-L1967 HydrophobicContact CZ-CD2 3.97Å; F1830-L1967 HydrophobicContact CZ-CG 3.74Å; F1830-E1968 HydrophobicContact CE2-CB 4.43Å; F1830-K2012 HydrophobicContact CD1-CB 4.47Å; F1830-K2012 HydrophobicContact CD1-CD 4.31Å; F1830-K2012 HydrophobicContact CD1-CG 4.21Å; F1830-K2012 HydrophobicContact CE1-CB 4.33Å; F1830-K2012 HydrophobicContact CE1-CD 3.69Å; F1830-K2012 HydrophobicContact CE1-CG 4.1Å; F1830-K2012 HydrophobicContact CZ-CD 4.4Å; F1830-A2015 HydrophobicContact CD1-CB 4.02Å; F1830-A2015 HydrophobicContact CD2-CB 4.48Å; F1830-A2015 HydrophobicContact CE1-CB 3.17Å; F1830-A2015 HydrophobicContact CE2-CB 3.66Å; F1830-A2015 HydrophobicContact CZ-CB 2.94Å | ||
| 1831 | N | 33.4 | Very low | 53.4 | Low | 97.2 Ų | 97.2 | 69.9 Ų | 69.9 | 52% | 0.52 | 37% | 0.371 | S | S | . | . | trans | -178.7 | 113.6 | 149.1 | -78.5 | -25.9 | 0 | 0 | 0 | 114.4 | E1824 A1825 S1826 Q1833 K2012 | E1824-N1831 WeakPolarHBondContact CA-OD1 3.45Å; E1824-N1831 WeakPolarHBondContact CB-ND2 3.25Å; A1825-N1831 VanDerWaalsContact C-OD1 3.23Å; A1825-N1831 HydrophobicContact CB-CB 4.03Å; A1825-N1831 VanDerWaalsContact CB-O 3.29Å; A1825-N1831 WeakPolarHBondContact CB-O 3.43Å; A1825-N1831 PolarHBondContact N-OD1 2.99Å; A1825-N1831 PolarHBondContact O-OD1 3.35Å; S1826-N1831 VanDerWaalsContact C-ND2 3.27Å; S1826-N1831 PolarHBondContact O-ND2 3.3Å; N1831-Q1833 PolarHBondContact O-N 3.42Å; N1831-K2012 VanDerWaalsContact OD1-CE 3.23Å; N1831-K2012 WeakPolarHBondContact OD1-CE 3.39Å | ||
| 1832 | F | 38.5 | Very low | 53.5 | Low | 95.8 Ų | 95.8 | 68.7 Ų | 68.7 | 42% | 0.42 | 37% | 0.365 | S | S | . | . | trans | -106.9 | 123.9 | 154.3 | -90.4 | -90.1 | 0 | 0 | 0 | 111.5 | E1824 F1830 V1834 A1868 G2008 S2011 K2012 | E1824-F1832 HydrophobicContact CB-CD2 4.49Å; E1824-F1832 HydrophobicContact CB-CE1 4.17Å; E1824-F1832 HydrophobicContact CB-CE2 3.64Å; E1824-F1832 HydrophobicContact CB-CZ 3.54Å; E1824-F1832 HydrophobicContact CG-CD1 4.44Å; E1824-F1832 HydrophobicContact CG-CE1 3.5Å; E1824-F1832 HydrophobicContact CG-CE2 3.91Å; E1824-F1832 HydrophobicContact CG-CZ 3.26Å; E1824-F1832 WeakPolarHBondContact OE1-CE1 3.35Å; E1824-F1832 WeakPolarHBondContact OE1-CZ 3.47Å; E1824-F1832 WeakPolarHBondContact OE2-CZ 3.11Å; F1830-F1832 PolarHBondContact O-N 3.26Å; F1832-V1834 VanDerWaalsContact C-N 3.32Å; F1832-V1834 PolarHBondContact O-N 3.24Å; F1832-A1868 HydrophobicContact CE1-CB 4.39Å; F1832-G2008 WeakPolarHBondContact CD2-O 3.49Å; F1832-G2008 WeakPolarHBondContact CE1-O 3.34Å; F1832-G2008 WeakPolarHBondContact CE2-O 3.2Å; F1832-G2008 WeakPolarHBondContact CZ-O 3.45Å; F1832-S2011 WeakPolarHBondContact CE2-OG 3.41Å; F1832-S2011 WeakPolarHBondContact CZ-OG 3.36Å; F1832-K2012 HydrophobicContact CE2-CG 4.26Å | ||
| 1833 | Q | 50.2 | Low | 53.5 | Low | 91.8 Ų | 91.8 | 69.5 Ų | 69.5 | 43% | 0.429 | 37% | 0.37 | S | S | . | . | S | Bend | trans | -78.3 | -15.5 | 165.9 | -91.4 | 171.5 | -20 | 0 | 0 | 111.5 | N1831 C1835 L2007 | N1831-Q1833 PolarHBondContact O-N 3.42Å; Q1833-C1835 HydrophobicContact CG-CB 4.16Å; Q1833-C1835 WeakPolarHBondContact CG-SG 3.38Å; Q1833-C1835 PolarHBondContact O-N 2.9Å; Q1833-C1835 VanDerWaalsContact O-N 3.17Å; Q1833-C1835 PolarHBondContact O-SG 2.88Å; Q1833-L2007 PolarHBondContact NE2-O 2.71Å; Q1833-L2007 PolarHBondContact OE1-O 3.35Å |
| 1834 | V | 51.4 | Low | 54.2 | Low | 25 Ų | 25 | 67.7 Ų | 67.7 | 15% | 0.152 | 36% | 0.36 | C | S | . | . | S | Bend | trans | -122.5 | 105 | 162.9 | -179.7 | 0 | 0 | 0 | 0 | 106.8 | F1832 V1836 I1842 T1843 V1844 A1864 V1867 | F1832-V1834 VanDerWaalsContact C-N 3.32Å; F1832-V1834 PolarHBondContact O-N 3.24Å; V1834-V1836 PolarHBondContact O-N 3.4Å; V1834-V1836 VanDerWaalsContact O-N 3.1Å; V1834-I1842 HydrophobicContact CG1-CB 3.77Å; V1834-I1842 HydrophobicContact CG1-CD1 3.41Å; V1834-I1842 HydrophobicContact CG1-CG1 3.47Å; V1834-I1842 HydrophobicContact CG1-CG2 4.25Å; V1834-T1843 CarbonylContact C-O 3.47Å; V1834-T1843 WeakPolarHBondContact CA-O 3.4Å; V1834-V1844 HydrophobicContact CG1-CG2 4.21Å; V1834-V1844 HydrophobicContact CG2-CG2 4.35Å; V1834-A1864 HydrophobicContact CB-CB 4.22Å; V1834-A1864 HydrophobicContact CG1-CB 3.79Å; V1834-A1864 VanDerWaalsContact CG1-CB 3.45Å; V1834-V1867 HydrophobicContact CG2-CB 4.02Å; V1834-V1867 HydrophobicContact CG2-CG1 3.75Å |
| 1835 | C | 54 | Low | 55.6 | Low | 47.2 Ų | 47.2 | 66 Ų | 66 | 32% | 0.319 | 36% | 0.356 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -84.6 | 111.5 | 179.3 | -82.2 | 0 | 0 | 0 | 0 | 108.8 | Q1833 V1837 I1842 T1843 | Q1833-C1835 HydrophobicContact CG-CB 4.16Å; Q1833-C1835 WeakPolarHBondContact CG-SG 3.38Å; Q1833-C1835 PolarHBondContact O-N 2.9Å; Q1833-C1835 VanDerWaalsContact O-N 3.17Å; Q1833-C1835 PolarHBondContact O-SG 2.88Å; C1835-V1837 VanDerWaalsContact C-N 3.31Å; C1835-V1837 HydrophobicContact CB-CG2 4.3Å; C1835-V1837 PolarHBondContact O-N 3.13Å; C1835-I1842 CarbonylContact O-C 3.32Å; C1835-I1842 WeakPolarHBondContact O-CA 3.41Å; C1835-T1843 WeakPolarHBondContact CB-OG1 3.45Å; C1835-T1843 PolarHBondContact N-O 3.08Å; C1835-T1843 VanDerWaalsContact N-O 3.11Å; C1835-T1843 PolarHBondContact O-N 3.15Å; C1835-T1843 VanDerWaalsContact O-N 3.07Å; C1835-T1843 PolarHBondContact O-OG1 3.01Å |
| 1836 | V | 56.4 | Low | 57.4 | Low | 58.8 Ų | 58.8 | 64.3 Ų | 64.3 | 36% | 0.356 | 34% | 0.341 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -71.1 | 104.6 | 160.3 | -178.4 | 0 | 0 | 0 | 0 | 106 | V1834 D1838 S1841 I1842 A1864 | V1834-V1836 PolarHBondContact O-N 3.4Å; V1834-V1836 VanDerWaalsContact O-N 3.1Å; V1836-D1838 VanDerWaalsContact C-N 3.32Å; V1836-D1838 VanDerWaalsContact CG1-O 3.26Å; V1836-D1838 WeakPolarHBondContact CG1-O 3.44Å; V1836-S1841 CarbonylContact C-O 3.39Å; V1836-S1841 VanDerWaalsContact CA-O 3.26Å; V1836-S1841 WeakPolarHBondContact CA-O 3.36Å; V1836-I1842 HydrophobicContact CG2-CG1 4.45Å; V1836-I1842 HydrophobicContact CG2-CG2 4.13Å; V1836-A1864 HydrophobicContact CG2-CB 4.1Å |
| 1837 | V | 58.5 | Low | 59.1 | Low | 83.4 Ų | 83.4 | 64.8 Ų | 64.8 | 51% | 0.505 | 34% | 0.34 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -77.8 | -39 | -176.2 | -179.4 | 0 | 0 | 0 | 0 | 109.4 | C1835 S1841 T1843 | C1835-V1837 VanDerWaalsContact C-N 3.31Å; C1835-V1837 HydrophobicContact CB-CG2 4.3Å; C1835-V1837 PolarHBondContact O-N 3.13Å; V1837-S1841 WeakPolarHBondContact CB-OG 3.38Å; V1837-S1841 PolarHBondContact N-O 3.1Å; V1837-T1843 VanDerWaalsContact CG2-OG1 3.29Å; V1837-T1843 WeakPolarHBondContact CG2-OG1 3.38Å |
| 1838 | D | 64.8 | Low | 60.7 | Low | 104.4 Ų | 104.4 | 60.7 Ų | 60.7 | 56% | 0.558 | 32% | 0.324 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -146.8 | 170.5 | 175.3 | -30.9 | -58.5 | 0 | 0 | 0 | 109.2 | V1836 N1840 S1841 | V1836-D1838 VanDerWaalsContact C-N 3.32Å; V1836-D1838 VanDerWaalsContact CG1-O 3.26Å; V1836-D1838 WeakPolarHBondContact CG1-O 3.44Å; D1838-N1840 PolarHBondContact O-N 3.1Å; D1838-S1841 VanDerWaalsContact CB-OG 3.31Å; D1838-S1841 WeakPolarHBondContact CB-OG 3.38Å; D1838-S1841 VanDerWaalsContact CG-OG 3.24Å; D1838-S1841 PolarHBondContact N-OG 3.3Å; D1838-S1841 VanDerWaalsContact N-OG 3.08Å; D1838-S1841 PolarHBondContact O-N 3.23Å; D1838-S1841 VanDerWaalsContact O-O 3.12Å; D1838-S1841 VanDerWaalsContact OD1-CB 3.25Å; D1838-S1841 WeakPolarHBondContact OD1-CB 3.41Å; D1838-S1841 PolarHBondContact OD1-OG 3.32Å; D1838-S1841 PolarHBondContact OD2-OG 3.35Å |
| 1839 | E | 69.6 | Low | 62.4 | Low | 173.8 Ų | 173.8 | 60.3 Ų | 60.3 | 81% | 0.812 | 32% | 0.316 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -50.8 | -26.2 | -178.1 | -67.3 | -171.7 | 168.1 | 0 | 0 | 114.5 | ||
| 1840 | N | 79.9 | Confident | 63.8 | Low | 84.6 Ų | 84.6 | 63.3 Ų | 63.3 | 45% | 0.452 | 34% | 0.338 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -116.6 | 7.6 | -177.3 | -64.6 | -46.4 | 0 | 0 | 0 | 114.2 | D1838 I1856 H1857 C1860 | D1838-N1840 PolarHBondContact O-N 3.1Å; N1840-I1856 HydrophobicContact CB-CG2 4.44Å; N1840-I1856 CarbonylContact O-C 3.47Å; N1840-I1856 VanDerWaalsContact O-CA 3.27Å; N1840-I1856 WeakPolarHBondContact O-CA 3.38Å; N1840-I1856 VanDerWaalsContact O-CG2 3.27Å; N1840-I1856 WeakPolarHBondContact O-CG2 3.36Å; N1840-H1857 CarbonylContact C-O 3.29Å; N1840-H1857 VanDerWaalsContact CA-O 3.28Å; N1840-H1857 WeakPolarHBondContact CA-O 3.41Å; N1840-H1857 PolarHBondContact O-N 3.09Å; N1840-H1857 VanDerWaalsContact O-N 3.09Å; N1840-C1860 PolarHBondContact O-SG 3.15Å |
| 1841 | S | 80.3 | Confident | 65.4 | Low | 15.2 Ų | 15.2 | 63.6 Ų | 63.6 | 11% | 0.106 | 35% | 0.348 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -133 | 136.4 | -175.3 | 77.1 | 0 | 0 | 0 | 0 | 112.6 | V1836 V1837 D1838 L1855 C1860 | V1836-S1841 CarbonylContact C-O 3.39Å; V1836-S1841 VanDerWaalsContact CA-O 3.26Å; V1836-S1841 WeakPolarHBondContact CA-O 3.36Å; V1837-S1841 WeakPolarHBondContact CB-OG 3.38Å; V1837-S1841 PolarHBondContact N-O 3.1Å; D1838-S1841 VanDerWaalsContact CB-OG 3.31Å; D1838-S1841 WeakPolarHBondContact CB-OG 3.38Å; D1838-S1841 VanDerWaalsContact CG-OG 3.24Å; D1838-S1841 PolarHBondContact N-OG 3.3Å; D1838-S1841 VanDerWaalsContact N-OG 3.08Å; D1838-S1841 PolarHBondContact O-N 3.23Å; D1838-S1841 VanDerWaalsContact O-O 3.12Å; D1838-S1841 VanDerWaalsContact OD1-CB 3.25Å; D1838-S1841 WeakPolarHBondContact OD1-CB 3.41Å; D1838-S1841 PolarHBondContact OD1-OG 3.32Å; D1838-S1841 PolarHBondContact OD2-OG 3.35Å; S1841-L1855 CarbonylContact C-O 3.48Å; S1841-L1855 WeakPolarHBondContact CA-O 3.4Å; S1841-C1860 PolarHBondContact N-SG 3.27Å |
| 1842 | I | 83 | Confident | 67.3 | Low | 0.6 Ų | 0.6 | 62.2 Ų | 62.2 | 0% | 0.003 | 34% | 0.344 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -133.4 | 139.8 | -177.1 | 175.6 | 179.9 | 0 | 0 | 0 | 110 | V1834 C1835 V1836 V1844 S1854 L1855 C1860 I1863 A1864 | V1834-I1842 HydrophobicContact CG1-CB 3.77Å; V1834-I1842 HydrophobicContact CG1-CD1 3.41Å; V1834-I1842 HydrophobicContact CG1-CG1 3.47Å; V1834-I1842 HydrophobicContact CG1-CG2 4.25Å; C1835-I1842 CarbonylContact O-C 3.32Å; C1835-I1842 WeakPolarHBondContact O-CA 3.41Å; V1836-I1842 HydrophobicContact CG2-CG1 4.45Å; V1836-I1842 HydrophobicContact CG2-CG2 4.13Å; I1842-V1844 HydrophobicContact CD1-CG2 4.21Å; I1842-V1844 HydrophobicContact CG1-CG2 4.39Å; I1842-S1854 CarbonylContact O-C 3.53Å; I1842-S1854 WeakPolarHBondContact O-CA 3.42Å; I1842-L1855 HydrophobicContact CD1-CD1 4.21Å; I1842-L1855 HydrophobicContact CG1-CB 3.86Å; I1842-L1855 HydrophobicContact CG1-CD1 4.38Å; I1842-L1855 HydrophobicContact CG2-CB 3.64Å; I1842-L1855 HydrophobicContact CG2-CD1 4.37Å; I1842-L1855 HydrophobicContact CG2-CG 4.47Å; I1842-L1855 WeakPolarHBondContact CG2-O 3.48Å; I1842-L1855 PolarHBondContact N-O 3.07Å; I1842-L1855 PolarHBondContact O-N 3.12Å; I1842-C1860 HydrophobicContact CB-CB 4.38Å; I1842-C1860 HydrophobicContact CG2-CB 3.59Å; I1842-I1863 HydrophobicContact CD1-CB 4.29Å; I1842-I1863 HydrophobicContact CD1-CG2 3.77Å; I1842-A1864 HydrophobicContact CD1-CB 3.61Å; I1842-A1864 HydrophobicContact CG1-CB 4.43Å; I1842-A1864 HydrophobicContact CG2-CB 4.38Å |
| 1843 | T | 79.5 | Confident | 69.3 | Low | 23.4 Ų | 23.4 | 58 Ų | 58 | 14% | 0.144 | 33% | 0.326 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -118.4 | 126.2 | 176.3 | -46 | 0 | 0 | 0 | 0 | 109.8 | V1834 C1835 V1837 P1852 L1853 S1854 | V1834-T1843 CarbonylContact C-O 3.47Å; V1834-T1843 WeakPolarHBondContact CA-O 3.4Å; C1835-T1843 WeakPolarHBondContact CB-OG1 3.45Å; C1835-T1843 PolarHBondContact N-O 3.08Å; C1835-T1843 VanDerWaalsContact N-O 3.11Å; C1835-T1843 PolarHBondContact O-N 3.15Å; C1835-T1843 VanDerWaalsContact O-N 3.07Å; C1835-T1843 PolarHBondContact O-OG1 3.01Å; V1837-T1843 VanDerWaalsContact CG2-OG1 3.29Å; V1837-T1843 WeakPolarHBondContact CG2-OG1 3.38Å; T1843-P1852 HydrophobicContact CG2-CB 3.69Å; T1843-P1852 HydrophobicContact CG2-CG 4.05Å; T1843-L1853 CarbonylContact C-O 3.55Å; T1843-L1853 VanDerWaalsContact CA-O 3.29Å; T1843-L1853 WeakPolarHBondContact CA-O 3.32Å; T1843-S1854 WeakPolarHBondContact CG2-OG 3.36Å; T1843-S1854 PolarHBondContact OG1-OG 3.15Å |
| 1844 | V | 80.1 | Confident | 71 | Confident | 1.2 Ų | 1.2 | 55.2 Ų | 55.2 | 1% | 0.007 | 32% | 0.317 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -114.5 | 124.4 | 178.4 | -176.6 | 0 | 0 | 0 | 0 | 109.1 | I1822 V1834 I1842 I1846 L1853 V1867 | I1822-V1844 HydrophobicContact CG2-CG1 4.26Å; V1834-V1844 HydrophobicContact CG1-CG2 4.21Å; V1834-V1844 HydrophobicContact CG2-CG2 4.35Å; I1842-V1844 HydrophobicContact CD1-CG2 4.21Å; I1842-V1844 HydrophobicContact CG1-CG2 4.39Å; V1844-I1846 HydrophobicContact CG1-CG1 4.29Å; V1844-L1853 HydrophobicContact CB-CB 4.46Å; V1844-L1853 PolarHBondContact N-O 3.11Å; V1844-L1853 WeakPolarHBondContact O-CB 3.29Å; V1844-L1853 PolarHBondContact O-N 3.18Å; V1844-V1867 HydrophobicContact CG1-CG1 4.46Å |
| 1845 | T | 76.6 | Confident | 72.6 | Confident | 50.2 Ų | 50.2 | 54.1 Ų | 54.1 | 31% | 0.308 | 31% | 0.311 | S | S | . | . | trans | -89.6 | 129.4 | 176.9 | -48.4 | 0 | 0 | 0 | 0 | 109.5 | D1823 | D1823-T1845 HydrophobicContact CB-CG2 4.14Å; D1823-T1845 PolarHBondContact N-O 3.17Å | ||
| 1846 | I | 78.5 | Confident | 74.2 | Confident | 7.8 Ų | 7.8 | 54.9 Ų | 54.9 | 4% | 0.04 | 31% | 0.311 | C | S | . | . | B | Isolated β-bridge | trans | -120.6 | 131.3 | -179.3 | -56.2 | -167.3 | 0 | 0 | 0 | 108.6 | Y1817 E1821 V1844 N1848 E1849 L1853 | Y1817-I1846 HydrophobicContact CD1-CD1 3.45Å; Y1817-I1846 VanDerWaalsContact CD1-CD1 3.41Å; Y1817-I1846 HydrophobicContact CD1-CG1 4.5Å; Y1817-I1846 HydrophobicContact CD1-CG2 3.69Å; Y1817-I1846 HydrophobicContact CD2-CD1 3.58Å; Y1817-I1846 VanDerWaalsContact CD2-CD1 3.47Å; Y1817-I1846 HydrophobicContact CE1-CD1 3.66Å; Y1817-I1846 HydrophobicContact CE1-CG2 4.06Å; Y1817-I1846 HydrophobicContact CE2-CD1 3.8Å; Y1817-I1846 HydrophobicContact CG-CD1 3.39Å; Y1817-I1846 HydrophobicContact CG-CG2 4.42Å; E1821-I1846 HydrophobicContact CB-CG2 4.19Å; E1821-I1846 CarbonylContact O-C 3.39Å; E1821-I1846 WeakPolarHBondContact O-CA 3.22Å; V1844-I1846 HydrophobicContact CG1-CG1 4.29Å; I1846-N1848 PolarHBondContact O-N 2.97Å; I1846-E1849 HydrophobicContact CB-CB 4.31Å; I1846-E1849 HydrophobicContact CB-CG 4.21Å; I1846-E1849 HydrophobicContact CG2-CG 4.2Å; I1846-E1849 PolarHBondContact O-N 2.93Å; I1846-L1853 HydrophobicContact CD1-CB 4.32Å; I1846-L1853 HydrophobicContact CD1-CD1 3.4Å; I1846-L1853 HydrophobicContact CD1-CD2 4.28Å; I1846-L1853 HydrophobicContact CD1-CG 4.25Å; I1846-L1853 HydrophobicContact CG1-CD1 3.85Å; I1846-L1853 HydrophobicContact CG1-CG 4.48Å |
| 1847 | L | 71.8 | Confident | 75.7 | Confident | 52.6 Ų | 52.6 | 53 Ų | 53 | 28% | 0.275 | 30% | 0.298 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -53.9 | 133.4 | 173.8 | -77.5 | 167 | 0 | 0 | 0 | 110 | S1820 E1821 D1823 E1849 | S1820-L1847 WeakPolarHBondContact O-CD1 3.48Å; E1821-L1847 HydrophobicContact CB-CB 4.44Å; E1821-L1847 VanDerWaalsContact O-CB 3.31Å; E1821-L1847 WeakPolarHBondContact O-CB 3.32Å; E1821-L1847 WeakPolarHBondContact O-CG 3.39Å; E1821-L1847 PolarHBondContact O-N 3.3Å; D1823-L1847 HydrophobicContact CB-CD1 4.37Å; D1823-L1847 HydrophobicContact CB-CD2 4.15Å; D1823-L1847 HydrophobicContact CB-CG 3.82Å; D1823-L1847 VanDerWaalsContact CG-CD2 3.46Å; D1823-L1847 VanDerWaalsContact OD1-CD2 3.3Å; D1823-L1847 WeakPolarHBondContact OD1-CD2 3.37Å; D1823-L1847 WeakPolarHBondContact OD1-CG 3.32Å; D1823-L1847 VanDerWaalsContact OD2-CD2 3.27Å; D1823-L1847 WeakPolarHBondContact OD2-CD2 3.42Å; L1847-E1849 VanDerWaalsContact C-N 3.27Å; L1847-E1849 PolarHBondContact O-N 3.15Å; L1847-E1849 VanDerWaalsContact O-N 3.14Å |
| 1848 | N | 65.8 | Low | 77.1 | Confident | 83.4 Ų | 83.4 | 53.5 Ų | 53.5 | 45% | 0.446 | 31% | 0.305 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 70.4 | -1.6 | 178.7 | -53.1 | -32.8 | 0 | 0 | 0 | 116.5 | I1846 R1889 | I1846-N1848 PolarHBondContact O-N 2.97Å; N1848-R1889 VanDerWaalsContact N-NH1 3.17Å; N1848-R1889 PolarHBondContact OD1-NH1 3.02Å |
| 1849 | E | 69.3 | Low | 78.1 | Confident | 70.8 Ų | 70.8 | 52.5 Ų | 52.5 | 33% | 0.331 | 30% | 0.297 | S | S | . | . | trans | -81.7 | 141.1 | 165.9 | -79.6 | -84.6 | 166.8 | 0 | 0 | 110.4 | Y1817 I1846 L1847 S1851 K1891 | Y1817-E1849 HydrophobicContact CE1-CG 4.35Å; Y1817-E1849 PolarHBondContact OH-OE1 3.12Å; I1846-E1849 HydrophobicContact CB-CB 4.31Å; I1846-E1849 HydrophobicContact CB-CG 4.21Å; I1846-E1849 HydrophobicContact CG2-CG 4.2Å; I1846-E1849 PolarHBondContact O-N 2.93Å; L1847-E1849 VanDerWaalsContact C-N 3.27Å; L1847-E1849 PolarHBondContact O-N 3.15Å; L1847-E1849 VanDerWaalsContact O-N 3.14Å; E1849-S1851 VanDerWaalsContact C-N 3.29Å; E1849-S1851 PolarHBondContact O-N 3.2Å; E1849-K1891 PolarHBondContact O-NZ 2.88Å; E1849-K1891 VanDerWaalsContact O-NZ 3.12Å | ||
| 1850 | P | 62 | Low | 78.7 | Confident | 94.6 Ų | 94.6 | 44.3 Ų | 44.3 | 61% | 0.614 | 26% | 0.259 | S | S | * | . | S | Bend | trans | -74.6 | -22.4 | -176.8 | 29.9 | -36.1 | 0 | 0 | 0 | 113.5 | ||
| 1851 | S | 68.8 | Low | 78.7 | Confident | 72.8 Ų | 72.8 | 47.4 Ų | 47.4 | 51% | 0.509 | 27% | 0.271 | S | S | . | . | S | Bend | trans | -138.1 | 141.2 | -177.4 | 58.7 | 0 | 0 | 0 | 0 | 109.9 | E1849 | E1849-S1851 VanDerWaalsContact C-N 3.29Å; E1849-S1851 PolarHBondContact O-N 3.2Å |
| 1852 | P | 73.9 | Confident | 78.9 | Confident | 68.2 Ų | 68.2 | 52 Ų | 52 | 44% | 0.443 | 29% | 0.29 | S | S | . | . | trans | -65.8 | 147.9 | 177.8 | 30.6 | -36 | 0 | 0 | 0 | 110.9 | T1843 S1854 | T1843-P1852 HydrophobicContact CG2-CB 3.69Å; T1843-P1852 HydrophobicContact CG2-CG 4.05Å; P1852-S1854 PolarHBondContact O-N 3.13Å | ||
| 1853 | L | 81 | Confident | 79.1 | Confident | 7.4 Ų | 7.4 | 52 Ų | 52 | 4% | 0.039 | 29% | 0.29 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -82.4 | 104.8 | -177.2 | -110.1 | 147.1 | 0 | 0 | 0 | 110.1 | R1779 I1798 Y1817 T1843 V1844 I1846 L1855 | R1779-L1853 HydrophobicContact CG-CD1 3.89Å; R1779-L1853 HydrophobicContact CG-CD2 4.24Å; R1779-L1853 VanDerWaalsContact CZ-CD2 3.48Å; R1779-L1853 VanDerWaalsContact NE-CD1 3.32Å; R1779-L1853 VanDerWaalsContact NE-CD2 3.35Å; R1779-L1853 VanDerWaalsContact NH2-CD2 3.32Å; I1798-L1853 HydrophobicContact CD1-CD1 4.04Å; I1798-L1853 HydrophobicContact CD1-CD2 3.8Å; I1798-L1853 HydrophobicContact CD1-CG 4.15Å; Y1817-L1853 HydrophobicContact CD2-CD1 4.35Å; Y1817-L1853 HydrophobicContact CE1-CD1 4.49Å; Y1817-L1853 HydrophobicContact CE2-CD1 3.78Å; Y1817-L1853 WeakPolarHBondContact OH-CD1 3.35Å; T1843-L1853 CarbonylContact C-O 3.55Å; T1843-L1853 VanDerWaalsContact CA-O 3.29Å; T1843-L1853 WeakPolarHBondContact CA-O 3.32Å; V1844-L1853 HydrophobicContact CB-CB 4.46Å; V1844-L1853 PolarHBondContact N-O 3.11Å; V1844-L1853 WeakPolarHBondContact O-CB 3.29Å; V1844-L1853 PolarHBondContact O-N 3.18Å; I1846-L1853 HydrophobicContact CD1-CB 4.32Å; I1846-L1853 HydrophobicContact CD1-CD1 3.4Å; I1846-L1853 HydrophobicContact CD1-CD2 4.28Å; I1846-L1853 HydrophobicContact CD1-CG 4.25Å; I1846-L1853 HydrophobicContact CG1-CD1 3.85Å; I1846-L1853 HydrophobicContact CG1-CG 4.48Å; L1853-L1855 HydrophobicContact CD1-CD2 4.22Å; L1853-L1855 HydrophobicContact CD2-CD1 4.16Å; L1853-L1855 HydrophobicContact CD2-CD2 3.76Å; L1853-L1855 VanDerWaalsContact CD2-CD2 3.47Å; L1853-L1855 HydrophobicContact CD2-CG 3.94Å; L1853-L1855 HydrophobicContact CG-CD2 3.96Å; L1853-L1855 HydrophobicContact CG-CG 4.12Å |
| 1854 | S | 84.9 | Confident | 79.2 | Confident | 34.2 Ų | 34.2 | 51.6 Ų | 51.6 | 24% | 0.239 | 29% | 0.289 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -89.4 | 124.1 | 174.9 | -60.8 | 0 | 0 | 0 | 0 | 111.1 | L1780 I1842 T1843 P1852 | L1780-S1854 PolarHBondContact N-O 3.22Å; I1842-S1854 CarbonylContact O-C 3.53Å; I1842-S1854 WeakPolarHBondContact O-CA 3.42Å; T1843-S1854 WeakPolarHBondContact CG2-OG 3.36Å; T1843-S1854 PolarHBondContact OG1-OG 3.15Å; P1852-S1854 PolarHBondContact O-N 3.13Å |
| 1855 | L | 85.9 | Confident | 79.4 | Confident | 2.4 Ų | 2.4 | 54.6 Ų | 54.6 | 1% | 0.013 | 31% | 0.311 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -122.3 | 143.1 | -179.3 | -54.8 | 171.9 | 0 | 0 | 0 | 109.9 | V1777 V1778 R1779 L1789 I1798 S1841 I1842 L1853 | V1777-L1855 HydrophobicContact CG1-CB 3.92Å; V1777-L1855 HydrophobicContact CG1-CD1 4.43Å; V1777-L1855 HydrophobicContact CG1-CD2 4.1Å; V1777-L1855 HydrophobicContact CG1-CG 4.41Å; V1778-L1855 CarbonylContact O-C 3.48Å; V1778-L1855 WeakPolarHBondContact O-CA 3.39Å; R1779-L1855 HydrophobicContact CB-CD2 4.02Å; R1779-L1855 HydrophobicContact CG-CD2 4.27Å; L1789-L1855 HydrophobicContact CD1-CD1 4.2Å; L1789-L1855 HydrophobicContact CD2-CD1 4.27Å; I1798-L1855 HydrophobicContact CD1-CD2 4.4Å; S1841-L1855 CarbonylContact C-O 3.48Å; S1841-L1855 WeakPolarHBondContact CA-O 3.4Å; I1842-L1855 HydrophobicContact CD1-CD1 4.21Å; I1842-L1855 HydrophobicContact CG1-CB 3.86Å; I1842-L1855 HydrophobicContact CG1-CD1 4.38Å; I1842-L1855 HydrophobicContact CG2-CB 3.64Å; I1842-L1855 HydrophobicContact CG2-CD1 4.37Å; I1842-L1855 HydrophobicContact CG2-CG 4.47Å; I1842-L1855 WeakPolarHBondContact CG2-O 3.48Å; I1842-L1855 PolarHBondContact N-O 3.07Å; I1842-L1855 PolarHBondContact O-N 3.12Å; L1853-L1855 HydrophobicContact CD1-CD2 4.22Å; L1853-L1855 HydrophobicContact CD2-CD1 4.16Å; L1853-L1855 HydrophobicContact CD2-CD2 3.76Å; L1853-L1855 VanDerWaalsContact CD2-CD2 3.47Å; L1853-L1855 HydrophobicContact CD2-CG 3.94Å; L1853-L1855 HydrophobicContact CG-CD2 3.96Å; L1853-L1855 HydrophobicContact CG-CG 4.12Å |
| 1856 | I | 86.5 | Confident | 79.8 | Confident | 62.6 Ų | 62.6 | 52.8 Ų | 52.8 | 32% | 0.321 | 30% | 0.3 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -117.4 | 129.2 | 173.3 | -59.2 | 173.9 | 0 | 0 | 0 | 109.1 | V1778 L1780 N1840 | V1778-I1856 HydrophobicContact CB-CB 4.25Å; V1778-I1856 PolarHBondContact N-O 3.02Å; V1778-I1856 PolarHBondContact O-N 3.11Å; L1780-I1856 HydrophobicContact CD1-CD1 3.73Å; L1780-I1856 HydrophobicContact CD1-CG1 3.95Å; L1780-I1856 HydrophobicContact CD2-CD1 3.91Å; L1780-I1856 HydrophobicContact CG-CD1 3.84Å; L1780-I1856 HydrophobicContact CG-CG1 4.15Å; N1840-I1856 HydrophobicContact CB-CG2 4.44Å; N1840-I1856 CarbonylContact O-C 3.47Å; N1840-I1856 VanDerWaalsContact O-CA 3.27Å; N1840-I1856 WeakPolarHBondContact O-CA 3.38Å; N1840-I1856 VanDerWaalsContact O-CG2 3.27Å; N1840-I1856 WeakPolarHBondContact O-CG2 3.36Å |
| 1857 | H | 89 | Confident | 80.1 | Confident | 20 Ų | 20 | 52.5 Ų | 52.5 | 9% | 0.093 | 30% | 0.299 | C | S | . | . | trans | -158.5 | 156.4 | 176.5 | -167.9 | -110.5 | 0 | 0 | 0 | 111.2 | N1775 V1777 N1840 E1859 C1860 I1863 | N1775-H1857 PolarHBondContact O-CD2 3.3Å; N1775-H1857 VanDerWaalsContact O-CD2 3.27Å; N1775-H1857 PolarHBondContact O-NE2 3.07Å; V1777-H1857 HydrophobicContact CG1-CB 4.5Å; V1777-H1857 HydrophobicContact CG2-CB 4.17Å; V1777-H1857 VanDerWaalsContact CG2-CD2 3.5Å; V1777-H1857 WeakPolarHBondContact CG2-CD2 3.48Å; N1840-H1857 CarbonylContact C-O 3.29Å; N1840-H1857 VanDerWaalsContact CA-O 3.28Å; N1840-H1857 WeakPolarHBondContact CA-O 3.41Å; N1840-H1857 PolarHBondContact O-N 3.09Å; N1840-H1857 VanDerWaalsContact O-N 3.09Å; H1857-E1859 VanDerWaalsContact C-N 3.28Å; H1857-E1859 IonicContact CE1-OE2 3.22Å; H1857-E1859 WeakPolarHBondContact ND1-CB 3.36Å; H1857-E1859 PolarHBondContact ND1-N 3.29Å; H1857-E1859 VanDerWaalsContact ND1-N 3.12Å; H1857-E1859 PolarHBondContact O-N 3.09Å; H1857-C1860 PolarHBondContact N-SG 2.93Å; H1857-C1860 PolarHBondContact O-SG 3.21Å; H1857-I1863 HydrophobicContact CB-CD1 3.72Å; H1857-I1863 WeakPolarHBondContact ND1-CD1 3.34Å | ||
| 1858 | S | 86.9 | Confident | 80.5 | Confident | 92.4 Ų | 92.4 | 51.4 Ų | 51.4 | 65% | 0.646 | 30% | 0.297 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -72.4 | -20 | 177.3 | 52.1 | 0 | 0 | 0 | 0 | 113.9 | ||
| 1859 | E | 86.3 | Confident | 81.4 | Confident | 84.2 Ų | 84.2 | 51.6 Ų | 51.6 | 39% | 0.393 | 30% | 0.298 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -112.1 | 41.4 | -179 | -55.7 | 176 | 169.3 | 0 | 0 | 111.4 | F1774 H1857 E1861 Q1862 I1863 | F1774-E1859 WeakPolarHBondContact CD1-OE2 3.4Å; H1857-E1859 VanDerWaalsContact C-N 3.28Å; H1857-E1859 IonicContact CE1-OE2 3.22Å; H1857-E1859 WeakPolarHBondContact ND1-CB 3.36Å; H1857-E1859 PolarHBondContact ND1-N 3.29Å; H1857-E1859 VanDerWaalsContact ND1-N 3.12Å; H1857-E1859 PolarHBondContact O-N 3.09Å; E1859-E1861 VanDerWaalsContact C-N 3.29Å; E1859-E1861 PolarHBondContact O-N 3.23Å; E1859-Q1862 HydrophobicContact CB-CB 4.38Å; E1859-Q1862 HydrophobicContact CB-CG 4.48Å; E1859-Q1862 PolarHBondContact O-N 3.22Å; E1859-Q1862 VanDerWaalsContact O-N 3.14Å; E1859-I1863 WeakPolarHBondContact O-CG1 3.43Å; E1859-I1863 PolarHBondContact O-N 3.15Å; E1859-I1863 VanDerWaalsContact O-N 3.14Å |
| 1860 | C | 83.5 | Confident | 82.1 | Confident | 1.4 Ų | 1.4 | 48.9 Ų | 48.9 | 1% | 0.009 | 29% | 0.286 | C | S | . | . | H | α-helix | trans | -56.8 | -38 | -175.5 | -88.9 | 0 | 0 | 0 | 0 | 113.6 | N1840 S1841 I1842 H1857 Q1862 I1863 A1864 | N1840-C1860 PolarHBondContact O-SG 3.15Å; S1841-C1860 PolarHBondContact N-SG 3.27Å; I1842-C1860 HydrophobicContact CB-CB 4.38Å; I1842-C1860 HydrophobicContact CG2-CB 3.59Å; H1857-C1860 PolarHBondContact N-SG 2.93Å; H1857-C1860 PolarHBondContact O-SG 3.21Å; C1860-Q1862 PolarHBondContact O-N 3.23Å; C1860-I1863 PolarHBondContact O-N 3.17Å; C1860-A1864 WeakPolarHBondContact O-CB 3.41Å; C1860-A1864 PolarHBondContact O-N 3.14Å |
| 1861 | E | 78.8 | Confident | 83 | Confident | 150 Ų | 150 | 45.7 Ų | 45.7 | 70% | 0.701 | 26% | 0.261 | S | S | * | . | H | α-helix | trans | -63.4 | -39.9 | 176.8 | -67.6 | -172.5 | 159.5 | 0 | 0 | 113 | E1859 I1863 A1864 S1865 | E1859-E1861 VanDerWaalsContact C-N 3.29Å; E1859-E1861 PolarHBondContact O-N 3.23Å; E1861-I1863 VanDerWaalsContact C-N 3.34Å; E1861-A1864 WeakPolarHBondContact O-CB 3.29Å; E1861-A1864 PolarHBondContact O-N 2.87Å; E1861-S1865 WeakPolarHBondContact O-CB 3.32Å; E1861-S1865 PolarHBondContact O-N 3.02Å |
| 1862 | Q | 85.6 | Confident | 83.5 | Confident | 111.4 Ų | 111.4 | 44.5 Ų | 44.5 | 52% | 0.521 | 25% | 0.253 | S | S | . | . | H | α-helix | trans | -69.5 | -36.4 | 178.3 | -65.1 | -171.2 | 25.8 | 0 | 0 | 111.7 | F1774 E1859 C1860 S1866 | F1774-Q1862 HydrophobicContact CE1-CB 4.21Å; F1774-Q1862 HydrophobicContact CZ-CB 4.45Å; E1859-Q1862 HydrophobicContact CB-CB 4.38Å; E1859-Q1862 HydrophobicContact CB-CG 4.48Å; E1859-Q1862 PolarHBondContact O-N 3.22Å; E1859-Q1862 VanDerWaalsContact O-N 3.14Å; C1860-Q1862 PolarHBondContact O-N 3.23Å; Q1862-S1866 VanDerWaalsContact O-CB 3.27Å; Q1862-S1866 WeakPolarHBondContact O-CB 3.34Å; Q1862-S1866 PolarHBondContact O-N 3.34Å; Q1862-S1866 PolarHBondContact O-OG 2.91Å |
| 1863 | I | 86 | Confident | 83.9 | Confident | 0.4 Ų | 0.4 | 48.4 Ų | 48.4 | 0% | 0.002 | 26% | 0.263 | C | S | . | . | H | α-helix | trans | -63.2 | -51.4 | 172.5 | -66.7 | 172.1 | 0 | 0 | 0 | 109.3 | F1774 V1777 L1789 I1791 I1842 H1857 E1859 C1860 E1861 S1865 S1866 V1867 | F1774-I1863 HydrophobicContact CB-CD1 4.26Å; F1774-I1863 HydrophobicContact CB-CG1 4.49Å; F1774-I1863 HydrophobicContact CD1-CD1 4.16Å; F1774-I1863 HydrophobicContact CD1-CG1 3.74Å; F1774-I1863 HydrophobicContact CD2-CD1 4.5Å; F1774-I1863 HydrophobicContact CD2-CG1 3.91Å; F1774-I1863 HydrophobicContact CE1-CG1 3.81Å; F1774-I1863 HydrophobicContact CE2-CG1 4.01Å; F1774-I1863 HydrophobicContact CG-CD1 4.06Å; F1774-I1863 HydrophobicContact CG-CG1 3.78Å; F1774-I1863 HydrophobicContact CZ-CG1 3.94Å; V1777-I1863 HydrophobicContact CG2-CD1 4.32Å; L1789-I1863 HydrophobicContact CD2-CB 4.46Å; L1789-I1863 HydrophobicContact CD2-CD1 4.02Å; L1789-I1863 HydrophobicContact CD2-CG1 4.14Å; L1789-I1863 HydrophobicContact CD2-CG2 3.51Å; L1789-I1863 VanDerWaalsContact CD2-CG2 3.48Å; I1791-I1863 HydrophobicContact CD1-CG2 4.16Å; I1842-I1863 HydrophobicContact CD1-CB 4.29Å; I1842-I1863 HydrophobicContact CD1-CG2 3.77Å; H1857-I1863 HydrophobicContact CB-CD1 3.72Å; H1857-I1863 WeakPolarHBondContact ND1-CD1 3.34Å; E1859-I1863 WeakPolarHBondContact O-CG1 3.43Å; E1859-I1863 PolarHBondContact O-N 3.15Å; E1859-I1863 VanDerWaalsContact O-N 3.14Å; C1860-I1863 PolarHBondContact O-N 3.17Å; E1861-I1863 VanDerWaalsContact C-N 3.34Å; I1863-S1865 VanDerWaalsContact C-N 3.35Å; I1863-S1865 PolarHBondContact O-N 3.36Å; I1863-S1866 PolarHBondContact O-N 3.07Å; I1863-S1866 VanDerWaalsContact O-N 3.12Å; I1863-V1867 HydrophobicContact CG2-CG2 4.36Å; I1863-V1867 WeakPolarHBondContact O-CG2 3.34Å; I1863-V1867 PolarHBondContact O-N 3.16Å |
| 1864 | A | 82 | Confident | 84 | Confident | 14.6 Ų | 14.6 | 51.3 Ų | 51.3 | 12% | 0.121 | 27% | 0.274 | C | S | . | . | H | α-helix | trans | -56.2 | -49.2 | 179.2 | 0 | 0 | 0 | 0 | 0 | 112 | V1834 V1836 I1842 C1860 E1861 S1866 V1867 A1868 | V1834-A1864 HydrophobicContact CB-CB 4.22Å; V1834-A1864 HydrophobicContact CG1-CB 3.79Å; V1834-A1864 VanDerWaalsContact CG1-CB 3.45Å; V1836-A1864 HydrophobicContact CG2-CB 4.1Å; I1842-A1864 HydrophobicContact CD1-CB 3.61Å; I1842-A1864 HydrophobicContact CG1-CB 4.43Å; I1842-A1864 HydrophobicContact CG2-CB 4.38Å; C1860-A1864 WeakPolarHBondContact O-CB 3.41Å; C1860-A1864 PolarHBondContact O-N 3.14Å; E1861-A1864 WeakPolarHBondContact O-CB 3.29Å; E1861-A1864 PolarHBondContact O-N 2.87Å; A1864-S1866 VanDerWaalsContact C-N 3.33Å; A1864-S1866 PolarHBondContact O-N 3.31Å; A1864-V1867 PolarHBondContact O-N 3.08Å; A1864-A1868 WeakPolarHBondContact O-CB 3.36Å; A1864-A1868 PolarHBondContact O-N 3.1Å |
| 1865 | S | 83.5 | Confident | 83.5 | Confident | 65.6 Ų | 65.6 | 52.4 Ų | 52.4 | 46% | 0.459 | 28% | 0.275 | S | S | . | . | H | α-helix | trans | -61.2 | -41.1 | 177 | -179.9 | 0 | 0 | 0 | 0 | 112 | E1861 I1863 A1868 N1869 | E1861-S1865 WeakPolarHBondContact O-CB 3.32Å; E1861-S1865 PolarHBondContact O-N 3.02Å; I1863-S1865 VanDerWaalsContact C-N 3.35Å; I1863-S1865 PolarHBondContact O-N 3.36Å; S1865-A1868 PolarHBondContact O-N 3.16Å; S1865-N1869 VanDerWaalsContact O-CB 3.31Å; S1865-N1869 WeakPolarHBondContact O-CB 3.38Å; S1865-N1869 VanDerWaalsContact O-CG 3.29Å; S1865-N1869 PolarHBondContact O-N 3.12Å; S1865-N1869 PolarHBondContact O-ND2 3.19Å; S1865-N1869 PolarHBondContact OG-ND2 3Å |
| 1866 | S | 85.1 | Confident | 83.2 | Confident | 11.2 Ų | 11.2 | 59.5 Ų | 59.5 | 8% | 0.078 | 31% | 0.312 | C | S | . | . | H | α-helix | trans | -69.1 | -39.5 | 179.6 | -60.4 | 0 | 0 | 0 | 0 | 112.2 | K1772 Q1862 I1863 A1864 N1869 I1870 | K1772-S1866 PolarHBondContact NZ-OG 2.93Å; Q1862-S1866 VanDerWaalsContact O-CB 3.27Å; Q1862-S1866 WeakPolarHBondContact O-CB 3.34Å; Q1862-S1866 PolarHBondContact O-N 3.34Å; Q1862-S1866 PolarHBondContact O-OG 2.91Å; I1863-S1866 PolarHBondContact O-N 3.07Å; I1863-S1866 VanDerWaalsContact O-N 3.12Å; A1864-S1866 VanDerWaalsContact C-N 3.33Å; A1864-S1866 PolarHBondContact O-N 3.31Å; S1866-N1869 PolarHBondContact O-N 3.28Å; S1866-I1870 WeakPolarHBondContact O-CG1 3.37Å; S1866-I1870 PolarHBondContact O-N 3.22Å |
| 1867 | V | 85 | Confident | 82.9 | Confident | 2.6 Ų | 2.6 | 60.3 Ų | 60.3 | 2% | 0.016 | 32% | 0.323 | C | S | . | . | H | α-helix | trans | -64.3 | -46.8 | 174 | 174 | 0 | 0 | 0 | 0 | 111 | I1791 L1796 I1822 V1834 V1844 I1863 A1864 N1869 I1870 R1871 | I1791-V1867 HydrophobicContact CD1-CG2 3.95Å; L1796-V1867 HydrophobicContact CD1-CG2 4.34Å; I1822-V1867 HydrophobicContact CD1-CG1 4.11Å; I1822-V1867 HydrophobicContact CG2-CG1 4.34Å; V1834-V1867 HydrophobicContact CG2-CB 4.02Å; V1834-V1867 HydrophobicContact CG2-CG1 3.75Å; V1844-V1867 HydrophobicContact CG1-CG1 4.46Å; I1863-V1867 HydrophobicContact CG2-CG2 4.36Å; I1863-V1867 WeakPolarHBondContact O-CG2 3.34Å; I1863-V1867 PolarHBondContact O-N 3.16Å; A1864-V1867 PolarHBondContact O-N 3.08Å; V1867-N1869 VanDerWaalsContact C-N 3.31Å; V1867-N1869 PolarHBondContact O-N 3.04Å; V1867-I1870 WeakPolarHBondContact O-CG1 3.23Å; V1867-I1870 PolarHBondContact O-N 3.11Å; V1867-R1871 PolarHBondContact O-N 3.2Å; V1867-R1871 VanDerWaalsContact O-N 3.15Å |
| 1868 | A | 80.6 | Confident | 82.2 | Confident | 30.2 Ų | 30.2 | 63.5 Ų | 63.5 | 25% | 0.25 | 34% | 0.338 | C | S | . | . | H | α-helix | trans | -60.1 | -40.7 | 176.8 | 0 | 0 | 0 | 0 | 0 | 112 | F1832 A1864 S1865 I1870 R1871 S1872 | F1832-A1868 HydrophobicContact CE1-CB 4.39Å; A1864-A1868 WeakPolarHBondContact O-CB 3.36Å; A1864-A1868 PolarHBondContact O-N 3.1Å; S1865-A1868 PolarHBondContact O-N 3.16Å; A1868-I1870 VanDerWaalsContact C-N 3.32Å; A1868-I1870 PolarHBondContact O-N 3.1Å; A1868-R1871 PolarHBondContact O-N 3.08Å; A1868-R1871 VanDerWaalsContact O-N 3.13Å; A1868-S1872 WeakPolarHBondContact O-CB 3.45Å; A1868-S1872 PolarHBondContact O-N 3.17Å; A1868-S1872 PolarHBondContact O-OG 3.17Å; A1868-S1872 VanDerWaalsContact O-OG 3.11Å |
| 1869 | N | 84 | Confident | 81.2 | Confident | 86.6 Ų | 86.6 | 63.1 Ų | 63.1 | 46% | 0.463 | 33% | 0.334 | S | S | . | . | H | α-helix | trans | -63.8 | -38.2 | 178.6 | -91.9 | -40.1 | 0 | 0 | 0 | 113.3 | S1865 S1866 V1867 R1871 K1873 | S1865-N1869 VanDerWaalsContact O-CB 3.31Å; S1865-N1869 WeakPolarHBondContact O-CB 3.38Å; S1865-N1869 VanDerWaalsContact O-CG 3.29Å; S1865-N1869 PolarHBondContact O-N 3.12Å; S1865-N1869 PolarHBondContact O-ND2 3.19Å; S1865-N1869 PolarHBondContact OG-ND2 3Å; S1866-N1869 PolarHBondContact O-N 3.28Å; V1867-N1869 VanDerWaalsContact C-N 3.31Å; V1867-N1869 PolarHBondContact O-N 3.04Å; N1869-R1871 VanDerWaalsContact C-N 3.32Å; N1869-R1871 PolarHBondContact O-N 3.37Å; N1869-K1873 VanDerWaalsContact O-CB 3.31Å; N1869-K1873 WeakPolarHBondContact O-CB 3.3Å; N1869-K1873 VanDerWaalsContact O-CG 3.25Å; N1869-K1873 WeakPolarHBondContact O-CG 3.31Å; N1869-K1873 PolarHBondContact O-N 3.25Å; N1869-K1873 VanDerWaalsContact O-N 3.1Å |
| 1870 | I | 85.3 | Confident | 79.7 | Confident | 13.2 Ų | 13.2 | 67.6 Ų | 67.6 | 7% | 0.068 | 36% | 0.36 | C | S | . | . | H | α-helix | trans | -65.3 | -41.6 | 175.3 | -40.9 | 164.3 | 0 | 0 | 0 | 110.4 | I1791 G1792 P1793 A1819 I1822 S1866 V1867 A1868 K1873 Y1874 | I1791-I1870 HydrophobicContact CB-CD1 4.45Å; I1791-I1870 HydrophobicContact CG2-CD1 3.18Å; I1791-I1870 HydrophobicContact CG2-CG1 4.19Å; G1792-I1870 WeakPolarHBondContact O-CD1 3.42Å; G1792-I1870 WeakPolarHBondContact O-CG1 3.38Å; G1792-I1870 WeakPolarHBondContact O-CG2 3.38Å; P1793-I1870 VanDerWaalsContact C-CG2 3.46Å; P1793-I1870 WeakPolarHBondContact O-CG2 3.35Å; A1819-I1870 HydrophobicContact CB-CD1 4.47Å; A1819-I1870 HydrophobicContact CB-CG2 3.81Å; I1822-I1870 HydrophobicContact CD1-CD1 3.99Å; I1822-I1870 HydrophobicContact CD1-CG1 4.48Å; S1866-I1870 WeakPolarHBondContact O-CG1 3.37Å; S1866-I1870 PolarHBondContact O-N 3.22Å; V1867-I1870 WeakPolarHBondContact O-CG1 3.23Å; V1867-I1870 PolarHBondContact O-N 3.11Å; A1868-I1870 VanDerWaalsContact C-N 3.32Å; A1868-I1870 PolarHBondContact O-N 3.1Å; I1870-K1873 PolarHBondContact O-N 3.18Å; I1870-Y1874 WeakPolarHBondContact O-CB 3.45Å; I1870-Y1874 PolarHBondContact O-N 3.21Å; I1870-Y1874 VanDerWaalsContact O-N 3.1Å |
| 1871 | R | 80.2 | Confident | 78.2 | Confident | 28.6 Ų | 28.6 | 73.5 Ų | 73.5 | 11% | 0.108 | 39% | 0.388 | C | S | . | . | H | α-helix | trans | -66.4 | -50 | 179.7 | -178.9 | 62.8 | -167.9 | -168.7 | -0.6 | 112 | A1819 S1820 I1822 E1824 V1867 A1868 N1869 K1873 Y1874 E1875 | A1819-R1871 VanDerWaalsContact O-CD 3.28Å; A1819-R1871 WeakPolarHBondContact O-CD 3.27Å; A1819-R1871 PolarHBondContact O-NH1 2.98Å; S1820-R1871 PolarHBondContact O-NH1 3.18Å; I1822-R1871 VanDerWaalsContact O-CZ 3.31Å; I1822-R1871 PolarHBondContact O-NH1 3.25Å; I1822-R1871 VanDerWaalsContact O-NH1 3.11Å; E1824-R1871 VanDerWaalsContact CD-NH2 3.35Å; E1824-R1871 HydrophobicContact CG-CG 4.45Å; E1824-R1871 IonicContact OE1-NH2 3.98Å; E1824-R1871 PolarHBondContact OE1-NH2 3.06Å; E1824-R1871 IonicContact OE2-NH2 3.47Å; E1824-R1871 PolarHBondContact OE2-NH2 2.98Å; V1867-R1871 PolarHBondContact O-N 3.2Å; V1867-R1871 VanDerWaalsContact O-N 3.15Å; A1868-R1871 PolarHBondContact O-N 3.08Å; A1868-R1871 VanDerWaalsContact O-N 3.13Å; N1869-R1871 VanDerWaalsContact C-N 3.32Å; N1869-R1871 PolarHBondContact O-N 3.37Å; R1871-K1873 VanDerWaalsContact C-N 3.29Å; R1871-K1873 PolarHBondContact O-N 3.09Å; R1871-Y1874 WeakPolarHBondContact O-CA 3.26Å; R1871-Y1874 WeakPolarHBondContact O-CB 3.4Å; R1871-Y1874 PolarHBondContact O-N 3.04Å; R1871-E1875 WeakPolarHBondContact CG-OE1 3.36Å; R1871-E1875 IonicContact CZ-OE1 2.98Å; R1871-E1875 VanDerWaalsContact CZ-OE1 3.3Å; R1871-E1875 IonicContact NE-OE1 3.17Å; R1871-E1875 PolarHBondContact NE-OE1 3.03Å; R1871-E1875 IonicContact NH2-OE1 3.19Å; R1871-E1875 PolarHBondContact NH2-OE1 3.25Å; R1871-E1875 VanDerWaalsContact NH2-OE1 3.11Å; R1871-E1875 PolarHBondContact O-N 3.02Å |
| 1872 | S | 78.9 | Confident | 76.5 | Confident | 47 Ų | 47 | 70.6 Ų | 70.6 | 33% | 0.329 | 38% | 0.384 | S | S | . | . | H | α-helix | trans | -61 | -37.6 | 178 | -102.5 | 0 | 0 | 0 | 0 | 112.3 | A1868 Y1874 E1875 L1876 | A1868-S1872 WeakPolarHBondContact O-CB 3.45Å; A1868-S1872 PolarHBondContact O-N 3.17Å; A1868-S1872 PolarHBondContact O-OG 3.17Å; A1868-S1872 VanDerWaalsContact O-OG 3.11Å; S1872-Y1874 VanDerWaalsContact C-N 3.34Å; S1872-E1875 PolarHBondContact O-N 3.17Å; S1872-L1876 WeakPolarHBondContact O-CB 3.34Å; S1872-L1876 WeakPolarHBondContact O-CD1 3.37Å; S1872-L1876 VanDerWaalsContact O-CG 3.26Å; S1872-L1876 WeakPolarHBondContact O-CG 3.37Å; S1872-L1876 PolarHBondContact O-N 2.91Å |
| 1873 | K | 83.4 | Confident | 74.6 | Confident | 149.4 Ų | 149.4 | 70.6 Ų | 70.6 | 65% | 0.65 | 39% | 0.394 | S | S | * | . | H | α-helix | trans | -64.1 | -39.8 | 172.6 | -80.2 | -179.4 | 178.1 | -176 | 0 | 112.5 | N1869 I1870 R1871 S1877 | N1869-K1873 VanDerWaalsContact O-CB 3.31Å; N1869-K1873 WeakPolarHBondContact O-CB 3.3Å; N1869-K1873 VanDerWaalsContact O-CG 3.25Å; N1869-K1873 WeakPolarHBondContact O-CG 3.31Å; N1869-K1873 PolarHBondContact O-N 3.25Å; N1869-K1873 VanDerWaalsContact O-N 3.1Å; I1870-K1873 PolarHBondContact O-N 3.18Å; R1871-K1873 VanDerWaalsContact C-N 3.29Å; R1871-K1873 PolarHBondContact O-N 3.09Å; K1873-S1877 WeakPolarHBondContact O-CB 3.39Å; K1873-S1877 PolarHBondContact O-N 3.05Å; K1873-S1877 VanDerWaalsContact O-N 3.13Å; K1873-S1877 PolarHBondContact O-OG 3.14Å |
| 1874 | Y | 82.2 | Confident | 72.7 | Confident | 69.8 Ų | 69.8 | 75.7 Ų | 75.7 | 27% | 0.274 | 43% | 0.425 | S | S | . | . | H | α-helix | trans | -64.2 | -47.2 | 175.8 | 172.5 | -95.8 | 0 | 0 | 0 | 111.2 | A1819 S1820 I1870 R1871 S1872 L1876 S1877 Q1878 | A1819-Y1874 HydrophobicContact CB-CD2 4.21Å; A1819-Y1874 HydrophobicContact CB-CG 3.98Å; S1820-Y1874 VanDerWaalsContact CB-CZ 3.43Å; S1820-Y1874 VanDerWaalsContact CB-OH 3.31Å; S1820-Y1874 WeakPolarHBondContact CB-OH 3.38Å; I1870-Y1874 WeakPolarHBondContact O-CB 3.45Å; I1870-Y1874 PolarHBondContact O-N 3.21Å; I1870-Y1874 VanDerWaalsContact O-N 3.1Å; R1871-Y1874 WeakPolarHBondContact O-CA 3.26Å; R1871-Y1874 WeakPolarHBondContact O-CB 3.4Å; R1871-Y1874 PolarHBondContact O-N 3.04Å; S1872-Y1874 VanDerWaalsContact C-N 3.34Å; Y1874-L1876 PolarHBondContact O-N 2.91Å; Y1874-S1877 WeakPolarHBondContact O-CB 3.31Å; Y1874-S1877 PolarHBondContact O-N 3.03Å; Y1874-S1877 VanDerWaalsContact O-N 3.09Å; Y1874-S1877 PolarHBondContact O-OG 2.94Å; Y1874-Q1878 HydrophobicContact CD1-CG 4.44Å; Y1874-Q1878 HydrophobicContact CE1-CG 4.12Å; Y1874-Q1878 VanDerWaalsContact CZ-NE2 3.34Å; Y1874-Q1878 WeakPolarHBondContact O-CG 3.19Å; Y1874-Q1878 PolarHBondContact O-N 3.37Å; Y1874-Q1878 PolarHBondContact O-NE2 3.02Å; Y1874-Q1878 PolarHBondContact OH-NE2 3.14Å; Y1874-Q1878 VanDerWaalsContact OH-NE2 3.17Å |
| 1875 | E | 75.6 | Confident | 71.1 | Confident | 56.4 Ų | 56.4 | 81.7 Ų | 81.7 | 26% | 0.264 | 45% | 0.45 | S | S | . | . | H | α-helix | trans | -59.6 | -49.1 | 177.5 | -75.9 | 163 | -177 | 0 | 0 | 112.3 | E1824 R1871 S1872 S1877 Q1878 | E1824-E1875 WeakPolarHBondContact CG-OE1 3.37Å; E1824-E1875 VanDerWaalsContact OE1-OE1 3.08Å; E1824-E1875 VanDerWaalsContact OE2-OE1 3.1Å; R1871-E1875 WeakPolarHBondContact CG-OE1 3.36Å; R1871-E1875 IonicContact CZ-OE1 2.98Å; R1871-E1875 VanDerWaalsContact CZ-OE1 3.3Å; R1871-E1875 IonicContact NE-OE1 3.17Å; R1871-E1875 PolarHBondContact NE-OE1 3.03Å; R1871-E1875 IonicContact NH2-OE1 3.19Å; R1871-E1875 PolarHBondContact NH2-OE1 3.25Å; R1871-E1875 VanDerWaalsContact NH2-OE1 3.11Å; R1871-E1875 PolarHBondContact O-N 3.02Å; S1872-E1875 PolarHBondContact O-N 3.17Å; E1875-S1877 PolarHBondContact O-N 3.27Å; E1875-S1877 VanDerWaalsContact O-N 3.14Å; E1875-Q1878 PolarHBondContact O-N 3.08Å; E1875-Q1878 VanDerWaalsContact O-N 3.09Å |
| 1876 | L | 79.2 | Confident | 69.5 | Low | 151.2 Ų | 151.2 | 81.7 Ų | 81.7 | 79% | 0.792 | 45% | 0.447 | S | S | * | . | H | α-helix | trans | -62.6 | -19.1 | 176.2 | -71.5 | 167.7 | 0 | 0 | 0 | 113.5 | S1872 Y1874 | S1872-L1876 WeakPolarHBondContact O-CB 3.34Å; S1872-L1876 WeakPolarHBondContact O-CD1 3.37Å; S1872-L1876 VanDerWaalsContact O-CG 3.26Å; S1872-L1876 WeakPolarHBondContact O-CG 3.37Å; S1872-L1876 PolarHBondContact O-N 2.91Å; Y1874-L1876 PolarHBondContact O-N 2.91Å |
| 1877 | S | 80.6 | Confident | 68.1 | Low | 79.8 Ų | 79.8 | 89 Ų | 89 | 56% | 0.558 | 48% | 0.478 | S | S | * | . | H | α-helix | trans | -89.9 | -14.1 | 177.1 | 75.7 | 0 | 0 | 0 | 0 | 113.8 | K1873 Y1874 E1875 | K1873-S1877 WeakPolarHBondContact O-CB 3.39Å; K1873-S1877 PolarHBondContact O-N 3.05Å; K1873-S1877 VanDerWaalsContact O-N 3.13Å; K1873-S1877 PolarHBondContact O-OG 3.14Å; Y1874-S1877 WeakPolarHBondContact O-CB 3.31Å; Y1874-S1877 PolarHBondContact O-N 3.03Å; Y1874-S1877 VanDerWaalsContact O-N 3.09Å; Y1874-S1877 PolarHBondContact O-OG 2.94Å; E1875-S1877 PolarHBondContact O-N 3.27Å; E1875-S1877 VanDerWaalsContact O-N 3.14Å |
| 1878 | Q | 72.7 | Confident | 66.8 | Low | 86.8 Ų | 86.8 | 92.1 Ų | 92.1 | 41% | 0.406 | 49% | 0.493 | S | S | . | . | S | Bend | trans | -76.4 | 135.9 | 175.3 | -64.8 | -56.6 | -39.3 | 0 | 0 | 109.8 | Y1874 E1875 | Y1874-Q1878 HydrophobicContact CD1-CG 4.44Å; Y1874-Q1878 HydrophobicContact CE1-CG 4.12Å; Y1874-Q1878 VanDerWaalsContact CZ-NE2 3.34Å; Y1874-Q1878 WeakPolarHBondContact O-CG 3.19Å; Y1874-Q1878 PolarHBondContact O-N 3.37Å; Y1874-Q1878 PolarHBondContact O-NE2 3.02Å; Y1874-Q1878 PolarHBondContact OH-NE2 3.14Å; Y1874-Q1878 VanDerWaalsContact OH-NE2 3.17Å; E1875-Q1878 PolarHBondContact O-N 3.08Å; E1875-Q1878 VanDerWaalsContact O-N 3.09Å |
| 1879 | P | 67.4 | Low | 65.9 | Low | 84 Ų | 84 | 93.4 Ų | 93.4 | 55% | 0.545 | 49% | 0.492 | S | S | . | . | trans | -63.6 | 145.2 | 171.3 | 25.9 | -31.1 | 0 | 0 | 0 | 110 | Q1881 | P1879-Q1881 VanDerWaalsContact C-N 3.31Å; P1879-Q1881 HydrophobicContact CB-CG 4.4Å; P1879-Q1881 HydrophobicContact CG-CG 4.3Å; P1879-Q1881 WeakPolarHBondContact O-CG 3.49Å; P1879-Q1881 PolarHBondContact O-N 2.86Å | ||
| 1880 | D | 55.2 | Low | 64.8 | Low | 178.4 Ų | 178.4 | 90.6 Ų | 90.6 | 95% | 0.954 | 48% | 0.481 | S | S | * | . | trans | -57.2 | 81.6 | 173.7 | -73.9 | -33.9 | 0 | 0 | 0 | 110.7 | ||||
| 1881 | Q | 50 | Low | 63.8 | Low | 125.4 Ų | 125.4 | 94.4 Ų | 94.4 | 59% | 0.586 | 50% | 0.497 | S | S | * | . | trans | -89.9 | 134.6 | 172.6 | -69.6 | -170.4 | 9.5 | 0 | 0 | 108.5 | P1879 V1884 | P1879-Q1881 VanDerWaalsContact C-N 3.31Å; P1879-Q1881 HydrophobicContact CB-CG 4.4Å; P1879-Q1881 HydrophobicContact CG-CG 4.3Å; P1879-Q1881 WeakPolarHBondContact O-CG 3.49Å; P1879-Q1881 PolarHBondContact O-N 2.86Å; Q1881-V1884 HydrophobicContact CB-CG2 4.44Å | ||
| 1882 | S | 44 | Very low | 63.1 | Low | 89.4 Ų | 89.4 | 96.3 Ų | 96.3 | 63% | 0.625 | 51% | 0.509 | S | S | * | . | trans | -38.4 | 135 | 168.5 | 50.8 | 0 | 0 | 0 | 0 | 110.4 | V1884 | S1882-V1884 PolarHBondContact O-N 3.21Š| ||
| 1883 | P | 46.4 | Very low | 63 | Low | 111.8 Ų | 111.8 | 95.1 Ų | 95.1 | 73% | 0.726 | 50% | 0.5 | S | S | * | . | trans | -54.8 | 105.2 | -173.1 | 23.3 | -33.4 | 0 | 0 | 0 | 108.5 | H1885 | P1883-H1885 VanDerWaalsContact C-N 3.26Å; P1883-H1885 PolarHBondContact O-N 3.1Å | ||
| 1884 | V | 45.9 | Very low | 63.1 | Low | 108.2 Ų | 108.2 | 88.7 Ų | 88.7 | 66% | 0.656 | 47% | 0.474 | S | S | * | . | trans | -60.3 | 113.5 | 171.4 | 175.8 | 0 | 0 | 0 | 0 | 103.9 | Q1881 S1882 T1886 | Q1881-V1884 HydrophobicContact CB-CG2 4.44Å; S1882-V1884 PolarHBondContact O-N 3.21Å; V1884-T1886 PolarHBondContact O-N 3.07Å | ||
| 1885 | H | 47.5 | Very low | 63.3 | Low | 140.4 Ų | 140.4 | 85.4 Ų | 85.4 | 65% | 0.65 | 46% | 0.461 | S | S | * | . | trans | -40 | 113.3 | -179.4 | -89.6 | -71.4 | 0 | 0 | 0 | 108.8 | M1221 P1883 K1887 | M1221-H1885 HydrophobicContact CE-CB 3.68Å; M1221-H1885 HydrophobicContact SD-CB 3.96Å; M1221-H1885 PolarHBondContact SD-ND1 3.13Å; M1221-H1885 VanDerWaalsContact SD-ND1 3.42Å; P1883-H1885 VanDerWaalsContact C-N 3.26Å; P1883-H1885 PolarHBondContact O-N 3.1Å; H1885-K1887 PolarHBondContact O-N 3.15Å; H1885-K1887 VanDerWaalsContact O-N 3.09Å | ||
| 1886 | T | 51 | Low | 64 | Low | 65.4 Ų | 65.4 | 83.9 Ų | 83.9 | 40% | 0.401 | 46% | 0.455 | S | S | . | . | trans | -51.5 | 122.4 | -174.7 | 38.5 | 0 | 0 | 0 | 0 | 108.6 | M1221 S1826 E1827 V1884 I1888 | M1221-T1886 WeakPolarHBondContact CE-O 3.26Å; S1826-T1886 WeakPolarHBondContact OG-CG2 3.17Å; E1827-T1886 HydrophobicContact CG-CG2 4.25Å; E1827-T1886 WeakPolarHBondContact OE2-CB 3.4Å; E1827-T1886 WeakPolarHBondContact OE2-CG2 3.21Å; E1827-T1886 PolarHBondContact OE2-OG1 2.82Å; V1884-T1886 PolarHBondContact O-N 3.07Å; T1886-I1888 VanDerWaalsContact C-N 3.29Å; T1886-I1888 VanDerWaalsContact O-CG1 3.3Å; T1886-I1888 WeakPolarHBondContact O-CG1 3.33Å; T1886-I1888 PolarHBondContact O-N 2.93Å | ||
| 1887 | K | 55.2 | Low | 64.5 | Low | 165.2 Ų | 165.2 | 77.6 Ų | 77.6 | 72% | 0.718 | 42% | 0.422 | S | S | * | . | trans | -62.6 | 97.3 | -178.7 | -89.7 | -179 | 179 | 179.3 | 0 | 108.7 | D1217 H1885 R1889 | D1217-K1887 HydrophobicContact CB-CB 4.44Å; D1217-K1887 HydrophobicContact CB-CD 4.39Å; D1217-K1887 HydrophobicContact CB-CG 4.48Å; D1217-K1887 IonicContact OD2-NZ 3.6Å; H1885-K1887 PolarHBondContact O-N 3.15Å; H1885-K1887 VanDerWaalsContact O-N 3.09Å; K1887-R1889 PolarHBondContact O-N 3.15Å; K1887-R1889 VanDerWaalsContact O-N 3.09Å | ||
| 1888 | I | 58.5 | Low | 65.1 | Low | 66.6 Ų | 66.6 | 73.8 Ų | 73.8 | 34% | 0.342 | 40% | 0.396 | S | S | . | . | trans | -75.8 | 109.9 | -180 | -57.5 | 179.5 | 0 | 0 | 0 | 107.4 | D1217 L1220 M1221 I1224 T1886 V1893 | D1217-I1888 PolarHBondContact O-N 2.96Å; L1220-I1888 HydrophobicContact CB-CG2 4.47Å; L1220-I1888 HydrophobicContact CD2-CG2 3.81Å; M1221-I1888 HydrophobicContact CB-CD1 4.24Å; M1221-I1888 HydrophobicContact CE-CG1 4.44Å; M1221-I1888 HydrophobicContact CG-CD1 4.39Å; I1224-I1888 HydrophobicContact CD1-CG2 4.48Å; T1886-I1888 VanDerWaalsContact C-N 3.29Å; T1886-I1888 VanDerWaalsContact O-CG1 3.3Å; T1886-I1888 WeakPolarHBondContact O-CG1 3.33Å; T1886-I1888 PolarHBondContact O-N 2.93Å; I1888-V1893 HydrophobicContact CG2-CB 4.33Å; I1888-V1893 HydrophobicContact CG2-CG1 3.53Å; I1888-V1893 VanDerWaalsContact CG2-CG1 3.47Å; I1888-V1893 HydrophobicContact CG2-CG2 3.8Å | ||
| 1889 | R | 60.6 | Low | 66.2 | Low | 57 Ų | 57 | 69.7 Ų | 69.7 | 22% | 0.215 | 38% | 0.377 | C | S | . | . | trans | -85.4 | 150.5 | 169.8 | -54.3 | 172.8 | -67.6 | -152.3 | -5.2 | 108.2 | D1823 N1848 K1887 K1891 D1892 | D1823-R1889 IonicContact OD2-CZ 3.71Å; D1823-R1889 IonicContact OD2-NH1 2.69Å; D1823-R1889 PolarHBondContact OD2-NH1 3.47Å; D1823-R1889 VanDerWaalsContact OD2-NH1 3.08Å; D1823-R1889 IonicContact OD2-NH2 3.22Å; D1823-R1889 PolarHBondContact OD2-NH2 3.14Å; N1848-R1889 VanDerWaalsContact N-NH1 3.17Å; N1848-R1889 PolarHBondContact OD1-NH1 3.02Å; K1887-R1889 PolarHBondContact O-N 3.15Å; K1887-R1889 VanDerWaalsContact O-N 3.09Å; R1889-K1891 HydrophobicContact CB-CG 4.05Å; R1889-K1891 VanDerWaalsContact CZ-CE 3.4Å; R1889-K1891 VanDerWaalsContact NE-CE 3.25Å; R1889-K1891 PolarHBondContact O-N 3.36Å; R1889-K1891 VanDerWaalsContact O-N 3.11Å; R1889-D1892 WeakPolarHBondContact CA-OD2 3.32Å; R1889-D1892 VanDerWaalsContact CB-OD2 3.28Å; R1889-D1892 WeakPolarHBondContact CB-OD2 3.46Å; R1889-D1892 VanDerWaalsContact CG-OD2 3.25Å; R1889-D1892 WeakPolarHBondContact CG-OD2 3.4Å; R1889-D1892 IonicContact CZ-OD1 2.81Å; R1889-D1892 IonicContact CZ-OD2 3.4Å; R1889-D1892 PolarHBondContact N-OD2 3.04Å; R1889-D1892 IonicContact NE-OD1 3.43Å; R1889-D1892 PolarHBondContact NE-OD1 3.04Å; R1889-D1892 VanDerWaalsContact NE-OD1 3.08Å; R1889-D1892 IonicContact NE-OD2 2.9Å; R1889-D1892 PolarHBondContact NE-OD2 2.89Å; R1889-D1892 IonicContact NH2-OD1 3.29Å; R1889-D1892 PolarHBondContact NH2-OD1 3.05Å; R1889-D1892 IonicContact NH2-OD2 3.23Å; R1889-D1892 PolarHBondContact NH2-OD2 3.09Å; R1889-D1892 WeakPolarHBondContact O-CB 3.29Å; R1889-D1892 PolarHBondContact O-N 3.12Å | ||
| 1890 | A | 62.1 | Low | 67.4 | Low | 27.6 Ų | 27.6 | 67.7 Ų | 67.7 | 23% | 0.228 | 36% | 0.36 | C | S | . | . | G | 310 helix | trans | -56.2 | -29 | 176.6 | 0 | 0 | 0 | 0 | 0 | 112.9 | I1216 L1220 F1252 D1892 V1893 L1897 F1927 | I1216-A1890 HydrophobicContact CD1-CB 3.71Å; I1216-A1890 HydrophobicContact CG1-CB 4.38Å; L1220-A1890 HydrophobicContact CD2-CB 4.26Å; F1252-A1890 HydrophobicContact CE1-CB 4.23Å; F1252-A1890 HydrophobicContact CZ-CB 3.76Å; A1890-D1892 VanDerWaalsContact C-N 3.29Å; A1890-D1892 PolarHBondContact O-N 3.07Å; A1890-V1893 PolarHBondContact O-N 3.03Å; A1890-L1897 HydrophobicContact CB-CD1 4.32Å; A1890-F1927 WeakPolarHBondContact O-CZ 3.37Å |
| 1891 | K | 62.3 | Low | 69.2 | Low | 94.8 Ų | 94.8 | 59.2 Ų | 59.2 | 41% | 0.412 | 32% | 0.315 | S | S | . | . | G | 310 helix | trans | -68.2 | -22 | 175.8 | -24.1 | 179.1 | -177 | 178.6 | 0 | 114.6 | F1252 E1849 R1889 V1893 P1894 F1927 | F1252-K1891 HydrophobicContact CE1-CB 3.66Å; F1252-K1891 HydrophobicContact CE1-CD 4.03Å; F1252-K1891 HydrophobicContact CE1-CG 4.05Å; F1252-K1891 HydrophobicContact CZ-CB 3.75Å; F1252-K1891 HydrophobicContact CZ-CG 4.2Å; E1849-K1891 PolarHBondContact O-NZ 2.88Å; E1849-K1891 VanDerWaalsContact O-NZ 3.12Å; R1889-K1891 HydrophobicContact CB-CG 4.05Å; R1889-K1891 VanDerWaalsContact CZ-CE 3.4Å; R1889-K1891 VanDerWaalsContact NE-CE 3.25Å; R1889-K1891 PolarHBondContact O-N 3.36Å; R1889-K1891 VanDerWaalsContact O-N 3.11Å; K1891-V1893 VanDerWaalsContact C-N 3.35Å; K1891-P1894 WeakPolarHBondContact O-CD 3.3Å; K1891-F1927 HydrophobicContact CB-CE1 4.4Å; K1891-F1927 HydrophobicContact CG-CE1 4.28Å |
| 1892 | D | 65.5 | Low | 71.3 | Confident | 66.8 Ų | 66.8 | 53.2 Ų | 53.2 | 36% | 0.357 | 29% | 0.287 | S | S | . | . | G | 310 helix | trans | -89.8 | -10.5 | -175.7 | -51.9 | -37.5 | 0 | 0 | 0 | 111.7 | R1889 A1890 P1894 | R1889-D1892 WeakPolarHBondContact CA-OD2 3.32Å; R1889-D1892 VanDerWaalsContact CB-OD2 3.28Å; R1889-D1892 WeakPolarHBondContact CB-OD2 3.46Å; R1889-D1892 VanDerWaalsContact CG-OD2 3.25Å; R1889-D1892 WeakPolarHBondContact CG-OD2 3.4Å; R1889-D1892 IonicContact CZ-OD1 2.81Å; R1889-D1892 IonicContact CZ-OD2 3.4Å; R1889-D1892 PolarHBondContact N-OD2 3.04Å; R1889-D1892 IonicContact NE-OD1 3.43Å; R1889-D1892 PolarHBondContact NE-OD1 3.04Å; R1889-D1892 VanDerWaalsContact NE-OD1 3.08Å; R1889-D1892 IonicContact NE-OD2 2.9Å; R1889-D1892 PolarHBondContact NE-OD2 2.89Å; R1889-D1892 IonicContact NH2-OD1 3.29Å; R1889-D1892 PolarHBondContact NH2-OD1 3.05Å; R1889-D1892 IonicContact NH2-OD2 3.23Å; R1889-D1892 PolarHBondContact NH2-OD2 3.09Å; R1889-D1892 WeakPolarHBondContact O-CB 3.29Å; R1889-D1892 PolarHBondContact O-N 3.12Å; A1890-D1892 VanDerWaalsContact C-N 3.29Å; A1890-D1892 PolarHBondContact O-N 3.07Å; D1892-P1894 VanDerWaalsContact C-CD 3.44Å |
| 1893 | V | 78.6 | Confident | 73.7 | Confident | 23 Ų | 23 | 49.5 Ų | 49.5 | 14% | 0.139 | 26% | 0.26 | C | S | . | . | trans | -129 | 46.2 | -177.2 | -66.5 | 0 | 0 | 0 | 0 | 115.9 | L1220 I1224 I1888 A1890 K1891 G1895 T1896 L1897 E1968 | L1220-V1893 HydrophobicContact CD2-CG2 3.45Å; L1220-V1893 VanDerWaalsContact CD2-CG2 3.45Å; I1224-V1893 HydrophobicContact CD1-CG2 4.41Å; I1888-V1893 HydrophobicContact CG2-CB 4.33Å; I1888-V1893 HydrophobicContact CG2-CG1 3.53Å; I1888-V1893 VanDerWaalsContact CG2-CG1 3.47Å; I1888-V1893 HydrophobicContact CG2-CG2 3.8Å; A1890-V1893 PolarHBondContact O-N 3.03Å; K1891-V1893 VanDerWaalsContact C-N 3.35Å; V1893-G1895 VanDerWaalsContact C-N 3.35Å; V1893-G1895 PolarHBondContact O-N 3.22Å; V1893-T1896 PolarHBondContact O-N 3.04Å; V1893-L1897 HydrophobicContact CG2-CG 4.44Å; V1893-L1897 WeakPolarHBondContact O-CG 3.38Å; V1893-L1897 PolarHBondContact O-N 3.13Å; V1893-E1968 WeakPolarHBondContact CA-OE1 3.43Å; V1893-E1968 WeakPolarHBondContact CB-OE1 3.35Å | ||
| 1894 | P | 84.6 | Confident | 76 | Confident | 15.4 Ų | 15.4 | 45 Ų | 45 | 10% | 0.1 | 23% | 0.23 | C | C | . | . | H | α-helix | trans | -62.2 | -37.7 | -180 | 24.8 | -33.3 | 0 | 0 | 0 | 113.4 | K1891 D1892 T1896 L1898 F1927 F1929 L1965 E1968 | K1891-P1894 WeakPolarHBondContact O-CD 3.3Å; D1892-P1894 VanDerWaalsContact C-CD 3.44Å; P1894-T1896 VanDerWaalsContact C-N 3.34Å; P1894-T1896 PolarHBondContact O-N 2.84Å; P1894-L1898 VanDerWaalsContact O-CB 3.3Å; P1894-L1898 WeakPolarHBondContact O-CB 3.41Å; P1894-L1898 PolarHBondContact O-N 3.05Å; P1894-F1927 HydrophobicContact CB-CD1 4.3Å; P1894-F1927 HydrophobicContact CB-CD2 4.31Å; P1894-F1927 HydrophobicContact CB-CE1 4.21Å; P1894-F1927 HydrophobicContact CB-CE2 4.2Å; P1894-F1927 HydrophobicContact CB-CG 4.43Å; P1894-F1927 HydrophobicContact CB-CZ 4.24Å; P1894-F1929 HydrophobicContact CB-CZ 4.31Å; P1894-L1965 HydrophobicContact CB-CD2 3.81Å; P1894-L1965 HydrophobicContact CG-CD2 3.43Å; P1894-L1965 VanDerWaalsContact CG-CD2 3.42Å; P1894-E1968 WeakPolarHBondContact CD-OE2 3.39Å |
| 1895 | G | 87.1 | Confident | 78.3 | Confident | 0 Ų | 0 | 39.9 Ų | 39.9 | 0% | 0 | 20% | 0.199 | C | C | . | . | H | α-helix | trans | -67 | -37 | 179.1 | 0 | 0 | 0 | 0 | 0 | 112.8 | V1893 L1898 N1899 E1968 F1969 | V1893-G1895 VanDerWaalsContact C-N 3.35Å; V1893-G1895 PolarHBondContact O-N 3.22Å; G1895-L1898 PolarHBondContact O-N 3.31Å; G1895-N1899 PolarHBondContact O-N 3.24Å; G1895-E1968 WeakPolarHBondContact CA-OE2 3.37Å; G1895-E1968 VanDerWaalsContact N-CD 3.27Å; G1895-E1968 PolarHBondContact N-OE1 2.86Å; G1895-E1968 VanDerWaalsContact N-OE1 3.16Å; G1895-E1968 PolarHBondContact N-OE2 3.1Å; G1895-F1969 WeakPolarHBondContact O-CD2 3.5Å |
| 1896 | T | 88.9 | Confident | 80.4 | Confident | 24.6 Ų | 24.6 | 34.1 Ų | 34.1 | 15% | 0.151 | 18% | 0.177 | C | C | . | . | H | α-helix | trans | -64.8 | -49.4 | 178.6 | -57.2 | 0 | 0 | 0 | 0 | 110.9 | I1224 V1893 P1894 L1898 N1899 M1900 E1968 E1972 | I1224-T1896 HydrophobicContact CD1-CG2 4.45Å; I1224-T1896 HydrophobicContact CG2-CG2 3.89Å; V1893-T1896 PolarHBondContact O-N 3.04Å; P1894-T1896 VanDerWaalsContact C-N 3.34Å; P1894-T1896 PolarHBondContact O-N 2.84Å; T1896-L1898 VanDerWaalsContact C-N 3.3Å; T1896-L1898 PolarHBondContact O-N 3.22Å; T1896-N1899 PolarHBondContact O-N 3.19Å; T1896-M1900 PolarHBondContact O-N 3.27Å; T1896-E1968 VanDerWaalsContact CB-OE1 3.32Å; T1896-E1968 WeakPolarHBondContact CB-OE1 3.41Å; T1896-E1968 PolarHBondContact N-OE1 2.99Å; T1896-E1968 PolarHBondContact OG1-OE1 3.07Å; T1896-E1972 HydrophobicContact CG2-CG 3.87Å |
| 1897 | L | 91 | Very high | 82.3 | Confident | 18 Ų | 18 | 31.5 Ų | 31.5 | 9% | 0.094 | 16% | 0.162 | C | C | . | . | H | α-helix | trans | -65.7 | -34.9 | 177.8 | -63 | 175.5 | 0 | 0 | 0 | 111.7 | L1242 A1890 V1893 M1900 A1901 L1923 | L1242-L1897 HydrophobicContact CD1-CD2 4Å; L1242-L1897 HydrophobicContact CD2-CD2 4.4Å; A1890-L1897 HydrophobicContact CB-CD1 4.32Å; V1893-L1897 HydrophobicContact CG2-CG 4.44Å; V1893-L1897 WeakPolarHBondContact O-CG 3.38Å; V1893-L1897 PolarHBondContact O-N 3.13Å; L1897-M1900 WeakPolarHBondContact O-CB 3.45Å; L1897-M1900 PolarHBondContact O-N 3.4Å; L1897-A1901 PolarHBondContact O-N 3.11Å; L1897-L1923 HydrophobicContact CB-CD1 3.9Å; L1897-L1923 HydrophobicContact CB-CD2 3.65Å; L1897-L1923 HydrophobicContact CB-CG 4.42Å; L1897-L1923 HydrophobicContact CD1-CD2 3.84Å; L1897-L1923 HydrophobicContact CG-CD2 4.4Å; L1897-L1923 WeakPolarHBondContact O-CD1 3.38Å |
| 1898 | L | 93.1 | Very high | 84 | Confident | 0 Ų | 0 | 29.5 Ų | 29.5 | 0% | 0 | 16% | 0.163 | C | C | . | . | H | α-helix | trans | -64.1 | -45.1 | 175 | 179.9 | 62.6 | 0 | 0 | 0 | 111.9 | P1894 G1895 T1896 M1900 A1901 L1902 L1920 L1958 L1965 F1969 W1995 | P1894-L1898 VanDerWaalsContact O-CB 3.3Å; P1894-L1898 WeakPolarHBondContact O-CB 3.41Å; P1894-L1898 PolarHBondContact O-N 3.05Å; G1895-L1898 PolarHBondContact O-N 3.31Å; T1896-L1898 VanDerWaalsContact C-N 3.3Å; T1896-L1898 PolarHBondContact O-N 3.22Å; L1898-M1900 VanDerWaalsContact C-N 3.32Å; L1898-M1900 PolarHBondContact O-N 3.16Å; L1898-A1901 PolarHBondContact O-N 3.27Å; L1898-L1902 HydrophobicContact CD1-CD1 4.17Å; L1898-L1902 HydrophobicContact CD1-CG 4.19Å; L1898-L1902 HydrophobicContact CG-CD1 4.17Å; L1898-L1902 HydrophobicContact CG-CG 4.49Å; L1898-L1902 WeakPolarHBondContact O-CG 3.35Å; L1898-L1902 PolarHBondContact O-N 3.24Å; L1898-L1920 HydrophobicContact CD1-CD1 3.74Å; L1898-L1958 HydrophobicContact CD1-CD1 3.62Å; L1898-L1958 HydrophobicContact CD2-CD1 3.89Å; L1898-L1958 HydrophobicContact CG-CD1 4.37Å; L1898-L1965 HydrophobicContact CD2-CD1 4.33Å; L1898-F1969 HydrophobicContact CB-CD2 4.28Å; L1898-F1969 HydrophobicContact CB-CE2 4.4Å; L1898-F1969 HydrophobicContact CD2-CD2 3.94Å; L1898-F1969 HydrophobicContact CD2-CE2 4.03Å; L1898-F1969 HydrophobicContact CG-CD2 4.08Å; L1898-F1969 HydrophobicContact CG-CE2 3.88Å; L1898-W1995 HydrophobicContact CD2-CH2 4.34Å; L1898-W1995 HydrophobicContact CD2-CZ2 4.08Å |
| 1899 | N | 94.3 | Very high | 85.5 | Confident | 1.8 Ų | 1.8 | 28.9 Ų | 28.9 | 1% | 0.01 | 16% | 0.161 | C | C | . | . | H | α-helix | trans | -60.3 | -44.6 | 174.6 | 179.4 | 60.3 | 0 | 0 | 0 | 111.2 | Y1228 G1895 T1896 A1901 L1902 L1903 F1969 E1972 C1973 Y1991 | Y1228-N1899 PolarHBondContact OH-ND2 3.38Å; G1895-N1899 PolarHBondContact O-N 3.24Å; T1896-N1899 PolarHBondContact O-N 3.19Å; N1899-A1901 VanDerWaalsContact C-N 3.3Å; N1899-A1901 PolarHBondContact O-N 3.21Å; N1899-L1902 PolarHBondContact O-N 3.22Å; N1899-L1903 VanDerWaalsContact O-CB 3.24Å; N1899-L1903 WeakPolarHBondContact O-CB 3.36Å; N1899-L1903 PolarHBondContact O-N 2.93Å; N1899-F1969 HydrophobicContact CB-CD2 4.15Å; N1899-F1969 HydrophobicContact CB-CE2 3.97Å; N1899-E1972 HydrophobicContact CB-CB 4.39Å; N1899-E1972 HydrophobicContact CB-CG 4.1Å; N1899-E1972 PolarHBondContact ND2-O 3Å; N1899-C1973 VanDerWaalsContact CG-SG 3.54Å; N1899-C1973 VanDerWaalsContact OD1-CA 3.28Å; N1899-C1973 WeakPolarHBondContact OD1-CA 3.33Å; N1899-C1973 WeakPolarHBondContact OD1-CB 3.46Å; N1899-C1973 PolarHBondContact OD1-SG 3.3Å; N1899-Y1991 PolarHBondContact OD1-OH 3.05Å |
| 1900 | M | 92.9 | Very high | 87 | Confident | 41.4 Ų | 41.4 | 29.8 Ų | 29.8 | 20% | 0.204 | 17% | 0.174 | C | C | . | . | H | α-helix | trans | -56.9 | -43.9 | 176.4 | -172.6 | -178 | -99 | 0 | 0 | 111.6 | I1224 F1238 L1242 T1896 L1897 L1898 N1904 L1919 | I1224-M1900 HydrophobicContact CG2-CE 4.29Å; I1224-M1900 VanDerWaalsContact O-CE 3.26Å; I1224-M1900 WeakPolarHBondContact O-CE 3.42Å; F1238-M1900 HydrophobicContact CD1-SD 4.25Å; F1238-M1900 HydrophobicContact CE1-CE 3.99Å; F1238-M1900 HydrophobicContact CE1-SD 3.82Å; L1242-M1900 HydrophobicContact CD1-CE 4.42Å; L1242-M1900 HydrophobicContact CD1-SD 3.7Å; T1896-M1900 PolarHBondContact O-N 3.27Å; L1897-M1900 WeakPolarHBondContact O-CB 3.45Å; L1897-M1900 PolarHBondContact O-N 3.4Å; L1898-M1900 VanDerWaalsContact C-N 3.32Å; L1898-M1900 PolarHBondContact O-N 3.16Å; M1900-N1904 WeakPolarHBondContact CG-ND2 3.25Å; M1900-N1904 VanDerWaalsContact O-CB 3.28Å; M1900-N1904 WeakPolarHBondContact O-CB 3.43Å; M1900-N1904 PolarHBondContact O-N 3.04Å; M1900-N1904 VanDerWaalsContact O-N 3.09Å; M1900-N1904 PolarHBondContact O-ND2 3.12Å; M1900-L1919 HydrophobicContact CG-CD2 4.48Å; M1900-L1919 HydrophobicContact SD-CD2 4.39Å |
| 1901 | A | 93.7 | Very high | 88.3 | Confident | 0.8 Ų | 0.8 | 31.6 Ų | 31.6 | 1% | 0.007 | 19% | 0.185 | C | C | . | . | H | α-helix | trans | -64.6 | -50 | 177.1 | 0 | 0 | 0 | 0 | 0 | 112.1 | L1897 L1898 N1899 L1903 N1904 L1905 L1919 L1920 L1923 | L1897-A1901 PolarHBondContact O-N 3.11Å; L1898-A1901 PolarHBondContact O-N 3.27Å; N1899-A1901 VanDerWaalsContact C-N 3.3Å; N1899-A1901 PolarHBondContact O-N 3.21Å; A1901-L1903 PolarHBondContact O-N 2.92Å; A1901-N1904 PolarHBondContact O-N 3.14Å; A1901-L1905 VanDerWaalsContact O-CB 3.29Å; A1901-L1905 WeakPolarHBondContact O-CB 3.25Å; A1901-L1905 PolarHBondContact O-N 3.22Å; A1901-L1905 VanDerWaalsContact O-N 3.1Å; A1901-L1919 HydrophobicContact CB-CD2 4.09Å; A1901-L1919 HydrophobicContact CB-CG 4.2Å; A1901-L1920 HydrophobicContact CB-CB 4.18Å; A1901-L1923 HydrophobicContact CB-CD1 4.19Å |
| 1902 | L | 94.9 | Very high | 89.8 | Confident | 0 Ų | 0 | 28.2 Ų | 28.2 | 0% | 0 | 17% | 0.171 | C | C | . | . | H | α-helix | trans | -66.6 | -39.9 | -176.7 | -65.5 | 178.1 | 0 | 0 | 0 | 112.8 | L1898 N1899 L1905 L1920 I1951 V1954 F1969 Y1991 | L1898-L1902 HydrophobicContact CD1-CD1 4.17Å; L1898-L1902 HydrophobicContact CD1-CG 4.19Å; L1898-L1902 HydrophobicContact CG-CD1 4.17Å; L1898-L1902 HydrophobicContact CG-CG 4.49Å; L1898-L1902 WeakPolarHBondContact O-CG 3.35Å; L1898-L1902 PolarHBondContact O-N 3.24Å; N1899-L1902 PolarHBondContact O-N 3.22Å; L1902-L1905 WeakPolarHBondContact O-CB 3.49Å; L1902-L1905 PolarHBondContact O-N 2.97Å; L1902-L1920 HydrophobicContact CD2-CD1 4.44Å; L1902-I1951 HydrophobicContact CB-CG2 4.26Å; L1902-I1951 HydrophobicContact CD2-CG2 4.2Å; L1902-V1954 HydrophobicContact CD2-CG1 3.94Å; L1902-F1969 HydrophobicContact CD1-CE2 3.91Å; L1902-F1969 HydrophobicContact CD1-CZ 3.84Å; L1902-Y1991 HydrophobicContact CB-CE2 4.45Å; L1902-Y1991 HydrophobicContact CD1-CD2 4.36Å |
| 1903 | L | 94.4 | Very high | 91.1 | Very high | 10.8 Ų | 10.8 | 25.6 Ų | 25.6 | 6% | 0.057 | 16% | 0.157 | C | C | . | . | H | α-helix | trans | -65.1 | -49.3 | 177.9 | -171 | 91.4 | 0 | 0 | 0 | 111.4 | Y1228 N1899 A1901 L1905 G1906 I1984 C1988 Y1991 | Y1228-L1903 HydrophobicContact CD1-CD2 3.5Å; Y1228-L1903 VanDerWaalsContact CD1-CD2 3.48Å; Y1228-L1903 HydrophobicContact CE1-CD2 3.52Å; N1899-L1903 VanDerWaalsContact O-CB 3.24Å; N1899-L1903 WeakPolarHBondContact O-CB 3.36Å; N1899-L1903 PolarHBondContact O-N 2.93Å; A1901-L1903 PolarHBondContact O-N 2.92Å; L1903-L1905 VanDerWaalsContact C-N 3.26Å; L1903-L1905 PolarHBondContact O-N 3.1Å; L1903-G1906 PolarHBondContact O-N 3.43Å; L1903-G1906 VanDerWaalsContact O-N 3.1Å; L1903-I1984 HydrophobicContact CD1-CG2 3.53Å; L1903-I1984 HydrophobicContact CD2-CG2 3.95Å; L1903-I1984 HydrophobicContact CG-CG2 3.93Å; L1903-C1988 WeakPolarHBondContact CD1-SG 3.3Å; L1903-Y1991 HydrophobicContact CD1-CE1 4.4Å; L1903-Y1991 VanDerWaalsContact CD1-OH 3.32Å; L1903-Y1991 WeakPolarHBondContact CD1-OH 3.46Å |
| 1904 | N | 93.9 | Very high | 91.8 | Very high | 17.6 Ų | 17.6 | 25.8 Ų | 25.8 | 9% | 0.094 | 16% | 0.158 | C | C | . | . | H | α-helix | trans | -68.9 | -25.4 | -178.9 | -76.3 | -67.9 | 0 | 0 | 0 | 112.7 | G1227 R1235 M1900 A1901 G1906 S1907 L1912 A1916 | G1227-N1904 PolarHBondContact O-ND2 2.92Å; R1235-N1904 PolarHBondContact NE-OD1 3.27Å; R1235-N1904 VanDerWaalsContact NH2-CG 3.3Å; R1235-N1904 PolarHBondContact NH2-OD1 3.29Å; M1900-N1904 WeakPolarHBondContact CG-ND2 3.25Å; M1900-N1904 VanDerWaalsContact O-CB 3.28Å; M1900-N1904 WeakPolarHBondContact O-CB 3.43Å; M1900-N1904 PolarHBondContact O-N 3.04Å; M1900-N1904 VanDerWaalsContact O-N 3.09Å; M1900-N1904 PolarHBondContact O-ND2 3.12Å; A1901-N1904 PolarHBondContact O-N 3.14Å; N1904-G1906 PolarHBondContact O-N 3.32Å; N1904-S1907 VanDerWaalsContact O-CB 3.26Å; N1904-S1907 WeakPolarHBondContact O-CB 3.38Å; N1904-S1907 PolarHBondContact O-N 3.04Å; N1904-S1907 VanDerWaalsContact O-N 3.12Å; N1904-L1912 HydrophobicContact CB-CD1 4.07Å; N1904-L1912 HydrophobicContact CB-CD2 4.42Å; N1904-L1912 HydrophobicContact CB-CG 4.09Å; N1904-L1912 WeakPolarHBondContact OD1-CD1 3.37Å; N1904-L1912 WeakPolarHBondContact OD1-CD2 3.24Å; N1904-A1916 HydrophobicContact CB-CB 3.68Å |
| 1905 | L | 93.9 | Very high | 92.1 | Very high | 0.6 Ų | 0.6 | 26.3 Ų | 26.3 | 0% | 0.003 | 16% | 0.163 | C | C | . | . | H | α-helix | trans | -64.1 | -23.4 | 174.4 | -162.2 | 63.5 | 0 | 0 | 0 | 112.5 | A1901 L1902 L1903 S1907 R1913 A1916 I1943 N1947 F1950 I1951 | A1901-L1905 VanDerWaalsContact O-CB 3.29Å; A1901-L1905 WeakPolarHBondContact O-CB 3.25Å; A1901-L1905 PolarHBondContact O-N 3.22Å; A1901-L1905 VanDerWaalsContact O-N 3.1Å; L1902-L1905 WeakPolarHBondContact O-CB 3.49Å; L1902-L1905 PolarHBondContact O-N 2.97Å; L1903-L1905 VanDerWaalsContact C-N 3.26Å; L1903-L1905 PolarHBondContact O-N 3.1Å; L1905-S1907 VanDerWaalsContact C-N 3.32Å; L1905-S1907 PolarHBondContact O-N 2.98Å; L1905-R1913 HydrophobicContact CD1-CB 4.38Å; L1905-R1913 VanDerWaalsContact CD1-O 3.28Å; L1905-R1913 WeakPolarHBondContact CD1-O 3.44Å; L1905-R1913 VanDerWaalsContact O-CD 3.26Å; L1905-R1913 WeakPolarHBondContact O-CD 3.42Å; L1905-R1913 VanDerWaalsContact O-CG 3.29Å; L1905-R1913 WeakPolarHBondContact O-CG 3.42Å; L1905-A1916 HydrophobicContact CB-CB 4.16Å; L1905-A1916 HydrophobicContact CD1-CB 4.26Å; L1905-I1943 HydrophobicContact CD1-CD1 3.95Å; L1905-I1943 HydrophobicContact CD1-CG2 4.46Å; L1905-N1947 PolarHBondContact O-ND2 3.19Å; L1905-N1947 PolarHBondContact O-OD1 3.19Å; L1905-F1950 HydrophobicContact CD2-CD1 3.92Å; L1905-F1950 HydrophobicContact CD2-CE1 3.75Å; L1905-I1951 HydrophobicContact CB-CD1 4Å; L1905-I1951 HydrophobicContact CB-CG1 4.26Å; L1905-I1951 HydrophobicContact CD2-CD1 4.41Å; L1905-I1951 HydrophobicContact CD2-CG1 3.83Å; L1905-I1951 HydrophobicContact CG-CD1 4.18Å; L1905-I1951 HydrophobicContact CG-CG1 4.13Å |
| 1906 | G | 91.4 | Very high | 92.5 | Very high | 17.8 Ų | 17.8 | 26.4 Ų | 26.4 | 18% | 0.184 | 16% | 0.164 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -85.5 | 3.8 | 174.2 | 0 | 0 | 0 | 0 | 0 | 115.9 | L1903 N1904 L1987 | L1903-G1906 PolarHBondContact O-N 3.43Å; L1903-G1906 VanDerWaalsContact O-N 3.1Å; N1904-G1906 PolarHBondContact O-N 3.32Å; G1906-L1987 VanDerWaalsContact CA-CD2 3.43Å |
| 1907 | S | 92.3 | Very high | 92.7 | Very high | 11.4 Ų | 11.4 | 26.5 Ų | 26.5 | 8% | 0.08 | 16% | 0.162 | C | C | . | . | trans | -66.2 | 151.1 | -177.4 | -176.8 | 0 | 0 | 0 | 0 | 112.9 | N1904 L1905 D1909 R1913 | N1904-S1907 VanDerWaalsContact O-CB 3.26Å; N1904-S1907 WeakPolarHBondContact O-CB 3.38Å; N1904-S1907 PolarHBondContact O-N 3.04Å; N1904-S1907 VanDerWaalsContact O-N 3.12Å; L1905-S1907 VanDerWaalsContact C-N 3.32Å; L1905-S1907 PolarHBondContact O-N 2.98Å; S1907-D1909 VanDerWaalsContact C-N 3.27Å; S1907-D1909 PolarHBondContact O-N 3.04Å; S1907-D1909 PolarHBondContact OG-N 3.15Å; S1907-D1909 VanDerWaalsContact OG-N 3.16Å; S1907-R1913 VanDerWaalsContact O-CD 3.31Å; S1907-R1913 WeakPolarHBondContact O-CD 3.38Å; S1907-R1913 WeakPolarHBondContact O-CG 3.37Å; S1907-R1913 PolarHBondContact O-NE 3.35Å; S1907-R1913 PolarHBondContact O-NH1 3.23Å | ||
| 1908 | T | 90.1 | Very high | 92.8 | Very high | 123.4 Ų | 123.4 | 26.8 Ų | 26.8 | 76% | 0.757 | 16% | 0.163 | S | C | * | . | S | Bend | trans | -67.9 | -25.8 | 170.7 | 52.6 | 0 | 0 | 0 | 0 | 112.3 | P1910 R1913 | T1908-P1910 WeakPolarHBondContact O-CD 3.31Å; T1908-R1913 PolarHBondContact O-NH1 3.4Å |
| 1909 | D | 90.9 | Very high | 92.7 | Very high | 53.8 Ų | 53.8 | 27.8 Ų | 27.8 | 29% | 0.288 | 17% | 0.169 | S | C | . | . | trans | -75.5 | 121.1 | 179.3 | 179 | 3.6 | 0 | 0 | 0 | 112.1 | T1232 S1907 S1911 L1912 R1913 | T1232-D1909 HydrophobicContact CG2-CB 3.68Å; S1907-D1909 VanDerWaalsContact C-N 3.27Å; S1907-D1909 PolarHBondContact O-N 3.04Å; S1907-D1909 PolarHBondContact OG-N 3.15Å; S1907-D1909 VanDerWaalsContact OG-N 3.16Å; D1909-S1911 VanDerWaalsContact C-N 3.31Å; D1909-S1911 PolarHBondContact O-N 3.01Å; D1909-S1911 WeakPolarHBondContact OD1-CA 3.07Å; D1909-S1911 WeakPolarHBondContact OD1-CB 3.32Å; D1909-S1911 PolarHBondContact OD1-N 3.27Å; D1909-S1911 VanDerWaalsContact OD1-N 3.13Å; D1909-S1911 PolarHBondContact OD1-OG 3.05Å; D1909-S1911 WeakPolarHBondContact OD2-CA 3.45Å; D1909-S1911 WeakPolarHBondContact OD2-CB 3.33Å; D1909-S1911 PolarHBondContact OD2-N 3.24Å; D1909-S1911 PolarHBondContact OD2-OG 3.07Å; D1909-L1912 HydrophobicContact CB-CB 4.12Å; D1909-L1912 PolarHBondContact O-N 3.35Å; D1909-L1912 PolarHBondContact OD1-N 3.12Å; D1909-L1912 VanDerWaalsContact OD2-CB 3.28Å; D1909-L1912 WeakPolarHBondContact OD2-CB 3.44Å; D1909-L1912 PolarHBondContact OD2-N 3.06Å; D1909-R1913 WeakPolarHBondContact O-CG 3.38Å; D1909-R1913 PolarHBondContact O-N 3.09Å; D1909-R1913 VanDerWaalsContact O-N 3.11Å; D1909-R1913 PolarHBondContact O-NE 2.85Å | ||
| 1910 | P | 91.1 | Very high | 92.6 | Very high | 75.4 Ų | 75.4 | 27.8 Ų | 27.8 | 49% | 0.49 | 17% | 0.169 | S | C | . | . | H | α-helix | trans | -61.6 | -35.2 | 178.1 | -13 | 21.2 | 0 | 0 | 0 | 113.7 | T1908 R1913 T1914 | T1908-P1910 WeakPolarHBondContact O-CD 3.31Å; P1910-R1913 PolarHBondContact O-N 3.16Å; P1910-T1914 PolarHBondContact O-N 3.05Å; P1910-T1914 VanDerWaalsContact O-N 3.14Å; P1910-T1914 PolarHBondContact O-OG1 3.19Å; P1910-T1914 VanDerWaalsContact O-OG1 3.13Å |
| 1911 | S | 90.3 | Very high | 92.5 | Very high | 65.6 Ų | 65.6 | 26.4 Ų | 26.4 | 46% | 0.459 | 16% | 0.163 | S | C | . | . | H | α-helix | trans | -69.3 | -41 | -176.6 | 80.4 | 0 | 0 | 0 | 0 | 111.5 | V1236 D1909 R1913 T1914 A1915 | V1236-S1911 WeakPolarHBondContact CG2-OG 3.35Å; D1909-S1911 VanDerWaalsContact C-N 3.31Å; D1909-S1911 PolarHBondContact O-N 3.01Å; D1909-S1911 WeakPolarHBondContact OD1-CA 3.07Å; D1909-S1911 WeakPolarHBondContact OD1-CB 3.32Å; D1909-S1911 PolarHBondContact OD1-N 3.27Å; D1909-S1911 VanDerWaalsContact OD1-N 3.13Å; D1909-S1911 PolarHBondContact OD1-OG 3.05Å; D1909-S1911 WeakPolarHBondContact OD2-CA 3.45Å; D1909-S1911 WeakPolarHBondContact OD2-CB 3.33Å; D1909-S1911 PolarHBondContact OD2-N 3.24Å; D1909-S1911 PolarHBondContact OD2-OG 3.07Å; S1911-R1913 VanDerWaalsContact C-N 3.32Å; S1911-R1913 PolarHBondContact O-N 2.98Å; S1911-T1914 PolarHBondContact O-N 3.11Å; S1911-A1915 WeakPolarHBondContact O-CB 3.41Å; S1911-A1915 PolarHBondContact O-N 3.17Å |
| 1912 | L | 92.3 | Very high | 92.1 | Very high | 24.2 Ų | 24.2 | 27.2 Ų | 27.2 | 13% | 0.127 | 17% | 0.169 | C | C | . | . | H | α-helix | trans | -65.2 | -37.5 | 175.4 | -174.8 | 53.5 | 0 | 0 | 0 | 112.2 | T1232 R1235 V1236 V1239 N1904 D1909 T1914 A1915 A1916 | T1232-L1912 HydrophobicContact CG2-CB 4.2Å; T1232-L1912 HydrophobicContact CG2-CD2 3.47Å; T1232-L1912 VanDerWaalsContact CG2-CD2 3.47Å; T1232-L1912 HydrophobicContact CG2-CG 4.47Å; R1235-L1912 HydrophobicContact CB-CD1 4Å; R1235-L1912 HydrophobicContact CB-CD2 4.15Å; V1236-L1912 HydrophobicContact CB-CD1 4.48Å; V1236-L1912 HydrophobicContact CG2-CB 3.65Å; V1236-L1912 HydrophobicContact CG2-CD1 3.91Å; V1236-L1912 HydrophobicContact CG2-CG 4.32Å; V1239-L1912 HydrophobicContact CG2-CD1 4.35Å; N1904-L1912 HydrophobicContact CB-CD1 4.07Å; N1904-L1912 HydrophobicContact CB-CD2 4.42Å; N1904-L1912 HydrophobicContact CB-CG 4.09Å; N1904-L1912 WeakPolarHBondContact OD1-CD1 3.37Å; N1904-L1912 WeakPolarHBondContact OD1-CD2 3.24Å; D1909-L1912 HydrophobicContact CB-CB 4.12Å; D1909-L1912 PolarHBondContact O-N 3.35Å; D1909-L1912 PolarHBondContact OD1-N 3.12Å; D1909-L1912 VanDerWaalsContact OD2-CB 3.28Å; D1909-L1912 WeakPolarHBondContact OD2-CB 3.44Å; D1909-L1912 PolarHBondContact OD2-N 3.06Å; L1912-T1914 VanDerWaalsContact C-N 3.32Å; L1912-T1914 PolarHBondContact O-N 2.84Å; L1912-A1915 PolarHBondContact O-N 3.25Å; L1912-A1916 VanDerWaalsContact O-CB 3.25Å; L1912-A1916 WeakPolarHBondContact O-CB 3.32Å; L1912-A1916 PolarHBondContact O-N 3.15Å |
| 1913 | R | 93.6 | Very high | 91.8 | Very high | 12.4 Ų | 12.4 | 27.3 Ų | 27.3 | 5% | 0.047 | 17% | 0.17 | C | C | . | . | H | α-helix | trans | -63.4 | -44.8 | 175.1 | -69 | -166.6 | -73.1 | 167.2 | 4.5 | 112.1 | L1905 S1907 T1908 D1909 P1910 S1911 A1915 A1916 Y1917 I1943 P1944 A1945 | L1905-R1913 HydrophobicContact CD1-CB 4.38Å; L1905-R1913 VanDerWaalsContact CD1-O 3.28Å; L1905-R1913 WeakPolarHBondContact CD1-O 3.44Å; L1905-R1913 VanDerWaalsContact O-CD 3.26Å; L1905-R1913 WeakPolarHBondContact O-CD 3.42Å; L1905-R1913 VanDerWaalsContact O-CG 3.29Å; L1905-R1913 WeakPolarHBondContact O-CG 3.42Å; S1907-R1913 VanDerWaalsContact O-CD 3.31Å; S1907-R1913 WeakPolarHBondContact O-CD 3.38Å; S1907-R1913 WeakPolarHBondContact O-CG 3.37Å; S1907-R1913 PolarHBondContact O-NE 3.35Å; S1907-R1913 PolarHBondContact O-NH1 3.23Å; T1908-R1913 PolarHBondContact O-NH1 3.4Å; D1909-R1913 WeakPolarHBondContact O-CG 3.38Å; D1909-R1913 PolarHBondContact O-N 3.09Å; D1909-R1913 VanDerWaalsContact O-N 3.11Å; D1909-R1913 PolarHBondContact O-NE 2.85Å; P1910-R1913 PolarHBondContact O-N 3.16Å; S1911-R1913 VanDerWaalsContact C-N 3.32Å; S1911-R1913 PolarHBondContact O-N 2.98Å; R1913-A1915 VanDerWaalsContact C-N 3.31Å; R1913-A1915 PolarHBondContact O-N 3.19Å; R1913-A1916 PolarHBondContact O-N 3.26Å; R1913-Y1917 WeakPolarHBondContact O-CB 3.33Å; R1913-Y1917 PolarHBondContact O-N 3.13Å; R1913-I1943 HydrophobicContact CB-CB 4.3Å; R1913-I1943 HydrophobicContact CB-CD1 4.3Å; R1913-I1943 HydrophobicContact CB-CG2 4.38Å; R1913-I1943 VanDerWaalsContact CZ-O 3.29Å; R1913-I1943 PolarHBondContact NE-O 3.34Å; R1913-I1943 PolarHBondContact NH1-O 3.05Å; R1913-I1943 PolarHBondContact NH2-O 2.96Å; R1913-I1943 WeakPolarHBondContact O-CD1 3.44Å; R1913-P1944 PolarHBondContact NE-O 3.18Å; R1913-P1944 PolarHBondContact NH1-O 3.32Å; R1913-A1945 VanDerWaalsContact CZ-CA 3.49Å; R1913-A1945 VanDerWaalsContact NH1-CA 3.3Å; R1913-A1945 VanDerWaalsContact NH1-N 3.14Å |
| 1914 | T | 92.4 | Very high | 91.4 | Very high | 27.8 Ų | 27.8 | 27.5 Ų | 27.5 | 17% | 0.171 | 17% | 0.173 | C | C | . | . | H | α-helix | trans | -63.1 | -42.8 | 176.7 | -53.6 | 0 | 0 | 0 | 0 | 111.2 | P1910 S1911 L1912 Y1917 N1918 L1941 | P1910-T1914 PolarHBondContact O-N 3.05Å; P1910-T1914 VanDerWaalsContact O-N 3.14Å; P1910-T1914 PolarHBondContact O-OG1 3.19Å; P1910-T1914 VanDerWaalsContact O-OG1 3.13Å; S1911-T1914 PolarHBondContact O-N 3.11Å; L1912-T1914 VanDerWaalsContact C-N 3.32Å; L1912-T1914 PolarHBondContact O-N 2.84Å; T1914-Y1917 PolarHBondContact O-N 3.15Å; T1914-N1918 VanDerWaalsContact O-CG 3.31Å; T1914-N1918 PolarHBondContact O-N 3.07Å; T1914-N1918 VanDerWaalsContact O-N 3.09Å; T1914-N1918 PolarHBondContact O-ND2 2.91Å; T1914-L1941 HydrophobicContact CG2-CB 4.19Å; T1914-L1941 PolarHBondContact OG1-O 3.09Å; T1914-L1941 VanDerWaalsContact OG1-O 3.07Å |
| 1915 | A | 92 | Very high | 90.8 | Very high | 25 Ų | 25 | 30 Ų | 30 | 21% | 0.207 | 20% | 0.196 | C | C | . | . | H | α-helix | trans | -62.4 | -45.2 | 175.9 | 0 | 0 | 0 | 0 | 0 | 112.1 | V1236 V1239 E1240 S1911 L1912 R1913 Y1917 N1918 L1919 | V1236-A1915 HydrophobicContact CG1-CB 4.35Å; V1239-A1915 HydrophobicContact CB-CB 4.26Å; V1239-A1915 VanDerWaalsContact CG1-C 3.42Å; V1239-A1915 HydrophobicContact CG1-CB 3.76Å; V1239-A1915 WeakPolarHBondContact CG1-O 3.22Å; E1240-A1915 HydrophobicContact CG-CB 4.06Å; S1911-A1915 WeakPolarHBondContact O-CB 3.41Å; S1911-A1915 PolarHBondContact O-N 3.17Å; L1912-A1915 PolarHBondContact O-N 3.25Å; R1913-A1915 VanDerWaalsContact C-N 3.31Å; R1913-A1915 PolarHBondContact O-N 3.19Å; A1915-Y1917 VanDerWaalsContact C-N 3.33Å; A1915-Y1917 PolarHBondContact O-N 3.09Å; A1915-N1918 PolarHBondContact O-N 3.3Å; A1915-L1919 WeakPolarHBondContact O-CB 3.5Å; A1915-L1919 PolarHBondContact O-N 3.18Å |
| 1916 | A | 94.2 | Very high | 90.1 | Very high | 2 Ų | 2 | 32.9 Ų | 32.9 | 2% | 0.017 | 21% | 0.214 | C | C | . | . | H | α-helix | trans | -65.3 | -36 | 178.8 | 0 | 0 | 0 | 0 | 0 | 113 | N1904 L1905 L1912 R1913 L1919 L1920 | N1904-A1916 HydrophobicContact CB-CB 3.68Å; L1905-A1916 HydrophobicContact CB-CB 4.16Å; L1905-A1916 HydrophobicContact CD1-CB 4.26Å; L1912-A1916 VanDerWaalsContact O-CB 3.25Å; L1912-A1916 WeakPolarHBondContact O-CB 3.32Å; L1912-A1916 PolarHBondContact O-N 3.15Å; R1913-A1916 PolarHBondContact O-N 3.26Å; A1916-L1919 PolarHBondContact O-N 3.14Å; A1916-L1920 PolarHBondContact O-N 3.14Å |
| 1917 | Y | 94.2 | Very high | 89.5 | Confident | 26.4 Ų | 26.4 | 34.4 Ų | 34.4 | 10% | 0.104 | 22% | 0.215 | C | C | . | . | H | α-helix | trans | -66.3 | -42.9 | 174.1 | -179.2 | -93.1 | 0 | 0 | 0 | 111.9 | R1913 T1914 A1915 L1919 L1920 C1921 L1935 L1936 L1941 I1943 F1950 | R1913-Y1917 WeakPolarHBondContact O-CB 3.33Å; R1913-Y1917 PolarHBondContact O-N 3.13Å; T1914-Y1917 PolarHBondContact O-N 3.15Å; A1915-Y1917 VanDerWaalsContact C-N 3.33Å; A1915-Y1917 PolarHBondContact O-N 3.09Å; Y1917-L1919 VanDerWaalsContact C-N 3.33Å; Y1917-L1919 PolarHBondContact O-N 3.1Å; Y1917-L1920 WeakPolarHBondContact O-CB 3.31Å; Y1917-L1920 PolarHBondContact O-N 3.36Å; Y1917-L1920 VanDerWaalsContact O-N 3.17Å; Y1917-C1921 VanDerWaalsContact CE1-SG 3.52Å; Y1917-C1921 PolarHBondContact O-N 3.11Å; Y1917-C1921 PolarHBondContact O-SG 3.04Å; Y1917-C1921 VanDerWaalsContact O-SG 3.36Å; Y1917-L1935 HydrophobicContact CE2-CD2 3.83Å; Y1917-L1936 VanDerWaalsContact CE1-O 3.26Å; Y1917-L1936 WeakPolarHBondContact CE1-O 3.39Å; Y1917-L1936 PolarHBondContact OH-N 3.02Å; Y1917-L1936 PolarHBondContact OH-O 3.15Å; Y1917-L1941 HydrophobicContact CD1-CD2 3.66Å; Y1917-L1941 HydrophobicContact CD2-CD2 4.41Å; Y1917-L1941 HydrophobicContact CE1-CD2 3.57Å; Y1917-L1941 VanDerWaalsContact CE1-CD2 3.49Å; Y1917-L1941 HydrophobicContact CE2-CD2 4.39Å; Y1917-L1941 HydrophobicContact CG-CD2 4.17Å; Y1917-I1943 VanDerWaalsContact CB-CD1 3.42Å; Y1917-I1943 HydrophobicContact CD1-CD1 4.5Å; Y1917-I1943 HydrophobicContact CD2-CD1 4.29Å; Y1917-I1943 HydrophobicContact CG-CD1 3.92Å; Y1917-F1950 HydrophobicContact CD2-CE1 4.32Å; Y1917-F1950 HydrophobicContact CD2-CZ 4.43Å; Y1917-F1950 HydrophobicContact CE2-CE1 4.29Å; Y1917-F1950 AromaticContact CE2-CZ 3.89Å; Y1917-F1950 HydrophobicContact CE2-CZ 3.95Å |
| 1918 | N | 92 | Very high | 88.9 | Confident | 24.6 Ų | 24.6 | 39.4 Ų | 39.4 | 13% | 0.132 | 24% | 0.241 | C | C | . | . | H | α-helix | trans | -65.6 | -38.1 | 175.7 | -68.3 | -18 | 0 | 0 | 0 | 111.4 | T1243 T1914 A1915 L1920 C1921 A1922 E1937 T1938 | T1243-N1918 HydrophobicContact CG2-CB 4.07Å; T1914-N1918 VanDerWaalsContact O-CG 3.31Å; T1914-N1918 PolarHBondContact O-N 3.07Å; T1914-N1918 VanDerWaalsContact O-N 3.09Å; T1914-N1918 PolarHBondContact O-ND2 2.91Å; A1915-N1918 PolarHBondContact O-N 3.3Å; N1918-L1920 VanDerWaalsContact C-N 3.34Å; N1918-L1920 PolarHBondContact O-N 3.07Å; N1918-C1921 WeakPolarHBondContact O-CB 3.33Å; N1918-C1921 PolarHBondContact O-N 3.3Å; N1918-A1922 WeakPolarHBondContact O-CB 3.2Å; N1918-A1922 PolarHBondContact O-N 3.13Å; N1918-E1937 HydrophobicContact CB-CG 4.15Å; N1918-E1937 WeakPolarHBondContact OD1-CG 3.46Å; N1918-T1938 PolarHBondContact ND2-O 2.69Å; N1918-T1938 PolarHBondContact OD1-N 3.25Å; N1918-T1938 PolarHBondContact OD1-O 3.29Å |
| 1919 | L | 91.9 | Very high | 88.5 | Confident | 21.8 Ų | 21.8 | 34.2 Ų | 34.2 | 11% | 0.114 | 21% | 0.208 | C | C | . | . | H | α-helix | trans | -59.2 | -45.8 | 171.2 | 179.1 | 62 | 0 | 0 | 0 | 111.4 | V1239 L1242 T1243 L1246 M1900 A1901 A1915 A1916 Y1917 C1921 A1922 L1923 | V1239-L1919 HydrophobicContact CG1-CB 3.86Å; V1239-L1919 HydrophobicContact CG1-CD2 3.95Å; V1239-L1919 HydrophobicContact CG1-CG 4.49Å; L1242-L1919 HydrophobicContact CB-CD1 4.1Å; T1243-L1919 WeakPolarHBondContact OG1-CA 3.46Å; T1243-L1919 WeakPolarHBondContact OG1-CB 3.42Å; T1243-L1919 PolarHBondContact OG1-N 3.49Å; L1246-L1919 HydrophobicContact CD1-CD1 3.58Å; M1900-L1919 HydrophobicContact CG-CD2 4.48Å; M1900-L1919 HydrophobicContact SD-CD2 4.39Å; A1901-L1919 HydrophobicContact CB-CD2 4.09Å; A1901-L1919 HydrophobicContact CB-CG 4.2Å; A1915-L1919 WeakPolarHBondContact O-CB 3.5Å; A1915-L1919 PolarHBondContact O-N 3.18Å; A1916-L1919 PolarHBondContact O-N 3.14Å; Y1917-L1919 VanDerWaalsContact C-N 3.33Å; Y1917-L1919 PolarHBondContact O-N 3.1Å; L1919-C1921 VanDerWaalsContact C-N 3.32Å; L1919-C1921 PolarHBondContact O-N 3.14Å; L1919-A1922 PolarHBondContact O-N 3.16Å; L1919-L1923 HydrophobicContact CD1-CD1 4.37Å; L1919-L1923 HydrophobicContact CD1-CG 4.25Å; L1919-L1923 HydrophobicContact CG-CD1 4.07Å; L1919-L1923 HydrophobicContact CG-CG 4.4Å; L1919-L1923 WeakPolarHBondContact O-CB 3.3Å; L1919-L1923 VanDerWaalsContact O-CG 3.26Å; L1919-L1923 WeakPolarHBondContact O-CG 3.24Å; L1919-L1923 PolarHBondContact O-N 2.95Å |
| 1920 | L | 92.4 | Very high | 87.8 | Confident | 1.8 Ų | 1.8 | 40.4 Ų | 40.4 | 1% | 0.009 | 23% | 0.228 | C | C | . | . | H | α-helix | trans | -59.8 | -41 | 176.2 | -178.8 | 66.7 | 0 | 0 | 0 | 112.1 | L1898 A1901 L1902 A1916 Y1917 N1918 L1923 A1924 L1935 V1954 | L1898-L1920 HydrophobicContact CD1-CD1 3.74Å; A1901-L1920 HydrophobicContact CB-CB 4.18Å; L1902-L1920 HydrophobicContact CD2-CD1 4.44Å; A1916-L1920 PolarHBondContact O-N 3.14Å; Y1917-L1920 WeakPolarHBondContact O-CB 3.31Å; Y1917-L1920 PolarHBondContact O-N 3.36Å; Y1917-L1920 VanDerWaalsContact O-N 3.17Å; N1918-L1920 VanDerWaalsContact C-N 3.34Å; N1918-L1920 PolarHBondContact O-N 3.07Å; L1920-L1923 PolarHBondContact O-N 3.04Å; L1920-A1924 WeakPolarHBondContact O-CB 3.35Å; L1920-A1924 PolarHBondContact O-N 3.11Å; L1920-L1935 HydrophobicContact CD2-CD1 4.11Å; L1920-L1935 HydrophobicContact CD2-CD2 4.16Å; L1920-L1935 HydrophobicContact CG-CD1 3.92Å; L1920-V1954 HydrophobicContact CD1-CG1 4.41Å; L1920-V1954 HydrophobicContact CD2-CG1 4.07Å |
| 1921 | C | 90.4 | Very high | 87 | Confident | 11.2 Ų | 11.2 | 38 Ų | 38 | 8% | 0.076 | 21% | 0.21 | C | C | . | . | H | α-helix | trans | -63.4 | -46 | 175.2 | -64.4 | 0 | 0 | 0 | 0 | 111.5 | Y1917 N1918 L1919 L1923 A1924 A1925 E1937 | Y1917-C1921 VanDerWaalsContact CE1-SG 3.52Å; Y1917-C1921 PolarHBondContact O-N 3.11Å; Y1917-C1921 PolarHBondContact O-SG 3.04Å; Y1917-C1921 VanDerWaalsContact O-SG 3.36Å; N1918-C1921 WeakPolarHBondContact O-CB 3.33Å; N1918-C1921 PolarHBondContact O-N 3.3Å; L1919-C1921 VanDerWaalsContact C-N 3.32Å; L1919-C1921 PolarHBondContact O-N 3.14Å; C1921-L1923 VanDerWaalsContact C-N 3.35Å; C1921-L1923 PolarHBondContact O-N 3.15Å; C1921-A1924 PolarHBondContact O-N 3.16Å; C1921-A1925 WeakPolarHBondContact O-CB 3.33Å; C1921-A1925 PolarHBondContact O-N 2.93Å; C1921-E1937 HydrophobicContact CB-CB 4.13Å |
| 1922 | A | 86.5 | Confident | 85.7 | Confident | 17.4 Ų | 17.4 | 41.7 Ų | 41.7 | 14% | 0.144 | 22% | 0.22 | C | C | . | . | H | α-helix | trans | -62.7 | -41.7 | 177.8 | 0 | 0 | 0 | 0 | 0 | 111.8 | T1243 L1246 Q1247 N1918 L1919 A1924 A1925 T1926 | T1243-A1922 HydrophobicContact CG2-CB 4.16Å; L1246-A1922 HydrophobicContact CB-CB 4.1Å; L1246-A1922 HydrophobicContact CD1-CB 4.3Å; Q1247-A1922 HydrophobicContact CG-CB 4.44Å; N1918-A1922 WeakPolarHBondContact O-CB 3.2Å; N1918-A1922 PolarHBondContact O-N 3.13Å; L1919-A1922 PolarHBondContact O-N 3.16Å; A1922-A1924 PolarHBondContact O-N 2.85Å; A1922-A1925 PolarHBondContact O-N 3.01Å; A1922-T1926 VanDerWaalsContact O-CB 3.28Å; A1922-T1926 WeakPolarHBondContact O-CB 3.38Å; A1922-T1926 PolarHBondContact O-N 3.16Å; A1922-T1926 PolarHBondContact O-OG1 3.23Å |
| 1923 | L | 87.3 | Confident | 84.5 | Confident | 3 Ų | 3 | 44.2 Ų | 44.2 | 2% | 0.016 | 25% | 0.252 | C | S | . | . | H | α-helix | trans | -61.9 | -47.3 | 175 | -71.2 | 171.2 | 0 | 0 | 0 | 111.8 | L1246 L1897 A1901 L1919 L1920 C1921 A1925 T1926 F1927 F1929 | L1246-L1923 HydrophobicContact CD1-CD2 3.61Å; L1246-L1923 HydrophobicContact CD1-CG 3.99Å; L1246-L1923 HydrophobicContact CD2-CD2 4.35Å; L1897-L1923 HydrophobicContact CB-CD1 3.9Å; L1897-L1923 HydrophobicContact CB-CD2 3.65Å; L1897-L1923 HydrophobicContact CB-CG 4.42Å; L1897-L1923 HydrophobicContact CD1-CD2 3.84Å; L1897-L1923 HydrophobicContact CG-CD2 4.4Å; L1897-L1923 WeakPolarHBondContact O-CD1 3.38Å; A1901-L1923 HydrophobicContact CB-CD1 4.19Å; L1919-L1923 HydrophobicContact CD1-CD1 4.37Å; L1919-L1923 HydrophobicContact CD1-CG 4.25Å; L1919-L1923 HydrophobicContact CG-CD1 4.07Å; L1919-L1923 HydrophobicContact CG-CG 4.4Å; L1919-L1923 WeakPolarHBondContact O-CB 3.3Å; L1919-L1923 VanDerWaalsContact O-CG 3.26Å; L1919-L1923 WeakPolarHBondContact O-CG 3.24Å; L1919-L1923 PolarHBondContact O-N 2.95Å; L1920-L1923 PolarHBondContact O-N 3.04Å; C1921-L1923 VanDerWaalsContact C-N 3.35Å; C1921-L1923 PolarHBondContact O-N 3.15Å; L1923-A1925 VanDerWaalsContact C-N 3.3Å; L1923-A1925 PolarHBondContact O-N 3.18Å; L1923-T1926 PolarHBondContact O-N 3.09Å; L1923-F1927 HydrophobicContact CB-CD2 4.48Å; L1923-F1927 HydrophobicContact CD2-CD2 4.01Å; L1923-F1927 HydrophobicContact CD2-CE2 3.65Å; L1923-F1927 WeakPolarHBondContact O-CB 3.18Å; L1923-F1927 WeakPolarHBondContact O-CD2 3.37Å; L1923-F1927 PolarHBondContact O-N 3.22Å; L1923-F1929 HydrophobicContact CB-CE2 4.15Å |
| 1924 | A | 85.7 | Confident | 83.6 | Confident | 13.4 Ų | 13.4 | 48.2 Ų | 48.2 | 11% | 0.111 | 27% | 0.271 | C | S | . | . | H | α-helix | trans | -61.1 | -39.6 | 178.7 | 0 | 0 | 0 | 0 | 0 | 112.3 | L1920 C1921 A1922 N1928 F1929 M1931 L1935 | L1920-A1924 WeakPolarHBondContact O-CB 3.35Å; L1920-A1924 PolarHBondContact O-N 3.11Å; C1921-A1924 PolarHBondContact O-N 3.16Å; A1922-A1924 PolarHBondContact O-N 2.85Å; A1924-N1928 CarbonylContact O-C 3.57Å; A1924-N1928 VanDerWaalsContact O-CA 3.27Å; A1924-N1928 WeakPolarHBondContact O-CA 3.43Å; A1924-N1928 PolarHBondContact O-N 3.22Å; A1924-N1928 VanDerWaalsContact O-N 3.13Å; A1924-F1929 HydrophobicContact CB-CB 4.38Å; A1924-F1929 HydrophobicContact CB-CD2 4.38Å; A1924-F1929 PolarHBondContact O-N 3.29Å; A1924-F1929 VanDerWaalsContact O-N 3.12Å; A1924-M1931 HydrophobicContact CB-CG 4.39Å; A1924-L1935 HydrophobicContact CB-CD1 4.09Å |
| 1925 | A | 82 | Confident | 83.2 | Confident | 70.6 Ų | 70.6 | 48.4 Ų | 48.4 | 58% | 0.583 | 27% | 0.271 | S | S | * | . | H | α-helix | trans | -71.9 | -40.6 | 176.7 | 0 | 0 | 0 | 0 | 0 | 113 | C1921 A1922 L1923 N1928 | C1921-A1925 WeakPolarHBondContact O-CB 3.33Å; C1921-A1925 PolarHBondContact O-N 2.93Å; A1922-A1925 PolarHBondContact O-N 3.01Å; L1923-A1925 VanDerWaalsContact C-N 3.3Å; L1923-A1925 PolarHBondContact O-N 3.18Å; A1925-N1928 PolarHBondContact O-OD1 3.35Å |
| 1926 | T | 79.7 | Confident | 82.7 | Confident | 61.2 Ų | 61.2 | 53.3 Ų | 53.3 | 38% | 0.375 | 29% | 0.293 | S | S | . | . | H | α-helix | trans | -73.5 | -40 | -176.1 | -54.1 | 0 | 0 | 0 | 0 | 112.2 | L1246 F1252 A1922 L1923 | L1246-T1926 HydrophobicContact CD2-CG2 4.15Å; F1252-T1926 HydrophobicContact CD2-CG2 4.14Å; F1252-T1926 HydrophobicContact CE2-CG2 4.23Å; A1922-T1926 VanDerWaalsContact O-CB 3.28Å; A1922-T1926 WeakPolarHBondContact O-CB 3.38Å; A1922-T1926 PolarHBondContact O-N 3.16Å; A1922-T1926 PolarHBondContact O-OG1 3.23Å; L1923-T1926 PolarHBondContact O-N 3.09Å |
| 1927 | F | 78.9 | Confident | 82.1 | Confident | 50.2 Ų | 50.2 | 57.8 Ų | 57.8 | 22% | 0.22 | 31% | 0.314 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -98 | 2.2 | -178 | -64.8 | -66.3 | 0 | 0 | 0 | 113.9 | L1246 A1890 K1891 P1894 L1923 F1929 | L1246-F1927 HydrophobicContact CD2-CE2 4.44Å; A1890-F1927 WeakPolarHBondContact O-CZ 3.37Å; K1891-F1927 HydrophobicContact CB-CE1 4.4Å; K1891-F1927 HydrophobicContact CG-CE1 4.28Å; P1894-F1927 HydrophobicContact CB-CD1 4.3Å; P1894-F1927 HydrophobicContact CB-CD2 4.31Å; P1894-F1927 HydrophobicContact CB-CE1 4.21Å; P1894-F1927 HydrophobicContact CB-CE2 4.2Å; P1894-F1927 HydrophobicContact CB-CG 4.43Å; P1894-F1927 HydrophobicContact CB-CZ 4.24Å; L1923-F1927 HydrophobicContact CB-CD2 4.48Å; L1923-F1927 HydrophobicContact CD2-CD2 4.01Å; L1923-F1927 HydrophobicContact CD2-CE2 3.65Å; L1923-F1927 WeakPolarHBondContact O-CB 3.18Å; L1923-F1927 WeakPolarHBondContact O-CD2 3.37Å; L1923-F1927 PolarHBondContact O-N 3.22Å; F1927-F1929 VanDerWaalsContact C-N 3.27Å; F1927-F1929 HydrophobicContact CB-CD1 3.77Å; F1927-F1929 HydrophobicContact CB-CE1 3.37Å; F1927-F1929 VanDerWaalsContact CB-CE1 3.41Å; F1927-F1929 HydrophobicContact CB-CE2 4.42Å; F1927-F1929 HydrophobicContact CB-CG 4.4Å; F1927-F1929 HydrophobicContact CB-CZ 3.73Å; F1927-F1929 HydrophobicContact CD2-CE1 4.46Å; F1927-F1929 AromaticContact CD2-CZ 3.98Å; F1927-F1929 HydrophobicContact CD2-CZ 4Å; F1927-F1929 HydrophobicContact CG-CE1 4.13Å; F1927-F1929 HydrophobicContact CG-CZ 4.12Å; F1927-F1929 PolarHBondContact O-N 2.87Å |
| 1928 | N | 78.4 | Confident | 81.3 | Confident | 117.2 Ų | 117.2 | 59.5 Ų | 59.5 | 63% | 0.627 | 33% | 0.327 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 53.3 | 40.7 | -177.5 | -68.2 | -46.4 | 0 | 0 | 0 | 113.5 | A1924 A1925 R1930 | A1924-N1928 CarbonylContact O-C 3.57Å; A1924-N1928 VanDerWaalsContact O-CA 3.27Å; A1924-N1928 WeakPolarHBondContact O-CA 3.43Å; A1924-N1928 PolarHBondContact O-N 3.22Å; A1924-N1928 VanDerWaalsContact O-N 3.13Å; A1925-N1928 PolarHBondContact O-OD1 3.35Å; N1928-R1930 PolarHBondContact O-N 2.98Å |
| 1929 | F | 81.6 | Confident | 80.4 | Confident | 14.2 Ų | 14.2 | 67.5 Ų | 67.5 | 6% | 0.062 | 36% | 0.361 | C | S | . | . | trans | -59.5 | 133.9 | 175 | -62.9 | -25.4 | 0 | 0 | 0 | 110 | P1894 L1923 A1924 F1927 M1931 L1958 E1962 L1965 | P1894-F1929 HydrophobicContact CB-CZ 4.31Å; L1923-F1929 HydrophobicContact CB-CE2 4.15Å; A1924-F1929 HydrophobicContact CB-CB 4.38Å; A1924-F1929 HydrophobicContact CB-CD2 4.38Å; A1924-F1929 PolarHBondContact O-N 3.29Å; A1924-F1929 VanDerWaalsContact O-N 3.12Å; F1927-F1929 VanDerWaalsContact C-N 3.27Å; F1927-F1929 HydrophobicContact CB-CD1 3.77Å; F1927-F1929 HydrophobicContact CB-CE1 3.37Å; F1927-F1929 VanDerWaalsContact CB-CE1 3.41Å; F1927-F1929 HydrophobicContact CB-CE2 4.42Å; F1927-F1929 HydrophobicContact CB-CG 4.4Å; F1927-F1929 HydrophobicContact CB-CZ 3.73Å; F1927-F1929 HydrophobicContact CD2-CE1 4.46Å; F1927-F1929 AromaticContact CD2-CZ 3.98Å; F1927-F1929 HydrophobicContact CD2-CZ 4Å; F1927-F1929 HydrophobicContact CG-CE1 4.13Å; F1927-F1929 HydrophobicContact CG-CZ 4.12Å; F1927-F1929 PolarHBondContact O-N 2.87Å; F1929-M1931 VanDerWaalsContact C-N 3.29Å; F1929-M1931 HydrophobicContact CB-CG 4.19Å; F1929-M1931 PolarHBondContact O-N 3.16Å; F1929-L1958 HydrophobicContact CB-CD2 3.94Å; F1929-L1958 HydrophobicContact CD2-CD2 4.15Å; F1929-L1958 HydrophobicContact CG-CD2 4.15Å; F1929-E1962 WeakPolarHBondContact CA-OE1 3.46Å; F1929-E1962 HydrophobicContact CB-CG 4.35Å; F1929-E1962 HydrophobicContact CD1-CG 4.05Å; F1929-E1962 HydrophobicContact CG-CG 4.4Å; F1929-L1965 HydrophobicContact CE1-CD1 3.78Å; F1929-L1965 HydrophobicContact CZ-CD1 3.91Å | ||
| 1930 | R | 75.9 | Confident | 79.7 | Confident | 183.4 Ų | 183.4 | 69.6 Ų | 69.6 | 69% | 0.692 | 39% | 0.387 | S | S | * | . | trans | -72.6 | 74.5 | -179 | -63.3 | -178.9 | -177.6 | -176.8 | 2.2 | 112 | N1928 N1961 E1962 | N1928-R1930 PolarHBondContact O-N 2.98Å; R1930-N1961 HydrophobicContact CB-CB 4.19Å; R1930-N1961 PolarHBondContact O-ND2 3.02Å; R1930-E1962 WeakPolarHBondContact CG-OE1 3.46Å; R1930-E1962 PolarHBondContact N-OE1 3.18Å; R1930-E1962 VanDerWaalsContact N-OE1 3.14Å | ||
| 1931 | M | 74.4 | Confident | 79.4 | Confident | 23.8 Ų | 23.8 | 72.4 Ų | 72.4 | 12% | 0.117 | 40% | 0.402 | C | S | . | . | trans | -105.2 | 105.8 | 176 | -64.7 | -64.5 | -76.6 | 0 | 0 | 109.1 | A1924 F1929 G1933 Q1934 L1935 V1954 K1957 L1958 | A1924-M1931 HydrophobicContact CB-CG 4.39Å; F1929-M1931 VanDerWaalsContact C-N 3.29Å; F1929-M1931 HydrophobicContact CB-CG 4.19Å; F1929-M1931 PolarHBondContact O-N 3.16Å; M1931-G1933 VanDerWaalsContact C-N 3.33Å; M1931-G1933 PolarHBondContact O-N 3.4Å; M1931-Q1934 PolarHBondContact O-N 3.21Å; M1931-L1935 HydrophobicContact CB-CD1 4.4Å; M1931-L1935 HydrophobicContact CE-CD1 3.91Å; M1931-L1935 HydrophobicContact CE-CG 4.28Å; M1931-L1935 HydrophobicContact CG-CD1 4.35Å; M1931-V1954 HydrophobicContact CE-CB 4.32Å; M1931-V1954 HydrophobicContact CE-CG1 3.8Å; M1931-V1954 HydrophobicContact CE-CG2 4.11Å; M1931-K1957 HydrophobicContact SD-CB 4.37Å; M1931-L1958 HydrophobicContact CG-CD2 4.08Å; M1931-L1958 HydrophobicContact SD-CD1 4.41Å; M1931-L1958 HydrophobicContact SD-CD2 3.56Å; M1931-L1958 VanDerWaalsContact SD-CD2 3.54Å; M1931-L1958 HydrophobicContact SD-CG 3.8Å | ||
| 1932 | E | 64.7 | Low | 79.3 | Confident | 144 Ų | 144 | 79.7 Ų | 79.7 | 67% | 0.673 | 44% | 0.439 | S | S | * | . | trans | -55.2 | 54.1 | -174 | -61.1 | 169 | 146.6 | 0 | 0 | 114.7 | Q1934 K1957 | E1932-Q1934 VanDerWaalsContact C-N 3.32Å; E1932-Q1934 HydrophobicContact CB-CG 4.3Å; E1932-Q1934 WeakPolarHBondContact O-CG 3.3Å; E1932-Q1934 PolarHBondContact O-N 2.87Å; E1932-Q1934 VanDerWaalsContact O-N 3.13Å; E1932-K1957 IonicContact OE2-NZ 3.28Å; E1932-K1957 PolarHBondContact OE2-NZ 3.05Å; E1932-K1957 VanDerWaalsContact OE2-NZ 3.09Å | ||
| 1933 | G | 65.5 | Low | 79.4 | Confident | 77.8 Ų | 77.8 | 80.1 Ų | 80.1 | 80% | 0.802 | 44% | 0.439 | S | S | * | . | S | Bend | trans | 63.3 | 17.6 | -179.8 | 0 | 0 | 0 | 0 | 0 | 115.2 | M1931 L1935 | M1931-G1933 VanDerWaalsContact C-N 3.33Å; M1931-G1933 PolarHBondContact O-N 3.4Å; G1933-L1935 VanDerWaalsContact C-N 3.31Å; G1933-L1935 PolarHBondContact O-N 3.18Å |
| 1934 | Q | 75.5 | Confident | 79.6 | Confident | 95.8 Ų | 95.8 | 84.2 Ų | 84.2 | 45% | 0.448 | 47% | 0.465 | S | S | . | . | trans | -84.9 | -9.7 | -173.1 | -59.1 | -165.7 | -43.2 | 0 | 0 | 114.4 | M1931 E1932 K1957 | M1931-Q1934 PolarHBondContact O-N 3.21Å; E1932-Q1934 VanDerWaalsContact C-N 3.32Å; E1932-Q1934 HydrophobicContact CB-CG 4.3Å; E1932-Q1934 WeakPolarHBondContact O-CG 3.3Å; E1932-Q1934 PolarHBondContact O-N 2.87Å; E1932-Q1934 VanDerWaalsContact O-N 3.13Å; Q1934-K1957 VanDerWaalsContact CD-NZ 3.3Å; Q1934-K1957 VanDerWaalsContact NE2-NZ 3.13Å | ||
| 1935 | L | 83.4 | Confident | 79.7 | Confident | 30.8 Ų | 30.8 | 86.8 Ų | 86.8 | 16% | 0.161 | 49% | 0.487 | C | S | . | . | trans | -116.7 | 132 | -175.3 | -63.3 | 178.3 | 0 | 0 | 0 | 109.8 | Y1917 L1920 A1924 M1931 G1933 F1950 | Y1917-L1935 HydrophobicContact CE2-CD2 3.83Å; L1920-L1935 HydrophobicContact CD2-CD1 4.11Å; L1920-L1935 HydrophobicContact CD2-CD2 4.16Å; L1920-L1935 HydrophobicContact CG-CD1 3.92Å; A1924-L1935 HydrophobicContact CB-CD1 4.09Å; M1931-L1935 HydrophobicContact CB-CD1 4.4Å; M1931-L1935 HydrophobicContact CE-CD1 3.91Å; M1931-L1935 HydrophobicContact CE-CG 4.28Å; M1931-L1935 HydrophobicContact CG-CD1 4.35Å; G1933-L1935 VanDerWaalsContact C-N 3.31Å; G1933-L1935 PolarHBondContact O-N 3.18Å; L1935-F1950 HydrophobicContact CD2-CZ 3.99Å | ||
| 1936 | L | 82.4 | Confident | 80.1 | Confident | 127.8 Ų | 127.8 | 89.8 Ų | 89.8 | 67% | 0.669 | 49% | 0.493 | S | S | * | . | trans | -143.1 | 121.6 | 176.6 | 179.8 | 67.8 | 0 | 0 | 0 | 109.3 | Y1917 T1938 | Y1917-L1936 VanDerWaalsContact CE1-O 3.26Å; Y1917-L1936 WeakPolarHBondContact CE1-O 3.39Å; Y1917-L1936 PolarHBondContact OH-N 3.02Å; Y1917-L1936 PolarHBondContact OH-O 3.15Å; L1936-T1938 HydrophobicContact CD2-CG2 4.06Å; L1936-T1938 HydrophobicContact CG-CG2 4.09Å; L1936-T1938 PolarHBondContact O-N 2.92Å | ||
| 1937 | E | 80.3 | Confident | 80.7 | Confident | 98.2 Ų | 98.2 | 87.4 Ų | 87.4 | 46% | 0.459 | 48% | 0.478 | S | S | . | . | trans | -67.2 | 130.9 | 176.3 | -168.5 | -174.9 | 163.9 | 0 | 0 | 110.8 | Q1247 N1918 C1921 | Q1247-E1937 PolarHBondContact NE2-OE1 3.17Å; Q1247-E1937 PolarHBondContact NE2-OE2 3.19Å; N1918-E1937 HydrophobicContact CB-CG 4.15Å; N1918-E1937 WeakPolarHBondContact OD1-CG 3.46Å; C1921-E1937 HydrophobicContact CB-CB 4.13Å | ||
| 1938 | T | 77.4 | Confident | 81.3 | Confident | 61.8 Ų | 61.8 | 87.4 Ų | 87.4 | 38% | 0.379 | 48% | 0.483 | S | S | . | . | trans | -151.3 | 138.4 | 177.5 | -64.7 | 0 | 0 | 0 | 0 | 111.6 | N1918 L1936 G1940 L1941 | N1918-T1938 PolarHBondContact ND2-O 2.69Å; N1918-T1938 PolarHBondContact OD1-N 3.25Å; N1918-T1938 PolarHBondContact OD1-O 3.29Å; L1936-T1938 HydrophobicContact CD2-CG2 4.06Å; L1936-T1938 HydrophobicContact CG-CG2 4.09Å; L1936-T1938 PolarHBondContact O-N 2.92Å; T1938-G1940 PolarHBondContact O-N 3.21Å; T1938-L1941 HydrophobicContact CG2-CB 3.84Å; T1938-L1941 HydrophobicContact CG2-CD1 4.05Å; T1938-L1941 HydrophobicContact CG2-CG 4.35Å | ||
| 1939 | K | 74.8 | Confident | 82 | Confident | 192.8 Ų | 192.8 | 88.2 Ų | 88.2 | 84% | 0.838 | 49% | 0.485 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -77 | 128.8 | 173.4 | -67.4 | -176 | 179.9 | 176.3 | 0 | 110 | ||
| 1940 | G | 77.1 | Confident | 82.6 | Confident | 64.4 Ų | 64.4 | 91.2 Ų | 91.2 | 66% | 0.664 | 50% | 0.498 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 89.2 | 16.4 | 175.8 | 0 | 0 | 0 | 0 | 0 | 115.7 | T1938 L1942 | T1938-G1940 PolarHBondContact O-N 3.21Å; G1940-L1942 PolarHBondContact O-N 3.14Å |
| 1941 | L | 85.1 | Confident | 83.5 | Confident | 62 Ų | 62 | 82.5 Ų | 82.5 | 33% | 0.325 | 47% | 0.465 | S | S | . | . | trans | -63.3 | 123.9 | 175.3 | -168.2 | 69.4 | 0 | 0 | 0 | 111.2 | T1914 Y1917 T1938 I1943 | T1914-L1941 HydrophobicContact CG2-CB 4.19Å; T1914-L1941 PolarHBondContact OG1-O 3.09Å; T1914-L1941 VanDerWaalsContact OG1-O 3.07Å; Y1917-L1941 HydrophobicContact CD1-CD2 3.66Å; Y1917-L1941 HydrophobicContact CD2-CD2 4.41Å; Y1917-L1941 HydrophobicContact CE1-CD2 3.57Å; Y1917-L1941 VanDerWaalsContact CE1-CD2 3.49Å; Y1917-L1941 HydrophobicContact CE2-CD2 4.39Å; Y1917-L1941 HydrophobicContact CG-CD2 4.17Å; T1938-L1941 HydrophobicContact CG2-CB 3.84Å; T1938-L1941 HydrophobicContact CG2-CD1 4.05Å; T1938-L1941 HydrophobicContact CG2-CG 4.35Å; L1941-I1943 HydrophobicContact CB-CG1 4.4Å; L1941-I1943 HydrophobicContact CD2-CD1 4.15Å; L1941-I1943 HydrophobicContact CD2-CG1 3.93Å; L1941-I1943 HydrophobicContact CG-CG1 4.08Å; L1941-I1943 PolarHBondContact O-N 3.14Å; L1941-I1943 VanDerWaalsContact O-N 3.14Å | ||
| 1942 | L | 87.9 | Confident | 84.4 | Confident | 163.8 Ų | 163.8 | 84.4 Ų | 84.4 | 86% | 0.858 | 47% | 0.473 | S | S | * | . | trans | -91.2 | 91.4 | 177.9 | -62.1 | 177.7 | 0 | 0 | 0 | 110.3 | G1940 P1944 | G1940-L1942 PolarHBondContact O-N 3.14Å; L1942-P1944 WeakPolarHBondContact O-CD 3.49Å | ||
| 1943 | I | 90.1 | Very high | 85.7 | Confident | 25.2 Ų | 25.2 | 80.3 Ų | 80.3 | 13% | 0.129 | 46% | 0.458 | C | S | . | . | trans | -80.6 | 132.1 | 179.9 | -55.9 | 179.3 | 0 | 0 | 0 | 109 | L1905 R1913 Y1917 L1941 N1947 | L1905-I1943 HydrophobicContact CD1-CD1 3.95Å; L1905-I1943 HydrophobicContact CD1-CG2 4.46Å; R1913-I1943 HydrophobicContact CB-CB 4.3Å; R1913-I1943 HydrophobicContact CB-CD1 4.3Å; R1913-I1943 HydrophobicContact CB-CG2 4.38Å; R1913-I1943 VanDerWaalsContact CZ-O 3.29Å; R1913-I1943 PolarHBondContact NE-O 3.34Å; R1913-I1943 PolarHBondContact NH1-O 3.05Å; R1913-I1943 PolarHBondContact NH2-O 2.96Å; R1913-I1943 WeakPolarHBondContact O-CD1 3.44Å; Y1917-I1943 VanDerWaalsContact CB-CD1 3.42Å; Y1917-I1943 HydrophobicContact CD1-CD1 4.5Å; Y1917-I1943 HydrophobicContact CD2-CD1 4.29Å; Y1917-I1943 HydrophobicContact CG-CD1 3.92Å; L1941-I1943 HydrophobicContact CB-CG1 4.4Å; L1941-I1943 HydrophobicContact CD2-CD1 4.15Å; L1941-I1943 HydrophobicContact CD2-CG1 3.93Å; L1941-I1943 HydrophobicContact CG-CG1 4.08Å; L1941-I1943 PolarHBondContact O-N 3.14Å; L1941-I1943 VanDerWaalsContact O-N 3.14Å; I1943-N1947 HydrophobicContact CG2-CB 4.39Å; I1943-N1947 WeakPolarHBondContact CG2-ND2 3.34Å | ||
| 1944 | P | 91.2 | Very high | 87 | Confident | 89.6 Ų | 89.6 | 76.8 Ų | 76.8 | 58% | 0.582 | 42% | 0.421 | S | S | * | . | trans | -68.2 | 146.7 | 173.6 | -20.2 | 32.8 | 0 | 0 | 0 | 112.7 | R1913 L1942 N1946 | R1913-P1944 PolarHBondContact NE-O 3.18Å; R1913-P1944 PolarHBondContact NH1-O 3.32Å; L1942-P1944 WeakPolarHBondContact O-CD 3.49Å; P1944-N1946 VanDerWaalsContact C-N 3.31Å; P1944-N1946 PolarHBondContact O-N 3.07Å | ||
| 1945 | A | 88.1 | Confident | 88 | Confident | 68.8 Ų | 68.8 | 72.2 Ų | 72.2 | 57% | 0.569 | 40% | 0.4 | S | S | * | . | S | Bend | trans | -64.2 | -33.8 | -179.7 | 0 | 0 | 0 | 0 | 0 | 112.9 | R1913 N1947 | R1913-A1945 VanDerWaalsContact CZ-CA 3.49Å; R1913-A1945 VanDerWaalsContact NH1-CA 3.3Å; R1913-A1945 VanDerWaalsContact NH1-N 3.14Å; A1945-N1947 PolarHBondContact O-N 2.94Å |
| 1946 | N | 89.8 | Confident | 88.4 | Confident | 132.4 Ų | 132.4 | 75 Ų | 75 | 71% | 0.708 | 41% | 0.412 | S | S | * | . | trans | -90.4 | 87.9 | 172 | -176.4 | 6.5 | 0 | 0 | 0 | 110.3 | P1944 | P1944-N1946 VanDerWaalsContact C-N 3.31Å; P1944-N1946 PolarHBondContact O-N 3.07Å | ||
| 1947 | N | 91.6 | Very high | 88.9 | Confident | 12.4 Ų | 12.4 | 71.3 Ų | 71.3 | 7% | 0.066 | 39% | 0.39 | C | S | . | . | trans | -121.7 | 16.2 | 178.8 | 62.1 | -4.8 | 0 | 0 | 0 | 113.1 | L1905 I1943 A1945 I1949 F1950 I1951 | L1905-N1947 PolarHBondContact O-ND2 3.19Å; L1905-N1947 PolarHBondContact O-OD1 3.19Å; I1943-N1947 HydrophobicContact CG2-CB 4.39Å; I1943-N1947 WeakPolarHBondContact CG2-ND2 3.34Å; A1945-N1947 PolarHBondContact O-N 2.94Å; N1947-I1949 VanDerWaalsContact C-N 3.28Å; N1947-I1949 PolarHBondContact O-N 3.08Å; N1947-F1950 WeakPolarHBondContact O-CB 3.25Å; N1947-F1950 PolarHBondContact O-N 3.06Å; N1947-I1951 WeakPolarHBondContact O-CG1 3.33Å; N1947-I1951 PolarHBondContact O-N 3.22Å; N1947-I1951 VanDerWaalsContact O-N 3.08Å; N1947-I1951 WeakPolarHBondContact OD1-CD1 3.39Å | ||
| 1948 | T | 93 | Very high | 89.5 | Confident | 49.8 Ų | 49.8 | 66.6 Ų | 66.6 | 31% | 0.306 | 37% | 0.369 | S | S | . | . | H | α-helix | trans | -52.9 | -41.5 | -179.4 | -55.2 | 0 | 0 | 0 | 0 | 113.2 | F1950 I1951 K1952 L1987 E1990 | T1948-F1950 VanDerWaalsContact C-N 3.33Å; T1948-F1950 PolarHBondContact O-N 3.2Å; T1948-I1951 PolarHBondContact O-N 3.27Å; T1948-K1952 WeakPolarHBondContact O-CB 3.34Å; T1948-K1952 PolarHBondContact O-N 3.24Å; T1948-L1987 HydrophobicContact CG2-CD1 3.81Å; T1948-E1990 HydrophobicContact CG2-CB 4.46Å; T1948-E1990 HydrophobicContact CG2-CG 4.36Å |
| 1949 | I | 93.1 | Very high | 90.2 | Very high | 134 Ų | 134 | 63.8 Ų | 63.8 | 69% | 0.687 | 35% | 0.351 | S | S | * | . | H | α-helix | trans | -63.4 | -41.1 | 178.9 | -61.4 | 173.9 | 0 | 0 | 0 | 110.9 | N1947 T1953 | N1947-I1949 VanDerWaalsContact C-N 3.28Å; N1947-I1949 PolarHBondContact O-N 3.08Å; I1949-T1953 WeakPolarHBondContact O-CB 3.38Å; I1949-T1953 PolarHBondContact O-N 3.19Å; I1949-T1953 PolarHBondContact O-OG1 3.09Å |
| 1950 | F | 93.4 | Very high | 91 | Very high | 76.4 Ų | 76.4 | 59.7 Ų | 59.7 | 34% | 0.335 | 34% | 0.342 | S | S | . | . | H | α-helix | trans | -63.8 | -49.7 | 177.1 | 174.3 | -98.8 | 0 | 0 | 0 | 110.8 | L1905 Y1917 L1935 N1947 T1948 K1952 T1953 V1954 | L1905-F1950 HydrophobicContact CD2-CD1 3.92Å; L1905-F1950 HydrophobicContact CD2-CE1 3.75Å; Y1917-F1950 HydrophobicContact CD2-CE1 4.32Å; Y1917-F1950 HydrophobicContact CD2-CZ 4.43Å; Y1917-F1950 HydrophobicContact CE2-CE1 4.29Å; Y1917-F1950 AromaticContact CE2-CZ 3.89Å; Y1917-F1950 HydrophobicContact CE2-CZ 3.95Å; L1935-F1950 HydrophobicContact CD2-CZ 3.99Å; N1947-F1950 WeakPolarHBondContact O-CB 3.25Å; N1947-F1950 PolarHBondContact O-N 3.06Å; T1948-F1950 VanDerWaalsContact C-N 3.33Å; T1948-F1950 PolarHBondContact O-N 3.2Å; F1950-K1952 VanDerWaalsContact C-N 3.32Å; F1950-K1952 PolarHBondContact O-N 3.1Å; F1950-T1953 PolarHBondContact O-N 3.09Å; F1950-T1953 VanDerWaalsContact O-N 3.16Å; F1950-V1954 HydrophobicContact CD1-CG2 4.4Å; F1950-V1954 HydrophobicContact CD2-CG2 4.42Å; F1950-V1954 HydrophobicContact CE1-CG2 3.95Å; F1950-V1954 HydrophobicContact CE2-CG2 3.98Å; F1950-V1954 HydrophobicContact CZ-CG2 3.73Å; F1950-V1954 WeakPolarHBondContact O-CG2 3.41Å; F1950-V1954 PolarHBondContact O-N 3.09Å |
| 1951 | I | 94.5 | Very high | 91.5 | Very high | 0 Ų | 0 | 59.7 Ų | 59.7 | 0% | 0 | 33% | 0.327 | C | S | . | . | H | α-helix | trans | -57.6 | -46.2 | 178.8 | -63.3 | 170.4 | 0 | 0 | 0 | 110.8 | L1902 L1905 N1947 T1948 T1953 V1954 S1955 L1987 Y1991 | L1902-I1951 HydrophobicContact CB-CG2 4.26Å; L1902-I1951 HydrophobicContact CD2-CG2 4.2Å; L1905-I1951 HydrophobicContact CB-CD1 4Å; L1905-I1951 HydrophobicContact CB-CG1 4.26Å; L1905-I1951 HydrophobicContact CD2-CD1 4.41Å; L1905-I1951 HydrophobicContact CD2-CG1 3.83Å; L1905-I1951 HydrophobicContact CG-CD1 4.18Å; L1905-I1951 HydrophobicContact CG-CG1 4.13Å; N1947-I1951 WeakPolarHBondContact O-CG1 3.33Å; N1947-I1951 PolarHBondContact O-N 3.22Å; N1947-I1951 VanDerWaalsContact O-N 3.08Å; N1947-I1951 WeakPolarHBondContact OD1-CD1 3.39Å; T1948-I1951 PolarHBondContact O-N 3.27Å; I1951-T1953 PolarHBondContact O-N 3.11Å; I1951-V1954 PolarHBondContact O-N 3.26Å; I1951-S1955 WeakPolarHBondContact O-CB 3.31Å; I1951-S1955 PolarHBondContact O-N 3.09Å; I1951-L1987 HydrophobicContact CB-CD1 4.2Å; I1951-L1987 HydrophobicContact CD1-CD1 3.92Å; I1951-L1987 HydrophobicContact CD1-CD2 3.79Å; I1951-L1987 HydrophobicContact CD1-CG 4.46Å; I1951-L1987 HydrophobicContact CG2-CD1 4.05Å; I1951-Y1991 HydrophobicContact CG2-CD1 4.03Å; I1951-Y1991 HydrophobicContact CG2-CG 4.35Å |
| 1952 | K | 93.5 | Very high | 91.7 | Very high | 64.8 Ų | 64.8 | 57.8 Ų | 57.8 | 28% | 0.282 | 32% | 0.317 | S | S | . | . | H | α-helix | trans | -61.7 | -44.1 | 177.5 | -176.9 | 175.6 | -176.4 | 167.7 | 0 | 112.4 | T1948 F1950 S1955 Q1956 E1990 | T1948-K1952 WeakPolarHBondContact O-CB 3.34Å; T1948-K1952 PolarHBondContact O-N 3.24Å; F1950-K1952 VanDerWaalsContact C-N 3.32Å; F1950-K1952 PolarHBondContact O-N 3.1Å; K1952-S1955 PolarHBondContact O-N 3.1Å; K1952-Q1956 HydrophobicContact CG-CG 4.48Å; K1952-Q1956 WeakPolarHBondContact O-CB 3.38Å; K1952-Q1956 VanDerWaalsContact O-CG 3.3Å; K1952-Q1956 WeakPolarHBondContact O-CG 3.33Å; K1952-Q1956 PolarHBondContact O-N 3.13Å; K1952-E1990 HydrophobicContact CD-CB 4.4Å; K1952-E1990 WeakPolarHBondContact CD-OE2 3.29Å; K1952-E1990 WeakPolarHBondContact CE-OE2 3.41Å; K1952-E1990 IonicContact NZ-OE2 3.38Å; K1952-E1990 PolarHBondContact NZ-OE2 2.93Å |
| 1953 | T | 93 | Very high | 91.7 | Very high | 57.8 Ų | 57.8 | 51.6 Ų | 51.6 | 36% | 0.355 | 29% | 0.285 | S | S | . | . | H | α-helix | trans | -64.7 | -42.9 | -179.8 | -56 | 0 | 0 | 0 | 0 | 111.3 | I1949 F1950 I1951 Q1956 K1957 | I1949-T1953 WeakPolarHBondContact O-CB 3.38Å; I1949-T1953 PolarHBondContact O-N 3.19Å; I1949-T1953 PolarHBondContact O-OG1 3.09Å; F1950-T1953 PolarHBondContact O-N 3.09Å; F1950-T1953 VanDerWaalsContact O-N 3.16Å; I1951-T1953 PolarHBondContact O-N 3.11Å; T1953-Q1956 PolarHBondContact O-N 3.24Å; T1953-K1957 PolarHBondContact O-N 3.25Å; T1953-K1957 VanDerWaalsContact O-N 3.09Å |
| 1954 | V | 92.6 | Very high | 91.3 | Very high | 3.4 Ų | 3.4 | 55.9 Ų | 55.9 | 2% | 0.021 | 31% | 0.305 | C | S | . | . | H | α-helix | trans | -60.1 | -50 | 173.9 | 167.7 | 0 | 0 | 0 | 0 | 110.5 | L1902 L1920 M1931 F1950 I1951 Q1956 K1957 L1958 | L1902-V1954 HydrophobicContact CD2-CG1 3.94Å; L1920-V1954 HydrophobicContact CD1-CG1 4.41Å; L1920-V1954 HydrophobicContact CD2-CG1 4.07Å; M1931-V1954 HydrophobicContact CE-CB 4.32Å; M1931-V1954 HydrophobicContact CE-CG1 3.8Å; M1931-V1954 HydrophobicContact CE-CG2 4.11Å; F1950-V1954 HydrophobicContact CD1-CG2 4.4Å; F1950-V1954 HydrophobicContact CD2-CG2 4.42Å; F1950-V1954 HydrophobicContact CE1-CG2 3.95Å; F1950-V1954 HydrophobicContact CE2-CG2 3.98Å; F1950-V1954 HydrophobicContact CZ-CG2 3.73Å; F1950-V1954 WeakPolarHBondContact O-CG2 3.41Å; F1950-V1954 PolarHBondContact O-N 3.09Å; I1951-V1954 PolarHBondContact O-N 3.26Å; V1954-Q1956 VanDerWaalsContact C-N 3.33Å; V1954-Q1956 PolarHBondContact O-N 3.17Å; V1954-K1957 PolarHBondContact O-N 2.95Å; V1954-L1958 HydrophobicContact CG1-CD1 3.85Å; V1954-L1958 WeakPolarHBondContact O-CG 3.36Å; V1954-L1958 PolarHBondContact O-N 3.21Å |
| 1955 | S | 94.6 | Very high | 91.2 | Very high | 0 Ų | 0 | 51.8 Ų | 51.8 | 0% | 0 | 28% | 0.278 | C | S | . | . | H | α-helix | trans | -60.1 | -41.5 | 179.3 | -171.3 | 0 | 0 | 0 | 0 | 112.4 | I1951 K1952 L1958 A1959 Y1991 W1995 | I1951-S1955 WeakPolarHBondContact O-CB 3.31Å; I1951-S1955 PolarHBondContact O-N 3.09Å; K1952-S1955 PolarHBondContact O-N 3.1Å; S1955-L1958 PolarHBondContact O-N 3.31Å; S1955-A1959 VanDerWaalsContact O-CB 3.3Å; S1955-A1959 WeakPolarHBondContact O-CB 3.38Å; S1955-A1959 PolarHBondContact O-N 3.19Å; S1955-Y1991 PolarHBondContact OG-O 3.25Å; S1955-W1995 PolarHBondContact OG-NE1 3.3Å |
| 1956 | Q | 93.8 | Very high | 91.3 | Very high | 89 Ų | 89 | 48.5 Ų | 48.5 | 42% | 0.416 | 25% | 0.251 | S | S | . | . | H | α-helix | trans | -62.2 | -45 | 176.7 | -92.1 | 175.1 | -22.2 | 0 | 0 | 112.5 | K1952 T1953 V1954 A1959 V1960 P1994 | K1952-Q1956 HydrophobicContact CG-CG 4.48Å; K1952-Q1956 WeakPolarHBondContact O-CB 3.38Å; K1952-Q1956 VanDerWaalsContact O-CG 3.3Å; K1952-Q1956 WeakPolarHBondContact O-CG 3.33Å; K1952-Q1956 PolarHBondContact O-N 3.13Å; T1953-Q1956 PolarHBondContact O-N 3.24Å; V1954-Q1956 VanDerWaalsContact C-N 3.33Å; V1954-Q1956 PolarHBondContact O-N 3.17Å; Q1956-A1959 PolarHBondContact O-N 3.15Å; Q1956-V1960 WeakPolarHBondContact O-CG2 3.35Å; Q1956-V1960 PolarHBondContact O-N 3.24Å; Q1956-P1994 HydrophobicContact CB-CB 4.37Å; Q1956-P1994 HydrophobicContact CB-CG 4.33Å; Q1956-P1994 HydrophobicContact CG-CB 3.95Å; Q1956-P1994 HydrophobicContact CG-CG 3.58Å |
| 1957 | K | 91.6 | Very high | 91.3 | Very high | 49.8 Ų | 49.8 | 42.4 Ų | 42.4 | 22% | 0.217 | 22% | 0.218 | C | C | . | . | H | α-helix | trans | -63.1 | -43.5 | 177 | -74 | -171.1 | 175.4 | -166.4 | 0 | 111.8 | M1931 E1932 Q1934 T1953 V1954 V1960 N1961 | M1931-K1957 HydrophobicContact SD-CB 4.37Å; E1932-K1957 IonicContact OE2-NZ 3.28Å; E1932-K1957 PolarHBondContact OE2-NZ 3.05Å; E1932-K1957 VanDerWaalsContact OE2-NZ 3.09Å; Q1934-K1957 VanDerWaalsContact CD-NZ 3.3Å; Q1934-K1957 VanDerWaalsContact NE2-NZ 3.13Å; T1953-K1957 PolarHBondContact O-N 3.25Å; T1953-K1957 VanDerWaalsContact O-N 3.09Å; V1954-K1957 PolarHBondContact O-N 2.95Å; K1957-V1960 PolarHBondContact O-N 3.1Å; K1957-N1961 WeakPolarHBondContact O-CB 3.43Å; K1957-N1961 PolarHBondContact O-N 2.96Å |
| 1958 | L | 92.2 | Very high | 91.1 | Very high | 1 Ų | 1 | 43.6 Ų | 43.6 | 1% | 0.005 | 22% | 0.223 | C | C | . | . | H | α-helix | trans | -65.9 | -40.6 | 177.5 | -69.8 | 172.3 | 0 | 0 | 0 | 112.1 | L1898 F1929 M1931 V1954 S1955 V1960 N1961 E1962 W1995 | L1898-L1958 HydrophobicContact CD1-CD1 3.62Å; L1898-L1958 HydrophobicContact CD2-CD1 3.89Å; L1898-L1958 HydrophobicContact CG-CD1 4.37Å; F1929-L1958 HydrophobicContact CB-CD2 3.94Å; F1929-L1958 HydrophobicContact CD2-CD2 4.15Å; F1929-L1958 HydrophobicContact CG-CD2 4.15Å; M1931-L1958 HydrophobicContact CG-CD2 4.08Å; M1931-L1958 HydrophobicContact SD-CD1 4.41Å; M1931-L1958 HydrophobicContact SD-CD2 3.56Å; M1931-L1958 VanDerWaalsContact SD-CD2 3.54Å; M1931-L1958 HydrophobicContact SD-CG 3.8Å; V1954-L1958 HydrophobicContact CG1-CD1 3.85Å; V1954-L1958 WeakPolarHBondContact O-CG 3.36Å; V1954-L1958 PolarHBondContact O-N 3.21Å; S1955-L1958 PolarHBondContact O-N 3.31Å; L1958-V1960 VanDerWaalsContact C-N 3.28Å; L1958-V1960 PolarHBondContact O-N 3.09Å; L1958-N1961 PolarHBondContact O-N 3.28Å; L1958-E1962 HydrophobicContact CD2-CG 4.28Å; L1958-E1962 WeakPolarHBondContact O-CA 3.33Å; L1958-E1962 WeakPolarHBondContact O-CB 3.38Å; L1958-E1962 PolarHBondContact O-N 3.28Å; L1958-W1995 HydrophobicContact CB-CH2 4.21Å; L1958-W1995 HydrophobicContact CB-CZ2 3.83Å |
| 1959 | A | 92.7 | Very high | 91.1 | Very high | 2.4 Ų | 2.4 | 41.3 Ų | 41.3 | 2% | 0.02 | 21% | 0.209 | C | C | . | . | H | α-helix | trans | -61.1 | -34.8 | 176.8 | 0 | 0 | 0 | 0 | 0 | 112.6 | S1955 Q1956 T1963 P1994 W1995 N1998 | S1955-A1959 VanDerWaalsContact O-CB 3.3Å; S1955-A1959 WeakPolarHBondContact O-CB 3.38Å; S1955-A1959 PolarHBondContact O-N 3.19Å; Q1956-A1959 PolarHBondContact O-N 3.15Å; A1959-T1963 WeakPolarHBondContact O-CG2 3.37Å; A1959-P1994 HydrophobicContact CB-CB 3.91Å; A1959-W1995 HydrophobicContact CB-CD2 3.7Å; A1959-W1995 HydrophobicContact CB-CE3 4.09Å; A1959-W1995 HydrophobicContact CB-CG 3.97Å; A1959-W1995 HydrophobicContact CB-CZ2 4.24Å; A1959-N1998 PolarHBondContact O-ND2 3.1Å |
| 1960 | V | 91.8 | Very high | 91.1 | Very high | 105.8 Ų | 105.8 | 34.9 Ų | 34.9 | 64% | 0.641 | 18% | 0.176 | S | C | * | . | H | α-helix | trans | -77.3 | -43.7 | 177.4 | 174.3 | 0 | 0 | 0 | 0 | 111.7 | Q1956 K1957 L1958 | Q1956-V1960 WeakPolarHBondContact O-CG2 3.35Å; Q1956-V1960 PolarHBondContact O-N 3.24Å; K1957-V1960 PolarHBondContact O-N 3.1Å; L1958-V1960 VanDerWaalsContact C-N 3.28Å; L1958-V1960 PolarHBondContact O-N 3.09Å |
| 1961 | N | 88.5 | Confident | 90.9 | Very high | 65.8 Ų | 65.8 | 32.7 Ų | 32.7 | 35% | 0.352 | 17% | 0.167 | S | C | . | . | H | α-helix | trans | -83.9 | -38.2 | -172.4 | -69.4 | -13.5 | 0 | 0 | 0 | 113.2 | R1930 K1957 L1958 | R1930-N1961 HydrophobicContact CB-CB 4.19Å; R1930-N1961 PolarHBondContact O-ND2 3.02Å; K1957-N1961 WeakPolarHBondContact O-CB 3.43Å; K1957-N1961 PolarHBondContact O-N 2.96Å; L1958-N1961 PolarHBondContact O-N 3.28Å |
| 1962 | E | 88 | Confident | 90.7 | Very high | 22.6 Ų | 22.6 | 35 Ų | 35 | 11% | 0.106 | 18% | 0.178 | C | C | . | . | trans | -116.2 | 53 | -170.3 | -55.2 | -56.7 | 160.1 | 0 | 0 | 111.9 | F1929 R1930 L1958 H1964 L1965 | F1929-E1962 WeakPolarHBondContact CA-OE1 3.46Å; F1929-E1962 HydrophobicContact CB-CG 4.35Å; F1929-E1962 HydrophobicContact CD1-CG 4.05Å; F1929-E1962 HydrophobicContact CG-CG 4.4Å; R1930-E1962 WeakPolarHBondContact CG-OE1 3.46Å; R1930-E1962 PolarHBondContact N-OE1 3.18Å; R1930-E1962 VanDerWaalsContact N-OE1 3.14Å; L1958-E1962 HydrophobicContact CD2-CG 4.28Å; L1958-E1962 WeakPolarHBondContact O-CA 3.33Å; L1958-E1962 WeakPolarHBondContact O-CB 3.38Å; L1958-E1962 PolarHBondContact O-N 3.28Å; E1962-H1964 PolarHBondContact O-N 3.17Å; E1962-H1964 VanDerWaalsContact O-N 3.08Å; E1962-H1964 IonicContact OE2-CE1 3.32Å; E1962-H1964 PolarHBondContact OE2-CE1 3.07Å; E1962-H1964 VanDerWaalsContact OE2-CE1 3.24Å; E1962-H1964 IonicContact OE2-ND1 2.98Å; E1962-L1965 HydrophobicContact CB-CD1 3.82Å; E1962-L1965 HydrophobicContact CB-CG 4.28Å; E1962-L1965 HydrophobicContact CG-CD1 4.5Å; E1962-L1965 PolarHBondContact O-N 2.84Å | ||
| 1963 | T | 87.5 | Confident | 90.7 | Very high | 32 Ų | 32 | 32 Ų | 32 | 20% | 0.196 | 17% | 0.165 | C | C | . | . | G | 310 helix | trans | -57.9 | -25.3 | -173.3 | 59.9 | 0 | 0 | 0 | 0 | 114.7 | A1959 L1965 T1966 R2001 F2002 | A1959-T1963 WeakPolarHBondContact O-CG2 3.37Å; T1963-L1965 PolarHBondContact O-N 3.28Å; T1963-T1966 WeakPolarHBondContact O-CB 3.39Å; T1963-T1966 PolarHBondContact O-N 3.23Å; T1963-T1966 PolarHBondContact O-OG1 3.03Å; T1963-R2001 PolarHBondContact OG1-NH1 3.32Å; T1963-F2002 WeakPolarHBondContact O-CZ 3.41Å |
| 1964 | H | 82.7 | Confident | 90.7 | Very high | 116.2 Ų | 116.2 | 29.4 Ų | 29.4 | 54% | 0.538 | 15% | 0.149 | S | C | . | . | G | 310 helix | trans | -64 | -24.5 | -179.3 | 68.3 | -83.4 | 0 | 0 | 0 | 113.4 | E1962 T1966 | E1962-H1964 PolarHBondContact O-N 3.17Å; E1962-H1964 VanDerWaalsContact O-N 3.08Å; E1962-H1964 IonicContact OE2-CE1 3.32Å; E1962-H1964 PolarHBondContact OE2-CE1 3.07Å; E1962-H1964 VanDerWaalsContact OE2-CE1 3.24Å; E1962-H1964 IonicContact OE2-ND1 2.98Å; H1964-T1966 VanDerWaalsContact C-N 3.28Å; H1964-T1966 PolarHBondContact O-N 3.18Å |
| 1965 | L | 88.7 | Confident | 90.5 | Very high | 3.2 Ų | 3.2 | 32.7 Ų | 32.7 | 2% | 0.017 | 16% | 0.164 | C | C | . | . | G | 310 helix | trans | -77.4 | -11.6 | -179.9 | -58.8 | 177.8 | 0 | 0 | 0 | 113.8 | P1894 L1898 F1929 E1962 T1963 L1967 E1968 F1969 W1995 | P1894-L1965 HydrophobicContact CB-CD2 3.81Å; P1894-L1965 HydrophobicContact CG-CD2 3.43Å; P1894-L1965 VanDerWaalsContact CG-CD2 3.42Å; L1898-L1965 HydrophobicContact CD2-CD1 4.33Å; F1929-L1965 HydrophobicContact CE1-CD1 3.78Å; F1929-L1965 HydrophobicContact CZ-CD1 3.91Å; E1962-L1965 HydrophobicContact CB-CD1 3.82Å; E1962-L1965 HydrophobicContact CB-CG 4.28Å; E1962-L1965 HydrophobicContact CG-CD1 4.5Å; E1962-L1965 PolarHBondContact O-N 2.84Å; T1963-L1965 PolarHBondContact O-N 3.28Å; L1965-L1967 VanDerWaalsContact C-N 3.33Å; L1965-L1967 PolarHBondContact O-N 3.17Å; L1965-E1968 PolarHBondContact O-N 3.05Å; L1965-F1969 VanDerWaalsContact O-CB 3.26Å; L1965-F1969 WeakPolarHBondContact O-CB 3.37Å; L1965-F1969 PolarHBondContact O-N 3.14Å; L1965-W1995 HydrophobicContact CB-CH2 4.11Å; L1965-W1995 HydrophobicContact CB-CZ3 4.01Å; L1965-W1995 HydrophobicContact CD1-CH2 4.43Å |
| 1966 | T | 91 | Very high | 90.2 | Very high | 0 Ų | 0 | 32.9 Ų | 32.9 | 0% | 0 | 17% | 0.166 | C | C | . | . | H | α-helix | trans | -52.3 | -48.5 | -166.3 | -60.5 | 0 | 0 | 0 | 0 | 113.3 | T1963 H1964 F1969 L1970 W1995 N1998 L1999 F2002 | T1963-T1966 WeakPolarHBondContact O-CB 3.39Å; T1963-T1966 PolarHBondContact O-N 3.23Å; T1963-T1966 PolarHBondContact O-OG1 3.03Å; H1964-T1966 VanDerWaalsContact C-N 3.28Å; H1964-T1966 PolarHBondContact O-N 3.18Å; T1966-F1969 PolarHBondContact O-N 2.94Å; T1966-L1970 HydrophobicContact CG2-CD1 3.71Å; T1966-L1970 HydrophobicContact CG2-CG 4.28Å; T1966-L1970 VanDerWaalsContact O-CB 3.29Å; T1966-L1970 WeakPolarHBondContact O-CB 3.35Å; T1966-L1970 WeakPolarHBondContact O-CG 3.32Å; T1966-L1970 PolarHBondContact O-N 3.12Å; T1966-W1995 HydrophobicContact CG2-CB 4.43Å; T1966-W1995 HydrophobicContact CG2-CE3 4.31Å; T1966-W1995 WeakPolarHBondContact CG2-O 3.29Å; T1966-N1998 HydrophobicContact CG2-CB 3.81Å; T1966-N1998 WeakPolarHBondContact OG1-CB 3.41Å; T1966-N1998 PolarHBondContact OG1-ND2 3.13Å; T1966-L1999 HydrophobicContact CG2-CD2 4.38Å; T1966-F2002 HydrophobicContact CG2-CE2 4.02Å |
| 1967 | L | 88.8 | Confident | 90.1 | Very high | 4.4 Ų | 4.4 | 28.8 Ų | 28.8 | 2% | 0.023 | 15% | 0.147 | C | C | . | . | H | α-helix | trans | -72.2 | -43.2 | -171.7 | -64.4 | 171.8 | 0 | 0 | 0 | 112 | F1830 L1965 L1970 Q1971 L1999 F2002 A2015 V2016 V2019 | F1830-L1967 HydrophobicContact CD1-CD1 3.68Å; F1830-L1967 HydrophobicContact CD2-CB 3.85Å; F1830-L1967 HydrophobicContact CD2-CD1 4.25Å; F1830-L1967 HydrophobicContact CE1-CB 3.94Å; F1830-L1967 HydrophobicContact CE1-CD1 3.21Å; F1830-L1967 HydrophobicContact CE1-CD2 4.37Å; F1830-L1967 HydrophobicContact CE1-CG 4.06Å; F1830-L1967 HydrophobicContact CE2-CB 3.51Å; F1830-L1967 HydrophobicContact CE2-CD1 3.78Å; F1830-L1967 HydrophobicContact CE2-CD2 4.44Å; F1830-L1967 HydrophobicContact CE2-CG 3.98Å; F1830-L1967 HydrophobicContact CG-CD1 4.23Å; F1830-L1967 HydrophobicContact CZ-CB 3.23Å; F1830-L1967 HydrophobicContact CZ-CD1 3.45Å; F1830-L1967 HydrophobicContact CZ-CD2 3.97Å; F1830-L1967 HydrophobicContact CZ-CG 3.74Å; L1965-L1967 VanDerWaalsContact C-N 3.33Å; L1965-L1967 PolarHBondContact O-N 3.17Å; L1967-L1970 PolarHBondContact O-N 3.4Å; L1967-Q1971 WeakPolarHBondContact O-CB 3.37Å; L1967-Q1971 VanDerWaalsContact O-CG 3.26Å; L1967-Q1971 WeakPolarHBondContact O-CG 3.39Å; L1967-Q1971 PolarHBondContact O-N 3.18Å; L1967-Q1971 VanDerWaalsContact O-N 3.08Å; L1967-L1999 HydrophobicContact CD2-CD2 3.84Å; L1967-F2002 HydrophobicContact CD1-CB 4.17Å; L1967-F2002 HydrophobicContact CD1-CD1 3.54Å; L1967-F2002 HydrophobicContact CD1-CD2 4.19Å; L1967-F2002 HydrophobicContact CD1-CE1 3.9Å; L1967-F2002 HydrophobicContact CD1-CE2 4.21Å; L1967-F2002 HydrophobicContact CD1-CG 3.74Å; L1967-F2002 HydrophobicContact CD1-CZ 4.28Å; L1967-F2002 HydrophobicContact CD2-CD2 4.2Å; L1967-F2002 HydrophobicContact CD2-CE2 4.32Å; L1967-F2002 HydrophobicContact CD2-CG 4.31Å; L1967-F2002 HydrophobicContact CG-CD1 4.11Å; L1967-F2002 HydrophobicContact CG-CD2 4.08Å; L1967-F2002 HydrophobicContact CG-CE1 4.18Å; L1967-F2002 HydrophobicContact CG-CE2 4.17Å; L1967-F2002 HydrophobicContact CG-CG 4.04Å; L1967-F2002 HydrophobicContact CG-CZ 4.21Å; L1967-A2015 HydrophobicContact CD1-CB 3.97Å; L1967-V2016 HydrophobicContact CD1-CG2 4.4Å; L1967-V2016 HydrophobicContact CD2-CG2 3.84Å; L1967-V2019 HydrophobicContact CD2-CG2 4.27Å |
| 1968 | E | 87.6 | Confident | 89.8 | Confident | 37.8 Ų | 37.8 | 30.8 Ų | 30.8 | 18% | 0.177 | 15% | 0.153 | C | C | . | . | H | α-helix | trans | -62.1 | -49.1 | 174.9 | -167.6 | -156.1 | 153.6 | 0 | 0 | 110.4 | F1830 V1893 P1894 G1895 T1896 L1965 L1970 Q1971 E1972 | F1830-E1968 HydrophobicContact CE2-CB 4.43Å; V1893-E1968 WeakPolarHBondContact CA-OE1 3.43Å; V1893-E1968 WeakPolarHBondContact CB-OE1 3.35Å; P1894-E1968 WeakPolarHBondContact CD-OE2 3.39Å; G1895-E1968 WeakPolarHBondContact CA-OE2 3.37Å; G1895-E1968 VanDerWaalsContact N-CD 3.27Å; G1895-E1968 PolarHBondContact N-OE1 2.86Å; G1895-E1968 VanDerWaalsContact N-OE1 3.16Å; G1895-E1968 PolarHBondContact N-OE2 3.1Å; T1896-E1968 VanDerWaalsContact CB-OE1 3.32Å; T1896-E1968 WeakPolarHBondContact CB-OE1 3.41Å; T1896-E1968 PolarHBondContact N-OE1 2.99Å; T1896-E1968 PolarHBondContact OG1-OE1 3.07Å; L1965-E1968 PolarHBondContact O-N 3.05Å; E1968-L1970 PolarHBondContact O-N 3.11Å; E1968-Q1971 PolarHBondContact O-N 3.25Å; E1968-E1972 PolarHBondContact O-N 3.28Å; E1968-E1972 VanDerWaalsContact O-N 3.09Å |
| 1969 | F | 92.9 | Very high | 89.6 | Confident | 0 Ų | 0 | 37 Ų | 37 | 0% | 0 | 18% | 0.182 | C | C | . | . | H | α-helix | trans | -57.8 | -47.9 | 179 | -177.8 | -99.3 | 0 | 0 | 0 | 112 | G1895 L1898 N1899 L1902 L1965 T1966 Q1971 E1972 C1973 Y1991 W1995 | G1895-F1969 WeakPolarHBondContact O-CD2 3.5Å; L1898-F1969 HydrophobicContact CB-CD2 4.28Å; L1898-F1969 HydrophobicContact CB-CE2 4.4Å; L1898-F1969 HydrophobicContact CD2-CD2 3.94Å; L1898-F1969 HydrophobicContact CD2-CE2 4.03Å; L1898-F1969 HydrophobicContact CG-CD2 4.08Å; L1898-F1969 HydrophobicContact CG-CE2 3.88Å; N1899-F1969 HydrophobicContact CB-CD2 4.15Å; N1899-F1969 HydrophobicContact CB-CE2 3.97Å; L1902-F1969 HydrophobicContact CD1-CE2 3.91Å; L1902-F1969 HydrophobicContact CD1-CZ 3.84Å; L1965-F1969 VanDerWaalsContact O-CB 3.26Å; L1965-F1969 WeakPolarHBondContact O-CB 3.37Å; L1965-F1969 PolarHBondContact O-N 3.14Å; T1966-F1969 PolarHBondContact O-N 2.94Å; F1969-Q1971 PolarHBondContact O-N 2.93Å; F1969-E1972 PolarHBondContact O-N 3.21Å; F1969-C1973 WeakPolarHBondContact CE1-SG 3.31Å; F1969-C1973 WeakPolarHBondContact CZ-SG 3.39Å; F1969-C1973 WeakPolarHBondContact O-CB 3.31Å; F1969-C1973 PolarHBondContact O-N 3.27Å; F1969-C1973 PolarHBondContact O-SG 3.23Å; F1969-Y1991 HydrophobicContact CE1-CD2 4.1Å; F1969-Y1991 HydrophobicContact CE1-CE2 4.18Å; F1969-Y1991 HydrophobicContact CE2-CE2 4.48Å; F1969-Y1991 AromaticContact CZ-CD2 3.64Å; F1969-Y1991 HydrophobicContact CZ-CD2 3.64Å; F1969-Y1991 AromaticContact CZ-CE2 3.61Å; F1969-Y1991 HydrophobicContact CZ-CE2 3.61Å; F1969-W1995 HydrophobicContact CD1-CB 4.43Å; F1969-W1995 AromaticContact CD1-CD1 3.73Å; F1969-W1995 AromaticContact CD1-CD2 3.66Å; F1969-W1995 HydrophobicContact CD1-CD2 3.66Å; F1969-W1995 AromaticContact CD1-CE2 3.64Å; F1969-W1995 HydrophobicContact CD1-CE3 4.33Å; F1969-W1995 AromaticContact CD1-CG 3.7Å; F1969-W1995 HydrophobicContact CD1-CG 3.7Å; F1969-W1995 HydrophobicContact CD1-CZ2 4.26Å; F1969-W1995 AromaticContact CD1-NE1 3.69Å; F1969-W1995 AromaticContact CE1-CD1 3.36Å; F1969-W1995 AromaticContact CE1-CD2 3.97Å; F1969-W1995 HydrophobicContact CE1-CD2 4.05Å; F1969-W1995 AromaticContact CE1-CE2 3.69Å; F1969-W1995 AromaticContact CE1-CG 3.84Å; F1969-W1995 HydrophobicContact CE1-CG 3.84Å; F1969-W1995 HydrophobicContact CE1-CZ2 4.41Å; F1969-W1995 AromaticContact CE1-NE1 3.26Å; F1969-W1995 VanDerWaalsContact CE1-NE1 3.29Å; F1969-W1995 HydrophobicContact CG-CD2 4.35Å; F1969-W1995 HydrophobicContact CG-CZ2 4.37Å; F1969-W1995 AromaticContact CZ-NE1 3.83Å |
| 1970 | L | 93.8 | Very high | 89.4 | Confident | 0.2 Ų | 0.2 | 37.8 Ų | 37.8 | 0% | 0.001 | 19% | 0.187 | C | C | . | . | H | α-helix | trans | -64.2 | -42.5 | 179.2 | -73.5 | 176.6 | 0 | 0 | 0 | 112.2 | T1966 L1967 E1968 E1972 C1973 I1974 I1992 W1995 L1996 L1999 V2019 | T1966-L1970 HydrophobicContact CG2-CD1 3.71Å; T1966-L1970 HydrophobicContact CG2-CG 4.28Å; T1966-L1970 VanDerWaalsContact O-CB 3.29Å; T1966-L1970 WeakPolarHBondContact O-CB 3.35Å; T1966-L1970 WeakPolarHBondContact O-CG 3.32Å; T1966-L1970 PolarHBondContact O-N 3.12Å; L1967-L1970 PolarHBondContact O-N 3.4Å; E1968-L1970 PolarHBondContact O-N 3.11Å; L1970-E1972 VanDerWaalsContact C-N 3.32Å; L1970-E1972 PolarHBondContact O-N 3.15Å; L1970-C1973 PolarHBondContact O-N 3.05Å; L1970-I1974 VanDerWaalsContact O-CD1 3.29Å; L1970-I1974 WeakPolarHBondContact O-CD1 3.32Å; L1970-I1974 VanDerWaalsContact O-CG1 3.23Å; L1970-I1974 WeakPolarHBondContact O-CG1 3.29Å; L1970-I1974 PolarHBondContact O-N 3.32Å; L1970-I1974 VanDerWaalsContact O-N 3.07Å; L1970-I1992 HydrophobicContact CD2-CD1 3.8Å; L1970-I1992 HydrophobicContact CD2-CG1 3.35Å; L1970-I1992 HydrophobicContact CD2-CG2 3.69Å; L1970-W1995 HydrophobicContact CD1-CB 4.43Å; L1970-W1995 HydrophobicContact CD2-CB 3.85Å; L1970-W1995 HydrophobicContact CG-CB 4.2Å; L1970-L1996 HydrophobicContact CD1-CD2 4.23Å; L1970-L1996 HydrophobicContact CD2-CD2 3.94Å; L1970-L1999 HydrophobicContact CD1-CD1 4.35Å; L1970-L1999 HydrophobicContact CD1-CD2 3.65Å; L1970-L1999 HydrophobicContact CD1-CG 4.05Å; L1970-V2019 HydrophobicContact CB-CG1 4.13Å; L1970-V2019 HydrophobicContact CD1-CG1 4.21Å |
| 1971 | Q | 89.9 | Confident | 89.3 | Confident | 30.8 Ų | 30.8 | 35.4 Ų | 35.4 | 14% | 0.144 | 18% | 0.176 | C | C | . | . | H | α-helix | trans | -62 | -42.4 | 179.3 | -75.4 | 179.9 | 3.7 | 0 | 0 | 112.1 | I1829 L1967 E1968 F1969 Q1975 V2019 | I1829-Q1971 VanDerWaalsContact CD1-CD 3.49Å; I1829-Q1971 VanDerWaalsContact CD1-NE2 3.34Å; L1967-Q1971 WeakPolarHBondContact O-CB 3.37Å; L1967-Q1971 VanDerWaalsContact O-CG 3.26Å; L1967-Q1971 WeakPolarHBondContact O-CG 3.39Å; L1967-Q1971 PolarHBondContact O-N 3.18Å; L1967-Q1971 VanDerWaalsContact O-N 3.08Å; E1968-Q1971 PolarHBondContact O-N 3.25Å; F1969-Q1971 PolarHBondContact O-N 2.93Å; Q1971-Q1975 WeakPolarHBondContact O-CB 3.23Å; Q1971-Q1975 PolarHBondContact O-N 3.2Å; Q1971-Q1975 VanDerWaalsContact O-N 3.13Å; Q1971-V2019 HydrophobicContact CG-CG2 3.64Å |
| 1972 | E | 90.2 | Very high | 89.3 | Confident | 48.4 Ų | 48.4 | 36.1 Ų | 36.1 | 23% | 0.226 | 18% | 0.179 | C | C | . | . | H | α-helix | trans | -73.9 | -38 | 178.8 | -172.5 | 62.8 | -167.1 | 0 | 0 | 112 | Y1228 T1896 N1899 E1968 F1969 L1970 I1974 Q1975 G1976 | Y1228-E1972 WeakPolarHBondContact CE2-OE1 3.34Å; Y1228-E1972 WeakPolarHBondContact OH-CG 3.37Å; Y1228-E1972 PolarHBondContact OH-OE1 3.42Å; T1896-E1972 HydrophobicContact CG2-CG 3.87Å; N1899-E1972 HydrophobicContact CB-CB 4.39Å; N1899-E1972 HydrophobicContact CB-CG 4.1Å; N1899-E1972 PolarHBondContact ND2-O 3Å; E1968-E1972 PolarHBondContact O-N 3.28Å; E1968-E1972 VanDerWaalsContact O-N 3.09Å; F1969-E1972 PolarHBondContact O-N 3.21Å; L1970-E1972 VanDerWaalsContact C-N 3.32Å; L1970-E1972 PolarHBondContact O-N 3.15Å; E1972-I1974 VanDerWaalsContact C-N 3.33Å; E1972-I1974 PolarHBondContact O-N 3.1Å; E1972-Q1975 WeakPolarHBondContact O-CB 3.35Å; E1972-Q1975 PolarHBondContact O-N 3.08Å; E1972-Q1975 VanDerWaalsContact O-N 3.14Å; E1972-G1976 PolarHBondContact O-N 3.22Å |
| 1973 | C | 93.5 | Very high | 89.4 | Confident | 1 Ų | 1 | 41.7 Ų | 41.7 | 1% | 0.007 | 20% | 0.204 | C | C | . | . | H | α-helix | trans | -59.4 | -43.8 | 175 | -136.2 | 0 | 0 | 0 | 0 | 111.8 | N1899 F1969 L1970 Q1975 G1976 F1977 Y1991 I1992 | N1899-C1973 VanDerWaalsContact CG-SG 3.54Å; N1899-C1973 VanDerWaalsContact OD1-CA 3.28Å; N1899-C1973 WeakPolarHBondContact OD1-CA 3.33Å; N1899-C1973 WeakPolarHBondContact OD1-CB 3.46Å; N1899-C1973 PolarHBondContact OD1-SG 3.3Å; F1969-C1973 WeakPolarHBondContact CE1-SG 3.31Å; F1969-C1973 WeakPolarHBondContact CZ-SG 3.39Å; F1969-C1973 WeakPolarHBondContact O-CB 3.31Å; F1969-C1973 PolarHBondContact O-N 3.27Å; F1969-C1973 PolarHBondContact O-SG 3.23Å; L1970-C1973 PolarHBondContact O-N 3.05Å; C1973-Q1975 VanDerWaalsContact C-N 3.33Å; C1973-Q1975 PolarHBondContact O-N 3.14Å; C1973-G1976 PolarHBondContact O-N 3.29Å; C1973-F1977 VanDerWaalsContact O-CB 3.29Å; C1973-F1977 WeakPolarHBondContact O-CB 3.34Å; C1973-F1977 PolarHBondContact O-N 3.11Å; C1973-Y1991 HydrophobicContact CB-CE2 4.45Å; C1973-Y1991 WeakPolarHBondContact SG-CE2 3.37Å; C1973-Y1991 PolarHBondContact SG-OH 3.1Å; C1973-Y1991 VanDerWaalsContact SG-OH 3.35Å; C1973-I1992 HydrophobicContact CB-CD1 3.97Å; C1973-I1992 HydrophobicContact CB-CG1 4.04Å |
| 1974 | I | 92 | Very high | 89.5 | Confident | 3.2 Ų | 3.2 | 41.5 Ų | 41.5 | 2% | 0.016 | 20% | 0.202 | C | C | . | . | H | α-helix | trans | -66 | -36.9 | 177.2 | -62.6 | 160.5 | 0 | 0 | 0 | 111.2 | L1970 E1972 F1977 R1978 I1992 V2019 K2022 L2023 L2026 | L1970-I1974 VanDerWaalsContact O-CD1 3.29Å; L1970-I1974 WeakPolarHBondContact O-CD1 3.32Å; L1970-I1974 VanDerWaalsContact O-CG1 3.23Å; L1970-I1974 WeakPolarHBondContact O-CG1 3.29Å; L1970-I1974 PolarHBondContact O-N 3.32Å; L1970-I1974 VanDerWaalsContact O-N 3.07Å; E1972-I1974 VanDerWaalsContact C-N 3.33Å; E1972-I1974 PolarHBondContact O-N 3.1Å; I1974-F1977 WeakPolarHBondContact O-CB 3.4Å; I1974-F1977 PolarHBondContact O-N 3.18Å; I1974-R1978 PolarHBondContact O-N 3.45Å; I1974-I1992 HydrophobicContact CG1-CD1 4.32Å; I1974-V2019 HydrophobicContact CD1-CG1 4.05Å; I1974-K2022 HydrophobicContact CD1-CB 4.18Å; I1974-K2022 HydrophobicContact CG2-CB 3.93Å; I1974-K2022 HydrophobicContact CG2-CD 4.45Å; I1974-L2023 HydrophobicContact CD1-CD2 3.58Å; I1974-L2023 HydrophobicContact CD1-CG 3.74Å; I1974-L2023 HydrophobicContact CG1-CD2 3.82Å; I1974-L2023 HydrophobicContact CG1-CG 4.43Å; I1974-L2026 HydrophobicContact CG2-CD1 3.96Å |
| 1975 | Q | 88.4 | Confident | 90 | Very high | 72.2 Ų | 72.2 | 37 Ų | 37 | 34% | 0.337 | 18% | 0.181 | S | C | . | . | H | α-helix | trans | -66 | -46.3 | 175.5 | -174 | 65 | 18.6 | 0 | 0 | 111.6 | Q1971 E1972 C1973 F1977 R1978 | Q1971-Q1975 WeakPolarHBondContact O-CB 3.23Å; Q1971-Q1975 PolarHBondContact O-N 3.2Å; Q1971-Q1975 VanDerWaalsContact O-N 3.13Å; E1972-Q1975 WeakPolarHBondContact O-CB 3.35Å; E1972-Q1975 PolarHBondContact O-N 3.08Å; E1972-Q1975 VanDerWaalsContact O-N 3.14Å; C1973-Q1975 VanDerWaalsContact C-N 3.33Å; C1973-Q1975 PolarHBondContact O-N 3.14Å; Q1975-F1977 VanDerWaalsContact C-N 3.32Å; Q1975-F1977 PolarHBondContact O-N 3.14Å; Q1975-R1978 PolarHBondContact O-N 3.25Å |
| 1976 | G | 87.6 | Confident | 90.2 | Very high | 4.4 Ų | 4.4 | 41 Ų | 41 | 5% | 0.045 | 20% | 0.199 | C | C | . | . | H | α-helix | trans | -66.5 | -30.6 | 176.9 | 0 | 0 | 0 | 0 | 0 | 113.5 | E1972 C1973 R1978 Q1979 S1980 | E1972-G1976 PolarHBondContact O-N 3.22Å; C1973-G1976 PolarHBondContact O-N 3.29Å; G1976-R1978 VanDerWaalsContact C-N 3.33Å; G1976-R1978 PolarHBondContact O-N 3.07Å; G1976-Q1979 PolarHBondContact O-N 3.21Å; G1976-Q1979 VanDerWaalsContact O-N 3.14Å; G1976-S1980 WeakPolarHBondContact O-CB 3.5Å; G1976-S1980 PolarHBondContact O-N 3.26Å; G1976-S1980 PolarHBondContact O-OG 3.09Å |
| 1977 | F | 91.9 | Very high | 90.3 | Very high | 3.6 Ų | 3.6 | 41.5 Ų | 41.5 | 2% | 0.016 | 20% | 0.202 | C | C | . | . | H | α-helix | trans | -57.1 | -45.8 | 176.6 | -174.4 | -81.9 | 0 | 0 | 0 | 112 | C1973 I1974 Q1975 Q1979 S1980 K1985 C1988 L1989 L2026 E2030 M2033 I2037 | C1973-F1977 VanDerWaalsContact O-CB 3.29Å; C1973-F1977 WeakPolarHBondContact O-CB 3.34Å; C1973-F1977 PolarHBondContact O-N 3.11Å; I1974-F1977 WeakPolarHBondContact O-CB 3.4Å; I1974-F1977 PolarHBondContact O-N 3.18Å; Q1975-F1977 VanDerWaalsContact C-N 3.32Å; Q1975-F1977 PolarHBondContact O-N 3.14Å; F1977-Q1979 PolarHBondContact O-N 3.29Å; F1977-S1980 WeakPolarHBondContact O-CB 3.36Å; F1977-S1980 PolarHBondContact O-N 3.3Å; F1977-S1980 VanDerWaalsContact O-N 3.15Å; F1977-K1985 HydrophobicContact CD1-CD 4.33Å; F1977-K1985 HydrophobicContact CD1-CG 4.17Å; F1977-K1985 HydrophobicContact CD2-CB 4.24Å; F1977-K1985 HydrophobicContact CD2-CG 4.16Å; F1977-K1985 HydrophobicContact CE1-CB 4.34Å; F1977-K1985 HydrophobicContact CE1-CD 3.79Å; F1977-K1985 HydrophobicContact CE1-CG 3.89Å; F1977-K1985 HydrophobicContact CE2-CB 3.63Å; F1977-K1985 HydrophobicContact CE2-CD 4.46Å; F1977-K1985 HydrophobicContact CE2-CG 3.9Å; F1977-K1985 WeakPolarHBondContact CE2-O 3.38Å; F1977-K1985 HydrophobicContact CG-CG 4.3Å; F1977-K1985 HydrophobicContact CZ-CB 3.7Å; F1977-K1985 HydrophobicContact CZ-CD 3.93Å; F1977-K1985 HydrophobicContact CZ-CG 3.77Å; F1977-K1985 VanDerWaalsContact O-CE 3.22Å; F1977-K1985 WeakPolarHBondContact O-CE 3.27Å; F1977-C1988 HydrophobicContact CD2-CB 3.71Å; F1977-C1988 HydrophobicContact CE2-CB 4.28Å; F1977-L1989 HydrophobicContact CE2-CD2 3.93Å; F1977-L1989 HydrophobicContact CE2-CG 3.95Å; F1977-L1989 HydrophobicContact CZ-CD2 4.36Å; F1977-L1989 HydrophobicContact CZ-CG 4.45Å; F1977-L2026 HydrophobicContact CB-CD1 4.18Å; F1977-L2026 HydrophobicContact CD1-CD1 3.48Å; F1977-L2026 VanDerWaalsContact CD1-CD1 3.45Å; F1977-L2026 HydrophobicContact CD1-CG 4.11Å; F1977-L2026 HydrophobicContact CD2-CD1 4.38Å; F1977-L2026 HydrophobicContact CE1-CD1 3.94Å; F1977-L2026 HydrophobicContact CE1-CD2 4.28Å; F1977-L2026 HydrophobicContact CE1-CG 4.15Å; F1977-L2026 HydrophobicContact CG-CD1 3.79Å; F1977-L2026 HydrophobicContact CZ-CD1 4.43Å; F1977-L2026 HydrophobicContact CZ-CD2 4.43Å; F1977-E2030 HydrophobicContact CD1-CG 4.39Å; F1977-E2030 HydrophobicContact CE1-CG 3.89Å; F1977-M2033 HydrophobicContact CE1-CE 4.38Å; F1977-M2033 HydrophobicContact CE2-CE 3.53Å; F1977-M2033 HydrophobicContact CZ-CB 4.49Å; F1977-M2033 HydrophobicContact CZ-CE 4.05Å; F1977-M2033 HydrophobicContact CZ-CG 4.41Å; F1977-M2033 HydrophobicContact CZ-SD 3.99Å; F1977-I2037 HydrophobicContact CZ-CD1 4.42Å |
| 1978 | R | 86.7 | Confident | 90.6 | Very high | 92 Ų | 92 | 41.3 Ų | 41.3 | 35% | 0.347 | 20% | 0.201 | S | C | . | . | H | α-helix | trans | -62.4 | -26.3 | -178.8 | -73.4 | 178.7 | 163.7 | 170.6 | -8.3 | 113.6 | I1974 Q1975 G1976 T2025 E2029 | I1974-R1978 PolarHBondContact O-N 3.45Å; Q1975-R1978 PolarHBondContact O-N 3.25Å; G1976-R1978 VanDerWaalsContact C-N 3.33Å; G1976-R1978 PolarHBondContact O-N 3.07Å; R1978-T2025 VanDerWaalsContact NH2-CG2 3.25Å; R1978-E2029 IonicContact CZ-OE1 2.67Å; R1978-E2029 IonicContact CZ-OE2 3.61Å; R1978-E2029 VanDerWaalsContact CZ-OE2 3.32Å; R1978-E2029 IonicContact NE-OE2 3.2Å; R1978-E2029 PolarHBondContact NE-OE2 3.12Å; R1978-E2029 VanDerWaalsContact NH2-CD 3.34Å; R1978-E2029 IonicContact NH2-OE1 2.94Å; R1978-E2029 PolarHBondContact NH2-OE1 3.19Å; R1978-E2029 IonicContact NH2-OE2 2.9Å; R1978-E2029 PolarHBondContact NH2-OE2 2.99Å |
| 1979 | Q | 86.4 | Confident | 90.9 | Very high | 130.8 Ų | 130.8 | 39.7 Ų | 39.7 | 61% | 0.611 | 19% | 0.193 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -97.3 | -0.3 | -177.7 | -59.2 | -176.4 | 5.5 | 0 | 0 | 113.2 | G1976 F1977 | G1976-Q1979 PolarHBondContact O-N 3.21Å; G1976-Q1979 VanDerWaalsContact O-N 3.14Å; F1977-Q1979 PolarHBondContact O-N 3.29Å |
| 1980 | S | 89.1 | Confident | 90.9 | Very high | 18.4 Ų | 18.4 | 41.7 Ų | 41.7 | 13% | 0.129 | 20% | 0.203 | C | C | . | . | S | Bend | trans | -95.5 | 155.2 | -172.8 | -67.1 | 0 | 0 | 0 | 0 | 113.3 | G1976 F1977 K1985 | G1976-S1980 WeakPolarHBondContact O-CB 3.5Å; G1976-S1980 PolarHBondContact O-N 3.26Å; G1976-S1980 PolarHBondContact O-OG 3.09Å; F1977-S1980 WeakPolarHBondContact O-CB 3.36Å; F1977-S1980 PolarHBondContact O-N 3.3Å; F1977-S1980 VanDerWaalsContact O-N 3.15Å; S1980-K1985 VanDerWaalsContact O-CE 3.29Å; S1980-K1985 WeakPolarHBondContact O-CE 3.39Å |
| 1981 | S | 90.1 | Very high | 91 | Very high | 57.4 Ų | 57.4 | 41.7 Ų | 41.7 | 40% | 0.401 | 20% | 0.203 | S | C | . | . | trans | -69.7 | 163.6 | 170 | 71.5 | 0 | 0 | 0 | 0 | 111.5 | E1983 I1984 K1985 | S1981-E1983 VanDerWaalsContact C-N 3.29Å; S1981-E1983 VanDerWaalsContact CB-OE2 3.26Å; S1981-E1983 WeakPolarHBondContact CB-OE2 3.32Å; S1981-E1983 PolarHBondContact O-N 3.15Å; S1981-E1983 PolarHBondContact OG-OE2 3.12Å; S1981-I1984 CarbonylContact O-C 3.38Å; S1981-I1984 PolarHBondContact O-N 3.17Å; S1981-I1984 VanDerWaalsContact O-N 3.14Å; S1981-K1985 WeakPolarHBondContact O-CB 3.38Å; S1981-K1985 VanDerWaalsContact O-CG 3.31Å; S1981-K1985 WeakPolarHBondContact O-CG 3.4Å; S1981-K1985 PolarHBondContact O-N 3.03Å | ||
| 1982 | I | 89.3 | Confident | 91.2 | Very high | 80.4 Ų | 80.4 | 40.5 Ų | 40.5 | 41% | 0.412 | 20% | 0.198 | S | C | . | . | H | α-helix | trans | -57.6 | -40.2 | -177 | -61.6 | 169.6 | 0 | 0 | 0 | 111.9 | I1984 K1985 H1986 E2032 M2033 | I1982-I1984 PolarHBondContact O-N 3.18Å; I1982-K1985 WeakPolarHBondContact O-CB 3.3Å; I1982-K1985 PolarHBondContact O-N 3.08Å; I1982-H1986 PolarHBondContact O-CD2 3.4Å; I1982-H1986 VanDerWaalsContact O-CD2 3.28Å; I1982-H1986 PolarHBondContact O-N 3.23Å; I1982-H1986 VanDerWaalsContact O-N 3.09Å; I1982-E2032 VanDerWaalsContact CD1-OE2 3.23Å; I1982-E2032 WeakPolarHBondContact CD1-OE2 3.42Å; I1982-M2033 HydrophobicContact CG2-SD 4.13Å |
| 1983 | E | 88.5 | Confident | 91.4 | Very high | 138.8 Ų | 138.8 | 39.4 Ų | 39.4 | 65% | 0.649 | 19% | 0.194 | S | C | * | . | H | α-helix | trans | -63.3 | -43.8 | 178.2 | -56 | 114.7 | 179.3 | 0 | 0 | 111.8 | S1981 H1986 L1987 | S1981-E1983 VanDerWaalsContact C-N 3.29Å; S1981-E1983 VanDerWaalsContact CB-OE2 3.26Å; S1981-E1983 WeakPolarHBondContact CB-OE2 3.32Å; S1981-E1983 PolarHBondContact O-N 3.15Å; S1981-E1983 PolarHBondContact OG-OE2 3.12Å; E1983-H1986 PolarHBondContact O-N 3.08Å; E1983-L1987 PolarHBondContact O-N 3.34Å |
| 1984 | I | 91.2 | Very high | 91.4 | Very high | 28.4 Ų | 28.4 | 40.7 Ų | 40.7 | 15% | 0.146 | 20% | 0.202 | C | C | . | . | H | α-helix | trans | -71.3 | -35.1 | 177.9 | -63.3 | 176.3 | 0 | 0 | 0 | 110.4 | L1903 S1981 I1982 H1986 L1987 C1988 | L1903-I1984 HydrophobicContact CD1-CG2 3.53Å; L1903-I1984 HydrophobicContact CD2-CG2 3.95Å; L1903-I1984 HydrophobicContact CG-CG2 3.93Å; S1981-I1984 CarbonylContact O-C 3.38Å; S1981-I1984 PolarHBondContact O-N 3.17Å; S1981-I1984 VanDerWaalsContact O-N 3.14Å; I1982-I1984 PolarHBondContact O-N 3.18Å; I1984-H1986 VanDerWaalsContact C-N 3.31Å; I1984-H1986 PolarHBondContact O-N 3.24Å; I1984-L1987 CarbonylContact O-C 3.26Å; I1984-L1987 WeakPolarHBondContact O-CA 3.34Å; I1984-L1987 VanDerWaalsContact O-CB 3.32Å; I1984-L1987 WeakPolarHBondContact O-CB 3.33Å; I1984-L1987 PolarHBondContact O-N 3.08Å; I1984-L1987 VanDerWaalsContact O-N 3.1Å; I1984-C1988 WeakPolarHBondContact O-CB 3.49Å; I1984-C1988 PolarHBondContact O-N 3.07Å; I1984-C1988 PolarHBondContact O-SG 3.34Å; I1984-C1988 VanDerWaalsContact O-SG 3.36Å |
| 1985 | K | 92.8 | Very high | 91.5 | Very high | 21.8 Ų | 21.8 | 40.5 Ų | 40.5 | 10% | 0.095 | 20% | 0.201 | C | C | . | . | H | α-helix | trans | -59.7 | -41.4 | 173.7 | -74.5 | 176.4 | 168.5 | -176.9 | 0 | 111.6 | F1977 S1980 S1981 I1982 L1987 C1988 L1989 E2030 M2033 | F1977-K1985 HydrophobicContact CD1-CD 4.33Å; F1977-K1985 HydrophobicContact CD1-CG 4.17Å; F1977-K1985 HydrophobicContact CD2-CB 4.24Å; F1977-K1985 HydrophobicContact CD2-CG 4.16Å; F1977-K1985 HydrophobicContact CE1-CB 4.34Å; F1977-K1985 HydrophobicContact CE1-CD 3.79Å; F1977-K1985 HydrophobicContact CE1-CG 3.89Å; F1977-K1985 HydrophobicContact CE2-CB 3.63Å; F1977-K1985 HydrophobicContact CE2-CD 4.46Å; F1977-K1985 HydrophobicContact CE2-CG 3.9Å; F1977-K1985 WeakPolarHBondContact CE2-O 3.38Å; F1977-K1985 HydrophobicContact CG-CG 4.3Å; F1977-K1985 HydrophobicContact CZ-CB 3.7Å; F1977-K1985 HydrophobicContact CZ-CD 3.93Å; F1977-K1985 HydrophobicContact CZ-CG 3.77Å; F1977-K1985 VanDerWaalsContact O-CE 3.22Å; F1977-K1985 WeakPolarHBondContact O-CE 3.27Å; S1980-K1985 VanDerWaalsContact O-CE 3.29Å; S1980-K1985 WeakPolarHBondContact O-CE 3.39Å; S1981-K1985 WeakPolarHBondContact O-CB 3.38Å; S1981-K1985 VanDerWaalsContact O-CG 3.31Å; S1981-K1985 WeakPolarHBondContact O-CG 3.4Å; S1981-K1985 PolarHBondContact O-N 3.03Å; I1982-K1985 WeakPolarHBondContact O-CB 3.3Å; I1982-K1985 PolarHBondContact O-N 3.08Å; K1985-L1987 VanDerWaalsContact C-N 3.32Å; K1985-L1987 PolarHBondContact O-N 3.23Å; K1985-C1988 WeakPolarHBondContact O-CB 3.4Å; K1985-C1988 PolarHBondContact O-N 3.29Å; K1985-C1988 VanDerWaalsContact O-N 3.17Å; K1985-L1989 WeakPolarHBondContact O-CG 3.46Å; K1985-L1989 PolarHBondContact O-N 3.1Å; K1985-L1989 VanDerWaalsContact O-N 3.11Å; K1985-E2030 WeakPolarHBondContact CE-OE1 3.48Å; K1985-E2030 IonicContact NZ-OE1 3.34Å; K1985-E2030 PolarHBondContact NZ-OE1 3.1Å; K1985-E2030 IonicContact NZ-OE2 3.28Å; K1985-E2030 PolarHBondContact NZ-OE2 3.13Å; K1985-M2033 HydrophobicContact CB-CE 3.65Å; K1985-M2033 HydrophobicContact CB-CG 4.45Å; K1985-M2033 HydrophobicContact CB-SD 3.75Å; K1985-M2033 WeakPolarHBondContact CB-SD 3.46Å; K1985-M2033 HydrophobicContact CD-CE 4.17Å; K1985-M2033 HydrophobicContact CD-CG 4.23Å; K1985-M2033 HydrophobicContact CD-SD 3.71Å; K1985-M2033 HydrophobicContact CG-CE 4.27Å; K1985-M2033 HydrophobicContact CG-SD 4.15Å |
| 1986 | H | 92.7 | Very high | 91.8 | Very high | 86.4 Ų | 86.4 | 37.2 Ų | 37.2 | 40% | 0.4 | 19% | 0.186 | S | C | . | . | H | α-helix | trans | -60.1 | -42.7 | 172.7 | -81.4 | -68.2 | 0 | 0 | 0 | 112.3 | I1982 E1983 I1984 C1988 L1989 E1990 M2033 S2036 | I1982-H1986 PolarHBondContact O-CD2 3.4Å; I1982-H1986 VanDerWaalsContact O-CD2 3.28Å; I1982-H1986 PolarHBondContact O-N 3.23Å; I1982-H1986 VanDerWaalsContact O-N 3.09Å; E1983-H1986 PolarHBondContact O-N 3.08Å; I1984-H1986 VanDerWaalsContact C-N 3.31Å; I1984-H1986 PolarHBondContact O-N 3.24Å; H1986-C1988 VanDerWaalsContact C-N 3.32Å; H1986-C1988 PolarHBondContact O-N 3.15Å; H1986-L1989 PolarHBondContact O-N 3.15Å; H1986-E1990 PolarHBondContact O-N 3.11Å; H1986-M2033 HydrophobicContact CB-CE 4.24Å; H1986-M2033 WeakPolarHBondContact ND1-CE 3.35Å; H1986-S2036 PolarHBondContact CE1-OG 3.33Å |
| 1987 | L | 93.4 | Very high | 91.9 | Very high | 10.8 Ų | 10.8 | 40 Ų | 40 | 6% | 0.057 | 21% | 0.209 | C | C | . | . | H | α-helix | trans | -61.8 | -42.8 | 174.6 | 173.4 | 65.8 | 0 | 0 | 0 | 112 | G1906 T1948 I1951 E1983 I1984 K1985 L1989 E1990 Y1991 | G1906-L1987 VanDerWaalsContact CA-CD2 3.43Å; T1948-L1987 HydrophobicContact CG2-CD1 3.81Å; I1951-L1987 HydrophobicContact CB-CD1 4.2Å; I1951-L1987 HydrophobicContact CD1-CD1 3.92Å; I1951-L1987 HydrophobicContact CD1-CD2 3.79Å; I1951-L1987 HydrophobicContact CD1-CG 4.46Å; I1951-L1987 HydrophobicContact CG2-CD1 4.05Å; E1983-L1987 PolarHBondContact O-N 3.34Å; I1984-L1987 CarbonylContact O-C 3.26Å; I1984-L1987 WeakPolarHBondContact O-CA 3.34Å; I1984-L1987 VanDerWaalsContact O-CB 3.32Å; I1984-L1987 WeakPolarHBondContact O-CB 3.33Å; I1984-L1987 PolarHBondContact O-N 3.08Å; I1984-L1987 VanDerWaalsContact O-N 3.1Å; K1985-L1987 VanDerWaalsContact C-N 3.32Å; K1985-L1987 PolarHBondContact O-N 3.23Å; L1987-L1989 VanDerWaalsContact C-N 3.3Å; L1987-L1989 PolarHBondContact O-N 3.05Å; L1987-E1990 WeakPolarHBondContact O-CB 3.45Å; L1987-E1990 PolarHBondContact O-N 3.15Å; L1987-E1990 VanDerWaalsContact O-N 3.09Å; L1987-Y1991 HydrophobicContact CD1-CD1 4.35Å; L1987-Y1991 HydrophobicContact CG-CD1 4.03Å; L1987-Y1991 HydrophobicContact CG-CE1 4.24Å; L1987-Y1991 WeakPolarHBondContact O-CD1 3.38Å; L1987-Y1991 PolarHBondContact O-N 3.18Å; L1987-Y1991 VanDerWaalsContact O-N 3.14Å |
| 1988 | C | 94.1 | Very high | 91.9 | Very high | 0.6 Ų | 0.6 | 40.7 Ų | 40.7 | 0% | 0.004 | 21% | 0.213 | C | C | . | . | H | α-helix | trans | -55.5 | -45.5 | 176.1 | -80 | 0 | 0 | 0 | 0 | 112 | L1903 F1977 I1984 K1985 H1986 E1990 Y1991 I1992 | L1903-C1988 WeakPolarHBondContact CD1-SG 3.3Å; F1977-C1988 HydrophobicContact CD2-CB 3.71Å; F1977-C1988 HydrophobicContact CE2-CB 4.28Å; I1984-C1988 WeakPolarHBondContact O-CB 3.49Å; I1984-C1988 PolarHBondContact O-N 3.07Å; I1984-C1988 PolarHBondContact O-SG 3.34Å; I1984-C1988 VanDerWaalsContact O-SG 3.36Å; K1985-C1988 WeakPolarHBondContact O-CB 3.4Å; K1985-C1988 PolarHBondContact O-N 3.29Å; K1985-C1988 VanDerWaalsContact O-N 3.17Å; H1986-C1988 VanDerWaalsContact C-N 3.32Å; H1986-C1988 PolarHBondContact O-N 3.15Å; C1988-E1990 VanDerWaalsContact C-N 3.3Å; C1988-E1990 PolarHBondContact O-N 3.2Å; C1988-Y1991 VanDerWaalsContact CA-CE1 3.47Å; C1988-Y1991 HydrophobicContact CB-CE1 4.15Å; C1988-Y1991 PolarHBondContact O-N 3.03Å; C1988-Y1991 PolarHBondContact SG-OH 3.25Å; C1988-I1992 HydrophobicContact CB-CD1 4.13Å; C1988-I1992 VanDerWaalsContact O-CB 3.27Å; C1988-I1992 WeakPolarHBondContact O-CB 3.38Å; C1988-I1992 WeakPolarHBondContact O-CD1 3.5Å; C1988-I1992 VanDerWaalsContact O-CG1 3.22Å; C1988-I1992 WeakPolarHBondContact O-CG1 3.43Å; C1988-I1992 VanDerWaalsContact O-CG2 3.29Å; C1988-I1992 WeakPolarHBondContact O-CG2 3.36Å; C1988-I1992 PolarHBondContact O-N 3.17Å; C1988-I1992 VanDerWaalsContact SG-CD1 3.55Å |
| 1989 | L | 94.1 | Very high | 92.1 | Very high | 3.6 Ų | 3.6 | 36.3 Ų | 36.3 | 2% | 0.019 | 20% | 0.196 | C | C | . | . | H | α-helix | trans | -61.7 | -37 | 176.5 | -64.4 | 178.2 | 0 | 0 | 0 | 112.5 | F1977 K1985 H1986 L1987 Y1991 T1993 M2033 I2037 K2040 I2041 | F1977-L1989 HydrophobicContact CE2-CD2 3.93Å; F1977-L1989 HydrophobicContact CE2-CG 3.95Å; F1977-L1989 HydrophobicContact CZ-CD2 4.36Å; F1977-L1989 HydrophobicContact CZ-CG 4.45Å; K1985-L1989 WeakPolarHBondContact O-CG 3.46Å; K1985-L1989 PolarHBondContact O-N 3.1Å; K1985-L1989 VanDerWaalsContact O-N 3.11Å; H1986-L1989 PolarHBondContact O-N 3.15Å; L1987-L1989 VanDerWaalsContact C-N 3.3Å; L1987-L1989 PolarHBondContact O-N 3.05Å; L1989-Y1991 PolarHBondContact O-N 2.94Å; L1989-T1993 PolarHBondContact O-N 3.1Å; L1989-T1993 PolarHBondContact O-OG1 2.93Å; L1989-M2033 HydrophobicContact CD1-CE 3.78Å; L1989-M2033 HydrophobicContact CG-CE 4.39Å; L1989-I2037 HydrophobicContact CD1-CG1 4.23Å; L1989-I2037 HydrophobicContact CD2-CG1 4.32Å; L1989-K2040 HydrophobicContact CB-CB 4.1Å; L1989-K2040 HydrophobicContact CB-CG 4.23Å; L1989-K2040 HydrophobicContact CD1-CB 4.48Å; L1989-K2040 HydrophobicContact CD1-CG 4.47Å; L1989-I2041 HydrophobicContact CD2-CD1 3.59Å; L1989-I2041 HydrophobicContact CD2-CG1 4.03Å |
| 1990 | E | 93.7 | Very high | 92.2 | Very high | 42.8 Ų | 42.8 | 30.6 Ų | 30.6 | 20% | 0.2 | 17% | 0.171 | C | C | . | . | H | α-helix | trans | -67 | -40.3 | 178.7 | -73.2 | -62.3 | 147.4 | 0 | 0 | 113.1 | T1948 K1952 H1986 L1987 C1988 K2040 | T1948-E1990 HydrophobicContact CG2-CB 4.46Å; T1948-E1990 HydrophobicContact CG2-CG 4.36Å; K1952-E1990 HydrophobicContact CD-CB 4.4Å; K1952-E1990 WeakPolarHBondContact CD-OE2 3.29Å; K1952-E1990 WeakPolarHBondContact CE-OE2 3.41Å; K1952-E1990 IonicContact NZ-OE2 3.38Å; K1952-E1990 PolarHBondContact NZ-OE2 2.93Å; H1986-E1990 PolarHBondContact O-N 3.11Å; L1987-E1990 WeakPolarHBondContact O-CB 3.45Å; L1987-E1990 PolarHBondContact O-N 3.15Å; L1987-E1990 VanDerWaalsContact O-N 3.09Å; C1988-E1990 VanDerWaalsContact C-N 3.3Å; C1988-E1990 PolarHBondContact O-N 3.2Å; E1990-K2040 WeakPolarHBondContact OE1-CE 3.35Å; E1990-K2040 IonicContact OE1-NZ 3.29Å; E1990-K2040 PolarHBondContact OE1-NZ 3.23Å; E1990-K2040 IonicContact OE2-NZ 2.97Å; E1990-K2040 PolarHBondContact OE2-NZ 3.4Å |
| 1991 | Y | 94.9 | Very high | 92 | Very high | 0.2 Ų | 0.2 | 36.9 Ų | 36.9 | 0% | 0.001 | 19% | 0.191 | C | C | . | . | H | α-helix | trans | -91.9 | -18.1 | -177.4 | 77.4 | -111.1 | 0 | 0 | 0 | 114.3 | N1899 L1902 L1903 I1951 S1955 F1969 C1973 L1987 C1988 L1989 P1994 W1995 | N1899-Y1991 PolarHBondContact OD1-OH 3.05Å; L1902-Y1991 HydrophobicContact CB-CE2 4.45Å; L1902-Y1991 HydrophobicContact CD1-CD2 4.36Å; L1903-Y1991 HydrophobicContact CD1-CE1 4.4Å; L1903-Y1991 VanDerWaalsContact CD1-OH 3.32Å; L1903-Y1991 WeakPolarHBondContact CD1-OH 3.46Å; I1951-Y1991 HydrophobicContact CG2-CD1 4.03Å; I1951-Y1991 HydrophobicContact CG2-CG 4.35Å; S1955-Y1991 PolarHBondContact OG-O 3.25Å; F1969-Y1991 HydrophobicContact CE1-CD2 4.1Å; F1969-Y1991 HydrophobicContact CE1-CE2 4.18Å; F1969-Y1991 HydrophobicContact CE2-CE2 4.48Å; F1969-Y1991 AromaticContact CZ-CD2 3.64Å; F1969-Y1991 HydrophobicContact CZ-CD2 3.64Å; F1969-Y1991 AromaticContact CZ-CE2 3.61Å; F1969-Y1991 HydrophobicContact CZ-CE2 3.61Å; C1973-Y1991 HydrophobicContact CB-CE2 4.45Å; C1973-Y1991 WeakPolarHBondContact SG-CE2 3.37Å; C1973-Y1991 PolarHBondContact SG-OH 3.1Å; C1973-Y1991 VanDerWaalsContact SG-OH 3.35Å; L1987-Y1991 HydrophobicContact CD1-CD1 4.35Å; L1987-Y1991 HydrophobicContact CG-CD1 4.03Å; L1987-Y1991 HydrophobicContact CG-CE1 4.24Å; L1987-Y1991 WeakPolarHBondContact O-CD1 3.38Å; L1987-Y1991 PolarHBondContact O-N 3.18Å; L1987-Y1991 VanDerWaalsContact O-N 3.14Å; C1988-Y1991 VanDerWaalsContact CA-CE1 3.47Å; C1988-Y1991 HydrophobicContact CB-CE1 4.15Å; C1988-Y1991 PolarHBondContact O-N 3.03Å; C1988-Y1991 PolarHBondContact SG-OH 3.25Å; L1989-Y1991 PolarHBondContact O-N 2.94Å; Y1991-P1994 VanDerWaalsContact O-CD 3.31Å; Y1991-P1994 WeakPolarHBondContact O-CD 3.33Å; Y1991-W1995 VanDerWaalsContact O-CD1 3.3Å |
| 1992 | I | 94.8 | Very high | 91.7 | Very high | 6 Ų | 6 | 35.3 Ų | 35.3 | 3% | 0.031 | 18% | 0.178 | C | C | . | . | H | α-helix | trans | -73.5 | -36.4 | 173.2 | -126.3 | 174.4 | 0 | 0 | 0 | 111.5 | L1970 C1973 I1974 C1988 P1994 W1995 L1996 | L1970-I1992 HydrophobicContact CD2-CD1 3.8Å; L1970-I1992 HydrophobicContact CD2-CG1 3.35Å; L1970-I1992 HydrophobicContact CD2-CG2 3.69Å; C1973-I1992 HydrophobicContact CB-CD1 3.97Å; C1973-I1992 HydrophobicContact CB-CG1 4.04Å; I1974-I1992 HydrophobicContact CG1-CD1 4.32Å; C1988-I1992 HydrophobicContact CB-CD1 4.13Å; C1988-I1992 VanDerWaalsContact O-CB 3.27Å; C1988-I1992 WeakPolarHBondContact O-CB 3.38Å; C1988-I1992 WeakPolarHBondContact O-CD1 3.5Å; C1988-I1992 VanDerWaalsContact O-CG1 3.22Å; C1988-I1992 WeakPolarHBondContact O-CG1 3.43Å; C1988-I1992 VanDerWaalsContact O-CG2 3.29Å; C1988-I1992 WeakPolarHBondContact O-CG2 3.36Å; C1988-I1992 PolarHBondContact O-N 3.17Å; C1988-I1992 VanDerWaalsContact SG-CD1 3.55Å; I1992-P1994 VanDerWaalsContact C-CD 3.45Å; I1992-P1994 VanDerWaalsContact C-N 3.35Å; I1992-P1994 WeakPolarHBondContact O-CD 3.45Å; I1992-P1994 VanDerWaalsContact O-N 3.12Å; I1992-W1995 WeakPolarHBondContact O-CB 3.32Å; I1992-W1995 PolarHBondContact O-N 3.27Å; I1992-L1996 HydrophobicContact CG2-CD1 4.21Å; I1992-L1996 HydrophobicContact CG2-CD2 4.14Å; I1992-L1996 HydrophobicContact CG2-CG 4.2Å |
| 1993 | T | 93.2 | Very high | 91.1 | Very high | 25.4 Ų | 25.4 | 32.8 Ų | 32.8 | 16% | 0.156 | 17% | 0.167 | C | C | . | . | H | α-helix | trans | -48.1 | -47.2 | -173.1 | -62.8 | 0 | 0 | 0 | 0 | 114.3 | L1989 W1995 L1996 K2040 N2044 | L1989-T1993 PolarHBondContact O-N 3.1Å; L1989-T1993 PolarHBondContact O-OG1 2.93Å; T1993-W1995 VanDerWaalsContact C-N 3.26Å; T1993-W1995 PolarHBondContact O-N 3Å; T1993-L1996 PolarHBondContact O-N 3.2Å; T1993-K2040 PolarHBondContact OG1-O 3Å; T1993-N2044 HydrophobicContact CG2-CB 4.22Å; T1993-N2044 VanDerWaalsContact CG2-ND2 3.34Å; T1993-N2044 WeakPolarHBondContact CG2-ND2 3.35Å |
| 1994 | P | 94 | Very high | 90.2 | Very high | 27 Ų | 27 | 33.3 Ų | 33.3 | 18% | 0.175 | 16% | 0.163 | C | C | . | . | H | α-helix | trans | -61.4 | -28 | -179.1 | -22.3 | 34.6 | 0 | 0 | 0 | 114.5 | Q1956 A1959 Y1991 I1992 | Q1956-P1994 HydrophobicContact CB-CB 4.37Å; Q1956-P1994 HydrophobicContact CB-CG 4.33Å; Q1956-P1994 HydrophobicContact CG-CB 3.95Å; Q1956-P1994 HydrophobicContact CG-CG 3.58Å; A1959-P1994 HydrophobicContact CB-CB 3.91Å; Y1991-P1994 VanDerWaalsContact O-CD 3.31Å; Y1991-P1994 WeakPolarHBondContact O-CD 3.33Å; I1992-P1994 VanDerWaalsContact C-CD 3.45Å; I1992-P1994 VanDerWaalsContact C-N 3.35Å; I1992-P1994 WeakPolarHBondContact O-CD 3.45Å; I1992-P1994 VanDerWaalsContact O-N 3.12Å |
| 1995 | W | 95.3 | Very high | 88.5 | Confident | 0 Ų | 0 | 38.2 Ų | 38.2 | 0% | 0 | 20% | 0.196 | C | C | . | . | H | α-helix | trans | -79.6 | -23.7 | -176.8 | -65.9 | 87.2 | 0 | 0 | 0 | 112.8 | L1898 S1955 L1958 A1959 L1965 T1966 F1969 L1970 Y1991 I1992 T1993 A1997 N1998 | L1898-W1995 HydrophobicContact CD2-CH2 4.34Å; L1898-W1995 HydrophobicContact CD2-CZ2 4.08Å; S1955-W1995 PolarHBondContact OG-NE1 3.3Å; L1958-W1995 HydrophobicContact CB-CH2 4.21Å; L1958-W1995 HydrophobicContact CB-CZ2 3.83Å; A1959-W1995 HydrophobicContact CB-CD2 3.7Å; A1959-W1995 HydrophobicContact CB-CE3 4.09Å; A1959-W1995 HydrophobicContact CB-CG 3.97Å; A1959-W1995 HydrophobicContact CB-CZ2 4.24Å; L1965-W1995 HydrophobicContact CB-CH2 4.11Å; L1965-W1995 HydrophobicContact CB-CZ3 4.01Å; L1965-W1995 HydrophobicContact CD1-CH2 4.43Å; T1966-W1995 HydrophobicContact CG2-CB 4.43Å; T1966-W1995 HydrophobicContact CG2-CE3 4.31Å; T1966-W1995 WeakPolarHBondContact CG2-O 3.29Å; F1969-W1995 HydrophobicContact CD1-CB 4.43Å; F1969-W1995 AromaticContact CD1-CD1 3.73Å; F1969-W1995 AromaticContact CD1-CD2 3.66Å; F1969-W1995 HydrophobicContact CD1-CD2 3.66Å; F1969-W1995 AromaticContact CD1-CE2 3.64Å; F1969-W1995 HydrophobicContact CD1-CE3 4.33Å; F1969-W1995 AromaticContact CD1-CG 3.7Å; F1969-W1995 HydrophobicContact CD1-CG 3.7Å; F1969-W1995 HydrophobicContact CD1-CZ2 4.26Å; F1969-W1995 AromaticContact CD1-NE1 3.69Å; F1969-W1995 AromaticContact CE1-CD1 3.36Å; F1969-W1995 AromaticContact CE1-CD2 3.97Å; F1969-W1995 HydrophobicContact CE1-CD2 4.05Å; F1969-W1995 AromaticContact CE1-CE2 3.69Å; F1969-W1995 AromaticContact CE1-CG 3.84Å; F1969-W1995 HydrophobicContact CE1-CG 3.84Å; F1969-W1995 HydrophobicContact CE1-CZ2 4.41Å; F1969-W1995 AromaticContact CE1-NE1 3.26Å; F1969-W1995 VanDerWaalsContact CE1-NE1 3.29Å; F1969-W1995 HydrophobicContact CG-CD2 4.35Å; F1969-W1995 HydrophobicContact CG-CZ2 4.37Å; F1969-W1995 AromaticContact CZ-NE1 3.83Å; L1970-W1995 HydrophobicContact CD1-CB 4.43Å; L1970-W1995 HydrophobicContact CD2-CB 3.85Å; L1970-W1995 HydrophobicContact CG-CB 4.2Å; Y1991-W1995 VanDerWaalsContact O-CD1 3.3Å; I1992-W1995 WeakPolarHBondContact O-CB 3.32Å; I1992-W1995 PolarHBondContact O-N 3.27Å; T1993-W1995 VanDerWaalsContact C-N 3.26Å; T1993-W1995 PolarHBondContact O-N 3Å; W1995-A1997 VanDerWaalsContact C-N 3.25Å; W1995-A1997 PolarHBondContact O-N 3.11Å; W1995-N1998 WeakPolarHBondContact O-CB 3.32Å; W1995-N1998 PolarHBondContact O-N 3.09Å; W1995-N1998 VanDerWaalsContact O-N 3.12Å |
| 1996 | L | 93.5 | Very high | 86.7 | Confident | 1.8 Ų | 1.8 | 41.7 Ų | 41.7 | 1% | 0.009 | 22% | 0.219 | C | C | . | . | H | α-helix | trans | -63.2 | -32.3 | -179.2 | -61.8 | 175.3 | 0 | 0 | 0 | 112.1 | L1970 I1992 T1993 N1998 L1999 L2023 I2041 V2045 | L1970-L1996 HydrophobicContact CD1-CD2 4.23Å; L1970-L1996 HydrophobicContact CD2-CD2 3.94Å; I1992-L1996 HydrophobicContact CG2-CD1 4.21Å; I1992-L1996 HydrophobicContact CG2-CD2 4.14Å; I1992-L1996 HydrophobicContact CG2-CG 4.2Å; T1993-L1996 PolarHBondContact O-N 3.2Å; L1996-N1998 PolarHBondContact O-N 3.1Å; L1996-L1999 HydrophobicContact CD2-CD1 4.27Å; L1996-L1999 WeakPolarHBondContact O-CB 3.34Å; L1996-L1999 WeakPolarHBondContact O-CG 3.41Å; L1996-L1999 PolarHBondContact O-N 3.18Å; L1996-L2023 HydrophobicContact CD2-CD1 4.2Å; L1996-I2041 HydrophobicContact CD1-CB 4.34Å; L1996-I2041 HydrophobicContact CD1-CG1 4.26Å; L1996-I2041 HydrophobicContact CD1-CG2 4.11Å; L1996-V2045 HydrophobicContact CB-CG2 3.92Å; L1996-V2045 HydrophobicContact CD1-CG2 3.87Å; L1996-V2045 HydrophobicContact CD2-CG2 4.42Å; L1996-V2045 HydrophobicContact CG-CG2 4.29Å |
| 1997 | A | 91.1 | Very high | 84.3 | Confident | 64.2 Ų | 64.2 | 46.2 Ų | 46.2 | 53% | 0.531 | 25% | 0.245 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -65.6 | -17.6 | 177.1 | 0 | 0 | 0 | 0 | 0 | 113.7 | W1995 P2000 | W1995-A1997 VanDerWaalsContact C-N 3.25Å; W1995-A1997 PolarHBondContact O-N 3.11Å; A1997-P2000 VanDerWaalsContact O-CD 3.3Å; A1997-P2000 WeakPolarHBondContact O-CD 3.39Å |
| 1998 | N | 91.9 | Very high | 82.2 | Confident | 17.2 Ų | 17.2 | 47.9 Ų | 47.9 | 9% | 0.092 | 27% | 0.266 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -85.4 | -15.4 | 179.1 | -72.5 | -26.2 | 0 | 0 | 0 | 113.6 | A1959 T1966 W1995 L1996 P2000 R2001 F2002 | A1959-N1998 PolarHBondContact O-ND2 3.1Å; T1966-N1998 HydrophobicContact CG2-CB 3.81Å; T1966-N1998 WeakPolarHBondContact OG1-CB 3.41Å; T1966-N1998 PolarHBondContact OG1-ND2 3.13Å; W1995-N1998 WeakPolarHBondContact O-CB 3.32Å; W1995-N1998 PolarHBondContact O-N 3.09Å; W1995-N1998 VanDerWaalsContact O-N 3.12Å; L1996-N1998 PolarHBondContact O-N 3.1Å; N1998-P2000 VanDerWaalsContact C-N 3.35Å; N1998-R2001 VanDerWaalsContact O-CB 3.28Å; N1998-R2001 WeakPolarHBondContact O-CB 3.37Å; N1998-R2001 WeakPolarHBondContact O-CG 3.27Å; N1998-R2001 PolarHBondContact O-N 3.21Å; N1998-R2001 VanDerWaalsContact O-N 3.11Å; N1998-R2001 PolarHBondContact OD1-NH1 3.39Å; N1998-F2002 WeakPolarHBondContact O-CD2 3.26Å |
| 1999 | L | 90.6 | Very high | 80.6 | Confident | 0 Ų | 0 | 48.9 Ų | 48.9 | 0% | 0 | 27% | 0.271 | C | S | . | . | G | 310 helix | trans | -52.8 | -38.3 | -177.5 | -72.7 | 176.4 | 0 | 0 | 0 | 115.1 | T1966 L1967 L1970 L1996 R2001 F2002 V2016 V2019 L2020 L2051 | T1966-L1999 HydrophobicContact CG2-CD2 4.38Å; L1967-L1999 HydrophobicContact CD2-CD2 3.84Å; L1970-L1999 HydrophobicContact CD1-CD1 4.35Å; L1970-L1999 HydrophobicContact CD1-CD2 3.65Å; L1970-L1999 HydrophobicContact CD1-CG 4.05Å; L1996-L1999 HydrophobicContact CD2-CD1 4.27Å; L1996-L1999 WeakPolarHBondContact O-CB 3.34Å; L1996-L1999 WeakPolarHBondContact O-CG 3.41Å; L1996-L1999 PolarHBondContact O-N 3.18Å; L1999-R2001 PolarHBondContact O-N 3.31Å; L1999-R2001 VanDerWaalsContact O-N 3.16Å; L1999-F2002 PolarHBondContact O-N 3.2Å; L1999-F2002 VanDerWaalsContact O-N 3.13Å; L1999-V2016 HydrophobicContact CD2-CG1 4.38Å; L1999-V2016 HydrophobicContact CD2-CG2 4.4Å; L1999-V2019 HydrophobicContact CD2-CG1 4.4Å; L1999-L2020 HydrophobicContact CD1-CD2 4.45Å; L1999-L2051 HydrophobicContact CB-CD1 3.59Å; L1999-L2051 HydrophobicContact CD1-CD1 4.43Å |
| 2000 | P | 87 | Confident | 79.3 | Confident | 12.2 Ų | 12.2 | 56 Ų | 56 | 8% | 0.079 | 30% | 0.304 | C | S | . | . | G | 310 helix | trans | -61.3 | -27.9 | 179.2 | -22 | 33 | 0 | 0 | 0 | 113.9 | A1997 N1998 F2002 C2003 V2048 E2050 L2051 | A1997-P2000 VanDerWaalsContact O-CD 3.3Å; A1997-P2000 WeakPolarHBondContact O-CD 3.39Å; N1998-P2000 VanDerWaalsContact C-N 3.35Å; P2000-F2002 PolarHBondContact O-N 3.04Å; P2000-F2002 VanDerWaalsContact O-N 3.11Å; P2000-C2003 PolarHBondContact O-N 3.29Å; P2000-V2048 HydrophobicContact CB-CG1 4.42Å; P2000-V2048 HydrophobicContact CG-CG1 3.16Å; P2000-E2050 HydrophobicContact CB-CB 4.2Å; P2000-E2050 VanDerWaalsContact CB-OE2 3.29Å; P2000-E2050 WeakPolarHBondContact CB-OE2 3.35Å; P2000-L2051 HydrophobicContact CG-CD1 3.88Å; P2000-L2051 HydrophobicContact CG-CG 4.02Å |
| 2001 | R | 85.3 | Confident | 78.2 | Confident | 149.5 Ų | 149.5 | 56 Ų | 56 | 56% | 0.564 | 31% | 0.309 | S | S | * | . | G | 310 helix | trans | -60.8 | -24.5 | 179.4 | -58.4 | 179.9 | 92.5 | 141 | 0.5 | 112.1 | T1963 N1998 L1999 | T1963-R2001 PolarHBondContact OG1-NH1 3.32Å; N1998-R2001 VanDerWaalsContact O-CB 3.28Å; N1998-R2001 WeakPolarHBondContact O-CB 3.37Å; N1998-R2001 WeakPolarHBondContact O-CG 3.27Å; N1998-R2001 PolarHBondContact O-N 3.21Å; N1998-R2001 VanDerWaalsContact O-N 3.11Å; N1998-R2001 PolarHBondContact OD1-NH1 3.39Å; L1999-R2001 PolarHBondContact O-N 3.31Å; L1999-R2001 VanDerWaalsContact O-N 3.16Å |
| 2002 | F | 84.1 | Confident | 77.1 | Confident | 25 Ų | 25 | 58.8 Ų | 58.8 | 11% | 0.11 | 32% | 0.321 | C | S | . | . | G | 310 helix | trans | -95.7 | 1.7 | 179.8 | -56.4 | -81.1 | 0 | 0 | 0 | 113.5 | T1963 T1966 L1967 N1998 L1999 P2000 K2012 R2013 V2016 | T1963-F2002 WeakPolarHBondContact O-CZ 3.41Å; T1966-F2002 HydrophobicContact CG2-CE2 4.02Å; L1967-F2002 HydrophobicContact CD1-CB 4.17Å; L1967-F2002 HydrophobicContact CD1-CD1 3.54Å; L1967-F2002 HydrophobicContact CD1-CD2 4.19Å; L1967-F2002 HydrophobicContact CD1-CE1 3.9Å; L1967-F2002 HydrophobicContact CD1-CE2 4.21Å; L1967-F2002 HydrophobicContact CD1-CG 3.74Å; L1967-F2002 HydrophobicContact CD1-CZ 4.28Å; L1967-F2002 HydrophobicContact CD2-CD2 4.2Å; L1967-F2002 HydrophobicContact CD2-CE2 4.32Å; L1967-F2002 HydrophobicContact CD2-CG 4.31Å; L1967-F2002 HydrophobicContact CG-CD1 4.11Å; L1967-F2002 HydrophobicContact CG-CD2 4.08Å; L1967-F2002 HydrophobicContact CG-CE1 4.18Å; L1967-F2002 HydrophobicContact CG-CE2 4.17Å; L1967-F2002 HydrophobicContact CG-CG 4.04Å; L1967-F2002 HydrophobicContact CG-CZ 4.21Å; N1998-F2002 WeakPolarHBondContact O-CD2 3.26Å; L1999-F2002 PolarHBondContact O-N 3.2Å; L1999-F2002 VanDerWaalsContact O-N 3.13Å; P2000-F2002 PolarHBondContact O-N 3.04Å; P2000-F2002 VanDerWaalsContact O-N 3.11Å; F2002-K2012 HydrophobicContact CB-CB 4.4Å; F2002-K2012 HydrophobicContact CD1-CD 4.24Å; F2002-K2012 CarbonylContact O-C 3.47Å; F2002-K2012 VanDerWaalsContact O-CB 3.25Å; F2002-K2012 WeakPolarHBondContact O-CB 3.33Å; F2002-R2013 PolarHBondContact O-N 3.13Å; F2002-V2016 HydrophobicContact CB-CG2 3.59Å |
| 2003 | C | 76.4 | Confident | 76.4 | Confident | 27.5 Ų | 27.5 | 64.2 Ų | 64.2 | 19% | 0.186 | 34% | 0.341 | C | S | . | . | S | Bend | trans | -107.8 | -2.1 | -179.4 | -67.4 | 0 | 0 | 0 | 0 | 114 | P2000 L2051 | P2000-C2003 PolarHBondContact O-N 3.29Å; C2003-L2051 HydrophobicContact CB-CD2 4.42Å; C2003-L2051 VanDerWaalsContact SG-CD2 3.58Å |
| 2004 | R | 69.3 | Low | 76 | Confident | 149.25 Ų | 149.25 | 68.5 Ų | 68.5 | 56% | 0.563 | 36% | 0.359 | S | S | * | . | S | Bend | trans | -70.2 | 140.4 | -177.4 | -69.8 | -175.4 | 178.7 | 178.2 | -1.9 | 111.4 | T2006 D2009 E2050 | R2004-T2006 VanDerWaalsContact C-N 3.34Å; R2004-T2006 PolarHBondContact O-N 3.12Å; R2004-D2009 VanDerWaalsContact O-CB 3.3Å; R2004-D2009 WeakPolarHBondContact O-CB 3.33Å; R2004-D2009 VanDerWaalsContact O-OD2 3.04Å; R2004-E2050 IonicContact NH2-OE1 2.9Å |
| 2005 | P | 56.2 | Low | 75.5 | Confident | 131.5 Ų | 131.5 | 67.2 Ų | 67.2 | 85% | 0.854 | 35% | 0.351 | S | S | * | . | trans | -80.9 | 81.6 | -178.8 | 31.7 | -33.2 | 0 | 0 | 0 | 110.9 | ||||
| 2006 | T | 54.2 | Low | 75.2 | Confident | 94 Ų | 94 | 67.2 Ų | 67.2 | 58% | 0.577 | 35% | 0.351 | S | S | * | . | trans | -102 | 146 | 160.3 | 4.7 | 0 | 0 | 0 | 0 | 109.1 | R2004 G2008 D2009 | R2004-T2006 VanDerWaalsContact C-N 3.34Å; R2004-T2006 PolarHBondContact O-N 3.12Å; T2006-G2008 PolarHBondContact O-N 2.88Å; T2006-D2009 WeakPolarHBondContact CA-OD2 3.39Å; T2006-D2009 VanDerWaalsContact CB-OD2 3.26Å; T2006-D2009 WeakPolarHBondContact CB-OD2 3.37Å; T2006-D2009 PolarHBondContact N-OD2 3.15Å; T2006-D2009 VanDerWaalsContact N-OD2 3.09Å; T2006-D2009 WeakPolarHBondContact O-CB 3.36Å; T2006-D2009 PolarHBondContact O-N 3.17Å; T2006-D2009 VanDerWaalsContact O-N 3.11Å; T2006-D2009 PolarHBondContact OG1-OD2 3.05Å | ||
| 2007 | L | 42.3 | Very low | 75 | Confident | 180.75 Ų | 180.75 | 67.4 Ų | 67.4 | 95% | 0.946 | 35% | 0.352 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -57 | 109 | -178.8 | -85.8 | 132.9 | 0 | 0 | 0 | 110.3 | Q1833 | Q1833-L2007 PolarHBondContact NE2-O 2.71Å; Q1833-L2007 PolarHBondContact OE1-O 3.35Å |
| 2008 | G | 50.8 | Low | 75 | Confident | 46.75 Ų | 46.75 | 69 Ų | 69 | 48% | 0.482 | 35% | 0.345 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 116.2 | 0.5 | -176.2 | 0 | 0 | 0 | 0 | 0 | 115.5 | F1832 T2006 E2010 | F1832-G2008 WeakPolarHBondContact CD2-O 3.49Å; F1832-G2008 WeakPolarHBondContact CE1-O 3.34Å; F1832-G2008 WeakPolarHBondContact CE2-O 3.2Å; F1832-G2008 WeakPolarHBondContact CZ-O 3.45Å; T2006-G2008 PolarHBondContact O-N 2.88Å; G2008-E2010 PolarHBondContact O-N 3.27Å |
| 2009 | D | 58.9 | Low | 75 | Confident | 23.25 Ų | 23.25 | 68.2 Ų | 68.2 | 12% | 0.124 | 34% | 0.341 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -93.9 | 5 | -172.8 | -81.7 | -36 | 0 | 0 | 0 | 116.4 | R2004 T2006 S2011 K2012 R2013 | R2004-D2009 VanDerWaalsContact O-CB 3.3Å; R2004-D2009 WeakPolarHBondContact O-CB 3.33Å; R2004-D2009 VanDerWaalsContact O-OD2 3.04Å; T2006-D2009 WeakPolarHBondContact CA-OD2 3.39Å; T2006-D2009 VanDerWaalsContact CB-OD2 3.26Å; T2006-D2009 WeakPolarHBondContact CB-OD2 3.37Å; T2006-D2009 PolarHBondContact N-OD2 3.15Å; T2006-D2009 VanDerWaalsContact N-OD2 3.09Å; T2006-D2009 WeakPolarHBondContact O-CB 3.36Å; T2006-D2009 PolarHBondContact O-N 3.17Å; T2006-D2009 VanDerWaalsContact O-N 3.11Å; T2006-D2009 PolarHBondContact OG1-OD2 3.05Å; D2009-S2011 VanDerWaalsContact C-N 3.29Å; D2009-S2011 PolarHBondContact O-N 3.17Å; D2009-K2012 HydrophobicContact CB-CG 4.44Å; D2009-K2012 WeakPolarHBondContact O-CB 3.31Å; D2009-K2012 PolarHBondContact O-N 3.02Å; D2009-K2012 VanDerWaalsContact O-N 3.08Å; D2009-K2012 VanDerWaalsContact OD1-CD 3.27Å; D2009-K2012 WeakPolarHBondContact OD1-CD 3.39Å; D2009-K2012 VanDerWaalsContact OD1-CE 3.26Å; D2009-K2012 WeakPolarHBondContact OD1-CE 3.37Å; D2009-K2012 WeakPolarHBondContact OD1-CG 3.37Å; D2009-K2012 IonicContact OD1-NZ 3.43Å; D2009-K2012 PolarHBondContact OD1-NZ 3.14Å; D2009-K2012 IonicContact OD2-NZ 2.6Å; D2009-R2013 PolarHBondContact O-N 3.12Å; D2009-R2013 VanDerWaalsContact O-N 3.14Å |
| 2010 | E | 68.8 | Low | 75.1 | Confident | 151.5 Ų | 151.5 | 68.2 Ų | 68.2 | 71% | 0.708 | 34% | 0.341 | S | S | * | . | H | α-helix | trans | -57.6 | -38.6 | 177.4 | -85.3 | -116.5 | 143.6 | 0 | 0 | 112.4 | G2008 K2012 R2013 Q2014 | G2008-E2010 PolarHBondContact O-N 3.27Å; E2010-K2012 VanDerWaalsContact C-N 3.33Å; E2010-K2012 PolarHBondContact O-N 3.31Å; E2010-R2013 PolarHBondContact O-N 3.22Å; E2010-Q2014 WeakPolarHBondContact O-CB 3.36Å; E2010-Q2014 VanDerWaalsContact O-CG 3.28Å; E2010-Q2014 WeakPolarHBondContact O-CG 3.26Å; E2010-Q2014 PolarHBondContact O-N 3.07Å |
| 2011 | S | 69.5 | Low | 75.4 | Confident | 43.25 Ų | 43.25 | 69.9 Ų | 69.9 | 30% | 0.302 | 35% | 0.349 | S | S | . | . | H | α-helix | trans | -62.6 | -39.5 | 176.6 | 63.6 | 0 | 0 | 0 | 0 | 112.2 | F1832 D2009 Q2014 A2015 | F1832-S2011 WeakPolarHBondContact CE2-OG 3.41Å; F1832-S2011 WeakPolarHBondContact CZ-OG 3.36Å; D2009-S2011 VanDerWaalsContact C-N 3.29Å; D2009-S2011 PolarHBondContact O-N 3.17Å; S2011-Q2014 PolarHBondContact O-N 3.26Å; S2011-A2015 WeakPolarHBondContact O-CB 3.25Å; S2011-A2015 PolarHBondContact O-N 3.29Å |
| 2012 | K | 71 | Confident | 75.8 | Confident | 59 Ų | 59 | 66 Ų | 66 | 26% | 0.257 | 34% | 0.336 | S | S | . | . | H | α-helix | trans | -68.5 | -43.8 | 177.4 | -60.4 | -157.6 | -167.9 | 122.9 | 0 | 111.2 | F1830 N1831 F1832 F2002 D2009 E2010 Q2014 A2015 V2016 | F1830-K2012 HydrophobicContact CD1-CB 4.47Å; F1830-K2012 HydrophobicContact CD1-CD 4.31Å; F1830-K2012 HydrophobicContact CD1-CG 4.21Å; F1830-K2012 HydrophobicContact CE1-CB 4.33Å; F1830-K2012 HydrophobicContact CE1-CD 3.69Å; F1830-K2012 HydrophobicContact CE1-CG 4.1Å; F1830-K2012 HydrophobicContact CZ-CD 4.4Å; N1831-K2012 VanDerWaalsContact OD1-CE 3.23Å; N1831-K2012 WeakPolarHBondContact OD1-CE 3.39Å; F1832-K2012 HydrophobicContact CE2-CG 4.26Å; F2002-K2012 HydrophobicContact CB-CB 4.4Å; F2002-K2012 HydrophobicContact CD1-CD 4.24Å; F2002-K2012 CarbonylContact O-C 3.47Å; F2002-K2012 VanDerWaalsContact O-CB 3.25Å; F2002-K2012 WeakPolarHBondContact O-CB 3.33Å; D2009-K2012 HydrophobicContact CB-CG 4.44Å; D2009-K2012 WeakPolarHBondContact O-CB 3.31Å; D2009-K2012 PolarHBondContact O-N 3.02Å; D2009-K2012 VanDerWaalsContact O-N 3.08Å; D2009-K2012 VanDerWaalsContact OD1-CD 3.27Å; D2009-K2012 WeakPolarHBondContact OD1-CD 3.39Å; D2009-K2012 VanDerWaalsContact OD1-CE 3.26Å; D2009-K2012 WeakPolarHBondContact OD1-CE 3.37Å; D2009-K2012 WeakPolarHBondContact OD1-CG 3.37Å; D2009-K2012 IonicContact OD1-NZ 3.43Å; D2009-K2012 PolarHBondContact OD1-NZ 3.14Å; D2009-K2012 IonicContact OD2-NZ 2.6Å; E2010-K2012 VanDerWaalsContact C-N 3.33Å; E2010-K2012 PolarHBondContact O-N 3.31Å; K2012-Q2014 VanDerWaalsContact C-N 3.3Å; K2012-Q2014 PolarHBondContact O-N 3.27Å; K2012-A2015 WeakPolarHBondContact O-CA 3.23Å; K2012-A2015 VanDerWaalsContact O-CB 3.22Å; K2012-A2015 WeakPolarHBondContact O-CB 3.24Å; K2012-A2015 PolarHBondContact O-N 3.24Å; K2012-A2015 VanDerWaalsContact O-N 3.14Å; K2012-V2016 WeakPolarHBondContact O-CG2 3.31Å; K2012-V2016 PolarHBondContact O-N 3.14Å |
| 2013 | R | 81.1 | Confident | 76.3 | Confident | 119.25 Ų | 119.25 | 64.8 Ų | 64.8 | 45% | 0.45 | 33% | 0.331 | S | S | . | . | H | α-helix | trans | -61.8 | -38.3 | 174.2 | -173.3 | 177.9 | 178 | 156.2 | 1.2 | 111.9 | F2002 D2009 E2010 A2015 V2016 S2017 | F2002-R2013 PolarHBondContact O-N 3.13Å; D2009-R2013 PolarHBondContact O-N 3.12Å; D2009-R2013 VanDerWaalsContact O-N 3.14Å; E2010-R2013 PolarHBondContact O-N 3.22Å; R2013-A2015 VanDerWaalsContact C-N 3.31Å; R2013-A2015 PolarHBondContact O-N 3.33Å; R2013-V2016 PolarHBondContact O-N 2.92Å; R2013-S2017 WeakPolarHBondContact O-CB 3.45Å; R2013-S2017 PolarHBondContact O-N 3.11Å; R2013-S2017 PolarHBondContact O-OG 3.01Å |
| 2014 | Q | 84.3 | Confident | 77.1 | Confident | 115 Ų | 115 | 63.6 Ų | 63.6 | 54% | 0.537 | 32% | 0.322 | S | S | . | . | H | α-helix | trans | -68.6 | -33.6 | 173.9 | -144.8 | -178.7 | 20.7 | 0 | 0 | 112.1 | E2010 S2011 K2012 S2017 R2018 | E2010-Q2014 WeakPolarHBondContact O-CB 3.36Å; E2010-Q2014 VanDerWaalsContact O-CG 3.28Å; E2010-Q2014 WeakPolarHBondContact O-CG 3.26Å; E2010-Q2014 PolarHBondContact O-N 3.07Å; S2011-Q2014 PolarHBondContact O-N 3.26Å; K2012-Q2014 VanDerWaalsContact C-N 3.3Å; K2012-Q2014 PolarHBondContact O-N 3.27Å; Q2014-S2017 WeakPolarHBondContact O-CA 3.41Å; Q2014-S2017 VanDerWaalsContact O-CB 3.23Å; Q2014-S2017 WeakPolarHBondContact O-CB 3.4Å; Q2014-S2017 PolarHBondContact O-N 3.07Å; Q2014-R2018 WeakPolarHBondContact O-CG 3.32Å; Q2014-R2018 PolarHBondContact O-N 3.11Å; Q2014-R2018 PolarHBondContact O-NE 3.16Å |
| 2015 | A | 83.8 | Confident | 78.3 | Confident | 0.25 Ų | 0.25 | 58.5 Ų | 58.5 | 0% | 0.002 | 31% | 0.308 | C | S | . | . | H | α-helix | trans | -71.6 | -38.8 | 174.9 | 0 | 0 | 0 | 0 | 0 | 112.4 | I1829 F1830 L1967 S2011 K2012 R2013 S2017 R2018 V2019 | I1829-A2015 HydrophobicContact CD1-CB 4.35Å; I1829-A2015 HydrophobicContact CG2-CB 3.7Å; I1829-A2015 VanDerWaalsContact CG2-CB 3.5Å; F1830-A2015 HydrophobicContact CD1-CB 4.02Å; F1830-A2015 HydrophobicContact CD2-CB 4.48Å; F1830-A2015 HydrophobicContact CE1-CB 3.17Å; F1830-A2015 HydrophobicContact CE2-CB 3.66Å; F1830-A2015 HydrophobicContact CZ-CB 2.94Å; L1967-A2015 HydrophobicContact CD1-CB 3.97Å; S2011-A2015 WeakPolarHBondContact O-CB 3.25Å; S2011-A2015 PolarHBondContact O-N 3.29Å; K2012-A2015 WeakPolarHBondContact O-CA 3.23Å; K2012-A2015 VanDerWaalsContact O-CB 3.22Å; K2012-A2015 WeakPolarHBondContact O-CB 3.24Å; K2012-A2015 PolarHBondContact O-N 3.24Å; K2012-A2015 VanDerWaalsContact O-N 3.14Å; R2013-A2015 VanDerWaalsContact C-N 3.31Å; R2013-A2015 PolarHBondContact O-N 3.33Å; A2015-S2017 VanDerWaalsContact C-N 3.31Å; A2015-S2017 PolarHBondContact O-N 3.23Å; A2015-R2018 WeakPolarHBondContact O-CB 3.46Å; A2015-R2018 PolarHBondContact O-N 3.02Å; A2015-V2019 WeakPolarHBondContact O-CG2 3.43Å; A2015-V2019 PolarHBondContact O-N 3.14Å |
| 2016 | V | 89.7 | Confident | 80 | Confident | 0 Ų | 0 | 52.4 Ų | 52.4 | 0% | 0 | 27% | 0.268 | C | S | . | . | H | α-helix | trans | -59.3 | -45.2 | 168.1 | 174.3 | 0 | 0 | 0 | 0 | 110.2 | L1967 L1999 F2002 K2012 R2013 R2018 V2019 L2020 L2051 L2054 | L1967-V2016 HydrophobicContact CD1-CG2 4.4Å; L1967-V2016 HydrophobicContact CD2-CG2 3.84Å; L1999-V2016 HydrophobicContact CD2-CG1 4.38Å; L1999-V2016 HydrophobicContact CD2-CG2 4.4Å; F2002-V2016 HydrophobicContact CB-CG2 3.59Å; K2012-V2016 WeakPolarHBondContact O-CG2 3.31Å; K2012-V2016 PolarHBondContact O-N 3.14Å; R2013-V2016 PolarHBondContact O-N 2.92Å; V2016-R2018 VanDerWaalsContact C-N 3.31Å; V2016-R2018 PolarHBondContact O-N 3.17Å; V2016-V2019 WeakPolarHBondContact O-CB 3.43Å; V2016-V2019 PolarHBondContact O-N 3.31Å; V2016-V2019 VanDerWaalsContact O-N 3.09Å; V2016-L2020 HydrophobicContact CG1-CD1 4.2Å; V2016-L2020 HydrophobicContact CG1-CG 4.38Å; V2016-L2020 WeakPolarHBondContact O-CG 3.38Å; V2016-L2020 PolarHBondContact O-N 3Å; V2016-L2051 HydrophobicContact CG1-CD2 4.43Å; V2016-L2054 HydrophobicContact CG1-CD2 4.31Å |
| 2017 | S | 89.7 | Confident | 81.9 | Confident | 5 Ų | 5 | 48 Ų | 48 | 4% | 0.035 | 24% | 0.241 | C | C | . | . | H | α-helix | trans | -56.9 | -44.4 | 175.9 | -62 | 0 | 0 | 0 | 0 | 112.1 | R2013 Q2014 A2015 V2019 L2020 D2021 R2058 | R2013-S2017 WeakPolarHBondContact O-CB 3.45Å; R2013-S2017 PolarHBondContact O-N 3.11Å; R2013-S2017 PolarHBondContact O-OG 3.01Å; Q2014-S2017 WeakPolarHBondContact O-CA 3.41Å; Q2014-S2017 VanDerWaalsContact O-CB 3.23Å; Q2014-S2017 WeakPolarHBondContact O-CB 3.4Å; Q2014-S2017 PolarHBondContact O-N 3.07Å; A2015-S2017 VanDerWaalsContact C-N 3.31Å; A2015-S2017 PolarHBondContact O-N 3.23Å; S2017-V2019 VanDerWaalsContact C-N 3.32Å; S2017-V2019 PolarHBondContact O-N 3.15Å; S2017-L2020 WeakPolarHBondContact O-CB 3.25Å; S2017-L2020 PolarHBondContact O-N 3.06Å; S2017-L2020 VanDerWaalsContact O-N 3.1Å; S2017-D2021 WeakPolarHBondContact O-CB 3.37Å; S2017-D2021 VanDerWaalsContact O-CG 3.23Å; S2017-D2021 PolarHBondContact O-N 3.23Å; S2017-R2058 VanDerWaalsContact CB-NH2 3.3Å; S2017-R2058 PolarHBondContact OG-NH2 3.12Å; S2017-R2058 VanDerWaalsContact OG-NH2 3.1Å |
| 2018 | R | 89.9 | Confident | 84.2 | Confident | 99.25 Ų | 99.25 | 41 Ų | 41 | 38% | 0.375 | 20% | 0.204 | S | C | . | . | H | α-helix | trans | -61.3 | -37.1 | 175.5 | -75.4 | -179.2 | -93.4 | 173.7 | -8.5 | 113 | I1829 Q2014 A2015 V2016 K2022 | I1829-R2018 VanDerWaalsContact CD1-CZ 3.45Å; I1829-R2018 VanDerWaalsContact CG2-NH2 3.35Å; Q2014-R2018 WeakPolarHBondContact O-CG 3.32Å; Q2014-R2018 PolarHBondContact O-N 3.11Å; Q2014-R2018 PolarHBondContact O-NE 3.16Å; A2015-R2018 WeakPolarHBondContact O-CB 3.46Å; A2015-R2018 PolarHBondContact O-N 3.02Å; V2016-R2018 VanDerWaalsContact C-N 3.31Å; V2016-R2018 PolarHBondContact O-N 3.17Å; R2018-K2022 WeakPolarHBondContact O-CG 3.34Å; R2018-K2022 PolarHBondContact O-N 3.02Å; R2018-K2022 VanDerWaalsContact O-N 3.11Å |
| 2019 | V | 92.1 | Very high | 86.1 | Confident | 0 Ų | 0 | 43.7 Ų | 43.7 | 0% | 0 | 21% | 0.205 | C | C | . | . | H | α-helix | trans | -64.8 | -45.9 | 173.9 | 173.3 | 0 | 0 | 0 | 0 | 110.5 | L1967 L1970 Q1971 I1974 L1999 A2015 V2016 S2017 K2022 L2023 | L1967-V2019 HydrophobicContact CD2-CG2 4.27Å; L1970-V2019 HydrophobicContact CB-CG1 4.13Å; L1970-V2019 HydrophobicContact CD1-CG1 4.21Å; Q1971-V2019 HydrophobicContact CG-CG2 3.64Å; I1974-V2019 HydrophobicContact CD1-CG1 4.05Å; L1999-V2019 HydrophobicContact CD2-CG1 4.4Å; A2015-V2019 WeakPolarHBondContact O-CG2 3.43Å; A2015-V2019 PolarHBondContact O-N 3.14Å; V2016-V2019 WeakPolarHBondContact O-CB 3.43Å; V2016-V2019 PolarHBondContact O-N 3.31Å; V2016-V2019 VanDerWaalsContact O-N 3.09Å; S2017-V2019 VanDerWaalsContact C-N 3.32Å; S2017-V2019 PolarHBondContact O-N 3.15Å; V2019-K2022 PolarHBondContact O-N 3.1Å; V2019-L2023 HydrophobicContact CG1-CD1 4.25Å; V2019-L2023 WeakPolarHBondContact O-CG 3.42Å; V2019-L2023 PolarHBondContact O-N 3.2Å |
| 2020 | L | 93.4 | Very high | 87.6 | Confident | 0.75 Ų | 0.75 | 44 Ų | 44 | 0% | 0.004 | 21% | 0.205 | C | C | . | . | H | α-helix | trans | -62.2 | -43.6 | 177.3 | -65.5 | 176.5 | 0 | 0 | 0 | 112 | L1999 V2016 S2017 K2022 L2023 I2024 L2054 I2055 | L1999-L2020 HydrophobicContact CD1-CD2 4.45Å; V2016-L2020 HydrophobicContact CG1-CD1 4.2Å; V2016-L2020 HydrophobicContact CG1-CG 4.38Å; V2016-L2020 WeakPolarHBondContact O-CG 3.38Å; V2016-L2020 PolarHBondContact O-N 3Å; S2017-L2020 WeakPolarHBondContact O-CB 3.25Å; S2017-L2020 PolarHBondContact O-N 3.06Å; S2017-L2020 VanDerWaalsContact O-N 3.1Å; L2020-K2022 VanDerWaalsContact C-N 3.3Å; L2020-K2022 PolarHBondContact O-N 3.1Å; L2020-L2023 HydrophobicContact CD2-CD1 4.49Å; L2020-L2023 PolarHBondContact O-N 3.04Å; L2020-L2023 VanDerWaalsContact O-N 3.14Å; L2020-I2024 WeakPolarHBondContact O-CB 3.42Å; L2020-I2024 VanDerWaalsContact O-CG1 3.28Å; L2020-I2024 WeakPolarHBondContact O-CG1 3.36Å; L2020-I2024 PolarHBondContact O-N 3.05Å; L2020-L2054 HydrophobicContact CD1-CD2 3.84Å; L2020-L2054 HydrophobicContact CD1-CG 3.97Å; L2020-I2055 HydrophobicContact CD1-CG1 3.84Å; L2020-I2055 HydrophobicContact CD2-CD1 4.48Å; L2020-I2055 HydrophobicContact CD2-CG1 4.01Å |
| 2021 | D | 93.4 | Very high | 88.4 | Confident | 47.5 Ų | 47.5 | 42.3 Ų | 42.3 | 25% | 0.254 | 20% | 0.196 | S | C | . | . | H | α-helix | trans | -60.6 | -39.8 | 176.8 | -67 | -26.6 | 0 | 0 | 0 | 111.2 | S2017 I2024 T2025 R2058 | S2017-D2021 WeakPolarHBondContact O-CB 3.37Å; S2017-D2021 VanDerWaalsContact O-CG 3.23Å; S2017-D2021 PolarHBondContact O-N 3.23Å; D2021-I2024 PolarHBondContact O-N 3.06Å; D2021-T2025 WeakPolarHBondContact O-CB 3.35Å; D2021-T2025 PolarHBondContact O-N 3.23Å; D2021-T2025 PolarHBondContact O-OG1 3.21Å; D2021-R2058 WeakPolarHBondContact OD1-CD 3.39Å; D2021-R2058 IonicContact OD1-NE 2.87Å; D2021-R2058 IonicContact OD1-NH1 3.31Å; D2021-R2058 PolarHBondContact OD1-NH1 3.16Å; D2021-R2058 IonicContact OD2-CZ 3.72Å; D2021-R2058 IonicContact OD2-NH1 3.61Å; D2021-R2058 PolarHBondContact OD2-NH1 3.02Å; D2021-R2058 VanDerWaalsContact OD2-NH1 3.09Å |
| 2022 | K | 92.5 | Very high | 89.2 | Confident | 66.5 Ų | 66.5 | 47.3 Ų | 47.3 | 29% | 0.289 | 21% | 0.214 | S | C | . | . | H | α-helix | trans | -66.4 | -40.6 | 173.3 | -75.5 | -172.5 | 176.3 | -167.6 | 0 | 112.7 | I1974 R2018 V2019 L2020 I2024 T2025 L2026 | I1974-K2022 HydrophobicContact CD1-CB 4.18Å; I1974-K2022 HydrophobicContact CG2-CB 3.93Å; I1974-K2022 HydrophobicContact CG2-CD 4.45Å; R2018-K2022 WeakPolarHBondContact O-CG 3.34Å; R2018-K2022 PolarHBondContact O-N 3.02Å; R2018-K2022 VanDerWaalsContact O-N 3.11Å; V2019-K2022 PolarHBondContact O-N 3.1Å; L2020-K2022 VanDerWaalsContact C-N 3.3Å; L2020-K2022 PolarHBondContact O-N 3.1Å; K2022-I2024 VanDerWaalsContact C-N 3.35Å; K2022-T2025 PolarHBondContact O-N 3.11Å; K2022-L2026 WeakPolarHBondContact O-CB 3.35Å; K2022-L2026 PolarHBondContact O-N 3.14Å |
| 2023 | L | 94.6 | Very high | 90.1 | Very high | 1.5 Ų | 1.5 | 44.8 Ų | 44.8 | 1% | 0.008 | 20% | 0.203 | C | C | . | . | H | α-helix | trans | -65.7 | -38.7 | 175.7 | -70.9 | 174 | 0 | 0 | 0 | 112.1 | I1974 L1996 V2019 L2020 L2026 T2027 I2041 W2042 | I1974-L2023 HydrophobicContact CD1-CD2 3.58Å; I1974-L2023 HydrophobicContact CD1-CG 3.74Å; I1974-L2023 HydrophobicContact CG1-CD2 3.82Å; I1974-L2023 HydrophobicContact CG1-CG 4.43Å; L1996-L2023 HydrophobicContact CD2-CD1 4.2Å; V2019-L2023 HydrophobicContact CG1-CD1 4.25Å; V2019-L2023 WeakPolarHBondContact O-CG 3.42Å; V2019-L2023 PolarHBondContact O-N 3.2Å; L2020-L2023 HydrophobicContact CD2-CD1 4.49Å; L2020-L2023 PolarHBondContact O-N 3.04Å; L2020-L2023 VanDerWaalsContact O-N 3.14Å; L2023-L2026 PolarHBondContact O-N 2.99Å; L2023-T2027 WeakPolarHBondContact O-CB 3.4Å; L2023-T2027 PolarHBondContact O-N 3.17Å; L2023-T2027 PolarHBondContact O-OG1 3.32Å; L2023-I2041 HydrophobicContact CD1-CG2 4.16Å; L2023-I2041 HydrophobicContact CD2-CD1 4.06Å; L2023-I2041 HydrophobicContact CD2-CG2 4.26Å; L2023-W2042 HydrophobicContact CB-CH2 4.21Å; L2023-W2042 HydrophobicContact CB-CZ2 4.08Å |
| 2024 | I | 94.5 | Very high | 90.6 | Very high | 0.75 Ų | 0.75 | 40.5 Ų | 40.5 | 0% | 0.004 | 19% | 0.187 | C | C | . | . | H | α-helix | trans | -60.1 | -50 | 172.8 | -75.5 | 165.1 | 0 | 0 | 0 | 109.9 | L2020 D2021 K2022 L2026 T2027 I2028 W2042 R2058 F2059 Q2062 L2076 | L2020-I2024 WeakPolarHBondContact O-CB 3.42Å; L2020-I2024 VanDerWaalsContact O-CG1 3.28Å; L2020-I2024 WeakPolarHBondContact O-CG1 3.36Å; L2020-I2024 PolarHBondContact O-N 3.05Å; D2021-I2024 PolarHBondContact O-N 3.06Å; K2022-I2024 VanDerWaalsContact C-N 3.35Å; I2024-L2026 VanDerWaalsContact C-N 3.32Å; I2024-L2026 PolarHBondContact O-N 3.18Å; I2024-T2027 WeakPolarHBondContact O-CB 3.29Å; I2024-T2027 PolarHBondContact O-N 3.27Å; I2024-T2027 VanDerWaalsContact O-N 3.12Å; I2024-I2028 HydrophobicContact CG2-CD1 3.85Å; I2024-I2028 WeakPolarHBondContact O-CD1 3.15Å; I2024-I2028 WeakPolarHBondContact O-CG1 3.39Å; I2024-I2028 PolarHBondContact O-N 3.02Å; I2024-I2028 VanDerWaalsContact O-N 3.08Å; I2024-W2042 HydrophobicContact CG1-CH2 3.96Å; I2024-W2042 HydrophobicContact CG1-CZ2 4.08Å; I2024-R2058 HydrophobicContact CD1-CB 3.61Å; I2024-F2059 HydrophobicContact CD1-CD1 3.67Å; I2024-F2059 HydrophobicContact CD1-CE1 3.88Å; I2024-F2059 HydrophobicContact CG1-CD1 3.86Å; I2024-F2059 HydrophobicContact CG1-CE1 3.6Å; I2024-Q2062 HydrophobicContact CG2-CB 4.32Å; I2024-Q2062 HydrophobicContact CG2-CG 3.81Å; I2024-L2076 HydrophobicContact CG1-CD2 4.45Å; I2024-L2076 HydrophobicContact CG2-CD1 4.24Å; I2024-L2076 HydrophobicContact CG2-CD2 3.96Å |
| 2025 | T | 93.3 | Very high | 91.1 | Very high | 43 Ų | 43 | 39.3 Ų | 39.3 | 26% | 0.264 | 19% | 0.19 | S | C | . | . | H | α-helix | trans | -61.7 | -44 | 179.6 | -49.3 | 0 | 0 | 0 | 0 | 111.2 | R1978 D2021 K2022 T2027 I2028 E2029 | R1978-T2025 VanDerWaalsContact NH2-CG2 3.25Å; D2021-T2025 WeakPolarHBondContact O-CB 3.35Å; D2021-T2025 PolarHBondContact O-N 3.23Å; D2021-T2025 PolarHBondContact O-OG1 3.21Å; K2022-T2025 PolarHBondContact O-N 3.11Å; T2025-T2027 VanDerWaalsContact C-N 3.29Å; T2025-T2027 PolarHBondContact O-N 3.26Å; T2025-I2028 PolarHBondContact O-N 3.22Å; T2025-I2028 VanDerWaalsContact O-N 3.16Å; T2025-E2029 HydrophobicContact CG2-CG 4.29Å; T2025-E2029 WeakPolarHBondContact CG2-OE1 3.39Å; T2025-E2029 WeakPolarHBondContact O-CB 3.33Å; T2025-E2029 WeakPolarHBondContact O-CG 3.36Å; T2025-E2029 PolarHBondContact O-N 3.18Å |
| 2026 | L | 92.7 | Very high | 91.5 | Very high | 3 Ų | 3 | 41 Ų | 41 | 2% | 0.016 | 20% | 0.202 | C | C | . | . | H | α-helix | trans | -57.8 | -41.4 | 174.1 | 180 | 153.8 | 0 | 0 | 0 | 111.8 | I1974 F1977 K2022 L2023 I2024 I2028 E2029 E2030 I2037 I2041 | I1974-L2026 HydrophobicContact CG2-CD1 3.96Å; F1977-L2026 HydrophobicContact CB-CD1 4.18Å; F1977-L2026 HydrophobicContact CD1-CD1 3.48Å; F1977-L2026 VanDerWaalsContact CD1-CD1 3.45Å; F1977-L2026 HydrophobicContact CD1-CG 4.11Å; F1977-L2026 HydrophobicContact CD2-CD1 4.38Å; F1977-L2026 HydrophobicContact CE1-CD1 3.94Å; F1977-L2026 HydrophobicContact CE1-CD2 4.28Å; F1977-L2026 HydrophobicContact CE1-CG 4.15Å; F1977-L2026 HydrophobicContact CG-CD1 3.79Å; F1977-L2026 HydrophobicContact CZ-CD1 4.43Å; F1977-L2026 HydrophobicContact CZ-CD2 4.43Å; K2022-L2026 WeakPolarHBondContact O-CB 3.35Å; K2022-L2026 PolarHBondContact O-N 3.14Å; L2023-L2026 PolarHBondContact O-N 2.99Å; I2024-L2026 VanDerWaalsContact C-N 3.32Å; I2024-L2026 PolarHBondContact O-N 3.18Å; L2026-I2028 VanDerWaalsContact C-N 3.31Å; L2026-I2028 PolarHBondContact O-N 3.07Å; L2026-E2029 PolarHBondContact O-N 3.2Å; L2026-E2030 HydrophobicContact CD2-CG 4.44Å; L2026-E2030 HydrophobicContact CG-CG 4.29Å; L2026-E2030 VanDerWaalsContact O-CB 3.26Å; L2026-E2030 WeakPolarHBondContact O-CB 3.4Å; L2026-E2030 WeakPolarHBondContact O-CG 3.28Å; L2026-E2030 PolarHBondContact O-N 3.21Å; L2026-I2037 HydrophobicContact CD2-CD1 3.6Å; L2026-I2037 HydrophobicContact CD2-CG1 3.98Å; L2026-I2037 HydrophobicContact CD2-CG2 4.26Å; L2026-I2041 HydrophobicContact CD2-CD1 4.36Å |
| 2027 | T | 93.8 | Very high | 91.7 | Very high | 1.75 Ų | 1.75 | 41 Ų | 41 | 1% | 0.011 | 20% | 0.202 | C | C | . | . | H | α-helix | trans | -66.8 | -32.7 | 179.6 | -55.7 | 0 | 0 | 0 | 0 | 112.5 | L2023 I2024 T2025 Y2034 I2037 W2042 V2075 T2079 | L2023-T2027 WeakPolarHBondContact O-CB 3.4Å; L2023-T2027 PolarHBondContact O-N 3.17Å; L2023-T2027 PolarHBondContact O-OG1 3.32Å; I2024-T2027 WeakPolarHBondContact O-CB 3.29Å; I2024-T2027 PolarHBondContact O-N 3.27Å; I2024-T2027 VanDerWaalsContact O-N 3.12Å; T2025-T2027 VanDerWaalsContact C-N 3.29Å; T2025-T2027 PolarHBondContact O-N 3.26Å; T2027-Y2034 HydrophobicContact CG2-CD2 4.11Å; T2027-Y2034 HydrophobicContact CG2-CE2 3.79Å; T2027-I2037 HydrophobicContact CG2-CG2 4.22Å; T2027-I2037 WeakPolarHBondContact OG1-CG2 3.34Å; T2027-W2042 PolarHBondContact OG1-NE1 3.14Å; T2027-V2075 HydrophobicContact CG2-CG1 4.21Å; T2027-T2079 HydrophobicContact CG2-CG2 4.48Å |
| 2028 | I | 91.1 | Very high | 91.9 | Very high | 32.75 Ų | 32.75 | 41.4 Ų | 41.4 | 17% | 0.168 | 20% | 0.203 | C | C | . | . | H | α-helix | trans | -76.3 | -41.1 | 178 | -65.8 | 161.4 | 0 | 0 | 0 | 111.2 | I2024 T2025 L2026 F2031 Q2062 Q2072 V2075 L2076 | I2024-I2028 HydrophobicContact CG2-CD1 3.85Å; I2024-I2028 WeakPolarHBondContact O-CD1 3.15Å; I2024-I2028 WeakPolarHBondContact O-CG1 3.39Å; I2024-I2028 PolarHBondContact O-N 3.02Å; I2024-I2028 VanDerWaalsContact O-N 3.08Å; T2025-I2028 PolarHBondContact O-N 3.22Å; T2025-I2028 VanDerWaalsContact O-N 3.16Å; L2026-I2028 VanDerWaalsContact C-N 3.31Å; L2026-I2028 PolarHBondContact O-N 3.07Å; I2028-F2031 WeakPolarHBondContact O-CE1 3.34Å; I2028-F2031 VanDerWaalsContact O-CZ 3.31Å; I2028-F2031 WeakPolarHBondContact O-CZ 3.28Å; I2028-Q2062 HydrophobicContact CD1-CG 4.25Å; I2028-Q2072 HydrophobicContact CD1-CB 4.18Å; I2028-Q2072 HydrophobicContact CD1-CG 3.92Å; I2028-Q2072 HydrophobicContact CG1-CG 4.46Å; I2028-Q2072 HydrophobicContact CG2-CB 4.42Å; I2028-Q2072 HydrophobicContact CG2-CG 3.94Å; I2028-V2075 HydrophobicContact CG1-CG1 4.34Å; I2028-L2076 HydrophobicContact CD1-CD1 4.3Å; I2028-L2076 HydrophobicContact CD1-CD2 4.46Å; I2028-L2076 HydrophobicContact CD1-CG 4.46Å; I2028-L2076 HydrophobicContact CG1-CD2 4.45Å; I2028-L2076 HydrophobicContact CG1-CG 4.49Å |
| 2029 | E | 90.2 | Very high | 92.1 | Very high | 104.75 Ų | 104.75 | 39.6 Ų | 39.6 | 49% | 0.489 | 21% | 0.209 | S | C | . | . | H | α-helix | trans | -77.8 | -36.3 | -175.8 | -70.2 | 171.2 | 169.8 | 0 | 0 | 113.2 | R1978 T2025 L2026 F2031 | R1978-E2029 IonicContact CZ-OE1 2.67Å; R1978-E2029 IonicContact CZ-OE2 3.61Å; R1978-E2029 VanDerWaalsContact CZ-OE2 3.32Å; R1978-E2029 IonicContact NE-OE2 3.2Å; R1978-E2029 PolarHBondContact NE-OE2 3.12Å; R1978-E2029 VanDerWaalsContact NH2-CD 3.34Å; R1978-E2029 IonicContact NH2-OE1 2.94Å; R1978-E2029 PolarHBondContact NH2-OE1 3.19Å; R1978-E2029 IonicContact NH2-OE2 2.9Å; R1978-E2029 PolarHBondContact NH2-OE2 2.99Å; T2025-E2029 HydrophobicContact CG2-CG 4.29Å; T2025-E2029 WeakPolarHBondContact CG2-OE1 3.39Å; T2025-E2029 WeakPolarHBondContact O-CB 3.33Å; T2025-E2029 WeakPolarHBondContact O-CG 3.36Å; T2025-E2029 PolarHBondContact O-N 3.18Å; L2026-E2029 PolarHBondContact O-N 3.2Å; E2029-F2031 WeakPolarHBondContact O-CD2 3.13Å; E2029-F2031 WeakPolarHBondContact O-CE2 3.47Å; E2029-F2031 PolarHBondContact O-N 2.87Å |
| 2030 | E | 89.8 | Confident | 92.1 | Very high | 29.5 Ų | 29.5 | 42.6 Ų | 42.6 | 14% | 0.138 | 22% | 0.222 | C | C | . | . | trans | -93.9 | 77.7 | -169 | -67.6 | -77.2 | 170.8 | 0 | 0 | 112.8 | F1977 K1985 L2026 E2032 M2033 Y2034 I2037 | F1977-E2030 HydrophobicContact CD1-CG 4.39Å; F1977-E2030 HydrophobicContact CE1-CG 3.89Å; K1985-E2030 WeakPolarHBondContact CE-OE1 3.48Å; K1985-E2030 IonicContact NZ-OE1 3.34Å; K1985-E2030 PolarHBondContact NZ-OE1 3.1Å; K1985-E2030 IonicContact NZ-OE2 3.28Å; K1985-E2030 PolarHBondContact NZ-OE2 3.13Å; L2026-E2030 HydrophobicContact CD2-CG 4.44Å; L2026-E2030 HydrophobicContact CG-CG 4.29Å; L2026-E2030 VanDerWaalsContact O-CB 3.26Å; L2026-E2030 WeakPolarHBondContact O-CB 3.4Å; L2026-E2030 WeakPolarHBondContact O-CG 3.28Å; L2026-E2030 PolarHBondContact O-N 3.21Å; E2030-E2032 PolarHBondContact O-N 3.17Å; E2030-M2033 PolarHBondContact O-N 2.96Å; E2030-Y2034 PolarHBondContact O-N 3.14Å; E2030-I2037 HydrophobicContact CB-CD1 3.68Å; E2030-I2037 HydrophobicContact CG-CD1 4.5Å | ||
| 2031 | F | 86.3 | Confident | 92.2 | Very high | 114.75 Ų | 114.75 | 42.7 Ų | 42.7 | 50% | 0.503 | 22% | 0.223 | S | C | . | . | trans | -65.1 | -42.6 | -176.8 | -157.3 | -95.3 | 0 | 0 | 0 | 114.2 | I2028 E2029 M2033 Y2034 V2071 P2228 R2229 | I2028-F2031 WeakPolarHBondContact O-CE1 3.34Å; I2028-F2031 VanDerWaalsContact O-CZ 3.31Å; I2028-F2031 WeakPolarHBondContact O-CZ 3.28Å; E2029-F2031 WeakPolarHBondContact O-CD2 3.13Å; E2029-F2031 WeakPolarHBondContact O-CE2 3.47Å; E2029-F2031 PolarHBondContact O-N 2.87Å; F2031-M2033 VanDerWaalsContact C-N 3.32Å; F2031-M2033 PolarHBondContact O-N 3.06Å; F2031-Y2034 WeakPolarHBondContact O-CB 3.39Å; F2031-Y2034 PolarHBondContact O-N 3.05Å; F2031-V2071 HydrophobicContact CE1-CG1 4.26Å; F2031-P2228 HydrophobicContact CD2-CB 3.8Å; F2031-P2228 HydrophobicContact CD2-CG 4.29Å; F2031-P2228 HydrophobicContact CE2-CB 3.62Å; F2031-P2228 HydrophobicContact CE2-CG 4Å; F2031-P2228 HydrophobicContact CZ-CB 4.5Å; F2031-R2229 HydrophobicContact CE1-CG 4.06Å; F2031-R2229 HydrophobicContact CE2-CG 4.36Å; F2031-R2229 HydrophobicContact CZ-CG 4Å | ||
| 2032 | E | 86.8 | Confident | 92.3 | Very high | 150 Ų | 150 | 40.4 Ų | 40.4 | 70% | 0.701 | 21% | 0.211 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -66.2 | -35.7 | -174.2 | -64.5 | -173.2 | 161.3 | 0 | 0 | 112.7 | I1982 E2030 Y2034 | I1982-E2032 VanDerWaalsContact CD1-OE2 3.23Å; I1982-E2032 WeakPolarHBondContact CD1-OE2 3.42Å; E2030-E2032 PolarHBondContact O-N 3.17Å; E2032-Y2034 VanDerWaalsContact C-N 3.32Å |
| 2033 | M | 89.7 | Confident | 92.3 | Very high | 4.5 Ų | 4.5 | 38.1 Ų | 38.1 | 2% | 0.022 | 21% | 0.205 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -94.9 | 5.2 | -177.7 | -66.3 | -138.1 | 10.2 | 0 | 0 | 113.5 | F1977 I1982 K1985 H1986 L1989 E2030 F2031 S2036 I2037 | F1977-M2033 HydrophobicContact CE1-CE 4.38Å; F1977-M2033 HydrophobicContact CE2-CE 3.53Å; F1977-M2033 HydrophobicContact CZ-CB 4.49Å; F1977-M2033 HydrophobicContact CZ-CE 4.05Å; F1977-M2033 HydrophobicContact CZ-CG 4.41Å; F1977-M2033 HydrophobicContact CZ-SD 3.99Å; I1982-M2033 HydrophobicContact CG2-SD 4.13Å; K1985-M2033 HydrophobicContact CB-CE 3.65Å; K1985-M2033 HydrophobicContact CB-CG 4.45Å; K1985-M2033 HydrophobicContact CB-SD 3.75Å; K1985-M2033 WeakPolarHBondContact CB-SD 3.46Å; K1985-M2033 HydrophobicContact CD-CE 4.17Å; K1985-M2033 HydrophobicContact CD-CG 4.23Å; K1985-M2033 HydrophobicContact CD-SD 3.71Å; K1985-M2033 HydrophobicContact CG-CE 4.27Å; K1985-M2033 HydrophobicContact CG-SD 4.15Å; H1986-M2033 HydrophobicContact CB-CE 4.24Å; H1986-M2033 WeakPolarHBondContact ND1-CE 3.35Å; L1989-M2033 HydrophobicContact CD1-CE 3.78Å; L1989-M2033 HydrophobicContact CG-CE 4.39Å; E2030-M2033 PolarHBondContact O-N 2.96Å; F2031-M2033 VanDerWaalsContact C-N 3.32Å; F2031-M2033 PolarHBondContact O-N 3.06Å; M2033-S2036 WeakPolarHBondContact O-CA 3.39Å; M2033-S2036 WeakPolarHBondContact O-CB 3.31Å; M2033-S2036 PolarHBondContact O-N 2.96Å; M2033-I2037 HydrophobicContact CB-CD1 4.02Å; M2033-I2037 HydrophobicContact CB-CG1 4.38Å; M2033-I2037 PolarHBondContact O-N 3.2Å |
| 2034 | Y | 91.7 | Very high | 92.2 | Very high | 29.75 Ų | 29.75 | 40.6 Ų | 40.6 | 12% | 0.117 | 22% | 0.219 | C | C | . | . | H | α-helix | trans | -49.1 | -49.4 | -172.9 | -179.6 | -100.5 | 0 | 0 | 0 | 113.6 | T2027 E2030 F2031 E2032 S2036 I2037 Q2038 V2075 D2078 T2079 R2229 | T2027-Y2034 HydrophobicContact CG2-CD2 4.11Å; T2027-Y2034 HydrophobicContact CG2-CE2 3.79Å; E2030-Y2034 PolarHBondContact O-N 3.14Å; F2031-Y2034 WeakPolarHBondContact O-CB 3.39Å; F2031-Y2034 PolarHBondContact O-N 3.05Å; E2032-Y2034 VanDerWaalsContact C-N 3.32Å; Y2034-S2036 VanDerWaalsContact C-N 3.28Å; Y2034-S2036 PolarHBondContact O-N 3.13Å; Y2034-I2037 PolarHBondContact O-N 3.2Å; Y2034-I2037 VanDerWaalsContact O-N 3.16Å; Y2034-Q2038 HydrophobicContact CD1-CG 4.17Å; Y2034-Q2038 HydrophobicContact CD2-CG 4.43Å; Y2034-Q2038 HydrophobicContact CE1-CG 3.79Å; Y2034-Q2038 HydrophobicContact CE2-CG 4.1Å; Y2034-Q2038 HydrophobicContact CG-CG 4.47Å; Y2034-Q2038 VanDerWaalsContact O-CG 3.31Å; Y2034-Q2038 WeakPolarHBondContact O-CG 3.38Å; Y2034-Q2038 PolarHBondContact O-N 2.94Å; Y2034-Q2038 PolarHBondContact OH-NE2 3.14Å; Y2034-V2075 HydrophobicContact CD2-CG1 4.39Å; Y2034-V2075 HydrophobicContact CE2-CG1 3.77Å; Y2034-V2075 PolarHBondContact OH-O 3.18Å; Y2034-D2078 VanDerWaalsContact CE1-OD2 3.31Å; Y2034-D2078 WeakPolarHBondContact CE1-OD2 3.27Å; Y2034-D2078 WeakPolarHBondContact OH-CB 3.31Å; Y2034-D2078 PolarHBondContact OH-OD2 3.27Å; Y2034-T2079 PolarHBondContact OH-N 3.28Å; Y2034-T2079 PolarHBondContact OH-OG1 2.96Å; Y2034-T2079 VanDerWaalsContact OH-OG1 3.06Å; Y2034-R2229 VanDerWaalsContact CZ-NH2 3.34Å; Y2034-R2229 PolarHBondContact OH-NH1 2.91Å; Y2034-R2229 PolarHBondContact OH-NH2 3.1Å |
| 2035 | P | 93.2 | Very high | 92.1 | Very high | 90.75 Ų | 90.75 | 40.6 Ų | 40.6 | 59% | 0.589 | 22% | 0.219 | S | C | * | . | H | α-helix | trans | -61.5 | -33.4 | 178.3 | -22.9 | 34.7 | 0 | 0 | 0 | 114 | A2039 | P2035-A2039 WeakPolarHBondContact O-CB 3.15Å; P2035-A2039 PolarHBondContact O-N 3.3Å; P2035-A2039 VanDerWaalsContact O-N 3.11Å |
| 2036 | S | 93.1 | Very high | 91.9 | Very high | 36.25 Ų | 36.25 | 38.6 Ų | 38.6 | 25% | 0.253 | 21% | 0.206 | S | C | . | . | H | α-helix | trans | -73.3 | -39.8 | 177.8 | -62.5 | 0 | 0 | 0 | 0 | 111.4 | H1986 M2033 Y2034 A2039 K2040 | H1986-S2036 PolarHBondContact CE1-OG 3.33Å; M2033-S2036 WeakPolarHBondContact O-CA 3.39Å; M2033-S2036 WeakPolarHBondContact O-CB 3.31Å; M2033-S2036 PolarHBondContact O-N 2.96Å; Y2034-S2036 VanDerWaalsContact C-N 3.28Å; Y2034-S2036 PolarHBondContact O-N 3.13Å; S2036-A2039 PolarHBondContact O-N 3.09Å; S2036-K2040 VanDerWaalsContact O-CB 3.28Å; S2036-K2040 WeakPolarHBondContact O-CB 3.32Å; S2036-K2040 VanDerWaalsContact O-CG 3.26Å; S2036-K2040 WeakPolarHBondContact O-CG 3.33Å; S2036-K2040 PolarHBondContact O-N 3.46Å |
| 2037 | I | 94.5 | Very high | 91.8 | Very high | 0 Ų | 0 | 44.8 Ų | 44.8 | 0% | 0 | 24% | 0.235 | C | C | . | . | H | α-helix | trans | -61.6 | -46.4 | 174.4 | -69.7 | 161.2 | 0 | 0 | 0 | 110 | F1977 L1989 L2026 T2027 E2030 M2033 Y2034 A2039 K2040 I2041 W2042 | F1977-I2037 HydrophobicContact CZ-CD1 4.42Å; L1989-I2037 HydrophobicContact CD1-CG1 4.23Å; L1989-I2037 HydrophobicContact CD2-CG1 4.32Å; L2026-I2037 HydrophobicContact CD2-CD1 3.6Å; L2026-I2037 HydrophobicContact CD2-CG1 3.98Å; L2026-I2037 HydrophobicContact CD2-CG2 4.26Å; T2027-I2037 HydrophobicContact CG2-CG2 4.22Å; T2027-I2037 WeakPolarHBondContact OG1-CG2 3.34Å; E2030-I2037 HydrophobicContact CB-CD1 3.68Å; E2030-I2037 HydrophobicContact CG-CD1 4.5Å; M2033-I2037 HydrophobicContact CB-CD1 4.02Å; M2033-I2037 HydrophobicContact CB-CG1 4.38Å; M2033-I2037 PolarHBondContact O-N 3.2Å; Y2034-I2037 PolarHBondContact O-N 3.2Å; Y2034-I2037 VanDerWaalsContact O-N 3.16Å; I2037-A2039 PolarHBondContact O-N 3.5Å; I2037-K2040 PolarHBondContact O-N 3.18Å; I2037-I2041 HydrophobicContact CG2-CB 4.48Å; I2037-I2041 HydrophobicContact CG2-CD1 4.05Å; I2037-I2041 HydrophobicContact CG2-CG1 4.36Å; I2037-I2041 WeakPolarHBondContact O-CA 3.29Å; I2037-I2041 VanDerWaalsContact O-CB 3.32Å; I2037-I2041 WeakPolarHBondContact O-CB 3.29Å; I2037-I2041 PolarHBondContact O-N 3.08Å; I2037-W2042 PolarHBondContact O-N 3.05Å |
| 2038 | Q | 93.7 | Very high | 91.6 | Very high | 13 Ų | 13 | 46 Ų | 46 | 6% | 0.061 | 24% | 0.243 | C | C | . | . | I | π-helix | trans | -55.5 | -55.1 | 175.1 | -67.8 | -57.3 | -43.8 | 0 | 0 | 111.2 | Y2034 K2040 W2042 G2043 T2079 T2082 | Y2034-Q2038 HydrophobicContact CD1-CG 4.17Å; Y2034-Q2038 HydrophobicContact CD2-CG 4.43Å; Y2034-Q2038 HydrophobicContact CE1-CG 3.79Å; Y2034-Q2038 HydrophobicContact CE2-CG 4.1Å; Y2034-Q2038 HydrophobicContact CG-CG 4.47Å; Y2034-Q2038 VanDerWaalsContact O-CG 3.31Å; Y2034-Q2038 WeakPolarHBondContact O-CG 3.38Å; Y2034-Q2038 PolarHBondContact O-N 2.94Å; Y2034-Q2038 PolarHBondContact OH-NE2 3.14Å; Q2038-K2040 PolarHBondContact O-N 3.07Å; Q2038-W2042 PolarHBondContact O-N 3.04Å; Q2038-G2043 PolarHBondContact O-N 3.08Å; Q2038-T2079 PolarHBondContact NE2-OG1 3.11Å; Q2038-T2082 HydrophobicContact CB-CG2 4.33Å; Q2038-T2082 WeakPolarHBondContact O-CG2 3.21Å; Q2038-T2082 VanDerWaalsContact OE1-CB 3.29Å; Q2038-T2082 PolarHBondContact OE1-OG1 3.17Å |
| 2039 | A | 92.9 | Very high | 91.6 | Very high | 61.5 Ų | 61.5 | 47.5 Ų | 47.5 | 51% | 0.508 | 26% | 0.256 | S | S | . | . | I | π-helix | trans | -66.8 | -35.9 | -175.8 | 0 | 0 | 0 | 0 | 0 | 114 | P2035 S2036 I2037 N2044 | P2035-A2039 WeakPolarHBondContact O-CB 3.15Å; P2035-A2039 PolarHBondContact O-N 3.3Å; P2035-A2039 VanDerWaalsContact O-N 3.11Å; S2036-A2039 PolarHBondContact O-N 3.09Å; I2037-A2039 PolarHBondContact O-N 3.5Å; A2039-N2044 PolarHBondContact O-ND2 3.12Å |
| 2040 | K | 93.2 | Very high | 91.5 | Very high | 62.75 Ų | 62.75 | 48.2 Ų | 48.2 | 27% | 0.273 | 26% | 0.259 | S | S | . | . | I | π-helix | trans | -94.5 | -35.7 | -172.6 | -63.4 | -72.4 | 169.8 | 169.2 | 0 | 113.8 | L1989 E1990 T1993 S2036 I2037 Q2038 N2044 | L1989-K2040 HydrophobicContact CB-CB 4.1Å; L1989-K2040 HydrophobicContact CB-CG 4.23Å; L1989-K2040 HydrophobicContact CD1-CB 4.48Å; L1989-K2040 HydrophobicContact CD1-CG 4.47Å; E1990-K2040 WeakPolarHBondContact OE1-CE 3.35Å; E1990-K2040 IonicContact OE1-NZ 3.29Å; E1990-K2040 PolarHBondContact OE1-NZ 3.23Å; E1990-K2040 IonicContact OE2-NZ 2.97Å; E1990-K2040 PolarHBondContact OE2-NZ 3.4Å; T1993-K2040 PolarHBondContact OG1-O 3Å; S2036-K2040 VanDerWaalsContact O-CB 3.28Å; S2036-K2040 WeakPolarHBondContact O-CB 3.32Å; S2036-K2040 VanDerWaalsContact O-CG 3.26Å; S2036-K2040 WeakPolarHBondContact O-CG 3.33Å; S2036-K2040 PolarHBondContact O-N 3.46Å; I2037-K2040 PolarHBondContact O-N 3.18Å; Q2038-K2040 PolarHBondContact O-N 3.07Å; K2040-N2044 PolarHBondContact O-ND2 3.01Å |
| 2041 | I | 94.8 | Very high | 91.5 | Very high | 2 Ų | 2 | 46.9 Ų | 46.9 | 1% | 0.01 | 25% | 0.253 | C | S | . | . | I | π-helix | trans | -94.7 | -70.2 | 179.6 | -61.7 | 170.3 | 0 | 0 | 0 | 109 | L1989 L1996 L2023 L2026 I2037 G2043 N2044 V2045 | L1989-I2041 HydrophobicContact CD2-CD1 3.59Å; L1989-I2041 HydrophobicContact CD2-CG1 4.03Å; L1996-I2041 HydrophobicContact CD1-CB 4.34Å; L1996-I2041 HydrophobicContact CD1-CG1 4.26Å; L1996-I2041 HydrophobicContact CD1-CG2 4.11Å; L2023-I2041 HydrophobicContact CD1-CG2 4.16Å; L2023-I2041 HydrophobicContact CD2-CD1 4.06Å; L2023-I2041 HydrophobicContact CD2-CG2 4.26Å; L2026-I2041 HydrophobicContact CD2-CD1 4.36Å; I2037-I2041 HydrophobicContact CG2-CB 4.48Å; I2037-I2041 HydrophobicContact CG2-CD1 4.05Å; I2037-I2041 HydrophobicContact CG2-CG1 4.36Å; I2037-I2041 WeakPolarHBondContact O-CA 3.29Å; I2037-I2041 VanDerWaalsContact O-CB 3.32Å; I2037-I2041 WeakPolarHBondContact O-CB 3.29Å; I2037-I2041 PolarHBondContact O-N 3.08Å; I2041-G2043 PolarHBondContact O-N 2.93Å; I2041-N2044 PolarHBondContact O-N 3.14Å; I2041-V2045 HydrophobicContact CG2-CG2 4.46Å; I2041-V2045 WeakPolarHBondContact O-CB 3.27Å; I2041-V2045 VanDerWaalsContact O-CG2 3.29Å; I2041-V2045 WeakPolarHBondContact O-CG2 3.33Å; I2041-V2045 PolarHBondContact O-N 3.16Å |
| 2042 | W | 95.4 | Very high | 91.8 | Very high | 0 Ų | 0 | 41.4 Ų | 41.4 | 0% | 0 | 23% | 0.229 | C | C | . | . | I | π-helix | trans | -69.8 | -33.7 | -169.1 | -61.2 | 116.3 | 0 | 0 | 0 | 113.4 | L2023 I2024 T2027 I2037 Q2038 N2044 V2045 G2046 I2055 F2059 T2079 T2082 L2083 | L2023-W2042 HydrophobicContact CB-CH2 4.21Å; L2023-W2042 HydrophobicContact CB-CZ2 4.08Å; I2024-W2042 HydrophobicContact CG1-CH2 3.96Å; I2024-W2042 HydrophobicContact CG1-CZ2 4.08Å; T2027-W2042 PolarHBondContact OG1-NE1 3.14Å; I2037-W2042 PolarHBondContact O-N 3.05Å; Q2038-W2042 PolarHBondContact O-N 3.04Å; W2042-N2044 VanDerWaalsContact C-N 3.33Å; W2042-N2044 PolarHBondContact O-N 3.19Å; W2042-V2045 PolarHBondContact O-N 2.95Å; W2042-G2046 WeakPolarHBondContact O-CA 3.33Å; W2042-G2046 PolarHBondContact O-N 3.09Å; W2042-I2055 HydrophobicContact CE3-CG2 4.41Å; W2042-I2055 HydrophobicContact CH2-CG2 4.39Å; W2042-I2055 HydrophobicContact CZ3-CD1 4.48Å; W2042-I2055 HydrophobicContact CZ3-CG2 3.73Å; W2042-F2059 HydrophobicContact CD2-CZ 4.09Å; W2042-F2059 HydrophobicContact CE3-CE1 4.41Å; W2042-F2059 AromaticContact CE3-CZ 3.95Å; W2042-F2059 HydrophobicContact CE3-CZ 3.95Å; W2042-F2059 AromaticContact CH2-CE1 3.53Å; W2042-F2059 HydrophobicContact CH2-CE1 3.53Å; W2042-F2059 VanDerWaalsContact CH2-CE1 3.48Å; W2042-F2059 AromaticContact CH2-CZ 3.82Å; W2042-F2059 HydrophobicContact CH2-CZ 3.82Å; W2042-F2059 AromaticContact CZ2-CE1 3.86Å; W2042-F2059 HydrophobicContact CZ2-CE1 3.91Å; W2042-F2059 AromaticContact CZ2-CZ 3.9Å; W2042-F2059 HydrophobicContact CZ2-CZ 3.95Å; W2042-F2059 AromaticContact CZ3-CE1 3.8Å; W2042-F2059 HydrophobicContact CZ3-CE1 3.8Å; W2042-F2059 AromaticContact CZ3-CZ 3.81Å; W2042-F2059 HydrophobicContact CZ3-CZ 3.81Å; W2042-T2079 HydrophobicContact CB-CG2 4.14Å; W2042-T2079 HydrophobicContact CD2-CG2 3.89Å; W2042-T2079 HydrophobicContact CG-CG2 3.54Å; W2042-T2082 HydrophobicContact CB-CG2 4.11Å; W2042-L2083 HydrophobicContact CB-CD2 4.34Å; W2042-L2083 HydrophobicContact CE3-CD2 4.09Å; W2042-L2083 WeakPolarHBondContact O-CD2 3.41Å |
| 2043 | G | 92.8 | Very high | 92 | Very high | 17 Ų | 17 | 38.4 Ų | 38.4 | 18% | 0.175 | 22% | 0.218 | C | C | . | . | H | α-helix | trans | -64 | -35.6 | 174.3 | 0 | 0 | 0 | 0 | 0 | 113.7 | Q2038 I2041 | Q2038-G2043 PolarHBondContact O-N 3.08Å; I2041-G2043 PolarHBondContact O-N 2.93Å |
| 2044 | N | 92.7 | Very high | 92 | Very high | 55.25 Ų | 55.25 | 39.1 Ų | 39.1 | 30% | 0.295 | 22% | 0.221 | S | C | . | . | H | α-helix | trans | -83.1 | -40.1 | 177.3 | -69.7 | -61.5 | 0 | 0 | 0 | 112 | T1993 A2039 K2040 I2041 W2042 G2046 Q2047 | T1993-N2044 HydrophobicContact CG2-CB 4.22Å; T1993-N2044 VanDerWaalsContact CG2-ND2 3.34Å; T1993-N2044 WeakPolarHBondContact CG2-ND2 3.35Å; A2039-N2044 PolarHBondContact O-ND2 3.12Å; K2040-N2044 PolarHBondContact O-ND2 3.01Å; I2041-N2044 PolarHBondContact O-N 3.14Å; W2042-N2044 VanDerWaalsContact C-N 3.33Å; W2042-N2044 PolarHBondContact O-N 3.19Å; N2044-G2046 VanDerWaalsContact C-N 3.27Å; N2044-G2046 PolarHBondContact O-N 3.14Å; N2044-Q2047 WeakPolarHBondContact O-CB 3.4Å; N2044-Q2047 PolarHBondContact O-N 3.07Å |
| 2045 | V | 91.4 | Very high | 92.2 | Very high | 0.75 Ų | 0.75 | 37.7 Ų | 37.7 | 1% | 0.005 | 22% | 0.216 | C | C | . | . | H | α-helix | trans | -65 | -34.2 | 175.6 | 174.3 | 0 | 0 | 0 | 0 | 111.1 | L1996 I2041 W2042 Q2047 V2048 I2055 | L1996-V2045 HydrophobicContact CB-CG2 3.92Å; L1996-V2045 HydrophobicContact CD1-CG2 3.87Å; L1996-V2045 HydrophobicContact CD2-CG2 4.42Å; L1996-V2045 HydrophobicContact CG-CG2 4.29Å; I2041-V2045 HydrophobicContact CG2-CG2 4.46Å; I2041-V2045 WeakPolarHBondContact O-CB 3.27Å; I2041-V2045 VanDerWaalsContact O-CG2 3.29Å; I2041-V2045 WeakPolarHBondContact O-CG2 3.33Å; I2041-V2045 PolarHBondContact O-N 3.16Å; W2042-V2045 PolarHBondContact O-N 2.95Å; V2045-Q2047 PolarHBondContact O-N 3.34Å; V2045-V2048 VanDerWaalsContact O-CB 3.3Å; V2045-V2048 WeakPolarHBondContact O-CB 3.3Å; V2045-V2048 PolarHBondContact O-N 3.03Å; V2045-I2055 HydrophobicContact CG1-CD1 3.2Å; V2045-I2055 HydrophobicContact CG1-CG1 4.47Å |
| 2046 | G | 90 | Very high | 92.2 | Very high | 0 Ų | 0 | 33.4 Ų | 33.4 | 0% | 0 | 19% | 0.188 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -61.8 | -23.3 | 176.1 | 0 | 0 | 0 | 0 | 0 | 114.3 | W2042 N2044 V2048 A2086 N2087 | W2042-G2046 WeakPolarHBondContact O-CA 3.33Å; W2042-G2046 PolarHBondContact O-N 3.09Å; N2044-G2046 VanDerWaalsContact C-N 3.27Å; N2044-G2046 PolarHBondContact O-N 3.14Å; G2046-V2048 PolarHBondContact O-N 2.97Å; G2046-A2086 VanDerWaalsContact C-CB 3.45Å; G2046-N2087 WeakPolarHBondContact O-CB 3.45Å |
| 2047 | Q | 90.1 | Very high | 92.2 | Very high | 134 Ų | 134 | 33.1 Ų | 33.1 | 63% | 0.626 | 18% | 0.184 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -72.7 | -15.1 | 173.6 | -62.6 | -163.2 | -15.4 | 0 | 0 | 112.5 | N2044 V2045 S2049 A2086 | N2044-Q2047 WeakPolarHBondContact O-CB 3.4Å; N2044-Q2047 PolarHBondContact O-N 3.07Å; V2045-Q2047 PolarHBondContact O-N 3.34Å; Q2047-S2049 PolarHBondContact O-N 2.88Å; Q2047-A2086 HydrophobicContact CG-CB 4.24Å |
| 2048 | V | 90.1 | Very high | 92.1 | Very high | 27.5 Ų | 27.5 | 35.8 Ų | 35.8 | 17% | 0.167 | 19% | 0.194 | C | C | . | . | trans | -96.8 | 88.3 | -173.6 | -172.7 | 0 | 0 | 0 | 0 | 110 | P2000 V2045 G2046 E2050 L2051 | P2000-V2048 HydrophobicContact CB-CG1 4.42Å; P2000-V2048 HydrophobicContact CG-CG1 3.16Å; V2045-V2048 VanDerWaalsContact O-CB 3.3Å; V2045-V2048 WeakPolarHBondContact O-CB 3.3Å; V2045-V2048 PolarHBondContact O-N 3.03Å; G2046-V2048 PolarHBondContact O-N 2.97Å; V2048-E2050 VanDerWaalsContact C-N 3.31Å; V2048-E2050 PolarHBondContact O-N 3.1Å; V2048-E2050 VanDerWaalsContact O-N 3.17Å; V2048-L2051 HydrophobicContact CB-CD1 4.4Å; V2048-L2051 HydrophobicContact CG1-CD1 3.96Å; V2048-L2051 HydrophobicContact CG1-CG 4.17Å; V2048-L2051 PolarHBondContact O-N 3.29Å; V2048-L2051 VanDerWaalsContact O-N 3.07Å | ||
| 2049 | S | 90.4 | Very high | 92.2 | Very high | 63.25 Ų | 63.25 | 35.1 Ų | 35.1 | 44% | 0.442 | 19% | 0.191 | S | C | . | . | G | 310 helix | trans | -55.1 | -38.2 | -172.9 | 53.1 | 0 | 0 | 0 | 0 | 114.7 | Q2047 L2051 L2052 | Q2047-S2049 PolarHBondContact O-N 2.88Å; S2049-L2051 PolarHBondContact O-N 3Å; S2049-L2051 VanDerWaalsContact O-N 3.12Å; S2049-L2052 PolarHBondContact O-N 3.01Å |
| 2050 | E | 87.8 | Confident | 92.2 | Very high | 120 Ų | 120 | 32.8 Ų | 32.8 | 56% | 0.561 | 17% | 0.17 | S | C | * | . | G | 310 helix | trans | -60.9 | -20.9 | -178.1 | -65.8 | -179.3 | -161.1 | 0 | 0 | 114.1 | P2000 R2004 V2048 | P2000-E2050 HydrophobicContact CB-CB 4.2Å; P2000-E2050 VanDerWaalsContact CB-OE2 3.29Å; P2000-E2050 WeakPolarHBondContact CB-OE2 3.35Å; R2004-E2050 IonicContact NH2-OE1 2.9Å; V2048-E2050 VanDerWaalsContact C-N 3.31Å; V2048-E2050 PolarHBondContact O-N 3.1Å; V2048-E2050 VanDerWaalsContact O-N 3.17Å |
| 2051 | L | 90.1 | Very high | 92.2 | Very high | 1 Ų | 1 | 36.3 Ų | 36.3 | 1% | 0.005 | 18% | 0.181 | C | C | . | . | G | 310 helix | trans | -101.4 | -14 | -177.1 | -66.7 | 173.9 | 0 | 0 | 0 | 114.1 | L1999 P2000 C2003 V2016 V2048 S2049 D2053 L2054 I2055 | L1999-L2051 HydrophobicContact CB-CD1 3.59Å; L1999-L2051 HydrophobicContact CD1-CD1 4.43Å; P2000-L2051 HydrophobicContact CG-CD1 3.88Å; P2000-L2051 HydrophobicContact CG-CG 4.02Å; C2003-L2051 HydrophobicContact CB-CD2 4.42Å; C2003-L2051 VanDerWaalsContact SG-CD2 3.58Å; V2016-L2051 HydrophobicContact CG1-CD2 4.43Å; V2048-L2051 HydrophobicContact CB-CD1 4.4Å; V2048-L2051 HydrophobicContact CG1-CD1 3.96Å; V2048-L2051 HydrophobicContact CG1-CG 4.17Å; V2048-L2051 PolarHBondContact O-N 3.29Å; V2048-L2051 VanDerWaalsContact O-N 3.07Å; S2049-L2051 PolarHBondContact O-N 3Å; S2049-L2051 VanDerWaalsContact O-N 3.12Å; L2051-D2053 VanDerWaalsContact C-N 3.35Å; L2051-D2053 PolarHBondContact O-N 2.98Å; L2051-L2054 PolarHBondContact O-N 3.3Å; L2051-L2054 VanDerWaalsContact O-N 3.15Å; L2051-I2055 HydrophobicContact CB-CD1 3.8Å; L2051-I2055 HydrophobicContact CB-CG1 4.42Å; L2051-I2055 WeakPolarHBondContact O-CD1 3.49Å; L2051-I2055 VanDerWaalsContact O-CG1 3.31Å; L2051-I2055 WeakPolarHBondContact O-CG1 3.41Å; L2051-I2055 PolarHBondContact O-N 3.17Å |
| 2052 | L | 92.6 | Very high | 92 | Very high | 0.5 Ų | 0.5 | 39 Ų | 39 | 0% | 0.003 | 19% | 0.194 | C | C | . | . | H | α-helix | trans | -59 | -42.8 | -169.5 | -68.6 | 175.7 | 0 | 0 | 0 | 112.8 | S2049 L2054 I2055 L2056 L2083 N2087 L2090 V2091 I2094 | S2049-L2052 PolarHBondContact O-N 3.01Å; L2052-L2054 PolarHBondContact O-N 3.2Å; L2052-I2055 PolarHBondContact O-N 3.19Å; L2052-L2056 WeakPolarHBondContact O-CB 3.35Å; L2052-L2056 VanDerWaalsContact O-CG 3.28Å; L2052-L2056 WeakPolarHBondContact O-CG 3.32Å; L2052-L2056 PolarHBondContact O-N 3.15Å; L2052-L2083 HydrophobicContact CD2-CD2 4.46Å; L2052-N2087 HydrophobicContact CD1-CB 3.86Å; L2052-L2090 HydrophobicContact CD1-CB 4.02Å; L2052-L2090 HydrophobicContact CD1-CD1 4.21Å; L2052-V2091 HydrophobicContact CD1-CG2 4.07Å; L2052-V2091 HydrophobicContact CD2-CG2 4.17Å; L2052-I2094 HydrophobicContact CB-CD1 4.25Å |
| 2053 | D | 90.9 | Very high | 91.9 | Very high | 87 Ų | 87 | 39 Ų | 39 | 47% | 0.465 | 19% | 0.194 | S | C | . | . | H | α-helix | trans | -62.7 | -43.4 | 178.7 | -174.8 | 47 | 0 | 0 | 0 | 112 | L2051 I2055 D2057 I2094 R2098 | L2051-D2053 VanDerWaalsContact C-N 3.35Å; L2051-D2053 PolarHBondContact O-N 2.98Å; D2053-I2055 PolarHBondContact O-N 2.93Å; D2053-D2057 VanDerWaalsContact O-CB 3.3Å; D2053-D2057 WeakPolarHBondContact O-CB 3.38Å; D2053-D2057 PolarHBondContact O-N 3.06Å; D2053-I2094 HydrophobicContact CB-CD1 4.22Å; D2053-R2098 PolarHBondContact O-NH2 2.91Å; D2053-R2098 IonicContact OD1-CZ 3.36Å; D2053-R2098 IonicContact OD1-NE 3.18Å; D2053-R2098 IonicContact OD1-NH2 3.25Å; D2053-R2098 PolarHBondContact OD1-NH2 3.17Å |
| 2054 | L | 90.9 | Very high | 91.7 | Very high | 18.25 Ų | 18.25 | 41.4 Ų | 41.4 | 10% | 0.096 | 20% | 0.202 | C | C | . | . | H | α-helix | trans | -64.4 | -43 | 176.1 | -179.5 | 62.9 | 0 | 0 | 0 | 111.5 | V2016 L2020 L2051 L2052 D2057 R2058 | V2016-L2054 HydrophobicContact CG1-CD2 4.31Å; L2020-L2054 HydrophobicContact CD1-CD2 3.84Å; L2020-L2054 HydrophobicContact CD1-CG 3.97Å; L2051-L2054 PolarHBondContact O-N 3.3Å; L2051-L2054 VanDerWaalsContact O-N 3.15Å; L2052-L2054 PolarHBondContact O-N 3.2Å; L2054-D2057 PolarHBondContact O-N 3.13Å; L2054-R2058 VanDerWaalsContact O-CG 3.29Å; L2054-R2058 WeakPolarHBondContact O-CG 3.4Å; L2054-R2058 PolarHBondContact O-N 3.04Å; L2054-R2058 VanDerWaalsContact O-N 3.08Å |
| 2055 | I | 94.5 | Very high | 91.6 | Very high | 1 Ų | 1 | 42.6 Ų | 42.6 | 1% | 0.005 | 22% | 0.219 | C | C | . | . | H | α-helix | trans | -65.2 | -48 | 180 | -67 | 161.2 | 0 | 0 | 0 | 110.7 | L2020 W2042 V2045 L2051 L2052 D2053 D2057 R2058 F2059 L2083 | L2020-I2055 HydrophobicContact CD1-CG1 3.84Å; L2020-I2055 HydrophobicContact CD2-CD1 4.48Å; L2020-I2055 HydrophobicContact CD2-CG1 4.01Å; W2042-I2055 HydrophobicContact CE3-CG2 4.41Å; W2042-I2055 HydrophobicContact CH2-CG2 4.39Å; W2042-I2055 HydrophobicContact CZ3-CD1 4.48Å; W2042-I2055 HydrophobicContact CZ3-CG2 3.73Å; V2045-I2055 HydrophobicContact CG1-CD1 3.2Å; V2045-I2055 HydrophobicContact CG1-CG1 4.47Å; L2051-I2055 HydrophobicContact CB-CD1 3.8Å; L2051-I2055 HydrophobicContact CB-CG1 4.42Å; L2051-I2055 WeakPolarHBondContact O-CD1 3.49Å; L2051-I2055 VanDerWaalsContact O-CG1 3.31Å; L2051-I2055 WeakPolarHBondContact O-CG1 3.41Å; L2051-I2055 PolarHBondContact O-N 3.17Å; L2052-I2055 PolarHBondContact O-N 3.19Å; D2053-I2055 PolarHBondContact O-N 2.93Å; I2055-D2057 VanDerWaalsContact C-N 3.3Å; I2055-D2057 PolarHBondContact O-N 3.19Å; I2055-R2058 PolarHBondContact O-N 3.03Å; I2055-R2058 VanDerWaalsContact O-N 3.15Å; I2055-F2059 HydrophobicContact CG2-CD1 3.92Å; I2055-F2059 HydrophobicContact CG2-CE1 3.58Å; I2055-F2059 HydrophobicContact CG2-CE2 4.44Å; I2055-F2059 HydrophobicContact CG2-CZ 3.9Å; I2055-F2059 VanDerWaalsContact O-CD1 3.27Å; I2055-F2059 WeakPolarHBondContact O-CD1 3.28Å; I2055-F2059 PolarHBondContact O-N 3.23Å; I2055-L2083 HydrophobicContact CG2-CD1 3.76Å |
| 2056 | L | 94.3 | Very high | 91.3 | Very high | 0.25 Ų | 0.25 | 44.1 Ų | 44.1 | 0% | 0.001 | 24% | 0.235 | C | C | . | . | H | α-helix | trans | -64.9 | -35.3 | 179.3 | -68.8 | 171.7 | 0 | 0 | 0 | 111.5 | L2052 R2058 F2059 I2060 L2083 V2091 I2094 L2095 R2098 | L2052-L2056 WeakPolarHBondContact O-CB 3.35Å; L2052-L2056 VanDerWaalsContact O-CG 3.28Å; L2052-L2056 WeakPolarHBondContact O-CG 3.32Å; L2052-L2056 PolarHBondContact O-N 3.15Å; L2056-R2058 VanDerWaalsContact C-N 3.34Å; L2056-R2058 PolarHBondContact O-N 2.94Å; L2056-F2059 PolarHBondContact O-N 3.09Å; L2056-I2060 WeakPolarHBondContact O-CB 3.3Å; L2056-I2060 WeakPolarHBondContact O-CD1 3.35Å; L2056-I2060 VanDerWaalsContact O-CG1 3.29Å; L2056-I2060 WeakPolarHBondContact O-CG1 3.42Å; L2056-I2060 PolarHBondContact O-N 3.28Å; L2056-L2083 HydrophobicContact CD2-CD1 4.21Å; L2056-V2091 HydrophobicContact CD1-CG1 4.13Å; L2056-V2091 HydrophobicContact CD1-CG2 4.46Å; L2056-V2091 HydrophobicContact CD2-CG1 4.39Å; L2056-I2094 HydrophobicContact CB-CG2 4.44Å; L2056-I2094 HydrophobicContact CD1-CB 3.97Å; L2056-I2094 HydrophobicContact CD1-CD1 4.04Å; L2056-I2094 HydrophobicContact CD1-CG2 3.71Å; L2056-L2095 HydrophobicContact CD1-CG 4.46Å; L2056-L2095 HydrophobicContact CD2-CD2 4.4Å; L2056-R2098 PolarHBondContact O-NH1 2.95Å |
| 2057 | D | 92.9 | Very high | 91 | Very high | 29.5 Ų | 29.5 | 45.4 Ų | 45.4 | 16% | 0.158 | 25% | 0.248 | C | C | . | . | H | α-helix | trans | -60.5 | -45.6 | 171.5 | -178.9 | 52.8 | 0 | 0 | 0 | 111.8 | D2053 L2054 I2055 F2059 I2060 R2061 R2098 | D2053-D2057 VanDerWaalsContact O-CB 3.3Å; D2053-D2057 WeakPolarHBondContact O-CB 3.38Å; D2053-D2057 PolarHBondContact O-N 3.06Å; L2054-D2057 PolarHBondContact O-N 3.13Å; I2055-D2057 VanDerWaalsContact C-N 3.3Å; I2055-D2057 PolarHBondContact O-N 3.19Å; D2057-F2059 PolarHBondContact O-N 3.12Å; D2057-I2060 PolarHBondContact O-N 3.08Å; D2057-R2061 VanDerWaalsContact CG-NE 3.25Å; D2057-R2061 VanDerWaalsContact O-CG 3.3Å; D2057-R2061 WeakPolarHBondContact O-CG 3.33Å; D2057-R2061 PolarHBondContact O-N 3.09Å; D2057-R2061 IonicContact OD1-CZ 3.32Å; D2057-R2061 IonicContact OD1-NE 2.97Å; D2057-R2061 PolarHBondContact OD1-NE 3.08Å; D2057-R2061 VanDerWaalsContact OD1-NE 3.08Å; D2057-R2061 IonicContact OD1-NH2 3.47Å; D2057-R2061 PolarHBondContact OD1-NH2 2.9Å; D2057-R2061 VanDerWaalsContact OD1-NH2 3.13Å; D2057-R2061 IonicContact OD2-CZ 3.03Å; D2057-R2061 VanDerWaalsContact OD2-CZ 3.28Å; D2057-R2061 IonicContact OD2-NE 3.32Å; D2057-R2061 PolarHBondContact OD2-NE 3.2Å; D2057-R2061 IonicContact OD2-NH2 3.28Å; D2057-R2061 PolarHBondContact OD2-NH2 3.07Å; D2057-R2098 VanDerWaalsContact CA-NH1 3.27Å; D2057-R2098 IonicContact OD1-CZ 3.25Å; D2057-R2098 IonicContact OD1-NH1 3.07Å; D2057-R2098 PolarHBondContact OD1-NH1 3.11Å; D2057-R2098 IonicContact OD1-NH2 3.38Å; D2057-R2098 PolarHBondContact OD1-NH2 3.32Å |
| 2058 | R | 93 | Very high | 90.6 | Very high | 56.25 Ų | 56.25 | 41.7 Ų | 41.7 | 21% | 0.212 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -65 | -41 | 175.4 | -63.6 | -60.4 | 178.9 | 160 | -12 | 112.6 | S2017 D2021 I2024 L2054 I2055 L2056 I2060 R2061 Q2062 | S2017-R2058 VanDerWaalsContact CB-NH2 3.3Å; S2017-R2058 PolarHBondContact OG-NH2 3.12Å; S2017-R2058 VanDerWaalsContact OG-NH2 3.1Å; D2021-R2058 WeakPolarHBondContact OD1-CD 3.39Å; D2021-R2058 IonicContact OD1-NE 2.87Å; D2021-R2058 IonicContact OD1-NH1 3.31Å; D2021-R2058 PolarHBondContact OD1-NH1 3.16Å; D2021-R2058 IonicContact OD2-CZ 3.72Å; D2021-R2058 IonicContact OD2-NH1 3.61Å; D2021-R2058 PolarHBondContact OD2-NH1 3.02Å; D2021-R2058 VanDerWaalsContact OD2-NH1 3.09Å; I2024-R2058 HydrophobicContact CD1-CB 3.61Å; L2054-R2058 VanDerWaalsContact O-CG 3.29Å; L2054-R2058 WeakPolarHBondContact O-CG 3.4Å; L2054-R2058 PolarHBondContact O-N 3.04Å; L2054-R2058 VanDerWaalsContact O-N 3.08Å; I2055-R2058 PolarHBondContact O-N 3.03Å; I2055-R2058 VanDerWaalsContact O-N 3.15Å; L2056-R2058 VanDerWaalsContact C-N 3.34Å; L2056-R2058 PolarHBondContact O-N 2.94Å; R2058-I2060 VanDerWaalsContact C-N 3.34Å; R2058-I2060 PolarHBondContact O-N 2.95Å; R2058-R2061 PolarHBondContact O-N 3.36Å; R2058-Q2062 VanDerWaalsContact O-CB 3.24Å; R2058-Q2062 WeakPolarHBondContact O-CB 3.33Å; R2058-Q2062 PolarHBondContact O-N 3.07Å |
| 2059 | F | 95.6 | Very high | 90 | Very high | 0 Ų | 0 | 42 Ų | 42 | 0% | 0 | 24% | 0.242 | C | C | . | . | H | α-helix | trans | -59 | -47.1 | 176.7 | -83.2 | 26.7 | 0 | 0 | 0 | 111.3 | I2024 W2042 I2055 L2056 D2057 Q2062 S2063 L2076 T2079 A2080 L2083 Y2129 | I2024-F2059 HydrophobicContact CD1-CD1 3.67Å; I2024-F2059 HydrophobicContact CD1-CE1 3.88Å; I2024-F2059 HydrophobicContact CG1-CD1 3.86Å; I2024-F2059 HydrophobicContact CG1-CE1 3.6Å; W2042-F2059 HydrophobicContact CD2-CZ 4.09Å; W2042-F2059 HydrophobicContact CE3-CE1 4.41Å; W2042-F2059 AromaticContact CE3-CZ 3.95Å; W2042-F2059 HydrophobicContact CE3-CZ 3.95Å; W2042-F2059 AromaticContact CH2-CE1 3.53Å; W2042-F2059 HydrophobicContact CH2-CE1 3.53Å; W2042-F2059 VanDerWaalsContact CH2-CE1 3.48Å; W2042-F2059 AromaticContact CH2-CZ 3.82Å; W2042-F2059 HydrophobicContact CH2-CZ 3.82Å; W2042-F2059 AromaticContact CZ2-CE1 3.86Å; W2042-F2059 HydrophobicContact CZ2-CE1 3.91Å; W2042-F2059 AromaticContact CZ2-CZ 3.9Å; W2042-F2059 HydrophobicContact CZ2-CZ 3.95Å; W2042-F2059 AromaticContact CZ3-CE1 3.8Å; W2042-F2059 HydrophobicContact CZ3-CE1 3.8Å; W2042-F2059 AromaticContact CZ3-CZ 3.81Å; W2042-F2059 HydrophobicContact CZ3-CZ 3.81Å; I2055-F2059 HydrophobicContact CG2-CD1 3.92Å; I2055-F2059 HydrophobicContact CG2-CE1 3.58Å; I2055-F2059 HydrophobicContact CG2-CE2 4.44Å; I2055-F2059 HydrophobicContact CG2-CZ 3.9Å; I2055-F2059 VanDerWaalsContact O-CD1 3.27Å; I2055-F2059 WeakPolarHBondContact O-CD1 3.28Å; I2055-F2059 PolarHBondContact O-N 3.23Å; L2056-F2059 PolarHBondContact O-N 3.09Å; D2057-F2059 PolarHBondContact O-N 3.12Å; F2059-Q2062 PolarHBondContact O-N 2.82Å; F2059-S2063 VanDerWaalsContact O-CB 3.25Å; F2059-S2063 WeakPolarHBondContact O-CB 3.33Å; F2059-S2063 PolarHBondContact O-N 3.07Å; F2059-S2063 PolarHBondContact O-OG 3.06Å; F2059-L2076 HydrophobicContact CD1-CD2 4.15Å; F2059-L2076 HydrophobicContact CD2-CB 4.34Å; F2059-L2076 HydrophobicContact CD2-CD2 4.36Å; F2059-L2076 WeakPolarHBondContact CD2-O 3.38Å; F2059-L2076 HydrophobicContact CE1-CD2 4.2Å; F2059-L2076 HydrophobicContact CE2-CD2 4.37Å; F2059-L2076 HydrophobicContact CG-CB 4.48Å; F2059-L2076 HydrophobicContact CG-CD2 4.26Å; F2059-L2076 HydrophobicContact CZ-CD2 4.35Å; F2059-T2079 HydrophobicContact CE2-CG2 3.63Å; F2059-T2079 HydrophobicContact CZ-CG2 3.61Å; F2059-A2080 HydrophobicContact CD2-CB 4.45Å; F2059-L2083 HydrophobicContact CD2-CD1 4.28Å; F2059-L2083 HydrophobicContact CE2-CD1 3.59Å; F2059-L2083 HydrophobicContact CZ-CD1 3.9Å; F2059-Y2129 HydrophobicContact CB-CE1 4.47Å; F2059-Y2129 PolarHBondContact O-OH 3.04Å |
| 2060 | I | 92.7 | Very high | 89.8 | Confident | 13.25 Ų | 13.25 | 40.2 Ų | 40.2 | 7% | 0.068 | 23% | 0.229 | C | C | . | . | H | α-helix | trans | -66.3 | -48.4 | -179.7 | -68.3 | 168 | 0 | 0 | 0 | 110.5 | L2056 D2057 R2058 Q2062 S2063 I2064 L2095 R2098 L2125 L2126 | L2056-I2060 WeakPolarHBondContact O-CB 3.3Å; L2056-I2060 WeakPolarHBondContact O-CD1 3.35Å; L2056-I2060 VanDerWaalsContact O-CG1 3.29Å; L2056-I2060 WeakPolarHBondContact O-CG1 3.42Å; L2056-I2060 PolarHBondContact O-N 3.28Å; D2057-I2060 PolarHBondContact O-N 3.08Å; R2058-I2060 VanDerWaalsContact C-N 3.34Å; R2058-I2060 PolarHBondContact O-N 2.95Å; I2060-Q2062 VanDerWaalsContact C-N 3.32Å; I2060-Q2062 PolarHBondContact O-N 3.13Å; I2060-S2063 WeakPolarHBondContact O-CB 3.26Å; I2060-S2063 PolarHBondContact O-N 3.18Å; I2060-S2063 VanDerWaalsContact O-N 3.13Å; I2060-I2064 HydrophobicContact CG2-CD1 3.61Å; I2060-I2064 HydrophobicContact CG2-CG1 4.25Å; I2060-I2064 VanDerWaalsContact O-CG1 3.25Å; I2060-I2064 WeakPolarHBondContact O-CG1 3.38Å; I2060-I2064 PolarHBondContact O-N 3.18Å; I2060-L2095 HydrophobicContact CD1-CD2 4.1Å; I2060-R2098 VanDerWaalsContact CD1-NH1 3.26Å; I2060-L2125 HydrophobicContact CG2-CD2 4.37Å; I2060-L2126 HydrophobicContact CD1-CD2 3.69Å; I2060-L2126 HydrophobicContact CD1-CG 4.33Å; I2060-L2126 HydrophobicContact CG1-CD2 4.22Å |
| 2061 | R | 92.3 | Very high | 89.7 | Confident | 136 Ų | 136 | 38 Ų | 38 | 51% | 0.513 | 22% | 0.223 | S | C | . | . | H | α-helix | trans | -58.4 | -44.2 | 178 | -71 | -179.7 | -162.2 | -154.2 | 7.2 | 112.4 | D2057 R2058 S2063 I2064 A2065 | D2057-R2061 VanDerWaalsContact CG-NE 3.25Å; D2057-R2061 VanDerWaalsContact O-CG 3.3Å; D2057-R2061 WeakPolarHBondContact O-CG 3.33Å; D2057-R2061 PolarHBondContact O-N 3.09Å; D2057-R2061 IonicContact OD1-CZ 3.32Å; D2057-R2061 IonicContact OD1-NE 2.97Å; D2057-R2061 PolarHBondContact OD1-NE 3.08Å; D2057-R2061 VanDerWaalsContact OD1-NE 3.08Å; D2057-R2061 IonicContact OD1-NH2 3.47Å; D2057-R2061 PolarHBondContact OD1-NH2 2.9Å; D2057-R2061 VanDerWaalsContact OD1-NH2 3.13Å; D2057-R2061 IonicContact OD2-CZ 3.03Å; D2057-R2061 VanDerWaalsContact OD2-CZ 3.28Å; D2057-R2061 IonicContact OD2-NE 3.32Å; D2057-R2061 PolarHBondContact OD2-NE 3.2Å; D2057-R2061 IonicContact OD2-NH2 3.28Å; D2057-R2061 PolarHBondContact OD2-NH2 3.07Å; R2058-R2061 PolarHBondContact O-N 3.36Å; R2061-S2063 VanDerWaalsContact C-N 3.32Å; R2061-S2063 PolarHBondContact O-N 2.93Å; R2061-I2064 PolarHBondContact O-N 3.33Å; R2061-A2065 WeakPolarHBondContact O-CB 3.28Å; R2061-A2065 PolarHBondContact O-N 3.29Å |
| 2062 | Q | 91.6 | Very high | 89.7 | Confident | 58.75 Ų | 58.75 | 40.5 Ų | 40.5 | 28% | 0.275 | 24% | 0.235 | S | C | . | . | H | α-helix | trans | -66.5 | -38.9 | 178.2 | -169 | 63.8 | 22.7 | 0 | 0 | 111.2 | I2024 I2028 R2058 F2059 I2060 A2065 G2066 Q2072 L2076 | I2024-Q2062 HydrophobicContact CG2-CB 4.32Å; I2024-Q2062 HydrophobicContact CG2-CG 3.81Å; I2028-Q2062 HydrophobicContact CD1-CG 4.25Å; R2058-Q2062 VanDerWaalsContact O-CB 3.24Å; R2058-Q2062 WeakPolarHBondContact O-CB 3.33Å; R2058-Q2062 PolarHBondContact O-N 3.07Å; F2059-Q2062 PolarHBondContact O-N 2.82Å; I2060-Q2062 VanDerWaalsContact C-N 3.32Å; I2060-Q2062 PolarHBondContact O-N 3.13Å; Q2062-A2065 PolarHBondContact O-N 3.24Å; Q2062-G2066 PolarHBondContact O-N 3.04Å; Q2062-G2066 VanDerWaalsContact O-N 3.14Å; Q2062-Q2072 HydrophobicContact CG-CG 4.03Å; Q2062-Q2072 VanDerWaalsContact NE2-OE1 3.1Å; Q2062-Q2072 PolarHBondContact O-NE2 3.07Å; Q2062-L2076 HydrophobicContact CB-CD1 3.81Å; Q2062-L2076 HydrophobicContact CG-CD1 3.87Å |
| 2063 | S | 92.3 | Very high | 89.6 | Confident | 0 Ų | 0 | 40.6 Ų | 40.6 | 0% | 0 | 24% | 0.236 | C | C | . | . | H | α-helix | trans | -66.7 | -39.7 | 176.1 | -64.1 | 0 | 0 | 0 | 0 | 112.7 | F2059 I2060 R2061 G2066 G2067 A2073 L2076 L2125 Y2129 | F2059-S2063 VanDerWaalsContact O-CB 3.25Å; F2059-S2063 WeakPolarHBondContact O-CB 3.33Å; F2059-S2063 PolarHBondContact O-N 3.07Å; F2059-S2063 PolarHBondContact O-OG 3.06Å; I2060-S2063 WeakPolarHBondContact O-CB 3.26Å; I2060-S2063 PolarHBondContact O-N 3.18Å; I2060-S2063 VanDerWaalsContact O-N 3.13Å; R2061-S2063 VanDerWaalsContact C-N 3.32Å; R2061-S2063 PolarHBondContact O-N 2.93Å; S2063-G2066 PolarHBondContact O-N 3.35Å; S2063-G2067 PolarHBondContact O-N 3.06Å; S2063-A2073 WeakPolarHBondContact OG-CA 3.32Å; S2063-L2076 WeakPolarHBondContact OG-CD1 3.41Å; S2063-L2125 VanDerWaalsContact CB-CD2 3.45Å; S2063-Y2129 PolarHBondContact OG-OH 3.16Å; S2063-Y2129 VanDerWaalsContact OG-OH 3.05Å |
| 2064 | I | 89.9 | Confident | 89.5 | Confident | 66 Ų | 66 | 37 Ų | 37 | 34% | 0.338 | 22% | 0.217 | S | C | . | . | H | α-helix | trans | -62.7 | -43.6 | 173.7 | -67.1 | 165 | 0 | 0 | 0 | 110.2 | I2060 R2061 G2066 G2067 D2122 L2125 | I2060-I2064 HydrophobicContact CG2-CD1 3.61Å; I2060-I2064 HydrophobicContact CG2-CG1 4.25Å; I2060-I2064 VanDerWaalsContact O-CG1 3.25Å; I2060-I2064 WeakPolarHBondContact O-CG1 3.38Å; I2060-I2064 PolarHBondContact O-N 3.18Å; R2061-I2064 PolarHBondContact O-N 3.33Å; I2064-G2066 VanDerWaalsContact C-N 3.26Å; I2064-G2066 PolarHBondContact O-N 3.26Å; I2064-G2067 PolarHBondContact O-N 3.01Å; I2064-G2067 VanDerWaalsContact O-N 3.09Å; I2064-D2122 HydrophobicContact CD1-CB 4.5Å; I2064-D2122 VanDerWaalsContact CD1-OD1 3.24Å; I2064-D2122 WeakPolarHBondContact CD1-OD1 3.37Å; I2064-D2122 WeakPolarHBondContact CG1-OD1 3.43Å; I2064-L2125 HydrophobicContact CG1-CD2 3.71Å |
| 2065 | A | 89.5 | Confident | 89.5 | Confident | 81 Ų | 81 | 36.8 Ų | 36.8 | 67% | 0.669 | 22% | 0.216 | S | C | * | . | H | α-helix | trans | -61.9 | -30.4 | 177.1 | 0 | 0 | 0 | 0 | 0 | 113.3 | R2061 Q2062 | R2061-A2065 WeakPolarHBondContact O-CB 3.28Å; R2061-A2065 PolarHBondContact O-N 3.29Å; Q2062-A2065 PolarHBondContact O-N 3.24Å |
| 2066 | G | 85.2 | Confident | 89.5 | Confident | 32 Ų | 32 | 36.7 Ų | 36.7 | 33% | 0.33 | 22% | 0.216 | S | C | . | . | H | α-helix | trans | -79 | -28.2 | 172.2 | 0 | 0 | 0 | 0 | 0 | 113.9 | Q2062 S2063 I2064 S2070 | Q2062-G2066 PolarHBondContact O-N 3.04Å; Q2062-G2066 VanDerWaalsContact O-N 3.14Å; S2063-G2066 PolarHBondContact O-N 3.35Å; I2064-G2066 VanDerWaalsContact C-N 3.26Å; I2064-G2066 PolarHBondContact O-N 3.26Å; G2066-S2070 VanDerWaalsContact O-CB 3.23Å; G2066-S2070 WeakPolarHBondContact O-CB 3.28Å; G2066-S2070 PolarHBondContact O-OG 3.17Å |
| 2067 | G | 83.8 | Confident | 89.4 | Confident | 27.5 Ų | 27.5 | 36.8 Ų | 36.8 | 28% | 0.284 | 22% | 0.216 | S | C | . | . | trans | 86.4 | 161.1 | -175.5 | 0 | 0 | 0 | 0 | 0 | 114 | S2063 I2064 G2069 S2070 | S2063-G2067 PolarHBondContact O-N 3.06Å; I2064-G2067 PolarHBondContact O-N 3.01Å; I2064-G2067 VanDerWaalsContact O-N 3.09Å; G2067-G2069 PolarHBondContact O-N 3Å; G2067-S2070 VanDerWaalsContact O-CB 3.27Å; G2067-S2070 WeakPolarHBondContact O-CB 3.3Å; G2067-S2070 PolarHBondContact O-N 3.44Å; G2067-S2070 VanDerWaalsContact O-N 3.13Å; G2067-S2070 PolarHBondContact O-OG 2.98Å | ||
| 2068 | L | 82.1 | Confident | 89.4 | Confident | 56 Ų | 56 | 38 Ų | 38 | 29% | 0.293 | 22% | 0.223 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -60.2 | 124 | 179.8 | -177.4 | 68.9 | 0 | 0 | 0 | 111 | S2070 A2124 L2125 R2128 P2160 | L2068-S2070 VanDerWaalsContact C-N 3.32Å; L2068-A2124 HydrophobicContact CD1-CB 4.14Å; L2068-A2124 HydrophobicContact CD2-CB 3.81Å; L2068-L2125 HydrophobicContact CD1-CB 4.5Å; L2068-R2128 HydrophobicContact CD1-CG 4.02Å; L2068-P2160 HydrophobicContact CD2-CG 4.39Å |
| 2069 | G | 77 | Confident | 89.4 | Confident | 35.25 Ų | 35.25 | 35.4 Ų | 35.4 | 36% | 0.363 | 21% | 0.213 | S | C | . | . | T | Hydrogen-bonded Turn | trans | 81.2 | 10.1 | -179.8 | 0 | 0 | 0 | 0 | 0 | 115.4 | G2067 I2226 | G2067-G2069 PolarHBondContact O-N 3Å; G2069-I2226 WeakPolarHBondContact O-CD1 3.38Å; G2069-I2226 VanDerWaalsContact O-CG2 3.32Å; G2069-I2226 WeakPolarHBondContact O-CG2 3.4Å |
| 2070 | S | 87.3 | Confident | 89.4 | Confident | 24.75 Ų | 24.75 | 35.4 Ų | 35.4 | 17% | 0.173 | 21% | 0.213 | C | C | . | . | trans | -69.6 | 153.5 | 166.9 | 65.2 | 0 | 0 | 0 | 0 | 111.8 | G2066 G2067 L2068 Q2072 A2073 E2074 | G2066-S2070 VanDerWaalsContact O-CB 3.23Å; G2066-S2070 WeakPolarHBondContact O-CB 3.28Å; G2066-S2070 PolarHBondContact O-OG 3.17Å; G2067-S2070 VanDerWaalsContact O-CB 3.27Å; G2067-S2070 WeakPolarHBondContact O-CB 3.3Å; G2067-S2070 PolarHBondContact O-N 3.44Å; G2067-S2070 VanDerWaalsContact O-N 3.13Å; G2067-S2070 PolarHBondContact O-OG 2.98Å; L2068-S2070 VanDerWaalsContact C-N 3.32Å; S2070-Q2072 PolarHBondContact O-N 3.34Å; S2070-A2073 PolarHBondContact O-N 3.14Å; S2070-A2073 VanDerWaalsContact O-N 3.15Å; S2070-A2073 VanDerWaalsContact OG-CB 3.31Å; S2070-A2073 WeakPolarHBondContact OG-CB 3.37Å; S2070-A2073 PolarHBondContact OG-N 3.41Å; S2070-A2073 VanDerWaalsContact OG-N 3.13Å; S2070-E2074 VanDerWaalsContact O-CG 3.29Å; S2070-E2074 WeakPolarHBondContact O-CG 3.42Å; S2070-E2074 PolarHBondContact O-N 3.29Å; S2070-E2074 VanDerWaalsContact O-N 3.11Å | ||
| 2071 | V | 86 | Confident | 89.5 | Confident | 72.75 Ų | 72.75 | 36.5 Ų | 36.5 | 44% | 0.441 | 22% | 0.22 | S | C | . | . | H | α-helix | trans | -55 | -39.9 | 173.6 | 179.1 | 0 | 0 | 0 | 0 | 110.5 | F2031 E2074 V2075 I2226 P2228 | F2031-V2071 HydrophobicContact CE1-CG1 4.26Å; V2071-E2074 PolarHBondContact O-N 3.07Å; V2071-V2075 HydrophobicContact CG1-CG2 4.07Å; V2071-V2075 VanDerWaalsContact O-CB 3.32Å; V2071-V2075 WeakPolarHBondContact O-CB 3.36Å; V2071-V2075 WeakPolarHBondContact O-CG2 3.26Å; V2071-V2075 PolarHBondContact O-N 3.08Å; V2071-I2226 HydrophobicContact CG2-CG2 4.17Å; V2071-P2228 HydrophobicContact CB-CG 4.22Å; V2071-P2228 HydrophobicContact CG1-CG 4.02Å; V2071-P2228 HydrophobicContact CG2-CB 4.33Å; V2071-P2228 HydrophobicContact CG2-CG 3.7Å; V2071-P2228 VanDerWaalsContact CG2-CG 3.43Å |
| 2072 | Q | 89.4 | Confident | 89.6 | Confident | 54.75 Ų | 54.75 | 31.6 Ų | 31.6 | 26% | 0.256 | 21% | 0.206 | S | C | . | . | H | α-helix | trans | -61.1 | -49.3 | 179 | -120.8 | 174.1 | -29.3 | 0 | 0 | 112 | I2028 Q2062 S2070 E2074 V2075 L2076 | I2028-Q2072 HydrophobicContact CD1-CB 4.18Å; I2028-Q2072 HydrophobicContact CD1-CG 3.92Å; I2028-Q2072 HydrophobicContact CG1-CG 4.46Å; I2028-Q2072 HydrophobicContact CG2-CB 4.42Å; I2028-Q2072 HydrophobicContact CG2-CG 3.94Å; Q2062-Q2072 HydrophobicContact CG-CG 4.03Å; Q2062-Q2072 VanDerWaalsContact NE2-OE1 3.1Å; Q2062-Q2072 PolarHBondContact O-NE2 3.07Å; S2070-Q2072 PolarHBondContact O-N 3.34Å; Q2072-E2074 VanDerWaalsContact C-N 3.33Å; Q2072-E2074 PolarHBondContact O-N 3.12Å; Q2072-V2075 PolarHBondContact O-N 3.42Å; Q2072-L2076 HydrophobicContact CG-CD1 4.25Å; Q2072-L2076 WeakPolarHBondContact O-CB 3.38Å; Q2072-L2076 VanDerWaalsContact O-CG 3.26Å; Q2072-L2076 WeakPolarHBondContact O-CG 3.29Å; Q2072-L2076 PolarHBondContact O-N 2.99Å; Q2072-L2076 VanDerWaalsContact O-N 3.13Å |
| 2073 | A | 89.7 | Confident | 89.7 | Confident | 2.75 Ų | 2.75 | 28.8 Ų | 28.8 | 2% | 0.023 | 19% | 0.193 | C | C | . | . | H | α-helix | trans | -62.3 | -42.5 | 178.9 | 0 | 0 | 0 | 0 | 0 | 112.4 | S2063 S2070 L2076 A2077 L2125 | S2063-A2073 WeakPolarHBondContact OG-CA 3.32Å; S2070-A2073 PolarHBondContact O-N 3.14Å; S2070-A2073 VanDerWaalsContact O-N 3.15Å; S2070-A2073 VanDerWaalsContact OG-CB 3.31Å; S2070-A2073 WeakPolarHBondContact OG-CB 3.37Å; S2070-A2073 PolarHBondContact OG-N 3.41Å; S2070-A2073 VanDerWaalsContact OG-N 3.13Å; A2073-L2076 PolarHBondContact O-N 3.15Å; A2073-A2077 VanDerWaalsContact O-CB 3.29Å; A2073-A2077 WeakPolarHBondContact O-CB 3.33Å; A2073-A2077 PolarHBondContact O-N 3.07Å; A2073-L2125 HydrophobicContact CB-CD1 3.79Å |
| 2074 | E | 89 | Confident | 89.7 | Confident | 10.5 Ų | 10.5 | 28.8 Ų | 28.8 | 5% | 0.049 | 19% | 0.193 | C | C | . | . | H | α-helix | trans | -69.2 | -42 | -179.8 | -66 | -70.3 | 149.3 | 0 | 0 | 112.3 | S2070 V2071 Q2072 L2076 A2077 D2078 R2128 F2132 I2226 | S2070-E2074 VanDerWaalsContact O-CG 3.29Å; S2070-E2074 WeakPolarHBondContact O-CG 3.42Å; S2070-E2074 PolarHBondContact O-N 3.29Å; S2070-E2074 VanDerWaalsContact O-N 3.11Å; V2071-E2074 PolarHBondContact O-N 3.07Å; Q2072-E2074 VanDerWaalsContact C-N 3.33Å; Q2072-E2074 PolarHBondContact O-N 3.12Å; E2074-L2076 VanDerWaalsContact C-N 3.32Å; E2074-L2076 PolarHBondContact O-N 3.01Å; E2074-A2077 PolarHBondContact O-N 2.88Å; E2074-D2078 WeakPolarHBondContact O-CB 3.43Å; E2074-D2078 PolarHBondContact O-N 2.95Å; E2074-R2128 WeakPolarHBondContact OE1-CD 3.27Å; E2074-R2128 IonicContact OE1-CZ 3.14Å; E2074-R2128 IonicContact OE1-NE 3.84Å; E2074-R2128 PolarHBondContact OE1-NE 3.11Å; E2074-R2128 VanDerWaalsContact OE1-NE 3.11Å; E2074-R2128 IonicContact OE1-NH2 2.89Å; E2074-R2128 PolarHBondContact OE1-NH2 2.98Å; E2074-R2128 IonicContact OE2-CZ 3.52Å; E2074-R2128 IonicContact OE2-NE 3.06Å; E2074-R2128 PolarHBondContact OE2-NE 3.37Å; E2074-R2128 IonicContact OE2-NH2 3.15Å; E2074-R2128 PolarHBondContact OE2-NH2 3.03Å; E2074-F2132 VanDerWaalsContact OE2-CE2 3.27Å; E2074-F2132 WeakPolarHBondContact OE2-CE2 3.41Å; E2074-F2132 VanDerWaalsContact OE2-CZ 3.29Å; E2074-F2132 WeakPolarHBondContact OE2-CZ 3.39Å; E2074-I2226 HydrophobicContact CG-CB 4.26Å; E2074-I2226 HydrophobicContact CG-CD1 3.89Å; E2074-I2226 HydrophobicContact CG-CG2 3.9Å; E2074-I2226 WeakPolarHBondContact OE1-CG2 3.37Å |
| 2075 | V | 91.8 | Very high | 89.8 | Confident | 13.5 Ų | 13.5 | 29.1 Ų | 29.1 | 8% | 0.082 | 21% | 0.205 | C | C | . | . | H | α-helix | trans | -62.3 | -40.1 | 176 | 169.3 | 0 | 0 | 0 | 0 | 111.2 | T2027 I2028 Y2034 V2071 Q2072 T2079 R2229 | T2027-V2075 HydrophobicContact CG2-CG1 4.21Å; I2028-V2075 HydrophobicContact CG1-CG1 4.34Å; Y2034-V2075 HydrophobicContact CD2-CG1 4.39Å; Y2034-V2075 HydrophobicContact CE2-CG1 3.77Å; Y2034-V2075 PolarHBondContact OH-O 3.18Å; V2071-V2075 HydrophobicContact CG1-CG2 4.07Å; V2071-V2075 VanDerWaalsContact O-CB 3.32Å; V2071-V2075 WeakPolarHBondContact O-CB 3.36Å; V2071-V2075 WeakPolarHBondContact O-CG2 3.26Å; V2071-V2075 PolarHBondContact O-N 3.08Å; Q2072-V2075 PolarHBondContact O-N 3.42Å; V2075-T2079 VanDerWaalsContact O-CB 3.31Å; V2075-T2079 WeakPolarHBondContact O-CB 3.34Å; V2075-T2079 PolarHBondContact O-N 3.14Å; V2075-T2079 PolarHBondContact O-OG1 3.21Å; V2075-R2229 VanDerWaalsContact CG1-NH2 3.26Å; V2075-R2229 VanDerWaalsContact CG2-CZ 3.45Å |
| 2076 | L | 94.2 | Very high | 89.9 | Confident | 0 Ų | 0 | 26.9 Ų | 26.9 | 0% | 0 | 19% | 0.187 | C | C | . | . | H | α-helix | trans | -75.5 | -33.6 | -180 | -66.3 | 174.3 | 0 | 0 | 0 | 112.8 | I2024 I2028 F2059 Q2062 S2063 Q2072 A2073 E2074 T2079 A2080 Y2129 | I2024-L2076 HydrophobicContact CG1-CD2 4.45Å; I2024-L2076 HydrophobicContact CG2-CD1 4.24Å; I2024-L2076 HydrophobicContact CG2-CD2 3.96Å; I2028-L2076 HydrophobicContact CD1-CD1 4.3Å; I2028-L2076 HydrophobicContact CD1-CD2 4.46Å; I2028-L2076 HydrophobicContact CD1-CG 4.46Å; I2028-L2076 HydrophobicContact CG1-CD2 4.45Å; I2028-L2076 HydrophobicContact CG1-CG 4.49Å; F2059-L2076 HydrophobicContact CD1-CD2 4.15Å; F2059-L2076 HydrophobicContact CD2-CB 4.34Å; F2059-L2076 HydrophobicContact CD2-CD2 4.36Å; F2059-L2076 WeakPolarHBondContact CD2-O 3.38Å; F2059-L2076 HydrophobicContact CE1-CD2 4.2Å; F2059-L2076 HydrophobicContact CE2-CD2 4.37Å; F2059-L2076 HydrophobicContact CG-CB 4.48Å; F2059-L2076 HydrophobicContact CG-CD2 4.26Å; F2059-L2076 HydrophobicContact CZ-CD2 4.35Å; Q2062-L2076 HydrophobicContact CB-CD1 3.81Å; Q2062-L2076 HydrophobicContact CG-CD1 3.87Å; S2063-L2076 WeakPolarHBondContact OG-CD1 3.41Å; Q2072-L2076 HydrophobicContact CG-CD1 4.25Å; Q2072-L2076 WeakPolarHBondContact O-CB 3.38Å; Q2072-L2076 VanDerWaalsContact O-CG 3.26Å; Q2072-L2076 WeakPolarHBondContact O-CG 3.29Å; Q2072-L2076 PolarHBondContact O-N 2.99Å; Q2072-L2076 VanDerWaalsContact O-N 3.13Å; A2073-L2076 PolarHBondContact O-N 3.15Å; E2074-L2076 VanDerWaalsContact C-N 3.32Å; E2074-L2076 PolarHBondContact O-N 3.01Å; L2076-T2079 PolarHBondContact O-N 3.15Å; L2076-A2080 WeakPolarHBondContact O-CB 3.3Å; L2076-A2080 PolarHBondContact O-N 3.19Å; L2076-Y2129 VanDerWaalsContact CB-OH 3.3Å; L2076-Y2129 WeakPolarHBondContact CB-OH 3.37Å |
| 2077 | A | 92.4 | Very high | 90.2 | Very high | 1.5 Ų | 1.5 | 27 Ų | 27 | 1% | 0.012 | 18% | 0.18 | C | C | . | . | H | α-helix | trans | -64.7 | -42.4 | 171.2 | 0 | 0 | 0 | 0 | 0 | 111.8 | A2073 E2074 A2080 Y2129 F2132 | A2073-A2077 VanDerWaalsContact O-CB 3.29Å; A2073-A2077 WeakPolarHBondContact O-CB 3.33Å; A2073-A2077 PolarHBondContact O-N 3.07Å; E2074-A2077 PolarHBondContact O-N 2.88Å; A2077-A2080 WeakPolarHBondContact O-CB 3.39Å; A2077-A2080 PolarHBondContact O-N 3.11Å; A2077-Y2129 HydrophobicContact CB-CD2 3.65Å; A2077-Y2129 HydrophobicContact CB-CE2 3.64Å; A2077-Y2129 HydrophobicContact CB-CG 4.15Å; A2077-F2132 HydrophobicContact CB-CB 4.47Å; A2077-F2132 HydrophobicContact CB-CD2 3.47Å; A2077-F2132 VanDerWaalsContact CB-CD2 3.47Å; A2077-F2132 HydrophobicContact CB-CE2 3.73Å; A2077-F2132 HydrophobicContact CB-CG 4.04Å; A2077-F2132 HydrophobicContact CB-CZ 4.4Å |
| 2078 | D | 92.5 | Very high | 90.6 | Very high | 56.25 Ų | 56.25 | 27.9 Ų | 27.9 | 30% | 0.301 | 18% | 0.18 | S | C | . | . | H | α-helix | trans | -65.8 | -41.1 | 174 | -169.9 | 48.8 | 0 | 0 | 0 | 111.5 | Y2034 E2074 A2080 V2081 F2132 R2229 | Y2034-D2078 VanDerWaalsContact CE1-OD2 3.31Å; Y2034-D2078 WeakPolarHBondContact CE1-OD2 3.27Å; Y2034-D2078 WeakPolarHBondContact OH-CB 3.31Å; Y2034-D2078 PolarHBondContact OH-OD2 3.27Å; E2074-D2078 WeakPolarHBondContact O-CB 3.43Å; E2074-D2078 PolarHBondContact O-N 2.95Å; D2078-A2080 VanDerWaalsContact C-N 3.28Å; D2078-A2080 PolarHBondContact O-N 2.99Å; D2078-V2081 VanDerWaalsContact O-CB 3.25Å; D2078-V2081 WeakPolarHBondContact O-CB 3.33Å; D2078-V2081 WeakPolarHBondContact O-CG2 3.35Å; D2078-V2081 PolarHBondContact O-N 3.18Å; D2078-V2081 VanDerWaalsContact O-N 3.11Å; D2078-F2132 HydrophobicContact CB-CD1 4.06Å; D2078-F2132 HydrophobicContact CB-CE1 3.89Å; D2078-R2229 VanDerWaalsContact CG-NH1 3.32Å; D2078-R2229 IonicContact OD1-NH1 3.7Å; D2078-R2229 PolarHBondContact OD1-NH1 3.34Å; D2078-R2229 IonicContact OD2-CZ 2.76Å; D2078-R2229 IonicContact OD2-NH1 2.96Å; D2078-R2229 PolarHBondContact OD2-NH1 2.99Å; D2078-R2229 IonicContact OD2-NH2 3.15Å; D2078-R2229 PolarHBondContact OD2-NH2 3.39Å |
| 2079 | T | 94.3 | Very high | 91 | Very high | 0 Ų | 0 | 31.6 Ų | 31.6 | 0% | 0 | 20% | 0.195 | C | C | . | . | H | α-helix | trans | -62.3 | -32.9 | 175.5 | -58.3 | 0 | 0 | 0 | 0 | 112.4 | T2027 Y2034 Q2038 W2042 F2059 V2075 L2076 V2081 T2082 L2083 | T2027-T2079 HydrophobicContact CG2-CG2 4.48Å; Y2034-T2079 PolarHBondContact OH-N 3.28Å; Y2034-T2079 PolarHBondContact OH-OG1 2.96Å; Y2034-T2079 VanDerWaalsContact OH-OG1 3.06Å; Q2038-T2079 PolarHBondContact NE2-OG1 3.11Å; W2042-T2079 HydrophobicContact CB-CG2 4.14Å; W2042-T2079 HydrophobicContact CD2-CG2 3.89Å; W2042-T2079 HydrophobicContact CG-CG2 3.54Å; F2059-T2079 HydrophobicContact CE2-CG2 3.63Å; F2059-T2079 HydrophobicContact CZ-CG2 3.61Å; V2075-T2079 VanDerWaalsContact O-CB 3.31Å; V2075-T2079 WeakPolarHBondContact O-CB 3.34Å; V2075-T2079 PolarHBondContact O-N 3.14Å; V2075-T2079 PolarHBondContact O-OG1 3.21Å; L2076-T2079 PolarHBondContact O-N 3.15Å; T2079-V2081 PolarHBondContact O-N 3.12Å; T2079-T2082 WeakPolarHBondContact O-CB 3.44Å; T2079-T2082 PolarHBondContact O-N 2.94Å; T2079-T2082 VanDerWaalsContact O-N 3.1Å; T2079-L2083 PolarHBondContact O-N 2.97Å |
| 2080 | A | 95 | Very high | 91.7 | Very high | 0 Ų | 0 | 32.9 Ų | 32.9 | 0% | 0 | 19% | 0.194 | C | C | . | . | H | α-helix | trans | -63.8 | -23.5 | 176.4 | 0 | 0 | 0 | 0 | 0 | 112.8 | F2059 L2076 A2077 D2078 T2082 L2083 A2084 Y2129 L2133 | F2059-A2080 HydrophobicContact CD2-CB 4.45Å; L2076-A2080 WeakPolarHBondContact O-CB 3.3Å; L2076-A2080 PolarHBondContact O-N 3.19Å; A2077-A2080 WeakPolarHBondContact O-CB 3.39Å; A2077-A2080 PolarHBondContact O-N 3.11Å; D2078-A2080 VanDerWaalsContact C-N 3.28Å; D2078-A2080 PolarHBondContact O-N 2.99Å; A2080-T2082 VanDerWaalsContact C-N 3.34Å; A2080-L2083 PolarHBondContact O-N 3.2Å; A2080-A2084 WeakPolarHBondContact O-CB 3.36Å; A2080-A2084 PolarHBondContact O-N 3.23Å; A2080-Y2129 HydrophobicContact CB-CD1 3.95Å; A2080-Y2129 HydrophobicContact CB-CE1 3.94Å; A2080-L2133 HydrophobicContact CB-CD1 3.89Å |
| 2081 | V | 94.5 | Very high | 92 | Very high | 36.5 Ų | 36.5 | 31.8 Ų | 31.8 | 22% | 0.221 | 19% | 0.186 | C | C | . | . | H | α-helix | trans | -63.3 | -41.2 | 172 | -175.3 | 0 | 0 | 0 | 0 | 110.9 | D2078 T2079 L2083 A2084 A2085 F2132 L2133 | D2078-V2081 VanDerWaalsContact O-CB 3.25Å; D2078-V2081 WeakPolarHBondContact O-CB 3.33Å; D2078-V2081 WeakPolarHBondContact O-CG2 3.35Å; D2078-V2081 PolarHBondContact O-N 3.18Å; D2078-V2081 VanDerWaalsContact O-N 3.11Å; T2079-V2081 PolarHBondContact O-N 3.12Å; V2081-L2083 VanDerWaalsContact C-N 3.34Å; V2081-L2083 PolarHBondContact O-N 3.31Å; V2081-A2084 PolarHBondContact O-N 3.13Å; V2081-A2085 WeakPolarHBondContact O-CB 3.35Å; V2081-A2085 PolarHBondContact O-N 3.45Å; V2081-F2132 HydrophobicContact CG2-CB 3.82Å; V2081-F2132 HydrophobicContact CG2-CD1 4.43Å; V2081-F2132 WeakPolarHBondContact CG2-O 3.45Å; V2081-L2133 HydrophobicContact CG2-CD1 4.4Å |
| 2082 | T | 94.1 | Very high | 92.4 | Very high | 34.25 Ų | 34.25 | 28.3 Ų | 28.3 | 21% | 0.21 | 17% | 0.165 | C | C | . | . | H | α-helix | trans | -64.5 | -38.7 | 176.9 | -52.9 | 0 | 0 | 0 | 0 | 111.8 | Q2038 W2042 T2079 A2080 A2085 A2086 | Q2038-T2082 HydrophobicContact CB-CG2 4.33Å; Q2038-T2082 WeakPolarHBondContact O-CG2 3.21Å; Q2038-T2082 VanDerWaalsContact OE1-CB 3.29Å; Q2038-T2082 PolarHBondContact OE1-OG1 3.17Å; W2042-T2082 HydrophobicContact CB-CG2 4.11Å; T2079-T2082 WeakPolarHBondContact O-CB 3.44Å; T2079-T2082 PolarHBondContact O-N 2.94Å; T2079-T2082 VanDerWaalsContact O-N 3.1Å; A2080-T2082 VanDerWaalsContact C-N 3.34Å; T2082-A2085 PolarHBondContact O-N 3.43Å; T2082-A2086 PolarHBondContact O-N 3.1Å |
| 2083 | L | 94.1 | Very high | 92.6 | Very high | 0.25 Ų | 0.25 | 27.7 Ų | 27.7 | 0% | 0.001 | 16% | 0.163 | C | C | . | . | H | α-helix | trans | -64.7 | -46.3 | 173.9 | -65.9 | 175.8 | 0 | 0 | 0 | 111.2 | W2042 L2052 I2055 L2056 F2059 T2079 A2080 V2081 A2085 A2086 N2087 V2091 | W2042-L2083 HydrophobicContact CB-CD2 4.34Å; W2042-L2083 HydrophobicContact CE3-CD2 4.09Å; W2042-L2083 WeakPolarHBondContact O-CD2 3.41Å; L2052-L2083 HydrophobicContact CD2-CD2 4.46Å; I2055-L2083 HydrophobicContact CG2-CD1 3.76Å; L2056-L2083 HydrophobicContact CD2-CD1 4.21Å; F2059-L2083 HydrophobicContact CD2-CD1 4.28Å; F2059-L2083 HydrophobicContact CE2-CD1 3.59Å; F2059-L2083 HydrophobicContact CZ-CD1 3.9Å; T2079-L2083 PolarHBondContact O-N 2.97Å; A2080-L2083 PolarHBondContact O-N 3.2Å; V2081-L2083 VanDerWaalsContact C-N 3.34Å; V2081-L2083 PolarHBondContact O-N 3.31Å; L2083-A2085 VanDerWaalsContact C-N 3.32Å; L2083-A2085 PolarHBondContact O-N 3.04Å; L2083-A2086 PolarHBondContact O-N 3.1Å; L2083-A2086 VanDerWaalsContact O-N 3.14Å; L2083-N2087 PolarHBondContact O-N 2.95Å; L2083-N2087 VanDerWaalsContact O-N 3.1Å; L2083-V2091 HydrophobicContact CB-CG2 4.32Å |
| 2084 | A | 92.7 | Very high | 92.8 | Very high | 0 Ų | 0 | 28.8 Ų | 28.8 | 0% | 0 | 17% | 0.169 | C | C | . | . | H | α-helix | trans | -64.9 | -34.4 | 178.5 | 0 | 0 | 0 | 0 | 0 | 112.5 | A2080 V2081 A2086 N2087 T2088 V2091 L2133 C2138 | A2080-A2084 WeakPolarHBondContact O-CB 3.36Å; A2080-A2084 PolarHBondContact O-N 3.23Å; V2081-A2084 PolarHBondContact O-N 3.13Å; A2084-A2086 VanDerWaalsContact C-N 3.27Å; A2084-A2086 PolarHBondContact O-N 3.11Å; A2084-N2087 CarbonylContact O-C 3.37Å; A2084-N2087 VanDerWaalsContact O-C 3.32Å; A2084-N2087 PolarHBondContact O-N 2.88Å; A2084-T2088 WeakPolarHBondContact O-CA 3.43Å; A2084-T2088 WeakPolarHBondContact O-CB 3.34Å; A2084-T2088 PolarHBondContact O-N 3.26Å; A2084-T2088 PolarHBondContact O-OG1 3.09Å; A2084-T2088 VanDerWaalsContact O-OG1 3.1Å; A2084-V2091 HydrophobicContact CB-CB 4.17Å; A2084-V2091 HydrophobicContact CB-CG1 3.86Å; A2084-L2133 HydrophobicContact CB-CD2 3.73Å; A2084-L2133 HydrophobicContact CB-CG 4.02Å; A2084-C2138 HydrophobicContact CB-CB 3.92Å |
| 2085 | A | 92 | Very high | 93.1 | Very high | 71.25 Ų | 71.25 | 28.4 Ų | 28.4 | 59% | 0.589 | 17% | 0.167 | S | C | * | . | H | α-helix | trans | -65.1 | -27.2 | 174.9 | 0 | 0 | 0 | 0 | 0 | 113 | V2081 T2082 L2083 | V2081-A2085 WeakPolarHBondContact O-CB 3.35Å; V2081-A2085 PolarHBondContact O-N 3.45Å; T2082-A2085 PolarHBondContact O-N 3.43Å; L2083-A2085 VanDerWaalsContact C-N 3.32Å; L2083-A2085 PolarHBondContact O-N 3.04Å |
| 2086 | A | 90.3 | Very high | 93.3 | Very high | 35 Ų | 35 | 28 Ų | 28 | 29% | 0.289 | 16% | 0.164 | S | C | . | . | H | α-helix | trans | -84.4 | -34.4 | 175 | 0 | 0 | 0 | 0 | 0 | 112.8 | G2046 Q2047 T2082 L2083 A2084 | G2046-A2086 VanDerWaalsContact C-CB 3.45Å; Q2047-A2086 HydrophobicContact CG-CB 4.24Å; T2082-A2086 PolarHBondContact O-N 3.1Å; L2083-A2086 PolarHBondContact O-N 3.1Å; L2083-A2086 VanDerWaalsContact O-N 3.14Å; A2084-A2086 VanDerWaalsContact C-N 3.27Å; A2084-A2086 PolarHBondContact O-N 3.11Å |
| 2087 | N | 92 | Very high | 93.3 | Very high | 35.25 Ų | 35.25 | 34.4 Ų | 34.4 | 19% | 0.189 | 19% | 0.188 | C | C | . | . | trans | -147.3 | 82.8 | 179.1 | -163.9 | -32.9 | 0 | 0 | 0 | 111.8 | G2046 L2052 L2083 A2084 L2090 V2091 | G2046-N2087 WeakPolarHBondContact O-CB 3.45Å; L2052-N2087 HydrophobicContact CD1-CB 3.86Å; L2083-N2087 PolarHBondContact O-N 2.95Å; L2083-N2087 VanDerWaalsContact O-N 3.1Å; A2084-N2087 CarbonylContact O-C 3.37Å; A2084-N2087 VanDerWaalsContact O-C 3.32Å; A2084-N2087 PolarHBondContact O-N 2.88Å; N2087-L2090 WeakPolarHBondContact ND2-CD1 3.44Å; N2087-L2090 WeakPolarHBondContact OD1-CB 3.4Å; N2087-L2090 WeakPolarHBondContact OD1-CG 3.38Å; N2087-L2090 PolarHBondContact OD1-N 3.27Å; N2087-V2091 WeakPolarHBondContact O-CB 3.36Å; N2087-V2091 VanDerWaalsContact O-CG2 3.26Å; N2087-V2091 WeakPolarHBondContact O-CG2 3.28Å; N2087-V2091 PolarHBondContact O-N 3.01Å | ||
| 2088 | T | 91.6 | Very high | 93.4 | Very high | 45.75 Ų | 45.75 | 37 Ų | 37 | 28% | 0.281 | 20% | 0.198 | S | C | . | . | H | α-helix | trans | -64.1 | -47.4 | -171.6 | -53.8 | 0 | 0 | 0 | 0 | 112.9 | A2084 L2090 V2091 S2092 N2137 C2138 D2140 | A2084-T2088 WeakPolarHBondContact O-CA 3.43Å; A2084-T2088 WeakPolarHBondContact O-CB 3.34Å; A2084-T2088 PolarHBondContact O-N 3.26Å; A2084-T2088 PolarHBondContact O-OG1 3.09Å; A2084-T2088 VanDerWaalsContact O-OG1 3.1Å; T2088-L2090 PolarHBondContact O-N 2.76Å; T2088-V2091 PolarHBondContact O-N 3.21Å; T2088-S2092 VanDerWaalsContact O-CB 3.27Å; T2088-S2092 WeakPolarHBondContact O-CB 3.39Å; T2088-S2092 PolarHBondContact O-N 3.07Å; T2088-S2092 VanDerWaalsContact O-N 3.1Å; T2088-S2092 PolarHBondContact O-OG 3.21Å; T2088-N2137 WeakPolarHBondContact CG2-O 3.33Å; T2088-C2138 WeakPolarHBondContact CG2-O 3.44Å; T2088-D2140 HydrophobicContact CG2-CB 4.28Å |
| 2089 | E | 90.4 | Very high | 93.6 | Very high | 132.5 Ų | 132.5 | 34.3 Ų | 34.3 | 62% | 0.619 | 18% | 0.183 | S | C | * | . | H | α-helix | trans | -62.2 | -50.8 | -174.3 | -153.6 | -177.9 | 173 | 0 | 0 | 111.6 | S2092 D2093 | E2089-S2092 PolarHBondContact O-OG 3.23Å; E2089-S2092 VanDerWaalsContact O-OG 3.08Å; E2089-D2093 VanDerWaalsContact O-CB 3.27Å; E2089-D2093 WeakPolarHBondContact O-CB 3.38Å; E2089-D2093 PolarHBondContact O-N 3.19Å; E2089-D2093 VanDerWaalsContact O-N 3.1Å |
| 2090 | L | 92.4 | Very high | 93.6 | Very high | 64 Ų | 64 | 35.2 Ų | 35.2 | 34% | 0.335 | 19% | 0.188 | S | C | . | . | H | α-helix | trans | -70.9 | -41.3 | -177 | -65.2 | -177.5 | 0 | 0 | 0 | 112.6 | L2052 N2087 T2088 I2094 | L2052-L2090 HydrophobicContact CD1-CB 4.02Å; L2052-L2090 HydrophobicContact CD1-CD1 4.21Å; N2087-L2090 WeakPolarHBondContact ND2-CD1 3.44Å; N2087-L2090 WeakPolarHBondContact OD1-CB 3.4Å; N2087-L2090 WeakPolarHBondContact OD1-CG 3.38Å; N2087-L2090 PolarHBondContact OD1-N 3.27Å; T2088-L2090 PolarHBondContact O-N 2.76Å; L2090-I2094 WeakPolarHBondContact O-CB 3.36Å; L2090-I2094 WeakPolarHBondContact O-CD1 3.37Å; L2090-I2094 WeakPolarHBondContact O-CG1 3.28Å; L2090-I2094 PolarHBondContact O-N 3.09Å |
| 2091 | V | 94.3 | Very high | 93.5 | Very high | 0 Ų | 0 | 39.7 Ų | 39.7 | 0% | 0 | 21% | 0.208 | C | C | . | . | H | α-helix | trans | -67.6 | -41.5 | -178 | 174.9 | 0 | 0 | 0 | 0 | 111 | L2052 L2056 L2083 A2084 N2087 T2088 L2095 L2133 | L2052-V2091 HydrophobicContact CD1-CG2 4.07Å; L2052-V2091 HydrophobicContact CD2-CG2 4.17Å; L2056-V2091 HydrophobicContact CD1-CG1 4.13Å; L2056-V2091 HydrophobicContact CD1-CG2 4.46Å; L2056-V2091 HydrophobicContact CD2-CG1 4.39Å; L2083-V2091 HydrophobicContact CB-CG2 4.32Å; A2084-V2091 HydrophobicContact CB-CB 4.17Å; A2084-V2091 HydrophobicContact CB-CG1 3.86Å; N2087-V2091 WeakPolarHBondContact O-CB 3.36Å; N2087-V2091 VanDerWaalsContact O-CG2 3.26Å; N2087-V2091 WeakPolarHBondContact O-CG2 3.28Å; N2087-V2091 PolarHBondContact O-N 3.01Å; T2088-V2091 PolarHBondContact O-N 3.21Å; V2091-L2095 HydrophobicContact CG1-CD1 4.12Å; V2091-L2095 WeakPolarHBondContact O-CG 3.38Å; V2091-L2095 PolarHBondContact O-N 3.18Å; V2091-L2133 HydrophobicContact CG1-CD2 3.87Å |
| 2092 | S | 93.8 | Very high | 93.4 | Very high | 0 Ų | 0 | 39 Ų | 39 | 0% | 0 | 20% | 0.203 | C | C | . | . | H | α-helix | trans | -64.6 | -47.7 | 176.8 | 60.9 | 0 | 0 | 0 | 0 | 111.6 | T2088 E2089 I2094 L2095 I2096 L2139 H2144 | T2088-S2092 VanDerWaalsContact O-CB 3.27Å; T2088-S2092 WeakPolarHBondContact O-CB 3.39Å; T2088-S2092 PolarHBondContact O-N 3.07Å; T2088-S2092 VanDerWaalsContact O-N 3.1Å; T2088-S2092 PolarHBondContact O-OG 3.21Å; E2089-S2092 PolarHBondContact O-OG 3.23Å; E2089-S2092 VanDerWaalsContact O-OG 3.08Å; S2092-I2094 PolarHBondContact O-N 2.91Å; S2092-L2095 PolarHBondContact O-N 3.21Å; S2092-I2096 VanDerWaalsContact O-CB 3.27Å; S2092-I2096 WeakPolarHBondContact O-CB 3.35Å; S2092-I2096 WeakPolarHBondContact O-CD1 3.38Å; S2092-I2096 WeakPolarHBondContact O-CG1 3.33Å; S2092-I2096 PolarHBondContact O-N 3.16Å; S2092-L2139 WeakPolarHBondContact CB-O 3.31Å; S2092-H2144 PolarHBondContact OG-CE1 3.06Å; S2092-H2144 VanDerWaalsContact OG-CE1 3.31Å; S2092-H2144 PolarHBondContact OG-NE2 2.96Å |
| 2093 | D | 94.4 | Very high | 93.4 | Very high | 42 Ų | 42 | 37.3 Ų | 37.3 | 23% | 0.225 | 19% | 0.193 | C | C | . | . | H | α-helix | trans | -60 | -44.5 | 178.5 | 177.2 | 45.3 | 0 | 0 | 0 | 112.3 | E2089 L2095 I2096 R2097 H2144 | E2089-D2093 VanDerWaalsContact O-CB 3.27Å; E2089-D2093 WeakPolarHBondContact O-CB 3.38Å; E2089-D2093 PolarHBondContact O-N 3.19Å; E2089-D2093 VanDerWaalsContact O-N 3.1Å; D2093-L2095 PolarHBondContact O-N 3.38Å; D2093-I2096 PolarHBondContact O-N 3.12Å; D2093-R2097 WeakPolarHBondContact O-CB 3.33Å; D2093-R2097 PolarHBondContact O-N 3.17Å; D2093-R2097 IonicContact OD1-CZ 3.8Å; D2093-R2097 IonicContact OD1-NE 2.95Å; D2093-R2097 PolarHBondContact OD1-NE 3.41Å; D2093-R2097 IonicContact OD1-NH2 3.5Å; D2093-R2097 PolarHBondContact OD1-NH2 3.09Å; D2093-R2097 IonicContact OD2-CZ 3.22Å; D2093-R2097 IonicContact OD2-NE 3.74Å; D2093-R2097 IonicContact OD2-NH1 2.98Å; D2093-R2097 IonicContact OD2-NH2 3.35Å; D2093-R2097 PolarHBondContact OD2-NH2 3.14Å; D2093-H2144 IonicContact OD1-CE1 2.64Å |
| 2094 | I | 93.9 | Very high | 93.2 | Very high | 27 Ų | 27 | 39.7 Ų | 39.7 | 14% | 0.138 | 20% | 0.204 | C | C | . | . | H | α-helix | trans | -59.8 | -48.9 | 177.6 | -69 | 163.8 | 0 | 0 | 0 | 111.3 | L2052 D2053 L2056 L2090 S2092 R2098 | L2052-I2094 HydrophobicContact CB-CD1 4.25Å; D2053-I2094 HydrophobicContact CB-CD1 4.22Å; L2056-I2094 HydrophobicContact CB-CG2 4.44Å; L2056-I2094 HydrophobicContact CD1-CB 3.97Å; L2056-I2094 HydrophobicContact CD1-CD1 4.04Å; L2056-I2094 HydrophobicContact CD1-CG2 3.71Å; L2090-I2094 WeakPolarHBondContact O-CB 3.36Å; L2090-I2094 WeakPolarHBondContact O-CD1 3.37Å; L2090-I2094 WeakPolarHBondContact O-CG1 3.28Å; L2090-I2094 PolarHBondContact O-N 3.09Å; S2092-I2094 PolarHBondContact O-N 2.91Å; I2094-R2098 VanDerWaalsContact O-CB 3.25Å; I2094-R2098 WeakPolarHBondContact O-CB 3.36Å; I2094-R2098 VanDerWaalsContact O-CG 3.23Å; I2094-R2098 WeakPolarHBondContact O-CG 3.31Å; I2094-R2098 PolarHBondContact O-N 3.07Å; I2094-R2098 VanDerWaalsContact O-N 3.08Å |
| 2095 | L | 95 | Very high | 93.1 | Very high | 1.25 Ų | 1.25 | 43.9 Ų | 43.9 | 1% | 0.007 | 22% | 0.222 | C | C | . | . | H | α-helix | trans | -69.1 | -41.3 | -177.1 | -70.1 | 173.9 | 0 | 0 | 0 | 112.1 | L2056 I2060 V2091 S2092 D2093 R2098 L2099 L2126 Y2129 L2130 L2133 | L2056-L2095 HydrophobicContact CD1-CG 4.46Å; L2056-L2095 HydrophobicContact CD2-CD2 4.4Å; I2060-L2095 HydrophobicContact CD1-CD2 4.1Å; V2091-L2095 HydrophobicContact CG1-CD1 4.12Å; V2091-L2095 WeakPolarHBondContact O-CG 3.38Å; V2091-L2095 PolarHBondContact O-N 3.18Å; S2092-L2095 PolarHBondContact O-N 3.21Å; D2093-L2095 PolarHBondContact O-N 3.38Å; L2095-R2098 PolarHBondContact O-N 3.37Å; L2095-L2099 PolarHBondContact O-N 3.24Å; L2095-L2126 HydrophobicContact CD2-CD2 3.88Å; L2095-Y2129 HydrophobicContact CD1-CD1 4.33Å; L2095-Y2129 HydrophobicContact CD2-CD1 4.23Å; L2095-L2130 HydrophobicContact CB-CD2 4.46Å; L2095-L2133 HydrophobicContact CD1-CD1 4.31Å; L2095-L2133 HydrophobicContact CD1-CD2 3.59Å |
| 2096 | I | 95.4 | Very high | 93.1 | Very high | 5.5 Ų | 5.5 | 40.5 Ų | 40.5 | 3% | 0.028 | 20% | 0.195 | C | C | . | . | H | α-helix | trans | -65.4 | -45.9 | 178.5 | -71.7 | 171.3 | 0 | 0 | 0 | 110.6 | S2092 D2093 R2098 L2099 M2100 L2130 H2144 V2147 L2148 F2151 | S2092-I2096 VanDerWaalsContact O-CB 3.27Å; S2092-I2096 WeakPolarHBondContact O-CB 3.35Å; S2092-I2096 WeakPolarHBondContact O-CD1 3.38Å; S2092-I2096 WeakPolarHBondContact O-CG1 3.33Å; S2092-I2096 PolarHBondContact O-N 3.16Å; D2093-I2096 PolarHBondContact O-N 3.12Å; I2096-R2098 VanDerWaalsContact C-N 3.31Å; I2096-R2098 PolarHBondContact O-N 3.14Å; I2096-L2099 PolarHBondContact O-N 3.05Å; I2096-M2100 PolarHBondContact O-N 3.3Å; I2096-L2130 HydrophobicContact CG1-CD2 4.03Å; I2096-H2144 HydrophobicContact CD1-CB 3.56Å; I2096-V2147 HydrophobicContact CG2-CB 4.27Å; I2096-V2147 HydrophobicContact CG2-CG1 3.5Å; I2096-V2147 VanDerWaalsContact CG2-CG1 3.49Å; I2096-L2148 HydrophobicContact CD1-CD2 3.95Å; I2096-L2148 HydrophobicContact CD1-CG 4.47Å; I2096-L2148 HydrophobicContact CG1-CD2 4.31Å; I2096-F2151 HydrophobicContact CB-CE2 4.39Å; I2096-F2151 HydrophobicContact CG1-CE2 4.4Å; I2096-F2151 HydrophobicContact CG2-CE2 3.93Å; I2096-F2151 HydrophobicContact CG2-CZ 4.16Å; I2096-F2151 WeakPolarHBondContact O-CZ 3.4Å |
| 2097 | R | 94.8 | Very high | 92.9 | Very high | 134.5 Ų | 134.5 | 39.7 Ų | 39.7 | 51% | 0.508 | 19% | 0.187 | S | C | . | . | H | α-helix | trans | -61.4 | -41 | 176.7 | -171.6 | -175.5 | -56.9 | 172 | 1.5 | 111.9 | D2093 M2100 H2101 P2786 | D2093-R2097 WeakPolarHBondContact O-CB 3.33Å; D2093-R2097 PolarHBondContact O-N 3.17Å; D2093-R2097 IonicContact OD1-CZ 3.8Å; D2093-R2097 IonicContact OD1-NE 2.95Å; D2093-R2097 PolarHBondContact OD1-NE 3.41Å; D2093-R2097 IonicContact OD1-NH2 3.5Å; D2093-R2097 PolarHBondContact OD1-NH2 3.09Å; D2093-R2097 IonicContact OD2-CZ 3.22Å; D2093-R2097 IonicContact OD2-NE 3.74Å; D2093-R2097 IonicContact OD2-NH1 2.98Å; D2093-R2097 IonicContact OD2-NH2 3.35Å; D2093-R2097 PolarHBondContact OD2-NH2 3.14Å; R2097-M2100 PolarHBondContact O-N 3.19Å; R2097-H2101 WeakPolarHBondContact O-CB 3.39Å; R2097-H2101 PolarHBondContact O-N 3.09Å; R2097-P2786 HydrophobicContact CB-CG 4.32Å; R2097-P2786 HydrophobicContact CG-CG 4.02Å |
| 2098 | R | 94.5 | Very high | 92.7 | Very high | 55.25 Ų | 55.25 | 44.8 Ų | 44.8 | 21% | 0.208 | 21% | 0.213 | C | C | . | . | H | α-helix | trans | -64.6 | -43.1 | 177.7 | -120 | 172.1 | -164.8 | -176.1 | 1.3 | 112 | D2053 L2056 D2057 I2060 I2094 L2095 I2096 H2101 L2102 L2126 | D2053-R2098 PolarHBondContact O-NH2 2.91Å; D2053-R2098 IonicContact OD1-CZ 3.36Å; D2053-R2098 IonicContact OD1-NE 3.18Å; D2053-R2098 IonicContact OD1-NH2 3.25Å; D2053-R2098 PolarHBondContact OD1-NH2 3.17Å; L2056-R2098 PolarHBondContact O-NH1 2.95Å; D2057-R2098 VanDerWaalsContact CA-NH1 3.27Å; D2057-R2098 IonicContact OD1-CZ 3.25Å; D2057-R2098 IonicContact OD1-NH1 3.07Å; D2057-R2098 PolarHBondContact OD1-NH1 3.11Å; D2057-R2098 IonicContact OD1-NH2 3.38Å; D2057-R2098 PolarHBondContact OD1-NH2 3.32Å; I2060-R2098 VanDerWaalsContact CD1-NH1 3.26Å; I2094-R2098 VanDerWaalsContact O-CB 3.25Å; I2094-R2098 WeakPolarHBondContact O-CB 3.36Å; I2094-R2098 VanDerWaalsContact O-CG 3.23Å; I2094-R2098 WeakPolarHBondContact O-CG 3.31Å; I2094-R2098 PolarHBondContact O-N 3.07Å; I2094-R2098 VanDerWaalsContact O-N 3.08Å; L2095-R2098 PolarHBondContact O-N 3.37Å; I2096-R2098 VanDerWaalsContact C-N 3.31Å; I2096-R2098 PolarHBondContact O-N 3.14Å; R2098-H2101 PolarHBondContact O-N 3.18Å; R2098-L2102 WeakPolarHBondContact O-CG 3.36Å; R2098-L2102 PolarHBondContact O-N 3.39Å; R2098-L2102 VanDerWaalsContact O-N 3.1Å; R2098-L2126 HydrophobicContact CB-CD1 4.19Å; R2098-L2126 HydrophobicContact CG-CD1 4.18Å |
| 2099 | L | 95 | Very high | 92.4 | Very high | 0.5 Ų | 0.5 | 46.4 Ų | 46.4 | 0% | 0.003 | 22% | 0.22 | C | C | . | . | H | α-helix | trans | -65.2 | -42.6 | 176.1 | -178.8 | 56.1 | 0 | 0 | 0 | 111.7 | L2095 I2096 H2101 L2102 L2103 I2123 L2126 L2130 F2151 | L2095-L2099 PolarHBondContact O-N 3.24Å; I2096-L2099 PolarHBondContact O-N 3.05Å; L2099-H2101 VanDerWaalsContact C-N 3.33Å; L2099-H2101 PolarHBondContact O-N 3.1Å; L2099-L2102 PolarHBondContact O-N 3.22Å; L2099-L2103 HydrophobicContact CD1-CG 4.49Å; L2099-L2103 WeakPolarHBondContact O-CG 3.32Å; L2099-L2103 PolarHBondContact O-N 3.01Å; L2099-I2123 HydrophobicContact CD1-CB 4.4Å; L2099-I2123 HydrophobicContact CD1-CG1 4.4Å; L2099-I2123 HydrophobicContact CD1-CG2 4.08Å; L2099-L2126 HydrophobicContact CB-CB 4.33Å; L2099-L2126 HydrophobicContact CB-CD1 4Å; L2099-L2126 HydrophobicContact CD1-CB 4.07Å; L2099-L2126 HydrophobicContact CD1-CD1 4.32Å; L2099-L2130 HydrophobicContact CD2-CD1 3.56Å; L2099-F2151 HydrophobicContact CB-CE1 4.42Å; L2099-F2151 HydrophobicContact CB-CE2 4.19Å; L2099-F2151 HydrophobicContact CB-CZ 3.95Å; L2099-F2151 HydrophobicContact CD2-CB 4.45Å; L2099-F2151 HydrophobicContact CD2-CD1 4.14Å; L2099-F2151 HydrophobicContact CD2-CD2 3.66Å; L2099-F2151 HydrophobicContact CD2-CE1 4.24Å; L2099-F2151 HydrophobicContact CD2-CE2 3.75Å; L2099-F2151 HydrophobicContact CD2-CG 3.86Å; L2099-F2151 HydrophobicContact CD2-CZ 4.04Å; L2099-F2151 HydrophobicContact CG-CD1 4.29Å; L2099-F2151 HydrophobicContact CG-CD2 4.43Å; L2099-F2151 HydrophobicContact CG-CE1 4.02Å; L2099-F2151 HydrophobicContact CG-CE2 4.14Å; L2099-F2151 HydrophobicContact CG-CG 4.46Å; L2099-F2151 HydrophobicContact CG-CZ 3.93Å |
| 2100 | M | 94.9 | Very high | 92.1 | Very high | 18.5 Ų | 18.5 | 42 Ų | 42 | 9% | 0.091 | 20% | 0.203 | C | C | . | . | H | α-helix | trans | -58.2 | -45.8 | 175.2 | -172.2 | 60.2 | 73.9 | 0 | 0 | 111.4 | I2096 R2097 L2102 L2103 E2104 V2147 F2151 L2288 F2292 | I2096-M2100 PolarHBondContact O-N 3.3Å; R2097-M2100 PolarHBondContact O-N 3.19Å; M2100-L2102 VanDerWaalsContact C-N 3.34Å; M2100-L2102 PolarHBondContact O-N 2.96Å; M2100-L2103 PolarHBondContact O-N 3.19Å; M2100-E2104 WeakPolarHBondContact O-CG 3.35Å; M2100-E2104 PolarHBondContact O-N 3.13Å; M2100-V2147 HydrophobicContact CE-CG1 3.6Å; M2100-F2151 HydrophobicContact CB-CE1 4.29Å; M2100-F2151 HydrophobicContact CB-CZ 4.16Å; M2100-F2151 HydrophobicContact CE-CD1 4.5Å; M2100-F2151 HydrophobicContact CE-CE1 3.62Å; M2100-F2151 HydrophobicContact CE-CZ 4.05Å; M2100-F2151 HydrophobicContact SD-CE1 4.21Å; M2100-L2288 HydrophobicContact CE-CD2 4.23Å; M2100-F2292 HydrophobicContact SD-CE2 3.67Å; M2100-F2292 HydrophobicContact SD-CZ 3.81Å |
| 2101 | H | 93.8 | Very high | 91.8 | Very high | 94 Ų | 94 | 42 Ų | 42 | 44% | 0.435 | 20% | 0.201 | S | C | . | . | H | α-helix | trans | -62 | -37.9 | 178.1 | -173.1 | 61 | 0 | 0 | 0 | 113.1 | R2097 R2098 L2099 E2104 K2105 | R2097-H2101 WeakPolarHBondContact O-CB 3.39Å; R2097-H2101 PolarHBondContact O-N 3.09Å; R2098-H2101 PolarHBondContact O-N 3.18Å; L2099-H2101 VanDerWaalsContact C-N 3.33Å; L2099-H2101 PolarHBondContact O-N 3.1Å; H2101-E2104 PolarHBondContact O-N 3.01Å; H2101-K2105 VanDerWaalsContact NE2-CE 3.26Å; H2101-K2105 WeakPolarHBondContact NE2-CE 3.46Å; H2101-K2105 PolarHBondContact NE2-NZ 3.17Å; H2101-K2105 VanDerWaalsContact O-CB 3.27Å; H2101-K2105 WeakPolarHBondContact O-CB 3.22Å; H2101-K2105 WeakPolarHBondContact O-CG 3.49Å; H2101-K2105 PolarHBondContact O-N 3.34Å |
| 2102 | L | 92.7 | Very high | 91.2 | Very high | 21.75 Ų | 21.75 | 46.8 Ų | 46.8 | 11% | 0.114 | 23% | 0.23 | C | C | . | . | H | α-helix | trans | -66.9 | -39.5 | 174.9 | -70.2 | 177.4 | 0 | 0 | 0 | 112.2 | R2098 L2099 M2100 K2105 S2106 L2119 D2122 I2123 L2126 | R2098-L2102 WeakPolarHBondContact O-CG 3.36Å; R2098-L2102 PolarHBondContact O-N 3.39Å; R2098-L2102 VanDerWaalsContact O-N 3.1Å; L2099-L2102 PolarHBondContact O-N 3.22Å; M2100-L2102 VanDerWaalsContact C-N 3.34Å; M2100-L2102 PolarHBondContact O-N 2.96Å; L2102-K2105 PolarHBondContact O-N 2.81Å; L2102-S2106 PolarHBondContact O-N 2.91Å; L2102-L2119 HydrophobicContact CD2-CB 4.49Å; L2102-L2119 HydrophobicContact CD2-CD1 4.2Å; L2102-L2119 HydrophobicContact CD2-CD2 4.34Å; L2102-L2119 HydrophobicContact CD2-CG 4.46Å; L2102-D2122 HydrophobicContact CD1-CB 3.68Å; L2102-D2122 HydrophobicContact CD2-CB 4.5Å; L2102-I2123 HydrophobicContact CB-CD1 4.48Å; L2102-I2123 HydrophobicContact CB-CG1 3.98Å; L2102-I2123 HydrophobicContact CD1-CG1 4.38Å; L2102-L2126 HydrophobicContact CD1-CD1 3.62Å |
| 2103 | L | 92.5 | Very high | 90.7 | Very high | 0 Ų | 0 | 48.7 Ų | 48.7 | 0% | 0 | 24% | 0.243 | C | C | . | . | H | α-helix | trans | -64.5 | -43.8 | 174.2 | -69.2 | 176.2 | 0 | 0 | 0 | 111.3 | L2099 M2100 K2105 S2106 L2114 I2123 F2151 V2154 F2292 L2300 | L2099-L2103 HydrophobicContact CD1-CG 4.49Å; L2099-L2103 WeakPolarHBondContact O-CG 3.32Å; L2099-L2103 PolarHBondContact O-N 3.01Å; M2100-L2103 PolarHBondContact O-N 3.19Å; L2103-K2105 VanDerWaalsContact C-N 3.33Å; L2103-K2105 PolarHBondContact O-N 3.11Å; L2103-S2106 WeakPolarHBondContact O-CB 3.41Å; L2103-S2106 PolarHBondContact O-N 3.33Å; L2103-S2106 PolarHBondContact O-OG 3.27Å; L2103-L2114 HydrophobicContact CD2-CD2 4.33Å; L2103-I2123 HydrophobicContact CD2-CD1 4.12Å; L2103-I2123 HydrophobicContact CD2-CG2 4.37Å; L2103-F2151 HydrophobicContact CD1-CD1 3.65Å; L2103-F2151 HydrophobicContact CD1-CE1 3.76Å; L2103-V2154 HydrophobicContact CD1-CG1 4.12Å; L2103-V2154 HydrophobicContact CD2-CG1 3.84Å; L2103-F2292 HydrophobicContact CB-CE1 4.13Å; L2103-F2292 HydrophobicContact CB-CZ 4.05Å; L2103-L2300 HydrophobicContact CD2-CD1 4.43Å |
| 2104 | E | 91.1 | Very high | 90.4 | Very high | 49.5 Ų | 49.5 | 47.2 Ų | 47.2 | 23% | 0.231 | 24% | 0.235 | C | C | . | . | H | α-helix | trans | -62 | -41.6 | 174.4 | -72.6 | -177.2 | -172.3 | 0 | 0 | 112.3 | M2100 H2101 S2106 C2107 H2291 F2292 | M2100-E2104 WeakPolarHBondContact O-CG 3.35Å; M2100-E2104 PolarHBondContact O-N 3.13Å; H2101-E2104 PolarHBondContact O-N 3.01Å; E2104-S2106 VanDerWaalsContact C-N 3.27Å; E2104-S2106 PolarHBondContact O-N 3.21Å; E2104-C2107 VanDerWaalsContact O-CB 3.3Å; E2104-C2107 WeakPolarHBondContact O-CB 3.27Å; E2104-C2107 PolarHBondContact O-N 3.09Å; E2104-C2107 VanDerWaalsContact O-N 3.16Å; E2104-H2291 IonicContact OE1-NE2 3.17Å; E2104-F2292 HydrophobicContact CG-CE1 4.42Å; E2104-F2292 HydrophobicContact CG-CZ 3.9Å |
| 2105 | K | 91.2 | Very high | 90.1 | Very high | 87.75 Ų | 87.75 | 48.5 Ų | 48.5 | 38% | 0.382 | 24% | 0.241 | S | C | . | . | H | α-helix | trans | -64.2 | -30.5 | 175.6 | -101.5 | -177.9 | 170.5 | 179.9 | 0 | 112.6 | H2101 L2102 L2103 C2107 L2108 L2119 | H2101-K2105 VanDerWaalsContact NE2-CE 3.26Å; H2101-K2105 WeakPolarHBondContact NE2-CE 3.46Å; H2101-K2105 PolarHBondContact NE2-NZ 3.17Å; H2101-K2105 VanDerWaalsContact O-CB 3.27Å; H2101-K2105 WeakPolarHBondContact O-CB 3.22Å; H2101-K2105 WeakPolarHBondContact O-CG 3.49Å; H2101-K2105 PolarHBondContact O-N 3.34Å; L2102-K2105 PolarHBondContact O-N 2.81Å; L2103-K2105 VanDerWaalsContact C-N 3.33Å; L2103-K2105 PolarHBondContact O-N 3.11Å; K2105-C2107 PolarHBondContact O-N 3.24Å; K2105-L2108 HydrophobicContact CG-CD1 4.28Å; K2105-L2108 VanDerWaalsContact O-CB 3.3Å; K2105-L2108 WeakPolarHBondContact O-CB 3.4Å; K2105-L2108 PolarHBondContact O-N 3.09Å; K2105-L2119 HydrophobicContact CB-CD1 3.91Å; K2105-L2119 HydrophobicContact CD-CD1 3.95Å; K2105-L2119 HydrophobicContact CG-CD1 3.97Å |
| 2106 | S | 91 | Very high | 89.7 | Confident | 0.5 Ų | 0.5 | 53.8 Ų | 53.8 | 0% | 0.003 | 27% | 0.266 | C | S | . | . | H | α-helix | trans | -63.3 | -21.9 | 175.9 | 79.8 | 0 | 0 | 0 | 0 | 113.2 | L2102 L2103 E2104 L2108 N2109 N2297 | L2102-S2106 PolarHBondContact O-N 2.91Å; L2103-S2106 WeakPolarHBondContact O-CB 3.41Å; L2103-S2106 PolarHBondContact O-N 3.33Å; L2103-S2106 PolarHBondContact O-OG 3.27Å; E2104-S2106 VanDerWaalsContact C-N 3.27Å; E2104-S2106 PolarHBondContact O-N 3.21Å; S2106-L2108 VanDerWaalsContact C-N 3.27Å; S2106-L2108 PolarHBondContact O-N 3.16Å; S2106-N2109 CarbonylContact O-C 3.51Å; S2106-N2109 PolarHBondContact O-N 3.33Å; S2106-N2297 PolarHBondContact O-ND2 2.66Å; S2106-N2297 PolarHBondContact OG-ND2 3.37Å; S2106-N2297 VanDerWaalsContact OG-ND2 3.13Å |
| 2107 | C | 87.1 | Confident | 89.4 | Confident | 19 Ų | 19 | 54.2 Ų | 54.2 | 13% | 0.128 | 27% | 0.267 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -73.9 | -13.1 | 173.3 | -57.1 | 0 | 0 | 0 | 0 | 113.4 | E2104 K2105 R2295 N2297 | E2104-C2107 VanDerWaalsContact O-CB 3.3Å; E2104-C2107 WeakPolarHBondContact O-CB 3.27Å; E2104-C2107 PolarHBondContact O-N 3.09Å; E2104-C2107 VanDerWaalsContact O-N 3.16Å; K2105-C2107 PolarHBondContact O-N 3.24Å; C2107-R2295 HydrophobicContact CB-CB 4.3Å; C2107-N2297 HydrophobicContact CB-CB 4.43Å; C2107-N2297 PolarHBondContact SG-ND2 3.22Å; C2107-N2297 VanDerWaalsContact SG-ND2 3.37Å |
| 2108 | L | 87.6 | Confident | 89.2 | Confident | 141 Ų | 141 | 54.4 Ų | 54.4 | 74% | 0.738 | 28% | 0.277 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -79.1 | -30 | 177.1 | -59.6 | 175.6 | 0 | 0 | 0 | 112.4 | K2105 S2106 | K2105-L2108 HydrophobicContact CG-CD1 4.28Å; K2105-L2108 VanDerWaalsContact O-CB 3.3Å; K2105-L2108 WeakPolarHBondContact O-CB 3.4Å; K2105-L2108 PolarHBondContact O-N 3.09Å; S2106-L2108 VanDerWaalsContact C-N 3.27Å; S2106-L2108 PolarHBondContact O-N 3.16Å |
| 2109 | N | 85.2 | Confident | 89.1 | Confident | 80.25 Ų | 80.25 | 53.3 Ų | 53.3 | 43% | 0.429 | 28% | 0.275 | S | S | . | . | S | Bend | trans | -129.4 | 68.4 | 176.5 | -172.1 | 13.6 | 0 | 0 | 0 | 110.7 | S2106 Q2111 H2117 | S2106-N2109 CarbonylContact O-C 3.51Å; S2106-N2109 PolarHBondContact O-N 3.33Å; N2109-Q2111 PolarHBondContact O-N 3.2Å; N2109-Q2111 PolarHBondContact OD1-NE2 3.11Å; N2109-H2117 PolarHBondContact O-CD2 2.88Å; N2109-H2117 PolarHBondContact O-NE2 3.32Å |
| 2110 | P | 83 | Confident | 88.9 | Confident | 40 Ų | 40 | 54.4 Ų | 54.4 | 26% | 0.26 | 28% | 0.279 | S | S | . | . | trans | -61.8 | 134.2 | -169.5 | 25 | -34.4 | 0 | 0 | 0 | 112.4 | F2296 | P2110-F2296 HydrophobicContact CB-CD1 4.13Å; P2110-F2296 HydrophobicContact CB-CE1 4.11Å; P2110-F2296 HydrophobicContact CG-CD1 3.79Å; P2110-F2296 HydrophobicContact CG-CE1 3.8Å | ||
| 2111 | Q | 85.7 | Confident | 88.6 | Confident | 64.75 Ų | 64.75 | 57.8 Ų | 57.8 | 30% | 0.303 | 30% | 0.298 | S | S | . | . | trans | -117.6 | 162.5 | 174.1 | -63.9 | -58 | -43.1 | 0 | 0 | 110.6 | N2109 C2113 E2116 H2117 A2299 | N2109-Q2111 PolarHBondContact O-N 3.2Å; N2109-Q2111 PolarHBondContact OD1-NE2 3.11Å; Q2111-C2113 VanDerWaalsContact C-N 3.33Å; Q2111-C2113 PolarHBondContact O-N 3.18Å; Q2111-E2116 HydrophobicContact CB-CB 4.42Å; Q2111-H2117 HydrophobicContact CG-CB 4.28Å; Q2111-A2299 PolarHBondContact O-N 3.42Å | ||
| 2112 | T | 82.3 | Confident | 88.5 | Confident | 98.75 Ų | 98.75 | 55.1 Ų | 55.1 | 61% | 0.606 | 29% | 0.287 | S | S | * | . | S | Bend | trans | -68.2 | -35.6 | 178.5 | 56.1 | 0 | 0 | 0 | 0 | 112.5 | E2116 | T2112-E2116 PolarHBondContact OG1-OE2 3.39Å; T2112-E2116 VanDerWaalsContact OG1-OE2 3.09Å |
| 2113 | C | 84.4 | Confident | 88.6 | Confident | 40.5 Ų | 40.5 | 54.1 Ų | 54.1 | 27% | 0.274 | 28% | 0.281 | S | S | . | . | S | Bend | trans | -124.6 | 141.3 | 174.2 | -64.9 | 0 | 0 | 0 | 0 | 109.6 | Q2111 E2115 E2116 | Q2111-C2113 VanDerWaalsContact C-N 3.33Å; Q2111-C2113 PolarHBondContact O-N 3.18Å; C2113-E2115 PolarHBondContact O-N 3.1Å; C2113-E2116 HydrophobicContact CB-CG 4.12Å; C2113-E2116 PolarHBondContact N-OE2 3.42Å; C2113-E2116 VanDerWaalsContact N-OE2 3.08Å; C2113-E2116 WeakPolarHBondContact O-CB 3.42Å; C2113-E2116 PolarHBondContact O-N 3.29Å; C2113-E2116 VanDerWaalsContact O-N 3.15Å |
| 2114 | L | 87.7 | Confident | 88.5 | Confident | 11 Ų | 11 | 54.1 Ų | 54.1 | 6% | 0.058 | 28% | 0.281 | C | S | . | . | G | 310 helix | trans | -63 | -27.1 | 178.2 | -168.1 | 63.8 | 0 | 0 | 0 | 112.2 | L2103 E2116 H2117 W2120 I2123 V2154 L2155 A2299 L2300 | L2103-L2114 HydrophobicContact CD2-CD2 4.33Å; L2114-E2116 VanDerWaalsContact C-N 3.28Å; L2114-E2116 PolarHBondContact O-N 3.11Å; L2114-H2117 VanDerWaalsContact O-CB 3.3Å; L2114-H2117 WeakPolarHBondContact O-CB 3.32Å; L2114-H2117 PolarHBondContact O-N 3.03Å; L2114-W2120 HydrophobicContact CB-CE3 4.43Å; L2114-W2120 HydrophobicContact CB-CZ3 4.45Å; L2114-W2120 HydrophobicContact CD2-CE3 4.35Å; L2114-W2120 HydrophobicContact CD2-CZ3 4.06Å; L2114-W2120 HydrophobicContact CG-CE3 3.99Å; L2114-W2120 HydrophobicContact CG-CZ3 4.14Å; L2114-I2123 HydrophobicContact CD1-CD1 4.14Å; L2114-I2123 HydrophobicContact CD2-CG2 4.4Å; L2114-I2123 HydrophobicContact CG-CD1 4.47Å; L2114-V2154 HydrophobicContact CD2-CG1 4.4Å; L2114-L2155 HydrophobicContact CD2-CD2 3.95Å; L2114-A2299 HydrophobicContact CB-CB 4.18Å; L2114-L2300 HydrophobicContact CD1-CD2 4.4Å; L2114-L2300 HydrophobicContact CD2-CD2 4.18Å |
| 2115 | E | 87.1 | Confident | 88.5 | Confident | 53.75 Ų | 53.75 | 52 Ų | 52 | 25% | 0.251 | 27% | 0.272 | S | S | . | . | G | 310 helix | trans | -68.6 | -20.7 | 177.6 | -62 | 173.2 | -151 | 0 | 0 | 114.2 | C2113 H2117 W2120 G2159 R2249 | C2113-E2115 PolarHBondContact O-N 3.1Å; E2115-H2117 VanDerWaalsContact C-N 3.3Å; E2115-W2120 HydrophobicContact CB-CD2 4.3Å; E2115-W2120 HydrophobicContact CB-CG 4.49Å; E2115-W2120 HydrophobicContact CG-CD2 4.2Å; E2115-W2120 HydrophobicContact CG-CE3 4.38Å; E2115-W2120 HydrophobicContact CG-CH2 4.04Å; E2115-W2120 HydrophobicContact CG-CZ2 3.85Å; E2115-W2120 HydrophobicContact CG-CZ3 4.31Å; E2115-G2159 VanDerWaalsContact CD-N 3.25Å; E2115-G2159 VanDerWaalsContact OE1-CA 3.31Å; E2115-G2159 WeakPolarHBondContact OE1-CA 3.4Å; E2115-G2159 PolarHBondContact OE1-N 3.06Å; E2115-R2249 VanDerWaalsContact CD-NH1 3.3Å; E2115-R2249 IonicContact OE1-CZ 3.47Å; E2115-R2249 IonicContact OE1-NH1 3.12Å; E2115-R2249 PolarHBondContact OE1-NH1 3.09Å; E2115-R2249 VanDerWaalsContact OE1-NH1 3.15Å; E2115-R2249 IonicContact OE1-NH2 3.52Å; E2115-R2249 PolarHBondContact OE1-NH2 3.02Å; E2115-R2249 IonicContact OE2-CZ 3.26Å; E2115-R2249 VanDerWaalsContact OE2-CZ 3.32Å; E2115-R2249 IonicContact OE2-NH1 3.37Å; E2115-R2249 PolarHBondContact OE2-NH1 2.95Å; E2115-R2249 VanDerWaalsContact OE2-NH1 3.12Å; E2115-R2249 IonicContact OE2-NH2 3.57Å; E2115-R2249 PolarHBondContact OE2-NH2 3.33Å |
| 2116 | E | 85.9 | Confident | 88.7 | Confident | 114 Ų | 114 | 48 Ų | 48 | 53% | 0.533 | 25% | 0.254 | S | S | . | . | G | 310 helix | trans | -89.4 | -7.5 | 178.6 | -64.2 | 167.6 | 165.1 | 0 | 0 | 111.5 | Q2111 T2112 C2113 L2114 | Q2111-E2116 HydrophobicContact CB-CB 4.42Å; T2112-E2116 PolarHBondContact OG1-OE2 3.39Å; T2112-E2116 VanDerWaalsContact OG1-OE2 3.09Å; C2113-E2116 HydrophobicContact CB-CG 4.12Å; C2113-E2116 PolarHBondContact N-OE2 3.42Å; C2113-E2116 VanDerWaalsContact N-OE2 3.08Å; C2113-E2116 WeakPolarHBondContact O-CB 3.42Å; C2113-E2116 PolarHBondContact O-N 3.29Å; C2113-E2116 VanDerWaalsContact O-N 3.15Å; L2114-E2116 VanDerWaalsContact C-N 3.28Å; L2114-E2116 PolarHBondContact O-N 3.11Å |
| 2117 | H | 90.4 | Very high | 88.8 | Confident | 12.75 Ų | 12.75 | 48.2 Ų | 48.2 | 6% | 0.059 | 26% | 0.257 | C | S | . | . | S | Bend | trans | -77.2 | 142.1 | -178.3 | -165.6 | -89.7 | 0 | 0 | 0 | 111.2 | N2109 Q2111 L2114 E2115 L2119 W2120 | N2109-H2117 PolarHBondContact O-CD2 2.88Å; N2109-H2117 PolarHBondContact O-NE2 3.32Å; Q2111-H2117 HydrophobicContact CG-CB 4.28Å; L2114-H2117 VanDerWaalsContact O-CB 3.3Å; L2114-H2117 WeakPolarHBondContact O-CB 3.32Å; L2114-H2117 PolarHBondContact O-N 3.03Å; E2115-H2117 VanDerWaalsContact C-N 3.3Å; H2117-L2119 VanDerWaalsContact CE1-CG 3.48Å; H2117-L2119 WeakPolarHBondContact CE1-CG 3.44Å; H2117-L2119 WeakPolarHBondContact ND1-CB 3.4Å; H2117-L2119 PolarHBondContact ND1-N 3.06Å; H2117-L2119 VanDerWaalsContact ND1-N 3.14Å; H2117-L2119 PolarHBondContact O-N 3.24Å; H2117-L2119 VanDerWaalsContact O-N 3.1Å; H2117-W2120 WeakPolarHBondContact O-CB 3.27Å; H2117-W2120 PolarHBondContact O-N 3.12Å |
| 2118 | I | 90.7 | Very high | 89 | Confident | 139 Ų | 139 | 47.7 Ų | 47.7 | 71% | 0.713 | 25% | 0.252 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -59.2 | -25.3 | -179.6 | 0.5 | 171 | 0 | 0 | 0 | 113.3 | W2120 | I2118-W2120 VanDerWaalsContact C-N 3.32Š|
| 2119 | L | 91.6 | Very high | 89.3 | Confident | 32.25 Ų | 32.25 | 41 Ų | 41 | 17% | 0.169 | 22% | 0.217 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -89.9 | 6.3 | 177.3 | -54.6 | 175.9 | 0 | 0 | 0 | 113.4 | L2102 K2105 H2117 D2121 D2122 I2123 | L2102-L2119 HydrophobicContact CD2-CB 4.49Å; L2102-L2119 HydrophobicContact CD2-CD1 4.2Å; L2102-L2119 HydrophobicContact CD2-CD2 4.34Å; L2102-L2119 HydrophobicContact CD2-CG 4.46Å; K2105-L2119 HydrophobicContact CB-CD1 3.91Å; K2105-L2119 HydrophobicContact CD-CD1 3.95Å; K2105-L2119 HydrophobicContact CG-CD1 3.97Å; H2117-L2119 VanDerWaalsContact CE1-CG 3.48Å; H2117-L2119 WeakPolarHBondContact CE1-CG 3.44Å; H2117-L2119 WeakPolarHBondContact ND1-CB 3.4Å; H2117-L2119 PolarHBondContact ND1-N 3.06Å; H2117-L2119 VanDerWaalsContact ND1-N 3.14Å; H2117-L2119 PolarHBondContact O-N 3.24Å; H2117-L2119 VanDerWaalsContact O-N 3.1Å; L2119-D2121 PolarHBondContact O-N 3.08Å; L2119-D2122 PolarHBondContact O-N 3.27Å; L2119-I2123 HydrophobicContact CB-CD1 4.33Å; L2119-I2123 WeakPolarHBondContact O-CD1 3.29Å; L2119-I2123 VanDerWaalsContact O-CG1 3.3Å; L2119-I2123 WeakPolarHBondContact O-CG1 3.41Å; L2119-I2123 PolarHBondContact O-N 3.28Å; L2119-I2123 VanDerWaalsContact O-N 3.08Å |
| 2120 | W | 91.5 | Very high | 89.7 | Confident | 22.5 Ų | 22.5 | 37.3 Ų | 37.3 | 9% | 0.085 | 20% | 0.197 | C | C | . | . | H | α-helix | trans | -59.4 | -45.3 | -176.1 | 170.5 | -112.9 | 0 | 0 | 0 | 112.4 | L2114 E2115 H2117 I2118 D2122 I2123 A2124 L2155 G2159 L2163 | L2114-W2120 HydrophobicContact CB-CE3 4.43Å; L2114-W2120 HydrophobicContact CB-CZ3 4.45Å; L2114-W2120 HydrophobicContact CD2-CE3 4.35Å; L2114-W2120 HydrophobicContact CD2-CZ3 4.06Å; L2114-W2120 HydrophobicContact CG-CE3 3.99Å; L2114-W2120 HydrophobicContact CG-CZ3 4.14Å; E2115-W2120 HydrophobicContact CB-CD2 4.3Å; E2115-W2120 HydrophobicContact CB-CG 4.49Å; E2115-W2120 HydrophobicContact CG-CD2 4.2Å; E2115-W2120 HydrophobicContact CG-CE3 4.38Å; E2115-W2120 HydrophobicContact CG-CH2 4.04Å; E2115-W2120 HydrophobicContact CG-CZ2 3.85Å; E2115-W2120 HydrophobicContact CG-CZ3 4.31Å; H2117-W2120 WeakPolarHBondContact O-CB 3.27Å; H2117-W2120 PolarHBondContact O-N 3.12Å; I2118-W2120 VanDerWaalsContact C-N 3.32Å; W2120-D2122 VanDerWaalsContact C-N 3.3Å; W2120-D2122 PolarHBondContact O-N 3.33Å; W2120-I2123 HydrophobicContact CZ3-CG2 4.48Å; W2120-I2123 PolarHBondContact O-N 2.98Å; W2120-A2124 HydrophobicContact CD2-CB 4.48Å; W2120-A2124 HydrophobicContact CH2-CB 4.46Å; W2120-A2124 HydrophobicContact CZ2-CB 4.09Å; W2120-A2124 VanDerWaalsContact O-CB 3.31Å; W2120-A2124 WeakPolarHBondContact O-CB 3.36Å; W2120-A2124 PolarHBondContact O-N 2.99Å; W2120-L2155 HydrophobicContact CZ3-CD2 4.42Å; W2120-G2159 VanDerWaalsContact CZ2-CA 3.5Å; W2120-L2163 HydrophobicContact CH2-CD2 3.4Å; W2120-L2163 VanDerWaalsContact CH2-CD2 3.42Å; W2120-L2163 HydrophobicContact CZ2-CD2 3.47Å; W2120-L2163 VanDerWaalsContact CZ2-CD2 3.47Å; W2120-L2163 HydrophobicContact CZ3-CD2 4.47Å |
| 2121 | D | 88.8 | Confident | 90.2 | Very high | 90.5 Ų | 90.5 | 35.5 Ų | 35.5 | 48% | 0.484 | 19% | 0.185 | S | C | . | . | H | α-helix | trans | -61.8 | -40.8 | -178.6 | -69.4 | -32.9 | 0 | 0 | 0 | 111.3 | L2119 A2124 L2125 | L2119-D2121 PolarHBondContact O-N 3.08Å; D2121-A2124 PolarHBondContact O-N 3.04Å; D2121-L2125 WeakPolarHBondContact O-CB 3.39Å; D2121-L2125 PolarHBondContact O-N 3.13Å |
| 2122 | D | 92 | Very high | 90.5 | Very high | 37.5 Ų | 37.5 | 33.4 Ų | 33.4 | 20% | 0.201 | 18% | 0.175 | C | C | . | . | H | α-helix | trans | -64.3 | -43.3 | 176.2 | -62.8 | 11.3 | 0 | 0 | 0 | 111.8 | I2064 L2102 L2119 W2120 L2125 L2126 | I2064-D2122 HydrophobicContact CD1-CB 4.5Å; I2064-D2122 VanDerWaalsContact CD1-OD1 3.24Å; I2064-D2122 WeakPolarHBondContact CD1-OD1 3.37Å; I2064-D2122 WeakPolarHBondContact CG1-OD1 3.43Å; L2102-D2122 HydrophobicContact CD1-CB 3.68Å; L2102-D2122 HydrophobicContact CD2-CB 4.5Å; L2119-D2122 PolarHBondContact O-N 3.27Å; W2120-D2122 VanDerWaalsContact C-N 3.3Å; W2120-D2122 PolarHBondContact O-N 3.33Å; D2122-L2125 PolarHBondContact O-N 3.26Å; D2122-L2126 WeakPolarHBondContact O-CB 3.38Å; D2122-L2126 WeakPolarHBondContact O-CG 3.23Å; D2122-L2126 PolarHBondContact O-N 3.02Å |
| 2123 | I | 93 | Very high | 91.1 | Very high | 0 Ų | 0 | 28.7 Ų | 28.7 | 0% | 0 | 15% | 0.146 | C | C | . | . | H | α-helix | trans | -64.6 | -47.8 | 177.4 | -70.1 | 165.6 | 0 | 0 | 0 | 110.4 | L2099 L2102 L2103 L2114 L2119 W2120 L2125 L2126 A2127 L2155 | L2099-I2123 HydrophobicContact CD1-CB 4.4Å; L2099-I2123 HydrophobicContact CD1-CG1 4.4Å; L2099-I2123 HydrophobicContact CD1-CG2 4.08Å; L2102-I2123 HydrophobicContact CB-CD1 4.48Å; L2102-I2123 HydrophobicContact CB-CG1 3.98Å; L2102-I2123 HydrophobicContact CD1-CG1 4.38Å; L2103-I2123 HydrophobicContact CD2-CD1 4.12Å; L2103-I2123 HydrophobicContact CD2-CG2 4.37Å; L2114-I2123 HydrophobicContact CD1-CD1 4.14Å; L2114-I2123 HydrophobicContact CD2-CG2 4.4Å; L2114-I2123 HydrophobicContact CG-CD1 4.47Å; L2119-I2123 HydrophobicContact CB-CD1 4.33Å; L2119-I2123 WeakPolarHBondContact O-CD1 3.29Å; L2119-I2123 VanDerWaalsContact O-CG1 3.3Å; L2119-I2123 WeakPolarHBondContact O-CG1 3.41Å; L2119-I2123 PolarHBondContact O-N 3.28Å; L2119-I2123 VanDerWaalsContact O-N 3.08Å; W2120-I2123 HydrophobicContact CZ3-CG2 4.48Å; W2120-I2123 PolarHBondContact O-N 2.98Å; I2123-L2125 VanDerWaalsContact C-N 3.32Å; I2123-L2125 PolarHBondContact O-N 3.03Å; I2123-L2126 PolarHBondContact O-N 3.17Å; I2123-A2127 WeakPolarHBondContact O-CB 3.36Å; I2123-A2127 PolarHBondContact O-N 3.06Å; I2123-L2155 HydrophobicContact CG2-CD2 3.78Å |
| 2124 | A | 91.2 | Very high | 91.5 | Very high | 0 Ų | 0 | 26.8 Ų | 26.8 | 0% | 0 | 13% | 0.133 | C | C | . | . | H | α-helix | trans | -63.7 | -39.5 | 179 | 0 | 0 | 0 | 0 | 0 | 111.5 | L2068 W2120 D2121 A2127 R2128 L2163 | L2068-A2124 HydrophobicContact CD1-CB 4.14Å; L2068-A2124 HydrophobicContact CD2-CB 3.81Å; W2120-A2124 HydrophobicContact CD2-CB 4.48Å; W2120-A2124 HydrophobicContact CH2-CB 4.46Å; W2120-A2124 HydrophobicContact CZ2-CB 4.09Å; W2120-A2124 VanDerWaalsContact O-CB 3.31Å; W2120-A2124 WeakPolarHBondContact O-CB 3.36Å; W2120-A2124 PolarHBondContact O-N 2.99Å; D2121-A2124 PolarHBondContact O-N 3.04Å; A2124-A2127 PolarHBondContact O-N 3.11Å; A2124-R2128 WeakPolarHBondContact O-CG 3.28Å; A2124-R2128 PolarHBondContact O-N 3.1Å; A2124-R2128 VanDerWaalsContact O-N 3.08Å; A2124-L2163 HydrophobicContact CB-CD1 4.41Å; A2124-L2163 HydrophobicContact CB-CD2 3.87Å |
| 2125 | L | 91.6 | Very high | 91.6 | Very high | 5.75 Ų | 5.75 | 32.2 Ų | 32.2 | 3% | 0.03 | 16% | 0.156 | C | C | . | . | H | α-helix | trans | -65.2 | -47.4 | 176.2 | -179.9 | 71.4 | 0 | 0 | 0 | 111.8 | I2060 S2063 I2064 L2068 A2073 D2121 D2122 I2123 A2127 R2128 Y2129 | I2060-L2125 HydrophobicContact CG2-CD2 4.37Å; S2063-L2125 VanDerWaalsContact CB-CD2 3.45Å; I2064-L2125 HydrophobicContact CG1-CD2 3.71Å; L2068-L2125 HydrophobicContact CD1-CB 4.5Å; A2073-L2125 HydrophobicContact CB-CD1 3.79Å; D2121-L2125 WeakPolarHBondContact O-CB 3.39Å; D2121-L2125 PolarHBondContact O-N 3.13Å; D2122-L2125 PolarHBondContact O-N 3.26Å; I2123-L2125 VanDerWaalsContact C-N 3.32Å; I2123-L2125 PolarHBondContact O-N 3.03Å; L2125-A2127 VanDerWaalsContact C-N 3.31Å; L2125-A2127 PolarHBondContact O-N 3.18Å; L2125-R2128 WeakPolarHBondContact O-CA 3.39Å; L2125-R2128 VanDerWaalsContact O-CB 3.29Å; L2125-R2128 WeakPolarHBondContact O-CB 3.21Å; L2125-R2128 PolarHBondContact O-N 3.1Å; L2125-R2128 VanDerWaalsContact O-N 3.09Å; L2125-Y2129 HydrophobicContact CD1-CD2 4.4Å; L2125-Y2129 HydrophobicContact CD1-CE2 4.01Å; L2125-Y2129 HydrophobicContact CG-CD2 4.33Å; L2125-Y2129 HydrophobicContact CG-CE2 4.12Å; L2125-Y2129 VanDerWaalsContact O-CD2 3.32Å; L2125-Y2129 WeakPolarHBondContact O-CD2 3.32Å; L2125-Y2129 PolarHBondContact O-N 3.29Å |
| 2126 | L | 94.2 | Very high | 91.5 | Very high | 3.5 Ų | 3.5 | 35.1 Ų | 35.1 | 2% | 0.018 | 17% | 0.174 | C | C | . | . | H | α-helix | trans | -64.1 | -36.4 | 176.8 | -80.1 | 178 | 0 | 0 | 0 | 112.3 | I2060 L2095 R2098 L2099 L2102 D2122 I2123 R2128 Y2129 L2130 | I2060-L2126 HydrophobicContact CD1-CD2 3.69Å; I2060-L2126 HydrophobicContact CD1-CG 4.33Å; I2060-L2126 HydrophobicContact CG1-CD2 4.22Å; L2095-L2126 HydrophobicContact CD2-CD2 3.88Å; R2098-L2126 HydrophobicContact CB-CD1 4.19Å; R2098-L2126 HydrophobicContact CG-CD1 4.18Å; L2099-L2126 HydrophobicContact CB-CB 4.33Å; L2099-L2126 HydrophobicContact CB-CD1 4Å; L2099-L2126 HydrophobicContact CD1-CB 4.07Å; L2099-L2126 HydrophobicContact CD1-CD1 4.32Å; L2102-L2126 HydrophobicContact CD1-CD1 3.62Å; D2122-L2126 WeakPolarHBondContact O-CB 3.38Å; D2122-L2126 WeakPolarHBondContact O-CG 3.23Å; D2122-L2126 PolarHBondContact O-N 3.02Å; I2123-L2126 PolarHBondContact O-N 3.17Å; L2126-R2128 VanDerWaalsContact C-N 3.27Å; L2126-R2128 PolarHBondContact O-N 2.9Å; L2126-Y2129 WeakPolarHBondContact O-CB 3.39Å; L2126-Y2129 PolarHBondContact O-N 2.93Å; L2126-Y2129 VanDerWaalsContact O-N 3.14Å; L2126-L2130 WeakPolarHBondContact O-CG 3.37Å; L2126-L2130 PolarHBondContact O-N 3.2Å |
| 2127 | A | 92.9 | Very high | 91.6 | Very high | 6 Ų | 6 | 31.3 Ų | 31.3 | 5% | 0.05 | 16% | 0.157 | C | C | . | . | H | α-helix | trans | -61.9 | -34.1 | 172.3 | 0 | 0 | 0 | 0 | 0 | 112.4 | I2123 A2124 L2125 L2130 L2131 L2155 L2163 | I2123-A2127 WeakPolarHBondContact O-CB 3.36Å; I2123-A2127 PolarHBondContact O-N 3.06Å; A2124-A2127 PolarHBondContact O-N 3.11Å; L2125-A2127 VanDerWaalsContact C-N 3.31Å; L2125-A2127 PolarHBondContact O-N 3.18Å; A2127-L2130 PolarHBondContact O-N 3.35Å; A2127-L2131 PolarHBondContact O-N 3.28Å; A2127-L2131 VanDerWaalsContact O-N 3.14Å; A2127-L2155 HydrophobicContact CB-CD1 3.68Å; A2127-L2163 HydrophobicContact CB-CD1 4.02Å |
| 2128 | R | 91.1 | Very high | 91.6 | Very high | 8.5 Ų | 8.5 | 31.1 Ų | 31.1 | 3% | 0.032 | 16% | 0.157 | C | C | . | . | H | α-helix | trans | -65.1 | -45.5 | 169.9 | -68.7 | -90.8 | -44.9 | 130.5 | 4.2 | 111.7 | L2068 E2074 A2124 L2125 L2126 L2130 L2131 F2132 L2163 S2166 A2223 | L2068-R2128 HydrophobicContact CD1-CG 4.02Å; E2074-R2128 WeakPolarHBondContact OE1-CD 3.27Å; E2074-R2128 IonicContact OE1-CZ 3.14Å; E2074-R2128 IonicContact OE1-NE 3.84Å; E2074-R2128 PolarHBondContact OE1-NE 3.11Å; E2074-R2128 VanDerWaalsContact OE1-NE 3.11Å; E2074-R2128 IonicContact OE1-NH2 2.89Å; E2074-R2128 PolarHBondContact OE1-NH2 2.98Å; E2074-R2128 IonicContact OE2-CZ 3.52Å; E2074-R2128 IonicContact OE2-NE 3.06Å; E2074-R2128 PolarHBondContact OE2-NE 3.37Å; E2074-R2128 IonicContact OE2-NH2 3.15Å; E2074-R2128 PolarHBondContact OE2-NH2 3.03Å; A2124-R2128 WeakPolarHBondContact O-CG 3.28Å; A2124-R2128 PolarHBondContact O-N 3.1Å; A2124-R2128 VanDerWaalsContact O-N 3.08Å; L2125-R2128 WeakPolarHBondContact O-CA 3.39Å; L2125-R2128 VanDerWaalsContact O-CB 3.29Å; L2125-R2128 WeakPolarHBondContact O-CB 3.21Å; L2125-R2128 PolarHBondContact O-N 3.1Å; L2125-R2128 VanDerWaalsContact O-N 3.09Å; L2126-R2128 VanDerWaalsContact C-N 3.27Å; L2126-R2128 PolarHBondContact O-N 2.9Å; R2128-L2130 VanDerWaalsContact C-N 3.3Å; R2128-L2130 PolarHBondContact O-N 3.04Å; R2128-L2131 WeakPolarHBondContact O-CA 3.15Å; R2128-L2131 WeakPolarHBondContact O-CB 3.32Å; R2128-L2131 PolarHBondContact O-N 3.2Å; R2128-L2131 VanDerWaalsContact O-N 3.09Å; R2128-F2132 VanDerWaalsContact O-CD2 3.31Å; R2128-F2132 WeakPolarHBondContact O-CD2 3.36Å; R2128-F2132 PolarHBondContact O-N 2.97Å; R2128-F2132 VanDerWaalsContact O-N 3.13Å; R2128-L2163 HydrophobicContact CG-CD1 4.36Å; R2128-S2166 WeakPolarHBondContact CD-OG 3.42Å; R2128-S2166 PolarHBondContact NH1-OG 3.41Å; R2128-A2223 VanDerWaalsContact CZ-O 3.28Å; R2128-A2223 PolarHBondContact NH1-O 3.23Å; R2128-A2223 PolarHBondContact NH2-O 3.08Å |
| 2129 | Y | 93.9 | Very high | 91.7 | Very high | 0 Ų | 0 | 24.5 Ų | 24.5 | 0% | 0 | 12% | 0.123 | C | C | . | . | H | α-helix | trans | -56.5 | -44.9 | 175.6 | -86 | -122.3 | 0 | 0 | 0 | 111.3 | F2059 S2063 L2076 A2077 A2080 L2095 L2125 L2126 L2131 F2132 L2133 | F2059-Y2129 HydrophobicContact CB-CE1 4.47Å; F2059-Y2129 PolarHBondContact O-OH 3.04Å; S2063-Y2129 PolarHBondContact OG-OH 3.16Å; S2063-Y2129 VanDerWaalsContact OG-OH 3.05Å; L2076-Y2129 VanDerWaalsContact CB-OH 3.3Å; L2076-Y2129 WeakPolarHBondContact CB-OH 3.37Å; A2077-Y2129 HydrophobicContact CB-CD2 3.65Å; A2077-Y2129 HydrophobicContact CB-CE2 3.64Å; A2077-Y2129 HydrophobicContact CB-CG 4.15Å; A2080-Y2129 HydrophobicContact CB-CD1 3.95Å; A2080-Y2129 HydrophobicContact CB-CE1 3.94Å; L2095-Y2129 HydrophobicContact CD1-CD1 4.33Å; L2095-Y2129 HydrophobicContact CD2-CD1 4.23Å; L2125-Y2129 HydrophobicContact CD1-CD2 4.4Å; L2125-Y2129 HydrophobicContact CD1-CE2 4.01Å; L2125-Y2129 HydrophobicContact CG-CD2 4.33Å; L2125-Y2129 HydrophobicContact CG-CE2 4.12Å; L2125-Y2129 VanDerWaalsContact O-CD2 3.32Å; L2125-Y2129 WeakPolarHBondContact O-CD2 3.32Å; L2125-Y2129 PolarHBondContact O-N 3.29Å; L2126-Y2129 WeakPolarHBondContact O-CB 3.39Å; L2126-Y2129 PolarHBondContact O-N 2.93Å; L2126-Y2129 VanDerWaalsContact O-N 3.14Å; Y2129-L2131 VanDerWaalsContact C-N 3.3Å; Y2129-L2131 PolarHBondContact O-N 3.31Å; Y2129-F2132 PolarHBondContact O-N 2.99Å; Y2129-F2132 VanDerWaalsContact O-N 3.12Å; Y2129-L2133 VanDerWaalsContact O-CD1 3.26Å; Y2129-L2133 WeakPolarHBondContact O-CD1 3.3Å; Y2129-L2133 PolarHBondContact O-N 3.02Å |
| 2130 | L | 95.1 | Very high | 91.6 | Very high | 2.25 Ų | 2.25 | 24.5 Ų | 24.5 | 1% | 0.012 | 12% | 0.123 | C | C | . | . | H | α-helix | trans | -60.3 | -37.4 | 175.8 | -66.2 | -177.6 | 0 | 0 | 0 | 112.5 | L2095 I2096 L2099 L2126 A2127 R2128 L2133 S2134 L2139 L2148 F2151 L2170 | L2095-L2130 HydrophobicContact CB-CD2 4.46Å; I2096-L2130 HydrophobicContact CG1-CD2 4.03Å; L2099-L2130 HydrophobicContact CD2-CD1 3.56Å; L2126-L2130 WeakPolarHBondContact O-CG 3.37Å; L2126-L2130 PolarHBondContact O-N 3.2Å; A2127-L2130 PolarHBondContact O-N 3.35Å; R2128-L2130 VanDerWaalsContact C-N 3.3Å; R2128-L2130 PolarHBondContact O-N 3.04Å; L2130-L2133 PolarHBondContact O-N 3.26Å; L2130-S2134 VanDerWaalsContact O-CB 3.29Å; L2130-S2134 WeakPolarHBondContact O-CB 3.23Å; L2130-S2134 PolarHBondContact O-N 3.19Å; L2130-L2139 HydrophobicContact CD2-CD1 4.47Å; L2130-L2139 HydrophobicContact CD2-CD2 3.61Å; L2130-L2148 HydrophobicContact CD1-CD2 4.45Å; L2130-F2151 HydrophobicContact CD1-CD2 3.73Å; L2130-F2151 HydrophobicContact CD1-CE2 4.1Å; L2130-L2170 HydrophobicContact CB-CD1 4.34Å; L2130-L2170 HydrophobicContact CB-CD2 4.35Å |
| 2131 | L | 93.5 | Very high | 91.6 | Very high | 2 Ų | 2 | 23.4 Ų | 23.4 | 1% | 0.01 | 12% | 0.119 | C | C | . | . | H | α-helix | trans | -59.5 | -49.4 | 172 | 174.7 | 72 | 0 | 0 | 0 | 111.3 | A2127 R2128 Y2129 L2133 S2134 S2166 A2223 F2224 | A2127-L2131 PolarHBondContact O-N 3.28Å; A2127-L2131 VanDerWaalsContact O-N 3.14Å; R2128-L2131 WeakPolarHBondContact O-CA 3.15Å; R2128-L2131 WeakPolarHBondContact O-CB 3.32Å; R2128-L2131 PolarHBondContact O-N 3.2Å; R2128-L2131 VanDerWaalsContact O-N 3.09Å; Y2129-L2131 VanDerWaalsContact C-N 3.3Å; Y2129-L2131 PolarHBondContact O-N 3.31Å; L2131-L2133 VanDerWaalsContact C-N 3.31Å; L2131-L2133 PolarHBondContact O-N 3.22Å; L2131-S2134 WeakPolarHBondContact O-CB 3.38Å; L2131-S2134 PolarHBondContact O-N 3.21Å; L2131-S2134 VanDerWaalsContact O-N 3.15Å; L2131-S2134 PolarHBondContact O-OG 3.1Å; L2131-S2166 WeakPolarHBondContact CD2-OG 3.46Å; L2131-A2223 HydrophobicContact CD2-CB 4.25Å; L2131-F2224 HydrophobicContact CD1-CZ 4.31Å; L2131-F2224 HydrophobicContact CD2-CD1 4.49Å; L2131-F2224 HydrophobicContact CD2-CE1 3.97Å; L2131-F2224 HydrophobicContact CD2-CE2 4.36Å; L2131-F2224 HydrophobicContact CD2-CZ 3.96Å; L2131-F2224 HydrophobicContact CG-CE1 4.34Å; L2131-F2224 HydrophobicContact CG-CZ 4.17Å |
| 2132 | F | 92 | Very high | 91.5 | Very high | 20.25 Ų | 20.25 | 20.7 Ų | 20.7 | 9% | 0.089 | 10% | 0.104 | C | C | . | . | H | α-helix | trans | -60.3 | -41.8 | -179 | -83.1 | -86.4 | 0 | 0 | 0 | 112 | E2074 A2077 D2078 V2081 R2128 Y2129 S2134 F2224 | E2074-F2132 VanDerWaalsContact OE2-CE2 3.27Å; E2074-F2132 WeakPolarHBondContact OE2-CE2 3.41Å; E2074-F2132 VanDerWaalsContact OE2-CZ 3.29Å; E2074-F2132 WeakPolarHBondContact OE2-CZ 3.39Å; A2077-F2132 HydrophobicContact CB-CB 4.47Å; A2077-F2132 HydrophobicContact CB-CD2 3.47Å; A2077-F2132 VanDerWaalsContact CB-CD2 3.47Å; A2077-F2132 HydrophobicContact CB-CE2 3.73Å; A2077-F2132 HydrophobicContact CB-CG 4.04Å; A2077-F2132 HydrophobicContact CB-CZ 4.4Å; D2078-F2132 HydrophobicContact CB-CD1 4.06Å; D2078-F2132 HydrophobicContact CB-CE1 3.89Å; V2081-F2132 HydrophobicContact CG2-CB 3.82Å; V2081-F2132 HydrophobicContact CG2-CD1 4.43Å; V2081-F2132 WeakPolarHBondContact CG2-O 3.45Å; R2128-F2132 VanDerWaalsContact O-CD2 3.31Å; R2128-F2132 WeakPolarHBondContact O-CD2 3.36Å; R2128-F2132 PolarHBondContact O-N 2.97Å; R2128-F2132 VanDerWaalsContact O-N 3.13Å; Y2129-F2132 PolarHBondContact O-N 2.99Å; Y2129-F2132 VanDerWaalsContact O-N 3.12Å; F2132-S2134 VanDerWaalsContact C-N 3.32Å; F2132-S2134 PolarHBondContact O-N 3.11Å; F2132-F2224 HydrophobicContact CD1-CE1 4.3Å; F2132-F2224 HydrophobicContact CE1-CD1 4.19Å; F2132-F2224 AromaticContact CE1-CE1 3.97Å; F2132-F2224 HydrophobicContact CE1-CE1 4.02Å; F2132-F2224 HydrophobicContact CE2-CE1 4.43Å; F2132-F2224 AromaticContact CZ-CD1 3.97Å; F2132-F2224 HydrophobicContact CZ-CD1 4.14Å; F2132-F2224 HydrophobicContact CZ-CE1 4.22Å |
| 2133 | L | 93.7 | Very high | 91.3 | Very high | 0 Ų | 0 | 22 Ų | 22 | 0% | 0 | 11% | 0.114 | C | C | . | . | H | α-helix | trans | -77.6 | -12.5 | 178.7 | -81.1 | 75.7 | 0 | 0 | 0 | 113.8 | A2080 V2081 A2084 V2091 L2095 Y2129 L2130 L2131 F2135 C2138 L2139 | A2080-L2133 HydrophobicContact CB-CD1 3.89Å; V2081-L2133 HydrophobicContact CG2-CD1 4.4Å; A2084-L2133 HydrophobicContact CB-CD2 3.73Å; A2084-L2133 HydrophobicContact CB-CG 4.02Å; V2091-L2133 HydrophobicContact CG1-CD2 3.87Å; L2095-L2133 HydrophobicContact CD1-CD1 4.31Å; L2095-L2133 HydrophobicContact CD1-CD2 3.59Å; Y2129-L2133 VanDerWaalsContact O-CD1 3.26Å; Y2129-L2133 WeakPolarHBondContact O-CD1 3.3Å; Y2129-L2133 PolarHBondContact O-N 3.02Å; L2130-L2133 PolarHBondContact O-N 3.26Å; L2131-L2133 VanDerWaalsContact C-N 3.31Å; L2131-L2133 PolarHBondContact O-N 3.22Å; L2133-F2135 PolarHBondContact O-N 3.01Å; L2133-F2135 VanDerWaalsContact O-N 3.16Å; L2133-C2138 HydrophobicContact CB-CB 4.44Å; L2133-C2138 CarbonylContact O-C 3.57Å; L2133-C2138 VanDerWaalsContact O-C 3.3Å; L2133-C2138 WeakPolarHBondContact O-CA 3.33Å; L2133-C2138 VanDerWaalsContact O-CB 3.24Å; L2133-C2138 WeakPolarHBondContact O-CB 3.32Å; L2133-C2138 PolarHBondContact O-N 3.32Å; L2133-L2139 HydrophobicContact CB-CD2 3.54Å; L2133-L2139 HydrophobicContact CB-CG 3.92Å; L2133-L2139 HydrophobicContact CD2-CD2 4.15Å; L2133-L2139 HydrophobicContact CG-CD2 4.5Å; L2133-L2139 PolarHBondContact O-N 3.4Å |
| 2134 | S | 92.9 | Very high | 91.3 | Very high | 0.25 Ų | 0.25 | 22.8 Ų | 22.8 | 0% | 0.002 | 12% | 0.118 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -69.3 | -16.1 | -175.3 | 65.6 | 0 | 0 | 0 | 0 | 114.6 | L2130 L2131 F2132 N2173 S2177 | L2130-S2134 VanDerWaalsContact O-CB 3.29Å; L2130-S2134 WeakPolarHBondContact O-CB 3.23Å; L2130-S2134 PolarHBondContact O-N 3.19Å; L2131-S2134 WeakPolarHBondContact O-CB 3.38Å; L2131-S2134 PolarHBondContact O-N 3.21Å; L2131-S2134 VanDerWaalsContact O-N 3.15Å; L2131-S2134 PolarHBondContact O-OG 3.1Å; F2132-S2134 VanDerWaalsContact C-N 3.32Å; F2132-S2134 PolarHBondContact O-N 3.11Å; S2134-N2173 WeakPolarHBondContact OG-CB 3.25Å; S2134-N2173 PolarHBondContact OG-ND2 2.88Å; S2134-S2177 PolarHBondContact O-OG 3.22Å; S2134-S2177 VanDerWaalsContact O-OG 3.11Å |
| 2135 | F | 89.8 | Confident | 91.4 | Very high | 125 Ų | 125 | 22.9 Ų | 22.9 | 55% | 0.548 | 12% | 0.118 | S | C | . | . | G | 310 helix | trans | -78.3 | 147.1 | 177.3 | -174.8 | -107.1 | 0 | 0 | 0 | 111.9 | L2133 N2137 C2138 | L2133-F2135 PolarHBondContact O-N 3.01Å; L2133-F2135 VanDerWaalsContact O-N 3.16Å; F2135-N2137 VanDerWaalsContact C-N 3.26Å; F2135-N2137 PolarHBondContact O-N 3.1Å; F2135-N2137 VanDerWaalsContact O-N 3.13Å; F2135-C2138 PolarHBondContact O-N 3.11Å; F2135-C2138 VanDerWaalsContact O-N 3.15Å; F2135-C2138 PolarHBondContact O-SG 3.15Å |
| 2136 | N | 86.1 | Confident | 91.5 | Very high | 114.75 Ų | 114.75 | 22.6 Ų | 22.6 | 61% | 0.614 | 12% | 0.117 | S | C | * | . | G | 310 helix | trans | 52.1 | 35.2 | 175.9 | -162.3 | 45.6 | 0 | 0 | 0 | 114.9 | C2138 | N2136-C2138 VanDerWaalsContact C-N 3.27Å; N2136-C2138 PolarHBondContact O-N 3.13Å |
| 2137 | N | 88.6 | Confident | 91.5 | Very high | 33.75 Ų | 33.75 | 23.8 Ų | 23.8 | 18% | 0.18 | 12% | 0.124 | C | C | . | . | G | 310 helix | trans | 57.7 | 28.4 | 179.9 | -163.7 | 34.4 | 0 | 0 | 0 | 115.3 | T2088 F2135 L2139 D2140 V2141 S2177 | T2088-N2137 WeakPolarHBondContact CG2-O 3.33Å; F2135-N2137 VanDerWaalsContact C-N 3.26Å; F2135-N2137 PolarHBondContact O-N 3.1Å; F2135-N2137 VanDerWaalsContact O-N 3.13Å; N2137-L2139 PolarHBondContact O-N 3Å; N2137-L2139 VanDerWaalsContact O-N 3.14Å; N2137-D2140 PolarHBondContact O-N 3.12Å; N2137-D2140 VanDerWaalsContact O-N 3.1Å; N2137-D2140 WeakPolarHBondContact OD1-CA 3.21Å; N2137-V2141 WeakPolarHBondContact OD1-CB 3.37Å; N2137-V2141 VanDerWaalsContact OD1-CG2 3.26Å; N2137-V2141 WeakPolarHBondContact OD1-CG2 3.39Å; N2137-V2141 PolarHBondContact OD1-N 3.24Å; N2137-S2177 PolarHBondContact N-OG 3.04Å |
| 2138 | C | 90.5 | Very high | 91.6 | Very high | 8.75 Ų | 8.75 | 23.5 Ų | 23.5 | 6% | 0.059 | 12% | 0.121 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -71.2 | 0.4 | 175.9 | -66.1 | 0 | 0 | 0 | 0 | 114.2 | A2084 T2088 L2133 F2135 N2136 | A2084-C2138 HydrophobicContact CB-CB 3.92Å; T2088-C2138 WeakPolarHBondContact CG2-O 3.44Å; L2133-C2138 HydrophobicContact CB-CB 4.44Å; L2133-C2138 CarbonylContact O-C 3.57Å; L2133-C2138 VanDerWaalsContact O-C 3.3Å; L2133-C2138 WeakPolarHBondContact O-CA 3.33Å; L2133-C2138 VanDerWaalsContact O-CB 3.24Å; L2133-C2138 WeakPolarHBondContact O-CB 3.32Å; L2133-C2138 PolarHBondContact O-N 3.32Å; F2135-C2138 PolarHBondContact O-N 3.11Å; F2135-C2138 VanDerWaalsContact O-N 3.15Å; F2135-C2138 PolarHBondContact O-SG 3.15Å; N2136-C2138 VanDerWaalsContact C-N 3.27Å; N2136-C2138 PolarHBondContact O-N 3.13Å |
| 2139 | L | 92.3 | Very high | 91.8 | Very high | 0 Ų | 0 | 23.1 Ų | 23.1 | 0% | 0 | 12% | 0.12 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -100.6 | 0.4 | 171.8 | -71.5 | 179.8 | 0 | 0 | 0 | 114.2 | S2092 L2130 L2133 N2137 V2141 H2144 L2148 L2170 | S2092-L2139 WeakPolarHBondContact CB-O 3.31Å; L2130-L2139 HydrophobicContact CD2-CD1 4.47Å; L2130-L2139 HydrophobicContact CD2-CD2 3.61Å; L2133-L2139 HydrophobicContact CB-CD2 3.54Å; L2133-L2139 HydrophobicContact CB-CG 3.92Å; L2133-L2139 HydrophobicContact CD2-CD2 4.15Å; L2133-L2139 HydrophobicContact CG-CD2 4.5Å; L2133-L2139 PolarHBondContact O-N 3.4Å; N2137-L2139 PolarHBondContact O-N 3Å; N2137-L2139 VanDerWaalsContact O-N 3.14Å; L2139-V2141 HydrophobicContact CB-CG1 4.32Å; L2139-V2141 HydrophobicContact CB-CG2 4.27Å; L2139-V2141 PolarHBondContact O-N 3.13Å; L2139-H2144 PolarHBondContact O-CD2 3.29Å; L2139-H2144 VanDerWaalsContact O-CD2 3.29Å; L2139-H2144 PolarHBondContact O-ND1 2.97Å; L2139-L2148 HydrophobicContact CB-CD1 4.33Å; L2139-L2148 HydrophobicContact CD1-CD1 4.26Å; L2139-L2148 HydrophobicContact CD1-CD2 4.06Å; L2139-L2170 HydrophobicContact CD1-CD1 3.97Å |
| 2140 | D | 89.6 | Confident | 91.9 | Very high | 32.5 Ų | 32.5 | 23.2 Ų | 23.2 | 17% | 0.174 | 12% | 0.12 | C | C | . | . | trans | 44.1 | 66.4 | -167.3 | -172.6 | 16 | 0 | 0 | 0 | 111.9 | T2088 N2137 I2142 T2143 H2144 | T2088-D2140 HydrophobicContact CG2-CB 4.28Å; N2137-D2140 PolarHBondContact O-N 3.12Å; N2137-D2140 VanDerWaalsContact O-N 3.1Å; N2137-D2140 WeakPolarHBondContact OD1-CA 3.21Å; D2140-I2142 PolarHBondContact O-N 3.18Å; D2140-I2142 VanDerWaalsContact O-N 3.11Å; D2140-T2143 VanDerWaalsContact CG-OG1 3.28Å; D2140-T2143 PolarHBondContact O-N 3.18Å; D2140-T2143 VanDerWaalsContact O-N 3.12Å; D2140-T2143 PolarHBondContact OD1-OG1 3.16Å; D2140-T2143 WeakPolarHBondContact OD2-CB 3.33Å; D2140-T2143 PolarHBondContact OD2-OG1 3.24Å; D2140-H2144 PolarHBondContact O-N 3.29Å; D2140-H2144 VanDerWaalsContact O-N 3.14Å; D2140-H2144 PolarHBondContact O-ND1 3.37Å | ||
| 2141 | V | 90 | Very high | 91.9 | Very high | 0 Ų | 0 | 23.2 Ų | 23.2 | 0% | 0 | 12% | 0.12 | C | C | . | . | H | α-helix | trans | -60.5 | -29.3 | -167.2 | -81.7 | 0 | 0 | 0 | 0 | 112.3 | N2137 L2139 H2144 L2145 L2148 I2174 L2178 | N2137-V2141 WeakPolarHBondContact OD1-CB 3.37Å; N2137-V2141 VanDerWaalsContact OD1-CG2 3.26Å; N2137-V2141 WeakPolarHBondContact OD1-CG2 3.39Å; N2137-V2141 PolarHBondContact OD1-N 3.24Å; L2139-V2141 HydrophobicContact CB-CG1 4.32Å; L2139-V2141 HydrophobicContact CB-CG2 4.27Å; L2139-V2141 PolarHBondContact O-N 3.13Å; V2141-H2144 PolarHBondContact O-N 2.78Å; V2141-L2145 HydrophobicContact CG1-CD1 3.94Å; V2141-L2145 VanDerWaalsContact O-CA 3.31Å; V2141-L2145 WeakPolarHBondContact O-CA 3.38Å; V2141-L2145 VanDerWaalsContact O-CB 3.23Å; V2141-L2145 WeakPolarHBondContact O-CB 3.29Å; V2141-L2145 PolarHBondContact O-N 3.21Å; V2141-L2148 HydrophobicContact CG1-CD1 4.32Å; V2141-I2174 HydrophobicContact CB-CG2 4.42Å; V2141-I2174 HydrophobicContact CG1-CB 4.42Å; V2141-I2174 HydrophobicContact CG1-CG1 4.34Å; V2141-I2174 HydrophobicContact CG1-CG2 4.14Å; V2141-L2178 HydrophobicContact CB-CD2 4.39Å; V2141-L2178 HydrophobicContact CG1-CD1 4.34Å; V2141-L2178 HydrophobicContact CG1-CD2 3.87Å; V2141-L2178 HydrophobicContact CG1-CG 3.84Å; V2141-L2178 HydrophobicContact CG2-CD2 3.69Å; V2141-L2178 HydrophobicContact CG2-CG 3.89Å |
| 2142 | I | 86.9 | Confident | 91.9 | Very high | 33.75 Ų | 33.75 | 23.1 Ų | 23.1 | 17% | 0.173 | 12% | 0.12 | C | C | . | . | H | α-helix | trans | -66.7 | -47.5 | 179.2 | -67.4 | 178 | 0 | 0 | 0 | 110.1 | D2140 H2144 L2178 C2181 S2183 F2185 I2276 R2279 | D2140-I2142 PolarHBondContact O-N 3.18Å; D2140-I2142 VanDerWaalsContact O-N 3.11Å; I2142-H2144 VanDerWaalsContact C-N 3.33Å; I2142-H2144 PolarHBondContact O-N 3.33Å; I2142-L2178 HydrophobicContact CG1-CD2 4.23Å; I2142-C2181 HydrophobicContact CD1-CB 4.4Å; I2142-C2181 VanDerWaalsContact CD1-SG 3.56Å; I2142-C2181 WeakPolarHBondContact CD1-SG 3.33Å; I2142-S2183 VanDerWaalsContact CD1-OG 3.3Å; I2142-S2183 WeakPolarHBondContact CD1-OG 3.23Å; I2142-F2185 HydrophobicContact CD1-CE2 4.29Å; I2142-F2185 HydrophobicContact CD1-CZ 4.25Å; I2142-F2185 HydrophobicContact CG1-CZ 4.48Å; I2142-I2276 HydrophobicContact CG2-CD1 4.06Å; I2142-R2279 PolarHBondContact O-NH1 2.9Å |
| 2143 | T | 89.2 | Confident | 92 | Very high | 64.25 Ų | 64.25 | 22.2 Ų | 22.2 | 39% | 0.394 | 12% | 0.116 | S | C | . | . | H | α-helix | trans | -66.6 | -40.2 | 179.5 | -57.1 | 0 | 0 | 0 | 0 | 111.3 | D2140 R2279 | D2140-T2143 VanDerWaalsContact CG-OG1 3.28Å; D2140-T2143 PolarHBondContact O-N 3.18Å; D2140-T2143 VanDerWaalsContact O-N 3.12Å; D2140-T2143 PolarHBondContact OD1-OG1 3.16Å; D2140-T2143 WeakPolarHBondContact OD2-CB 3.33Å; D2140-T2143 PolarHBondContact OD2-OG1 3.24Å; T2143-R2279 VanDerWaalsContact O-CZ 3.27Å; T2143-R2279 PolarHBondContact O-NH1 3.11Å; T2143-R2279 PolarHBondContact O-NH2 3.26Å |
| 2144 | H | 92.5 | Very high | 91.8 | Very high | 18 Ų | 18 | 22.5 Ų | 22.5 | 8% | 0.083 | 12% | 0.117 | C | C | . | . | H | α-helix | trans | -101.2 | 3.6 | -171.1 | -59.6 | 114.7 | 0 | 0 | 0 | 116.2 | S2092 D2093 I2096 L2139 D2140 V2141 I2142 P2146 V2147 L2148 | S2092-H2144 PolarHBondContact OG-CE1 3.06Å; S2092-H2144 VanDerWaalsContact OG-CE1 3.31Å; S2092-H2144 PolarHBondContact OG-NE2 2.96Å; D2093-H2144 IonicContact OD1-CE1 2.64Å; I2096-H2144 HydrophobicContact CD1-CB 3.56Å; L2139-H2144 PolarHBondContact O-CD2 3.29Å; L2139-H2144 VanDerWaalsContact O-CD2 3.29Å; L2139-H2144 PolarHBondContact O-ND1 2.97Å; D2140-H2144 PolarHBondContact O-N 3.29Å; D2140-H2144 VanDerWaalsContact O-N 3.14Å; D2140-H2144 PolarHBondContact O-ND1 3.37Å; V2141-H2144 PolarHBondContact O-N 2.78Å; I2142-H2144 VanDerWaalsContact C-N 3.33Å; I2142-H2144 PolarHBondContact O-N 3.33Å; H2144-P2146 VanDerWaalsContact C-CD 3.49Å; H2144-V2147 PolarHBondContact O-N 3.23Å; H2144-L2148 HydrophobicContact CB-CD1 4.17Å; H2144-L2148 HydrophobicContact CB-CG 4.12Å; H2144-L2148 WeakPolarHBondContact O-CG 3.2Å; H2144-L2148 PolarHBondContact O-N 2.99Å |
| 2145 | L | 92.7 | Very high | 91.8 | Very high | 1 Ų | 1 | 22.7 Ų | 22.7 | 1% | 0.005 | 12% | 0.118 | C | C | . | . | H | α-helix | trans | -48.4 | -49.9 | -170.9 | -164.7 | 59.8 | 0 | 0 | 0 | 115.2 | V2141 V2147 L2148 F2149 I2174 L2178 I2269 M2281 | V2141-L2145 HydrophobicContact CG1-CD1 3.94Å; V2141-L2145 VanDerWaalsContact O-CA 3.31Å; V2141-L2145 WeakPolarHBondContact O-CA 3.38Å; V2141-L2145 VanDerWaalsContact O-CB 3.23Å; V2141-L2145 WeakPolarHBondContact O-CB 3.29Å; V2141-L2145 PolarHBondContact O-N 3.21Å; L2145-V2147 VanDerWaalsContact C-N 3.28Å; L2145-V2147 PolarHBondContact O-N 3.09Å; L2145-L2148 PolarHBondContact O-N 3.28Å; L2145-F2149 HydrophobicContact CD1-CD1 4.17Å; L2145-F2149 HydrophobicContact CD1-CD2 4.44Å; L2145-F2149 HydrophobicContact CD1-CE1 3.74Å; L2145-F2149 HydrophobicContact CD1-CE2 4.06Å; L2145-F2149 HydrophobicContact CD1-CG 4.48Å; L2145-F2149 HydrophobicContact CD1-CZ 3.66Å; L2145-F2149 HydrophobicContact CG-CD2 4.48Å; L2145-F2149 HydrophobicContact CG-CE2 4.26Å; L2145-F2149 HydrophobicContact CG-CZ 4.36Å; L2145-F2149 PolarHBondContact O-N 3.12Å; L2145-I2174 HydrophobicContact CD1-CG2 3.64Å; L2145-L2178 HydrophobicContact CD1-CD1 4.02Å; L2145-L2178 HydrophobicContact CD2-CD1 4.22Å; L2145-I2269 HydrophobicContact CD2-CG1 4.02Å; L2145-I2269 HydrophobicContact CG-CG1 4.36Å; L2145-M2281 HydrophobicContact CB-SD 4.12Å; L2145-M2281 HydrophobicContact CD2-CE 4.2Å; L2145-M2281 HydrophobicContact CD2-SD 4Å |
| 2146 | P | 93.3 | Very high | 91.9 | Very high | 1 Ų | 1 | 16.7 Ų | 16.7 | 1% | 0.006 | 9% | 0.092 | C | C | . | . | H | α-helix | trans | -59.6 | -38.7 | -179.3 | -25.2 | 37.2 | 0 | 0 | 0 | 112.9 | H2144 H2150 M2281 E2284 W2285 L2288 | H2144-P2146 VanDerWaalsContact C-CD 3.49Å; P2146-H2150 WeakPolarHBondContact O-CB 3.32Å; P2146-H2150 PolarHBondContact O-N 3.24Å; P2146-H2150 VanDerWaalsContact O-N 3.07Å; P2146-M2281 HydrophobicContact CG-CB 3.96Å; P2146-M2281 HydrophobicContact CG-CG 4.2Å; P2146-E2284 HydrophobicContact CB-CB 4.22Å; P2146-E2284 HydrophobicContact CG-CB 4.08Å; P2146-W2285 HydrophobicContact CB-CB 3.98Å; P2146-L2288 HydrophobicContact CB-CD1 4.43Å |
| 2147 | V | 94.7 | Very high | 91.9 | Very high | 27 Ų | 27 | 12.4 Ų | 12.4 | 16% | 0.164 | 7% | 0.069 | C | C | . | . | H | α-helix | trans | -73.5 | -41.8 | -178.5 | -178.8 | 0 | 0 | 0 | 0 | 110.7 | I2096 M2100 H2144 L2145 F2149 H2150 F2151 L2288 | I2096-V2147 HydrophobicContact CG2-CB 4.27Å; I2096-V2147 HydrophobicContact CG2-CG1 3.5Å; I2096-V2147 VanDerWaalsContact CG2-CG1 3.49Å; M2100-V2147 HydrophobicContact CE-CG1 3.6Å; H2144-V2147 PolarHBondContact O-N 3.23Å; L2145-V2147 VanDerWaalsContact C-N 3.28Å; L2145-V2147 PolarHBondContact O-N 3.09Å; V2147-F2149 PolarHBondContact O-N 3.2Å; V2147-H2150 WeakPolarHBondContact O-CB 3.38Å; V2147-H2150 PolarHBondContact O-N 3.08Å; V2147-F2151 HydrophobicContact CG1-CD2 4.31Å; V2147-F2151 HydrophobicContact CG1-CE1 4.02Å; V2147-F2151 HydrophobicContact CG1-CE2 3.67Å; V2147-F2151 HydrophobicContact CG1-CZ 3.49Å; V2147-F2151 VanDerWaalsContact CG1-CZ 3.49Å; V2147-F2151 WeakPolarHBondContact O-CG 3.4Å; V2147-F2151 PolarHBondContact O-N 3.24Å; V2147-L2288 HydrophobicContact CB-CD1 4.44Å; V2147-L2288 HydrophobicContact CG2-CD1 3.79Å |
| 2148 | L | 95.5 | Very high | 91.9 | Very high | 0 Ų | 0 | 11.2 Ų | 11.2 | 0% | 0 | 6% | 0.063 | C | C | . | . | H | α-helix | trans | -62.5 | -43.5 | 177.4 | -66.9 | 175.5 | 0 | 0 | 0 | 111.6 | I2096 L2130 L2139 V2141 H2144 L2145 H2150 F2151 V2152 I2174 | I2096-L2148 HydrophobicContact CD1-CD2 3.95Å; I2096-L2148 HydrophobicContact CD1-CG 4.47Å; I2096-L2148 HydrophobicContact CG1-CD2 4.31Å; L2130-L2148 HydrophobicContact CD1-CD2 4.45Å; L2139-L2148 HydrophobicContact CB-CD1 4.33Å; L2139-L2148 HydrophobicContact CD1-CD1 4.26Å; L2139-L2148 HydrophobicContact CD1-CD2 4.06Å; V2141-L2148 HydrophobicContact CG1-CD1 4.32Å; H2144-L2148 HydrophobicContact CB-CD1 4.17Å; H2144-L2148 HydrophobicContact CB-CG 4.12Å; H2144-L2148 WeakPolarHBondContact O-CG 3.2Å; H2144-L2148 PolarHBondContact O-N 2.99Å; L2145-L2148 PolarHBondContact O-N 3.28Å; L2148-H2150 VanDerWaalsContact C-N 3.33Å; L2148-H2150 PolarHBondContact O-N 2.9Å; L2148-F2151 HydrophobicContact CD2-CD2 4.46Å; L2148-F2151 PolarHBondContact O-N 3.15Å; L2148-V2152 WeakPolarHBondContact O-CG2 3.29Å; L2148-V2152 PolarHBondContact O-N 3.21Å; L2148-I2174 HydrophobicContact CB-CD1 3.85Å; L2148-I2174 HydrophobicContact CD1-CD1 4.07Å; L2148-I2174 HydrophobicContact CD1-CG1 4.23Å; L2148-I2174 HydrophobicContact CG-CD1 4.47Å |
| 2149 | F | 95.3 | Very high | 91.6 | Very high | 0.25 Ų | 0.25 | 11.1 Ų | 11.1 | 0% | 0.001 | 6% | 0.064 | C | C | . | . | H | α-helix | trans | -68.4 | -33.2 | 175.6 | -75.2 | 1.9 | 0 | 0 | 0 | 112.4 | L2145 V2147 F2151 V2152 I2153 I2174 L2265 L2268 I2269 W2285 | L2145-F2149 HydrophobicContact CD1-CD1 4.17Å; L2145-F2149 HydrophobicContact CD1-CD2 4.44Å; L2145-F2149 HydrophobicContact CD1-CE1 3.74Å; L2145-F2149 HydrophobicContact CD1-CE2 4.06Å; L2145-F2149 HydrophobicContact CD1-CG 4.48Å; L2145-F2149 HydrophobicContact CD1-CZ 3.66Å; L2145-F2149 HydrophobicContact CG-CD2 4.48Å; L2145-F2149 HydrophobicContact CG-CE2 4.26Å; L2145-F2149 HydrophobicContact CG-CZ 4.36Å; L2145-F2149 PolarHBondContact O-N 3.12Å; V2147-F2149 PolarHBondContact O-N 3.2Å; F2149-F2151 VanDerWaalsContact C-N 3.35Å; F2149-F2151 PolarHBondContact O-N 3.36Å; F2149-V2152 PolarHBondContact O-N 3.05Å; F2149-I2153 WeakPolarHBondContact O-CG1 3.42Å; F2149-I2153 PolarHBondContact O-N 3.12Å; F2149-I2153 VanDerWaalsContact O-N 3.08Å; F2149-I2174 HydrophobicContact CD1-CD1 4.49Å; F2149-I2174 HydrophobicContact CE1-CB 4.47Å; F2149-I2174 HydrophobicContact CE1-CD1 4.39Å; F2149-I2174 HydrophobicContact CE1-CG2 3.7Å; F2149-I2174 HydrophobicContact CZ-CG2 4.26Å; F2149-L2265 HydrophobicContact CB-CD1 4.35Å; F2149-L2265 HydrophobicContact CD1-CD2 4.24Å; F2149-L2265 HydrophobicContact CD2-CB 3.86Å; F2149-L2265 HydrophobicContact CD2-CD1 4.43Å; F2149-L2265 HydrophobicContact CD2-CD2 4.1Å; F2149-L2265 HydrophobicContact CD2-CG 4.34Å; F2149-L2265 HydrophobicContact CE1-CD2 4.01Å; F2149-L2265 HydrophobicContact CE2-CB 4.07Å; F2149-L2265 HydrophobicContact CE2-CD2 3.89Å; F2149-L2265 HydrophobicContact CE2-CG 4.43Å; F2149-L2265 HydrophobicContact CG-CB 4.49Å; F2149-L2265 HydrophobicContact CG-CD1 4.27Å; F2149-L2265 HydrophobicContact CG-CD2 4.29Å; F2149-L2265 HydrophobicContact CZ-CD2 3.84Å; F2149-L2268 HydrophobicContact CE2-CB 4.23Å; F2149-L2268 HydrophobicContact CZ-CB 4.49Å; F2149-L2268 HydrophobicContact CZ-CD1 4.28Å; F2149-I2269 HydrophobicContact CD2-CD1 3.59Å; F2149-I2269 HydrophobicContact CD2-CG1 3.81Å; F2149-I2269 HydrophobicContact CE2-CD1 4.1Å; F2149-I2269 HydrophobicContact CE2-CG1 3.76Å; F2149-W2285 HydrophobicContact CB-CH2 4.05Å; F2149-W2285 HydrophobicContact CB-CZ2 3.86Å; F2149-W2285 HydrophobicContact CB-CZ3 4.45Å; F2149-W2285 HydrophobicContact CD2-CH2 4.46Å; F2149-W2285 HydrophobicContact CD2-CZ3 4.37Å |
| 2150 | H | 94.8 | Very high | 91.2 | Very high | 2.5 Ų | 2.5 | 13.8 Ų | 13.8 | 1% | 0.012 | 8% | 0.081 | C | C | . | . | H | α-helix | trans | -59.4 | -45.8 | 169.6 | -171.4 | 78.2 | 0 | 0 | 0 | 112 | P2146 V2147 L2148 V2152 I2153 V2154 W2285 L2288 F2292 | P2146-H2150 WeakPolarHBondContact O-CB 3.32Å; P2146-H2150 PolarHBondContact O-N 3.24Å; P2146-H2150 VanDerWaalsContact O-N 3.07Å; V2147-H2150 WeakPolarHBondContact O-CB 3.38Å; V2147-H2150 PolarHBondContact O-N 3.08Å; L2148-H2150 VanDerWaalsContact C-N 3.33Å; L2148-H2150 PolarHBondContact O-N 2.9Å; H2150-V2152 VanDerWaalsContact C-N 3.34Å; H2150-V2152 PolarHBondContact O-N 3Å; H2150-I2153 PolarHBondContact O-N 3.03Å; H2150-V2154 WeakPolarHBondContact O-CB 3.32Å; H2150-V2154 WeakPolarHBondContact O-CG2 3.31Å; H2150-V2154 PolarHBondContact O-N 2.99Å; H2150-W2285 AromaticContact ND1-NE1 3.9Å; H2150-L2288 HydrophobicContact CB-CD1 4.34Å; H2150-F2292 AromaticContact CE1-CD2 3.59Å; H2150-F2292 AromaticContact NE2-CD2 3.24Å; H2150-F2292 VanDerWaalsContact NE2-CD2 3.26Å; H2150-F2292 WeakPolarHBondContact NE2-CD2 3.4Å; H2150-F2292 AromaticContact NE2-CE2 3.44Å; H2150-F2292 WeakPolarHBondContact NE2-CE2 3.37Å; H2150-F2292 AromaticContact NE2-CG 3.93Å |
| 2151 | F | 95.1 | Very high | 90.8 | Very high | 1.75 Ų | 1.75 | 15.4 Ų | 15.4 | 1% | 0.008 | 9% | 0.089 | C | C | . | . | H | α-helix | trans | -62.3 | -40 | 175.6 | -62.3 | -27.7 | 0 | 0 | 0 | 112.9 | I2096 L2099 M2100 L2103 L2130 V2147 L2148 F2149 I2153 V2154 L2155 | I2096-F2151 HydrophobicContact CB-CE2 4.39Å; I2096-F2151 HydrophobicContact CG1-CE2 4.4Å; I2096-F2151 HydrophobicContact CG2-CE2 3.93Å; I2096-F2151 HydrophobicContact CG2-CZ 4.16Å; I2096-F2151 WeakPolarHBondContact O-CZ 3.4Å; L2099-F2151 HydrophobicContact CB-CE1 4.42Å; L2099-F2151 HydrophobicContact CB-CE2 4.19Å; L2099-F2151 HydrophobicContact CB-CZ 3.95Å; L2099-F2151 HydrophobicContact CD2-CB 4.45Å; L2099-F2151 HydrophobicContact CD2-CD1 4.14Å; L2099-F2151 HydrophobicContact CD2-CD2 3.66Å; L2099-F2151 HydrophobicContact CD2-CE1 4.24Å; L2099-F2151 HydrophobicContact CD2-CE2 3.75Å; L2099-F2151 HydrophobicContact CD2-CG 3.86Å; L2099-F2151 HydrophobicContact CD2-CZ 4.04Å; L2099-F2151 HydrophobicContact CG-CD1 4.29Å; L2099-F2151 HydrophobicContact CG-CD2 4.43Å; L2099-F2151 HydrophobicContact CG-CE1 4.02Å; L2099-F2151 HydrophobicContact CG-CE2 4.14Å; L2099-F2151 HydrophobicContact CG-CG 4.46Å; L2099-F2151 HydrophobicContact CG-CZ 3.93Å; M2100-F2151 HydrophobicContact CB-CE1 4.29Å; M2100-F2151 HydrophobicContact CB-CZ 4.16Å; M2100-F2151 HydrophobicContact CE-CD1 4.5Å; M2100-F2151 HydrophobicContact CE-CE1 3.62Å; M2100-F2151 HydrophobicContact CE-CZ 4.05Å; M2100-F2151 HydrophobicContact SD-CE1 4.21Å; L2103-F2151 HydrophobicContact CD1-CD1 3.65Å; L2103-F2151 HydrophobicContact CD1-CE1 3.76Å; L2130-F2151 HydrophobicContact CD1-CD2 3.73Å; L2130-F2151 HydrophobicContact CD1-CE2 4.1Å; V2147-F2151 HydrophobicContact CG1-CD2 4.31Å; V2147-F2151 HydrophobicContact CG1-CE1 4.02Å; V2147-F2151 HydrophobicContact CG1-CE2 3.67Å; V2147-F2151 HydrophobicContact CG1-CZ 3.49Å; V2147-F2151 VanDerWaalsContact CG1-CZ 3.49Å; V2147-F2151 WeakPolarHBondContact O-CG 3.4Å; V2147-F2151 PolarHBondContact O-N 3.24Å; L2148-F2151 HydrophobicContact CD2-CD2 4.46Å; L2148-F2151 PolarHBondContact O-N 3.15Å; F2149-F2151 VanDerWaalsContact C-N 3.35Å; F2149-F2151 PolarHBondContact O-N 3.36Å; F2151-I2153 VanDerWaalsContact C-N 3.34Å; F2151-I2153 PolarHBondContact O-N 3.31Å; F2151-V2154 PolarHBondContact O-N 3.19Å; F2151-L2155 WeakPolarHBondContact O-CB 3.35Å; F2151-L2155 WeakPolarHBondContact O-CG 3.39Å; F2151-L2155 PolarHBondContact O-N 3.15Å |
| 2152 | V | 94.5 | Very high | 90.4 | Very high | 0 Ų | 0 | 16.6 Ų | 16.6 | 0% | 0 | 10% | 0.099 | C | C | . | . | H | α-helix | trans | -58.2 | -48.9 | 176 | 167.8 | 0 | 0 | 0 | 0 | 110.8 | L2148 F2149 H2150 V2154 L2155 V2156 V2167 L2170 V2171 F2209 L2265 | L2148-V2152 WeakPolarHBondContact O-CG2 3.29Å; L2148-V2152 PolarHBondContact O-N 3.21Å; F2149-V2152 PolarHBondContact O-N 3.05Å; H2150-V2152 VanDerWaalsContact C-N 3.34Å; H2150-V2152 PolarHBondContact O-N 3Å; V2152-V2154 PolarHBondContact O-N 3.35Å; V2152-L2155 PolarHBondContact O-N 3.25Å; V2152-V2156 VanDerWaalsContact O-CB 3.29Å; V2152-V2156 WeakPolarHBondContact O-CB 3.28Å; V2152-V2156 PolarHBondContact O-N 3.36Å; V2152-V2167 HydrophobicContact CB-CG1 4.47Å; V2152-V2167 HydrophobicContact CG1-CG1 4.19Å; V2152-V2167 HydrophobicContact CG2-CG1 4.49Å; V2152-L2170 HydrophobicContact CG2-CD2 4.23Å; V2152-L2170 HydrophobicContact CG2-CG 4.47Å; V2152-V2171 HydrophobicContact CB-CG2 4.11Å; V2152-V2171 HydrophobicContact CG1-CG2 3.38Å; V2152-V2171 VanDerWaalsContact CG1-CG2 3.41Å; V2152-V2171 HydrophobicContact CG2-CG2 3.54Å; V2152-F2209 HydrophobicContact CG1-CE1 4.29Å; V2152-F2209 HydrophobicContact CG1-CZ 4.48Å; V2152-L2265 HydrophobicContact CG1-CD1 4.21Å |
| 2153 | I | 93.2 | Very high | 90.5 | Very high | 1.75 Ų | 1.75 | 15.1 Ų | 15.1 | 1% | 0.009 | 9% | 0.092 | C | C | . | . | H | α-helix | trans | -64.7 | -41.4 | 179 | -68.8 | -57.1 | 0 | 0 | 0 | 111.7 | F2149 H2150 F2151 L2155 V2156 L2258 I2261 T2262 L2265 W2285 R2303 V2307 | F2149-I2153 WeakPolarHBondContact O-CG1 3.42Å; F2149-I2153 PolarHBondContact O-N 3.12Å; F2149-I2153 VanDerWaalsContact O-N 3.08Å; H2150-I2153 PolarHBondContact O-N 3.03Å; F2151-I2153 VanDerWaalsContact C-N 3.34Å; F2151-I2153 PolarHBondContact O-N 3.31Å; I2153-L2155 VanDerWaalsContact C-N 3.27Å; I2153-L2155 PolarHBondContact O-N 3.03Å; I2153-V2156 WeakPolarHBondContact O-CG1 3.36Å; I2153-L2258 HydrophobicContact CD1-CD1 3.91Å; I2153-L2258 HydrophobicContact CD1-CG 4.4Å; I2153-L2258 HydrophobicContact CG2-CD1 3.97Å; I2153-L2258 HydrophobicContact CG2-CD2 4.27Å; I2153-L2258 HydrophobicContact CG2-CG 4.28Å; I2153-I2261 HydrophobicContact CD1-CB 4.42Å; I2153-I2261 HydrophobicContact CD1-CG2 3.95Å; I2153-T2262 WeakPolarHBondContact CD1-OG1 3.3Å; I2153-L2265 HydrophobicContact CD1-CD1 3.94Å; I2153-L2265 HydrophobicContact CG1-CD1 4.17Å; I2153-W2285 HydrophobicContact CG1-CH2 4.41Å; I2153-W2285 HydrophobicContact CG1-CZ2 3.84Å; I2153-R2303 PolarHBondContact O-NH1 3.39Å; I2153-V2307 HydrophobicContact CB-CG2 4.21Å; I2153-V2307 HydrophobicContact CD1-CG2 4.19Å; I2153-V2307 HydrophobicContact CG1-CG2 4.14Å; I2153-V2307 HydrophobicContact CG2-CB 4.19Å; I2153-V2307 HydrophobicContact CG2-CG1 4.41Å; I2153-V2307 HydrophobicContact CG2-CG2 3.25Å |
| 2154 | V | 90.9 | Very high | 90.4 | Very high | 5.25 Ų | 5.25 | 14.5 Ų | 14.5 | 3% | 0.032 | 8% | 0.082 | C | C | . | . | H | α-helix | trans | -63.3 | -37.9 | 178.2 | 164.5 | 0 | 0 | 0 | 0 | 111.4 | L2103 L2114 H2150 F2151 V2152 L2300 R2303 | L2103-V2154 HydrophobicContact CD1-CG1 4.12Å; L2103-V2154 HydrophobicContact CD2-CG1 3.84Å; L2114-V2154 HydrophobicContact CD2-CG1 4.4Å; H2150-V2154 WeakPolarHBondContact O-CB 3.32Å; H2150-V2154 WeakPolarHBondContact O-CG2 3.31Å; H2150-V2154 PolarHBondContact O-N 2.99Å; F2151-V2154 PolarHBondContact O-N 3.19Å; V2152-V2154 PolarHBondContact O-N 3.35Å; V2154-L2300 HydrophobicContact CB-CD2 4.47Å; V2154-L2300 HydrophobicContact CG1-CD2 3.5Å; V2154-L2300 VanDerWaalsContact CG1-CD2 3.47Å; V2154-L2300 HydrophobicContact CG2-CD2 4.48Å; V2154-R2303 PolarHBondContact O-NH1 3.49Å |
| 2155 | L | 91.8 | Very high | 90.2 | Very high | 4.5 Ų | 4.5 | 13.6 Ų | 13.6 | 2% | 0.024 | 8% | 0.078 | C | C | . | . | H | α-helix | trans | -101.1 | -6.2 | -172.8 | -60.3 | 175.6 | 0 | 0 | 0 | 115.1 | L2114 W2120 I2123 A2127 F2151 V2152 I2153 N2157 T2158 V2167 | L2114-L2155 HydrophobicContact CD2-CD2 3.95Å; W2120-L2155 HydrophobicContact CZ3-CD2 4.42Å; I2123-L2155 HydrophobicContact CG2-CD2 3.78Å; A2127-L2155 HydrophobicContact CB-CD1 3.68Å; F2151-L2155 WeakPolarHBondContact O-CB 3.35Å; F2151-L2155 WeakPolarHBondContact O-CG 3.39Å; F2151-L2155 PolarHBondContact O-N 3.15Å; V2152-L2155 PolarHBondContact O-N 3.25Å; I2153-L2155 VanDerWaalsContact C-N 3.27Å; I2153-L2155 PolarHBondContact O-N 3.03Å; L2155-N2157 PolarHBondContact O-N 3.34Å; L2155-T2158 WeakPolarHBondContact CA-OG1 3.43Å; L2155-T2158 WeakPolarHBondContact O-CB 3.4Å; L2155-T2158 PolarHBondContact O-N 3.01Å; L2155-T2158 VanDerWaalsContact O-N 3.11Å; L2155-T2158 PolarHBondContact O-OG1 3.16Å; L2155-V2167 HydrophobicContact CB-CG2 3.89Å |
| 2156 | V | 91.9 | Very high | 90 | Very high | 0 Ų | 0 | 13.7 Ų | 13.7 | 0% | 0 | 8% | 0.079 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -62.5 | 135.2 | -177.4 | 66.3 | 0 | 0 | 0 | 0 | 111.6 | V2152 I2153 T2158 V2167 F2209 L2253 L2258 I2261 R2303 | V2152-V2156 VanDerWaalsContact O-CB 3.29Å; V2152-V2156 WeakPolarHBondContact O-CB 3.28Å; V2152-V2156 PolarHBondContact O-N 3.36Å; I2153-V2156 WeakPolarHBondContact O-CG1 3.36Å; V2156-T2158 PolarHBondContact O-N 3.08Å; V2156-T2158 VanDerWaalsContact O-N 3.16Å; V2156-V2167 HydrophobicContact CB-CG1 4.38Å; V2156-F2209 HydrophobicContact CG2-CB 4.43Å; V2156-F2209 HydrophobicContact CG2-CD1 3.73Å; V2156-F2209 HydrophobicContact CG2-CD2 4.27Å; V2156-F2209 HydrophobicContact CG2-CE1 4.06Å; V2156-F2209 HydrophobicContact CG2-CG 3.97Å; V2156-F2209 HydrophobicContact CG2-CZ 4.36Å; V2156-L2253 HydrophobicContact CG1-CD2 3.71Å; V2156-L2258 HydrophobicContact CG1-CD1 3.57Å; V2156-I2261 HydrophobicContact CG1-CD1 4.3Å; V2156-I2261 HydrophobicContact CG2-CD1 3.88Å; V2156-R2303 PolarHBondContact O-NH1 3.32Å; V2156-R2303 PolarHBondContact O-NH2 3.1Å; V2156-R2303 VanDerWaalsContact O-NH2 3.09Å |
| 2157 | N | 87.4 | Confident | 90 | Very high | 23.5 Ų | 23.5 | 13.9 Ų | 13.9 | 13% | 0.126 | 8% | 0.08 | C | C | . | . | T | Hydrogen-bonded Turn | trans | 51.5 | 32.1 | -174.4 | -161.5 | 21.6 | 0 | 0 | 0 | 114.4 | L2155 R2164 G2210 D2251 L2253 | L2155-N2157 PolarHBondContact O-N 3.34Å; N2157-R2164 VanDerWaalsContact OD1-CD 3.28Å; N2157-R2164 WeakPolarHBondContact OD1-CD 3.26Å; N2157-R2164 PolarHBondContact OD1-NH1 3.08Å; N2157-R2164 VanDerWaalsContact OD1-NH1 3.13Å; N2157-G2210 WeakPolarHBondContact OD1-CA 3.33Å; N2157-D2251 PolarHBondContact ND2-O 3.18Å; N2157-L2253 HydrophobicContact CB-CB 4.07Å; N2157-L2253 HydrophobicContact CB-CD2 4.47Å; N2157-L2253 PolarHBondContact ND2-N 3.23Å; N2157-L2253 VanDerWaalsContact ND2-N 3.19Å |
| 2158 | T | 87.2 | Confident | 89.9 | Confident | 9.5 Ų | 9.5 | 12.7 Ų | 12.7 | 6% | 0.058 | 7% | 0.073 | C | C | . | . | trans | -107.7 | 147.5 | 170.4 | 67.7 | 0 | 0 | 0 | 0 | 111.4 | L2155 V2156 R2164 | L2155-T2158 WeakPolarHBondContact CA-OG1 3.43Å; L2155-T2158 WeakPolarHBondContact O-CB 3.4Å; L2155-T2158 PolarHBondContact O-N 3.01Å; L2155-T2158 VanDerWaalsContact O-N 3.11Å; L2155-T2158 PolarHBondContact O-OG1 3.16Å; V2156-T2158 PolarHBondContact O-N 3.08Å; V2156-T2158 VanDerWaalsContact O-N 3.16Å; T2158-R2164 VanDerWaalsContact O-CG 3.25Å; T2158-R2164 WeakPolarHBondContact O-CG 3.34Å | ||
| 2159 | G | 84.6 | Confident | 89.7 | Confident | 7.25 Ų | 7.25 | 13.4 Ų | 13.4 | 8% | 0.075 | 8% | 0.079 | C | C | . | . | S | Bend | trans | 79.1 | -168.7 | 173.5 | 0 | 0 | 0 | 0 | 0 | 116 | E2115 W2120 R2164 | E2115-G2159 VanDerWaalsContact CD-N 3.25Å; E2115-G2159 VanDerWaalsContact OE1-CA 3.31Å; E2115-G2159 WeakPolarHBondContact OE1-CA 3.4Å; E2115-G2159 PolarHBondContact OE1-N 3.06Å; W2120-G2159 VanDerWaalsContact CZ2-CA 3.5Å; G2159-R2164 PolarHBondContact O-NE 3.22Å |
| 2160 | P | 83.4 | Confident | 89.6 | Confident | 55.5 Ų | 55.5 | 13.7 Ų | 13.7 | 36% | 0.36 | 8% | 0.081 | S | C | . | . | S | Bend | trans | -65.4 | 161.2 | 179.8 | 27.4 | -34.2 | 0 | 0 | 0 | 111.7 | L2068 A2162 L2163 R2164 | L2068-P2160 HydrophobicContact CD2-CG 4.39Å; P2160-A2162 PolarHBondContact O-N 3.2Å; P2160-A2162 VanDerWaalsContact O-N 3.11Å; P2160-L2163 HydrophobicContact CG-CB 4.13Å; P2160-L2163 PolarHBondContact O-N 2.93Å; P2160-R2164 PolarHBondContact O-N 3.15Å; P2160-R2164 VanDerWaalsContact O-N 3.09Å |
| 2161 | L | 81.7 | Confident | 89.6 | Confident | 65.75 Ų | 65.75 | 13.6 Ų | 13.6 | 34% | 0.344 | 8% | 0.081 | S | C | . | . | H | α-helix | trans | -53.7 | -35.9 | -178.6 | -176.4 | 65.5 | 0 | 0 | 0 | 113.1 | R2164 A2165 V2211 L2214 T2222 | L2161-R2164 PolarHBondContact O-N 3.09Å; L2161-A2165 WeakPolarHBondContact O-CB 3.32Å; L2161-A2165 PolarHBondContact O-N 3.06Å; L2161-V2211 HydrophobicContact CD1-CG1 4.16Å; L2161-L2214 HydrophobicContact CD1-CD1 4.21Å; L2161-L2214 HydrophobicContact CD2-CD1 4.39Å; L2161-L2214 HydrophobicContact CD2-CD2 4.39Å; L2161-L2214 HydrophobicContact CG-CD1 4.35Å; L2161-T2222 HydrophobicContact CD2-CG2 4.12Å; L2161-T2222 HydrophobicContact CG-CG2 4.03Å |
| 2162 | A | 82.7 | Confident | 89.5 | Confident | 26 Ų | 26 | 14.4 Ų | 14.4 | 22% | 0.215 | 9% | 0.086 | C | C | . | . | H | α-helix | trans | -64 | -39.8 | 177 | 0 | 0 | 0 | 0 | 0 | 112.8 | P2160 A2165 S2166 I2226 | P2160-A2162 PolarHBondContact O-N 3.2Å; P2160-A2162 VanDerWaalsContact O-N 3.11Å; A2162-A2165 PolarHBondContact O-N 2.89Å; A2162-S2166 WeakPolarHBondContact O-CB 3.44Å; A2162-S2166 PolarHBondContact O-N 3.14Å; A2162-S2166 PolarHBondContact O-OG 3.17Å; A2162-I2226 HydrophobicContact CB-CD1 3.48Å; A2162-I2226 VanDerWaalsContact CB-CD1 3.43Å; A2162-I2226 HydrophobicContact CB-CG1 4.08Å |
| 2163 | L | 87.1 | Confident | 89.4 | Confident | 2.5 Ų | 2.5 | 16 Ų | 16 | 1% | 0.013 | 9% | 0.094 | C | C | . | . | H | α-helix | trans | -70.6 | -41.1 | 176.7 | -172.6 | 67.4 | 0 | 0 | 0 | 111 | W2120 A2124 A2127 R2128 P2160 A2165 S2166 V2167 | W2120-L2163 HydrophobicContact CH2-CD2 3.4Å; W2120-L2163 VanDerWaalsContact CH2-CD2 3.42Å; W2120-L2163 HydrophobicContact CZ2-CD2 3.47Å; W2120-L2163 VanDerWaalsContact CZ2-CD2 3.47Å; W2120-L2163 HydrophobicContact CZ3-CD2 4.47Å; A2124-L2163 HydrophobicContact CB-CD1 4.41Å; A2124-L2163 HydrophobicContact CB-CD2 3.87Å; A2127-L2163 HydrophobicContact CB-CD1 4.02Å; R2128-L2163 HydrophobicContact CG-CD1 4.36Å; P2160-L2163 HydrophobicContact CG-CB 4.13Å; P2160-L2163 PolarHBondContact O-N 2.93Å; L2163-A2165 VanDerWaalsContact C-N 3.33Å; L2163-A2165 PolarHBondContact O-N 3.15Å; L2163-S2166 CarbonylContact O-C 3.41Å; L2163-S2166 WeakPolarHBondContact O-CA 3.39Å; L2163-S2166 VanDerWaalsContact O-CB 3.26Å; L2163-S2166 WeakPolarHBondContact O-CB 3.42Å; L2163-S2166 PolarHBondContact O-N 3.09Å; L2163-V2167 PolarHBondContact O-N 3.17Å |
| 2164 | R | 88 | Confident | 89.4 | Confident | 51.25 Ų | 51.25 | 15.9 Ų | 15.9 | 19% | 0.193 | 9% | 0.094 | C | C | . | . | H | α-helix | trans | -60.6 | -41.9 | 174.9 | -65.3 | -173.1 | -73.7 | 162.2 | 6 | 112.2 | N2157 T2158 G2159 P2160 L2161 S2166 V2167 H2168 G2210 V2211 | N2157-R2164 VanDerWaalsContact OD1-CD 3.28Å; N2157-R2164 WeakPolarHBondContact OD1-CD 3.26Å; N2157-R2164 PolarHBondContact OD1-NH1 3.08Å; N2157-R2164 VanDerWaalsContact OD1-NH1 3.13Å; T2158-R2164 VanDerWaalsContact O-CG 3.25Å; T2158-R2164 WeakPolarHBondContact O-CG 3.34Å; G2159-R2164 PolarHBondContact O-NE 3.22Å; P2160-R2164 PolarHBondContact O-N 3.15Å; P2160-R2164 VanDerWaalsContact O-N 3.09Å; L2161-R2164 PolarHBondContact O-N 3.09Å; R2164-S2166 VanDerWaalsContact C-N 3.3Å; R2164-S2166 PolarHBondContact O-N 3.26Å; R2164-V2167 PolarHBondContact O-N 3.2Å; R2164-H2168 PolarHBondContact O-N 2.86Å; R2164-H2168 VanDerWaalsContact O-N 3.13Å; R2164-G2210 PolarHBondContact NH1-O 3.25Å; R2164-G2210 VanDerWaalsContact NH1-O 3.1Å; R2164-G2210 PolarHBondContact NH2-O 3.28Å; R2164-V2211 HydrophobicContact CB-CG1 4.17Å |
| 2165 | A | 87.4 | Confident | 89.5 | Confident | 0 Ų | 0 | 15.6 Ų | 15.6 | 0% | 0 | 9% | 0.092 | C | C | . | . | H | α-helix | trans | -64.4 | -33.4 | 171.2 | 0 | 0 | 0 | 0 | 0 | 112.4 | L2161 A2162 L2163 G2169 V2211 V2219 T2222 A2223 | L2161-A2165 WeakPolarHBondContact O-CB 3.32Å; L2161-A2165 PolarHBondContact O-N 3.06Å; A2162-A2165 PolarHBondContact O-N 2.89Å; L2163-A2165 VanDerWaalsContact C-N 3.33Å; L2163-A2165 PolarHBondContact O-N 3.15Å; A2165-G2169 PolarHBondContact O-N 3.28Å; A2165-V2211 HydrophobicContact CB-CG1 4.24Å; A2165-V2219 HydrophobicContact CB-CG1 4.32Å; A2165-T2222 HydrophobicContact CB-CG2 4.38Å; A2165-A2223 HydrophobicContact CB-CB 4.02Å |
| 2166 | S | 90.3 | Very high | 89.5 | Confident | 2 Ų | 2 | 18.9 Ų | 18.9 | 1% | 0.014 | 11% | 0.107 | C | C | . | . | H | α-helix | trans | -66.9 | -42.6 | 174.3 | -56.8 | 0 | 0 | 0 | 0 | 112.5 | R2128 L2131 A2162 L2163 R2164 H2168 G2169 L2170 | R2128-S2166 WeakPolarHBondContact CD-OG 3.42Å; R2128-S2166 PolarHBondContact NH1-OG 3.41Å; L2131-S2166 WeakPolarHBondContact CD2-OG 3.46Å; A2162-S2166 WeakPolarHBondContact O-CB 3.44Å; A2162-S2166 PolarHBondContact O-N 3.14Å; A2162-S2166 PolarHBondContact O-OG 3.17Å; L2163-S2166 CarbonylContact O-C 3.41Å; L2163-S2166 WeakPolarHBondContact O-CA 3.39Å; L2163-S2166 VanDerWaalsContact O-CB 3.26Å; L2163-S2166 WeakPolarHBondContact O-CB 3.42Å; L2163-S2166 PolarHBondContact O-N 3.09Å; R2164-S2166 VanDerWaalsContact C-N 3.3Å; R2164-S2166 PolarHBondContact O-N 3.26Å; S2166-H2168 VanDerWaalsContact C-N 3.32Å; S2166-H2168 PolarHBondContact O-N 3.13Å; S2166-G2169 PolarHBondContact O-N 3.18Å; S2166-L2170 VanDerWaalsContact O-CB 3.29Å; S2166-L2170 WeakPolarHBondContact O-CB 3.27Å; S2166-L2170 PolarHBondContact O-N 3.18Å |
| 2167 | V | 92.5 | Very high | 89.5 | Confident | 4.75 Ų | 4.75 | 18.9 Ų | 18.9 | 3% | 0.029 | 11% | 0.107 | C | C | . | . | H | α-helix | trans | -65.7 | -40.1 | 177.5 | 177.1 | 0 | 0 | 0 | 0 | 111 | V2152 L2155 V2156 L2163 R2164 L2170 V2171 F2209 | V2152-V2167 HydrophobicContact CB-CG1 4.47Å; V2152-V2167 HydrophobicContact CG1-CG1 4.19Å; V2152-V2167 HydrophobicContact CG2-CG1 4.49Å; L2155-V2167 HydrophobicContact CB-CG2 3.89Å; V2156-V2167 HydrophobicContact CB-CG1 4.38Å; L2163-V2167 PolarHBondContact O-N 3.17Å; R2164-V2167 PolarHBondContact O-N 3.2Å; V2167-L2170 WeakPolarHBondContact O-CB 3.4Å; V2167-L2170 PolarHBondContact O-N 2.95Å; V2167-V2171 WeakPolarHBondContact O-CG2 3.28Å; V2167-V2171 PolarHBondContact O-N 3.01Å; V2167-F2209 HydrophobicContact CG1-CD1 4.48Å; V2167-F2209 HydrophobicContact CG1-CE1 4.32Å |
| 2168 | H | 92.3 | Very high | 89.6 | Confident | 3.25 Ų | 3.25 | 17.9 Ų | 17.9 | 2% | 0.015 | 10% | 0.102 | C | C | . | . | H | α-helix | trans | -62.7 | -47.3 | 171.9 | 179 | -93.3 | 0 | 0 | 0 | 111.8 | R2164 S2166 L2170 V2171 V2172 F2200 Y2206 F2209 | R2164-H2168 PolarHBondContact O-N 2.86Å; R2164-H2168 VanDerWaalsContact O-N 3.13Å; S2166-H2168 VanDerWaalsContact C-N 3.32Å; S2166-H2168 PolarHBondContact O-N 3.13Å; H2168-L2170 VanDerWaalsContact C-N 3.29Å; H2168-L2170 PolarHBondContact O-N 3.05Å; H2168-V2171 PolarHBondContact O-N 3.1Å; H2168-V2172 WeakPolarHBondContact O-CG2 3.32Å; H2168-V2172 PolarHBondContact O-N 3.32Å; H2168-V2172 VanDerWaalsContact O-N 3.12Å; H2168-F2200 PolarHBondContact NE2-O 3.11Å; H2168-Y2206 AromaticContact CE1-CE1 3.5Å; H2168-Y2206 VanDerWaalsContact CE1-CE1 3.46Å; H2168-Y2206 WeakPolarHBondContact CE1-CE1 3.4Å; H2168-Y2206 AromaticContact NE2-CD1 3.85Å; H2168-Y2206 AromaticContact NE2-CE1 3.58Å; H2168-F2209 HydrophobicContact CB-CB 4.25Å; H2168-F2209 HydrophobicContact CB-CD1 3.7Å; H2168-F2209 HydrophobicContact CB-CE1 4.34Å; H2168-F2209 HydrophobicContact CB-CG 4.13Å; H2168-F2209 AromaticContact CD2-CD1 3.98Å; H2168-F2209 AromaticContact CD2-CG 3.87Å |
| 2169 | G | 91 | Very high | 89.7 | Confident | 13.75 Ų | 13.75 | 18.3 Ų | 18.3 | 14% | 0.142 | 11% | 0.105 | C | C | . | . | H | α-helix | trans | -60.2 | -36.4 | 176.7 | 0 | 0 | 0 | 0 | 0 | 113.5 | A2165 S2166 V2172 N2173 | A2165-G2169 PolarHBondContact O-N 3.28Å; S2166-G2169 PolarHBondContact O-N 3.18Å; G2169-V2172 PolarHBondContact O-N 3.2Å; G2169-N2173 VanDerWaalsContact O-CB 3.31Å; G2169-N2173 WeakPolarHBondContact O-CB 3.34Å; G2169-N2173 VanDerWaalsContact O-CG 3.3Å; G2169-N2173 PolarHBondContact O-N 3.11Å |
| 2170 | L | 94.1 | Very high | 89.9 | Confident | 7.75 Ų | 7.75 | 21.4 Ų | 21.4 | 4% | 0.041 | 12% | 0.123 | C | C | . | . | H | α-helix | trans | -60.9 | -47 | 175.1 | 175.9 | 60.2 | 0 | 0 | 0 | 111.1 | L2130 L2139 V2152 S2166 V2167 H2168 N2173 I2174 | L2130-L2170 HydrophobicContact CB-CD1 4.34Å; L2130-L2170 HydrophobicContact CB-CD2 4.35Å; L2139-L2170 HydrophobicContact CD1-CD1 3.97Å; V2152-L2170 HydrophobicContact CG2-CD2 4.23Å; V2152-L2170 HydrophobicContact CG2-CG 4.47Å; S2166-L2170 VanDerWaalsContact O-CB 3.29Å; S2166-L2170 WeakPolarHBondContact O-CB 3.27Å; S2166-L2170 PolarHBondContact O-N 3.18Å; V2167-L2170 WeakPolarHBondContact O-CB 3.4Å; V2167-L2170 PolarHBondContact O-N 2.95Å; H2168-L2170 VanDerWaalsContact C-N 3.29Å; H2168-L2170 PolarHBondContact O-N 3.05Å; L2170-N2173 PolarHBondContact O-N 3.16Å; L2170-I2174 HydrophobicContact CD1-CD1 3.84Å; L2170-I2174 HydrophobicContact CD1-CG1 4.19Å; L2170-I2174 HydrophobicContact CG-CD1 3.84Å; L2170-I2174 WeakPolarHBondContact O-CB 3.33Å; L2170-I2174 WeakPolarHBondContact O-CD1 3.42Å; L2170-I2174 VanDerWaalsContact O-CG1 3.25Å; L2170-I2174 WeakPolarHBondContact O-CG1 3.26Å; L2170-I2174 PolarHBondContact O-N 3.2Å |
| 2171 | V | 94.2 | Very high | 89.8 | Confident | 0 Ų | 0 | 19.4 Ų | 19.4 | 0% | 0 | 11% | 0.11 | C | C | . | . | H | α-helix | trans | -61 | -47.8 | 176.9 | 175.6 | 0 | 0 | 0 | 0 | 111.2 | V2152 V2167 H2168 N2173 I2174 I2175 F2200 F2209 L2265 | V2152-V2171 HydrophobicContact CB-CG2 4.11Å; V2152-V2171 HydrophobicContact CG1-CG2 3.38Å; V2152-V2171 VanDerWaalsContact CG1-CG2 3.41Å; V2152-V2171 HydrophobicContact CG2-CG2 3.54Å; V2167-V2171 WeakPolarHBondContact O-CG2 3.28Å; V2167-V2171 PolarHBondContact O-N 3.01Å; H2168-V2171 PolarHBondContact O-N 3.1Å; V2171-N2173 VanDerWaalsContact C-N 3.3Å; V2171-N2173 PolarHBondContact O-N 3.1Å; V2171-I2174 PolarHBondContact O-N 3.11Å; V2171-I2175 HydrophobicContact CG1-CD1 3.78Å; V2171-I2175 HydrophobicContact CG1-CG1 4.44Å; V2171-I2175 WeakPolarHBondContact O-CG1 3.41Å; V2171-I2175 PolarHBondContact O-N 3.24Å; V2171-F2200 HydrophobicContact CG1-CD1 3.89Å; V2171-F2200 HydrophobicContact CG1-CE1 3.77Å; V2171-F2200 HydrophobicContact CG1-CE2 4.46Å; V2171-F2200 HydrophobicContact CG1-CG 4.3Å; V2171-F2200 HydrophobicContact CG1-CZ 4.09Å; V2171-F2209 HydrophobicContact CG2-CE1 3.95Å; V2171-F2209 HydrophobicContact CG2-CZ 4.04Å; V2171-L2265 HydrophobicContact CG1-CD2 4.31Å |
| 2172 | V | 92.5 | Very high | 89.2 | Confident | 18.25 Ų | 18.25 | 22.6 Ų | 22.6 | 11% | 0.111 | 13% | 0.134 | C | C | . | . | H | α-helix | trans | -57.3 | -45.6 | 178.2 | 170.6 | 0 | 0 | 0 | 0 | 110.9 | H2168 G2169 I2175 H2176 L2197 F2201 | H2168-V2172 WeakPolarHBondContact O-CG2 3.32Å; H2168-V2172 PolarHBondContact O-N 3.32Å; H2168-V2172 VanDerWaalsContact O-N 3.12Å; G2169-V2172 PolarHBondContact O-N 3.2Å; V2172-I2175 PolarHBondContact O-N 3.38Å; V2172-H2176 VanDerWaalsContact O-CB 3.28Å; V2172-H2176 WeakPolarHBondContact O-CB 3.42Å; V2172-H2176 PolarHBondContact O-N 3.21Å; V2172-L2197 HydrophobicContact CG1-CD1 3.96Å; V2172-F2201 HydrophobicContact CG1-CE1 3.89Å; V2172-F2201 HydrophobicContact CG1-CE2 4.44Å; V2172-F2201 HydrophobicContact CG1-CZ 3.63Å; V2172-F2201 HydrophobicContact CG2-CE1 4.03Å; V2172-F2201 HydrophobicContact CG2-CZ 4.41Å |
| 2173 | N | 93.5 | Very high | 88.4 | Confident | 32.75 Ų | 32.75 | 23.2 Ų | 23.2 | 18% | 0.175 | 14% | 0.137 | C | C | . | . | H | α-helix | trans | -71.6 | -31.2 | -179.7 | -76.5 | -10.1 | 0 | 0 | 0 | 113.3 | S2134 G2169 L2170 V2171 S2177 | S2134-N2173 WeakPolarHBondContact OG-CB 3.25Å; S2134-N2173 PolarHBondContact OG-ND2 2.88Å; G2169-N2173 VanDerWaalsContact O-CB 3.31Å; G2169-N2173 WeakPolarHBondContact O-CB 3.34Å; G2169-N2173 VanDerWaalsContact O-CG 3.3Å; G2169-N2173 PolarHBondContact O-N 3.11Å; L2170-N2173 PolarHBondContact O-N 3.16Å; V2171-N2173 VanDerWaalsContact C-N 3.3Å; V2171-N2173 PolarHBondContact O-N 3.1Å; N2173-S2177 VanDerWaalsContact O-CB 3.23Å; N2173-S2177 WeakPolarHBondContact O-CB 3.34Å; N2173-S2177 PolarHBondContact O-N 3.2Å; N2173-S2177 PolarHBondContact O-OG 3Å |
| 2174 | I | 94 | Very high | 87.3 | Confident | 0 Ų | 0 | 28.8 Ų | 28.8 | 0% | 0 | 18% | 0.176 | C | C | . | . | H | α-helix | trans | -64.6 | -50.9 | 171.7 | -71.7 | 162.2 | 0 | 0 | 0 | 110.2 | V2141 L2145 L2148 F2149 L2170 V2171 H2176 S2177 L2178 | V2141-I2174 HydrophobicContact CB-CG2 4.42Å; V2141-I2174 HydrophobicContact CG1-CB 4.42Å; V2141-I2174 HydrophobicContact CG1-CG1 4.34Å; V2141-I2174 HydrophobicContact CG1-CG2 4.14Å; L2145-I2174 HydrophobicContact CD1-CG2 3.64Å; L2148-I2174 HydrophobicContact CB-CD1 3.85Å; L2148-I2174 HydrophobicContact CD1-CD1 4.07Å; L2148-I2174 HydrophobicContact CD1-CG1 4.23Å; L2148-I2174 HydrophobicContact CG-CD1 4.47Å; F2149-I2174 HydrophobicContact CD1-CD1 4.49Å; F2149-I2174 HydrophobicContact CE1-CB 4.47Å; F2149-I2174 HydrophobicContact CE1-CD1 4.39Å; F2149-I2174 HydrophobicContact CE1-CG2 3.7Å; F2149-I2174 HydrophobicContact CZ-CG2 4.26Å; L2170-I2174 HydrophobicContact CD1-CD1 3.84Å; L2170-I2174 HydrophobicContact CD1-CG1 4.19Å; L2170-I2174 HydrophobicContact CG-CD1 3.84Å; L2170-I2174 WeakPolarHBondContact O-CB 3.33Å; L2170-I2174 WeakPolarHBondContact O-CD1 3.42Å; L2170-I2174 VanDerWaalsContact O-CG1 3.25Å; L2170-I2174 WeakPolarHBondContact O-CG1 3.26Å; L2170-I2174 PolarHBondContact O-N 3.2Å; V2171-I2174 PolarHBondContact O-N 3.11Å; I2174-H2176 VanDerWaalsContact C-N 3.32Å; I2174-H2176 PolarHBondContact O-N 3.02Å; I2174-S2177 PolarHBondContact O-N 3.2Å; I2174-L2178 HydrophobicContact CG2-CD1 4.2Å; I2174-L2178 WeakPolarHBondContact O-CG 3.45Å; I2174-L2178 PolarHBondContact O-N 2.97Å |
| 2175 | I | 92.4 | Very high | 87.1 | Confident | 0 Ų | 0 | 26.9 Ų | 26.9 | 0% | 0 | 17% | 0.17 | C | C | . | . | H | α-helix | trans | -62.5 | -42.6 | 179.5 | -60.8 | 165.7 | 0 | 0 | 0 | 110.3 | V2171 V2172 S2177 L2178 C2179 L2193 L2197 F2200 L2268 | V2171-I2175 HydrophobicContact CG1-CD1 3.78Å; V2171-I2175 HydrophobicContact CG1-CG1 4.44Å; V2171-I2175 WeakPolarHBondContact O-CG1 3.41Å; V2171-I2175 PolarHBondContact O-N 3.24Å; V2172-I2175 PolarHBondContact O-N 3.38Å; I2175-S2177 PolarHBondContact O-N 3.48Å; I2175-L2178 WeakPolarHBondContact O-CB 3.22Å; I2175-L2178 PolarHBondContact O-N 2.94Å; I2175-C2179 PolarHBondContact O-N 3.2Å; I2175-C2179 PolarHBondContact O-SG 3.17Å; I2175-L2193 WeakPolarHBondContact CG2-O 3.37Å; I2175-L2197 HydrophobicContact CB-CD1 4.11Å; I2175-L2197 HydrophobicContact CG2-CB 3.81Å; I2175-L2197 HydrophobicContact CG2-CD1 4.07Å; I2175-L2197 HydrophobicContact CG2-CG 4.47Å; I2175-F2200 HydrophobicContact CD1-CD2 3.46Å; I2175-F2200 VanDerWaalsContact CD1-CD2 3.44Å; I2175-F2200 HydrophobicContact CD1-CE2 3.68Å; I2175-F2200 HydrophobicContact CD1-CG 4.17Å; I2175-F2200 HydrophobicContact CD1-CZ 4.45Å; I2175-L2268 HydrophobicContact CD1-CD1 3.65Å; I2175-L2268 HydrophobicContact CG1-CD1 3.84Å; I2175-L2268 HydrophobicContact CG1-CD2 4.44Å; I2175-L2268 HydrophobicContact CG2-CD2 4.39Å |
| 2176 | H | 92.1 | Very high | 87 | Confident | 72.75 Ų | 72.75 | 30.3 Ų | 30.3 | 34% | 0.337 | 19% | 0.19 | S | C | . | . | H | α-helix | trans | -60.6 | -46.4 | 174.9 | -179.5 | -87.6 | 0 | 0 | 0 | 111.6 | V2172 I2174 L2178 C2179 T2180 | V2172-H2176 VanDerWaalsContact O-CB 3.28Å; V2172-H2176 WeakPolarHBondContact O-CB 3.42Å; V2172-H2176 PolarHBondContact O-N 3.21Å; I2174-H2176 VanDerWaalsContact C-N 3.32Å; I2174-H2176 PolarHBondContact O-N 3.02Å; H2176-L2178 VanDerWaalsContact C-N 3.31Å; H2176-L2178 PolarHBondContact O-N 3.03Å; H2176-C2179 WeakPolarHBondContact O-CA 3.46Å; H2176-C2179 WeakPolarHBondContact O-CB 3.38Å; H2176-C2179 PolarHBondContact O-N 3.27Å; H2176-C2179 VanDerWaalsContact O-N 3.08Å; H2176-T2180 PolarHBondContact O-N 3.13Å; H2176-T2180 PolarHBondContact O-OG1 3.33Å; H2176-T2180 VanDerWaalsContact O-OG1 3.11Å |
| 2177 | S | 91.7 | Very high | 86.8 | Confident | 0 Ų | 0 | 35.4 Ų | 35.4 | 0% | 0 | 21% | 0.214 | C | C | . | . | H | α-helix | trans | -62.5 | -36.2 | 177.8 | -67.3 | 0 | 0 | 0 | 0 | 112.4 | S2134 N2137 N2173 I2174 I2175 T2180 C2181 | S2134-S2177 PolarHBondContact O-OG 3.22Å; S2134-S2177 VanDerWaalsContact O-OG 3.11Å; N2137-S2177 PolarHBondContact N-OG 3.04Å; N2173-S2177 VanDerWaalsContact O-CB 3.23Å; N2173-S2177 WeakPolarHBondContact O-CB 3.34Å; N2173-S2177 PolarHBondContact O-N 3.2Å; N2173-S2177 PolarHBondContact O-OG 3Å; I2174-S2177 PolarHBondContact O-N 3.2Å; I2175-S2177 PolarHBondContact O-N 3.48Å; S2177-T2180 PolarHBondContact O-N 2.94Å; S2177-T2180 PolarHBondContact O-OG1 3.2Å; S2177-C2181 WeakPolarHBondContact O-CB 3.29Å; S2177-C2181 PolarHBondContact O-N 3.12Å |
| 2178 | L | 89.8 | Confident | 86.5 | Confident | 2 Ų | 2 | 37.2 Ų | 37.2 | 1% | 0.01 | 23% | 0.234 | C | C | . | . | H | α-helix | trans | -63.9 | -40.4 | 171.2 | -71 | 168.1 | 0 | 0 | 0 | 111.8 | V2141 I2142 L2145 I2174 I2175 H2176 T2180 F2185 L2193 | V2141-L2178 HydrophobicContact CB-CD2 4.39Å; V2141-L2178 HydrophobicContact CG1-CD1 4.34Å; V2141-L2178 HydrophobicContact CG1-CD2 3.87Å; V2141-L2178 HydrophobicContact CG1-CG 3.84Å; V2141-L2178 HydrophobicContact CG2-CD2 3.69Å; V2141-L2178 HydrophobicContact CG2-CG 3.89Å; I2142-L2178 HydrophobicContact CG1-CD2 4.23Å; L2145-L2178 HydrophobicContact CD1-CD1 4.02Å; L2145-L2178 HydrophobicContact CD2-CD1 4.22Å; I2174-L2178 HydrophobicContact CG2-CD1 4.2Å; I2174-L2178 WeakPolarHBondContact O-CG 3.45Å; I2174-L2178 PolarHBondContact O-N 2.97Å; I2175-L2178 WeakPolarHBondContact O-CB 3.22Å; I2175-L2178 PolarHBondContact O-N 2.94Å; H2176-L2178 VanDerWaalsContact C-N 3.31Å; H2176-L2178 PolarHBondContact O-N 3.03Å; L2178-T2180 VanDerWaalsContact C-N 3.32Å; L2178-T2180 PolarHBondContact O-N 3.12Å; L2178-F2185 HydrophobicContact CD2-CE2 4.25Å; L2178-F2185 HydrophobicContact CD2-CZ 4.17Å; L2178-F2185 WeakPolarHBondContact O-CD2 3.36Å; L2178-F2185 WeakPolarHBondContact O-CE2 3.28Å; L2178-L2193 HydrophobicContact CB-CD1 4.02Å |
| 2179 | C | 88.7 | Confident | 86.4 | Confident | 19 Ų | 19 | 37.2 Ų | 37.2 | 13% | 0.128 | 23% | 0.234 | C | C | . | . | H | α-helix | trans | -65 | -34.6 | 176.3 | -65.5 | 0 | 0 | 0 | 0 | 113.1 | I2175 H2176 L2193 | I2175-C2179 PolarHBondContact O-N 3.2Å; I2175-C2179 PolarHBondContact O-SG 3.17Å; H2176-C2179 WeakPolarHBondContact O-CA 3.46Å; H2176-C2179 WeakPolarHBondContact O-CB 3.38Å; H2176-C2179 PolarHBondContact O-N 3.27Å; H2176-C2179 VanDerWaalsContact O-N 3.08Å; C2179-L2193 WeakPolarHBondContact SG-CB 3.19Å |
| 2180 | T | 87.8 | Confident | 86.2 | Confident | 72.75 Ų | 72.75 | 38.6 Ų | 38.6 | 45% | 0.446 | 24% | 0.236 | S | C | . | . | H | α-helix | trans | -98.4 | -2.4 | -176.4 | 58.7 | 0 | 0 | 0 | 0 | 113.9 | H2176 S2177 L2178 | H2176-T2180 PolarHBondContact O-N 3.13Å; H2176-T2180 PolarHBondContact O-OG1 3.33Å; H2176-T2180 VanDerWaalsContact O-OG1 3.11Å; S2177-T2180 PolarHBondContact O-N 2.94Å; S2177-T2180 PolarHBondContact O-OG1 3.2Å; L2178-T2180 VanDerWaalsContact C-N 3.32Å; L2178-T2180 PolarHBondContact O-N 3.12Å |
| 2181 | C | 81.4 | Confident | 86 | Confident | 13.75 Ų | 13.75 | 41.3 Ų | 41.3 | 9% | 0.093 | 25% | 0.253 | C | S | . | . | trans | -63.3 | 136.2 | -179.1 | -161.2 | 0 | 0 | 0 | 0 | 110 | I2142 S2177 S2183 F2185 | I2142-C2181 HydrophobicContact CD1-CB 4.4Å; I2142-C2181 VanDerWaalsContact CD1-SG 3.56Å; I2142-C2181 WeakPolarHBondContact CD1-SG 3.33Å; S2177-C2181 WeakPolarHBondContact O-CB 3.29Å; S2177-C2181 PolarHBondContact O-N 3.12Å; C2181-S2183 WeakPolarHBondContact CB-OG 3.39Å; C2181-S2183 PolarHBondContact O-N 2.98Å; C2181-S2183 VanDerWaalsContact O-N 3.12Å; C2181-S2183 PolarHBondContact SG-OG 3.1Å; C2181-S2183 VanDerWaalsContact SG-OG 3.33Å; C2181-F2185 HydrophobicContact CB-CE2 4.36Å | ||
| 2182 | P | 70.1 | Confident | 85.9 | Confident | 131.75 Ų | 131.75 | 44.8 Ų | 44.8 | 86% | 0.856 | 27% | 0.271 | S | S | * | . | S | Bend | trans | -68.8 | -7.9 | 177.7 | 26.4 | -34.8 | 0 | 0 | 0 | 113.8 | ||
| 2183 | S | 66.5 | Low | 85.8 | Confident | 39.5 Ų | 39.5 | 43.9 Ų | 43.9 | 28% | 0.276 | 27% | 0.266 | S | S | . | . | S | Bend | trans | -63.3 | 151.9 | 176.4 | 56.7 | 0 | 0 | 0 | 0 | 112.4 | I2142 C2181 F2185 | I2142-S2183 VanDerWaalsContact CD1-OG 3.3Å; I2142-S2183 WeakPolarHBondContact CD1-OG 3.23Å; C2181-S2183 WeakPolarHBondContact CB-OG 3.39Å; C2181-S2183 PolarHBondContact O-N 2.98Å; C2181-S2183 VanDerWaalsContact O-N 3.12Å; C2181-S2183 PolarHBondContact SG-OG 3.1Å; C2181-S2183 VanDerWaalsContact SG-OG 3.33Å; S2183-F2185 PolarHBondContact O-N 3.23Å; S2183-F2185 VanDerWaalsContact OG-CD2 3.24Å; S2183-F2185 WeakPolarHBondContact OG-CD2 3.41Å; S2183-F2185 WeakPolarHBondContact OG-CE2 3.34Å |
| 2184 | S | 64.1 | Low | 85.7 | Confident | 120 Ų | 120 | 47.8 Ų | 47.8 | 84% | 0.839 | 28% | 0.278 | S | S | * | . | trans | -69.6 | 45.6 | -167.9 | -43.6 | 0 | 0 | 0 | 0 | 116 | T2186 | S2184-T2186 PolarHBondContact O-N 3.1Š| ||
| 2185 | F | 83.3 | Confident | 85.6 | Confident | 11.25 Ų | 11.25 | 52.7 Ų | 52.7 | 5% | 0.049 | 30% | 0.304 | C | S | . | . | trans | -64.3 | 135.9 | 170.2 | -67.6 | -54.7 | 0 | 0 | 0 | 110.6 | I2142 L2178 C2181 S2183 T2189 K2190 C2272 D2275 I2276 | I2142-F2185 HydrophobicContact CD1-CE2 4.29Å; I2142-F2185 HydrophobicContact CD1-CZ 4.25Å; I2142-F2185 HydrophobicContact CG1-CZ 4.48Å; L2178-F2185 HydrophobicContact CD2-CE2 4.25Å; L2178-F2185 HydrophobicContact CD2-CZ 4.17Å; L2178-F2185 WeakPolarHBondContact O-CD2 3.36Å; L2178-F2185 WeakPolarHBondContact O-CE2 3.28Å; C2181-F2185 HydrophobicContact CB-CE2 4.36Å; S2183-F2185 PolarHBondContact O-N 3.23Å; S2183-F2185 VanDerWaalsContact OG-CD2 3.24Å; S2183-F2185 WeakPolarHBondContact OG-CD2 3.41Å; S2183-F2185 WeakPolarHBondContact OG-CE2 3.34Å; F2185-T2189 HydrophobicContact CB-CG2 4.25Å; F2185-T2189 HydrophobicContact CD1-CG2 3.85Å; F2185-T2189 HydrophobicContact CE1-CG2 4.49Å; F2185-T2189 HydrophobicContact CG-CG2 4.23Å; F2185-K2190 HydrophobicContact CB-CG 4.04Å; F2185-K2190 WeakPolarHBondContact O-CE 3.38Å; F2185-C2272 HydrophobicContact CE1-CB 4.26Å; F2185-D2275 VanDerWaalsContact CA-OD2 3.28Å; F2185-D2275 WeakPolarHBondContact CA-OD2 3.35Å; F2185-D2275 HydrophobicContact CD1-CB 3.84Å; F2185-D2275 HydrophobicContact CE1-CB 4.42Å; F2185-I2276 HydrophobicContact CE1-CD1 3.98Å; F2185-I2276 HydrophobicContact CE1-CG1 4.08Å; F2185-I2276 HydrophobicContact CZ-CD1 4.14Å | ||
| 2186 | T | 85.7 | Confident | 85.5 | Confident | 71.25 Ų | 71.25 | 53.4 Ų | 53.4 | 44% | 0.437 | 31% | 0.31 | S | S | . | . | trans | -67.8 | 155.4 | 175 | 62.5 | 0 | 0 | 0 | 0 | 110.6 | S2184 G2188 T2189 K2190 D2275 | S2184-T2186 PolarHBondContact O-N 3.1Å; T2186-G2188 PolarHBondContact O-N 3.13Å; T2186-T2189 WeakPolarHBondContact O-CB 3.2Å; T2186-T2189 PolarHBondContact O-N 3.05Å; T2186-T2189 VanDerWaalsContact O-N 3.15Å; T2186-T2189 PolarHBondContact OG1-N 3.12Å; T2186-T2189 PolarHBondContact OG1-OG1 3.15Å; T2186-T2189 VanDerWaalsContact OG1-OG1 3.06Å; T2186-K2190 PolarHBondContact O-N 2.95Å; T2186-D2275 VanDerWaalsContact CG2-OD1 3.23Å; T2186-D2275 WeakPolarHBondContact CG2-OD1 3.34Å; T2186-D2275 PolarHBondContact N-OD2 3.28Å; T2186-D2275 PolarHBondContact OG1-OD1 3.42Å; T2186-D2275 PolarHBondContact OG1-OD2 3.3Å | ||
| 2187 | E | 85.5 | Confident | 85.5 | Confident | 109.25 Ų | 109.25 | 51.3 Ų | 51.3 | 51% | 0.511 | 30% | 0.301 | S | S | . | . | H | α-helix | trans | -63.1 | -25 | 177.6 | -74.1 | -55.4 | 129.9 | 0 | 0 | 112.7 | K2190 T2191 R2194 | E2187-K2190 WeakPolarHBondContact OE1-CD 3.36Å; E2187-K2190 IonicContact OE1-NZ 3.69Å; E2187-K2190 PolarHBondContact OE1-NZ 2.96Å; E2187-K2190 VanDerWaalsContact OE1-NZ 3.07Å; E2187-T2191 VanDerWaalsContact O-CB 3.29Å; E2187-T2191 WeakPolarHBondContact O-CB 3.34Å; E2187-T2191 PolarHBondContact O-N 3.14Å; E2187-T2191 PolarHBondContact O-OG1 3.25Å; E2187-R2194 IonicContact OE2-CZ 3.83Å; E2187-R2194 IonicContact OE2-NH1 3.1Å; E2187-R2194 PolarHBondContact OE2-NH1 3.28Å; E2187-R2194 IonicContact OE2-NH2 3.12Å; E2187-R2194 PolarHBondContact OE2-NH2 3.28Å |
| 2188 | G | 86.7 | Confident | 85.4 | Confident | 43 Ų | 43 | 55.4 Ų | 55.4 | 44% | 0.443 | 33% | 0.326 | S | S | . | . | H | α-helix | trans | -62.4 | -54.8 | 170.3 | 0 | 0 | 0 | 0 | 0 | 111.5 | T2186 K2190 T2191 N2192 | T2186-G2188 PolarHBondContact O-N 3.13Å; G2188-K2190 VanDerWaalsContact C-N 3.35Å; G2188-K2190 PolarHBondContact O-N 3.21Å; G2188-T2191 WeakPolarHBondContact O-CB 3.34Å; G2188-T2191 PolarHBondContact O-N 3.43Å; G2188-T2191 VanDerWaalsContact O-N 3.09Å; G2188-N2192 PolarHBondContact O-N 3.38Å |
| 2189 | T | 88.7 | Confident | 85.5 | Confident | 2.25 Ų | 2.25 | 58.3 Ų | 58.3 | 1% | 0.014 | 34% | 0.34 | C | S | . | . | H | α-helix | trans | -54.7 | -48.4 | 175.3 | -56.6 | 0 | 0 | 0 | 0 | 111.8 | F2185 T2186 T2191 N2192 L2193 T2271 D2275 | F2185-T2189 HydrophobicContact CB-CG2 4.25Å; F2185-T2189 HydrophobicContact CD1-CG2 3.85Å; F2185-T2189 HydrophobicContact CE1-CG2 4.49Å; F2185-T2189 HydrophobicContact CG-CG2 4.23Å; T2186-T2189 WeakPolarHBondContact O-CB 3.2Å; T2186-T2189 PolarHBondContact O-N 3.05Å; T2186-T2189 VanDerWaalsContact O-N 3.15Å; T2186-T2189 PolarHBondContact OG1-N 3.12Å; T2186-T2189 PolarHBondContact OG1-OG1 3.15Å; T2186-T2189 VanDerWaalsContact OG1-OG1 3.06Å; T2189-T2191 VanDerWaalsContact C-N 3.28Å; T2189-T2191 PolarHBondContact O-N 3.11Å; T2189-N2192 PolarHBondContact O-N 3.17Å; T2189-L2193 HydrophobicContact CG2-CD1 4.17Å; T2189-L2193 HydrophobicContact CG2-CG 4.42Å; T2189-L2193 VanDerWaalsContact O-CG 3.32Å; T2189-L2193 WeakPolarHBondContact O-CG 3.35Å; T2189-L2193 PolarHBondContact O-N 3.18Å; T2189-T2271 HydrophobicContact CG2-CG2 3.78Å; T2189-D2275 WeakPolarHBondContact CB-OD2 3.19Å; T2189-D2275 WeakPolarHBondContact CG2-OD2 3.27Å; T2189-D2275 PolarHBondContact OG1-OD2 3.11Å |
| 2190 | K | 87.9 | Confident | 85.6 | Confident | 42.5 Ų | 42.5 | 57.4 Ų | 57.4 | 19% | 0.185 | 33% | 0.334 | C | S | . | . | H | α-helix | trans | -61.4 | -35.6 | 177.4 | -67.8 | -178.9 | -165.7 | 161.7 | 0 | 112.8 | F2185 T2186 E2187 G2188 L2193 R2194 | F2185-K2190 HydrophobicContact CB-CG 4.04Å; F2185-K2190 WeakPolarHBondContact O-CE 3.38Å; T2186-K2190 PolarHBondContact O-N 2.95Å; E2187-K2190 WeakPolarHBondContact OE1-CD 3.36Å; E2187-K2190 IonicContact OE1-NZ 3.69Å; E2187-K2190 PolarHBondContact OE1-NZ 2.96Å; E2187-K2190 VanDerWaalsContact OE1-NZ 3.07Å; G2188-K2190 VanDerWaalsContact C-N 3.35Å; G2188-K2190 PolarHBondContact O-N 3.21Å; K2190-L2193 PolarHBondContact O-N 3.01Å; K2190-R2194 WeakPolarHBondContact O-CB 3.49Å; K2190-R2194 WeakPolarHBondContact O-CD 3.39Å; K2190-R2194 VanDerWaalsContact O-CG 3.26Å; K2190-R2194 WeakPolarHBondContact O-CG 3.25Å; K2190-R2194 PolarHBondContact O-N 3.12Å |
| 2191 | T | 90 | Very high | 85.6 | Confident | 64.5 Ų | 64.5 | 57.5 Ų | 57.5 | 40% | 0.396 | 33% | 0.328 | S | S | . | . | H | α-helix | trans | -66.3 | -44.2 | 176.7 | -59.1 | 0 | 0 | 0 | 0 | 110.8 | E2187 G2188 T2189 L2193 R2194 L2195 | E2187-T2191 VanDerWaalsContact O-CB 3.29Å; E2187-T2191 WeakPolarHBondContact O-CB 3.34Å; E2187-T2191 PolarHBondContact O-N 3.14Å; E2187-T2191 PolarHBondContact O-OG1 3.25Å; G2188-T2191 WeakPolarHBondContact O-CB 3.34Å; G2188-T2191 PolarHBondContact O-N 3.43Å; G2188-T2191 VanDerWaalsContact O-N 3.09Å; T2189-T2191 VanDerWaalsContact C-N 3.28Å; T2189-T2191 PolarHBondContact O-N 3.11Å; T2191-L2193 PolarHBondContact O-N 2.89Å; T2191-R2194 PolarHBondContact O-N 3.27Å; T2191-L2195 HydrophobicContact CG2-CD1 4.45Å; T2191-L2195 WeakPolarHBondContact O-CG 3.38Å; T2191-L2195 PolarHBondContact O-N 3.07Å |
| 2192 | N | 90.8 | Very high | 85.9 | Confident | 73.25 Ų | 73.25 | 61.1 Ų | 61.1 | 39% | 0.392 | 35% | 0.346 | S | S | . | . | H | α-helix | trans | -63.2 | -42.6 | 175.5 | -68.2 | -6.7 | 0 | 0 | 0 | 112 | G2188 T2189 R2194 L2195 A2196 T2271 | G2188-N2192 PolarHBondContact O-N 3.38Å; T2189-N2192 PolarHBondContact O-N 3.17Å; N2192-R2194 VanDerWaalsContact C-N 3.34Å; N2192-R2194 PolarHBondContact O-N 3.23Å; N2192-L2195 WeakPolarHBondContact O-CB 3.31Å; N2192-L2195 PolarHBondContact O-N 3.22Å; N2192-L2195 VanDerWaalsContact O-N 3.16Å; N2192-A2196 WeakPolarHBondContact O-CB 3.41Å; N2192-A2196 PolarHBondContact O-N 3.09Å; N2192-T2271 HydrophobicContact CB-CG2 3.7Å |
| 2193 | L | 91.4 | Very high | 86.6 | Confident | 0 Ų | 0 | 59.2 Ų | 59.2 | 0% | 0 | 33% | 0.334 | C | S | . | . | H | α-helix | trans | -62 | -39.4 | 175.2 | -67.1 | 174.7 | 0 | 0 | 0 | 112.4 | I2175 L2178 C2179 T2189 K2190 T2191 A2196 L2197 L2268 T2271 | I2175-L2193 WeakPolarHBondContact CG2-O 3.37Å; L2178-L2193 HydrophobicContact CB-CD1 4.02Å; C2179-L2193 WeakPolarHBondContact SG-CB 3.19Å; T2189-L2193 HydrophobicContact CG2-CD1 4.17Å; T2189-L2193 HydrophobicContact CG2-CG 4.42Å; T2189-L2193 VanDerWaalsContact O-CG 3.32Å; T2189-L2193 WeakPolarHBondContact O-CG 3.35Å; T2189-L2193 PolarHBondContact O-N 3.18Å; K2190-L2193 PolarHBondContact O-N 3.01Å; T2191-L2193 PolarHBondContact O-N 2.89Å; L2193-A2196 PolarHBondContact O-N 3.26Å; L2193-L2197 WeakPolarHBondContact O-CB 3.27Å; L2193-L2197 PolarHBondContact O-N 3.05Å; L2193-L2268 HydrophobicContact CD2-CD2 3.57Å; L2193-T2271 HydrophobicContact CD2-CG2 4.31Å; L2193-T2271 HydrophobicContact CG-CG2 4.32Å |
| 2194 | R | 91.4 | Very high | 87.7 | Confident | 114.25 Ų | 114.25 | 62.1 Ų | 62.1 | 43% | 0.431 | 34% | 0.341 | S | S | . | . | H | α-helix | trans | -65.2 | -39.1 | 174.1 | -71.6 | 171.7 | -163.9 | 128.1 | -0.5 | 111.9 | E2187 K2190 T2191 N2192 L2197 T2198 | E2187-R2194 IonicContact OE2-CZ 3.83Å; E2187-R2194 IonicContact OE2-NH1 3.1Å; E2187-R2194 PolarHBondContact OE2-NH1 3.28Å; E2187-R2194 IonicContact OE2-NH2 3.12Å; E2187-R2194 PolarHBondContact OE2-NH2 3.28Å; K2190-R2194 WeakPolarHBondContact O-CB 3.49Å; K2190-R2194 WeakPolarHBondContact O-CD 3.39Å; K2190-R2194 VanDerWaalsContact O-CG 3.26Å; K2190-R2194 WeakPolarHBondContact O-CG 3.25Å; K2190-R2194 PolarHBondContact O-N 3.12Å; T2191-R2194 PolarHBondContact O-N 3.27Å; N2192-R2194 VanDerWaalsContact C-N 3.34Å; N2192-R2194 PolarHBondContact O-N 3.23Å; R2194-L2197 WeakPolarHBondContact O-CB 3.37Å; R2194-L2197 PolarHBondContact O-N 3.23Å; R2194-T2198 WeakPolarHBondContact O-CG2 3.27Å; R2194-T2198 PolarHBondContact O-N 3.21Å; R2194-T2198 VanDerWaalsContact O-N 3.09Å |
| 2195 | L | 92.1 | Very high | 88.8 | Confident | 103.75 Ų | 103.75 | 56.4 Ų | 56.4 | 54% | 0.543 | 30% | 0.301 | S | S | . | . | H | α-helix | trans | -64.2 | -48.1 | 175.3 | -72.1 | 171.9 | 0 | 0 | 0 | 110.9 | T2191 N2192 L2197 T2198 E2199 | T2191-L2195 HydrophobicContact CG2-CD1 4.45Å; T2191-L2195 WeakPolarHBondContact O-CG 3.38Å; T2191-L2195 PolarHBondContact O-N 3.07Å; N2192-L2195 WeakPolarHBondContact O-CB 3.31Å; N2192-L2195 PolarHBondContact O-N 3.22Å; N2192-L2195 VanDerWaalsContact O-N 3.16Å; L2195-L2197 VanDerWaalsContact C-N 3.31Å; L2195-L2197 PolarHBondContact O-N 3.03Å; L2195-T2198 WeakPolarHBondContact O-CA 3.23Å; L2195-T2198 PolarHBondContact O-N 3.24Å; L2195-T2198 VanDerWaalsContact O-N 3.1Å; L2195-T2198 PolarHBondContact O-OG1 3.16Å; L2195-E2199 PolarHBondContact O-N 3.27Å |
| 2196 | A | 90.4 | Very high | 89.1 | Confident | 15 Ų | 15 | 56.5 Ų | 56.5 | 12% | 0.124 | 30% | 0.301 | C | S | . | . | H | α-helix | trans | -58.3 | -43.1 | 174.9 | 0 | 0 | 0 | 0 | 0 | 111.5 | N2192 L2193 T2198 E2199 F2200 L2268 | N2192-A2196 WeakPolarHBondContact O-CB 3.41Å; N2192-A2196 PolarHBondContact O-N 3.09Å; L2193-A2196 PolarHBondContact O-N 3.26Å; A2196-T2198 VanDerWaalsContact C-N 3.29Å; A2196-T2198 PolarHBondContact O-N 3.32Å; A2196-E2199 WeakPolarHBondContact O-CA 3.39Å; A2196-E2199 VanDerWaalsContact O-CB 3.25Å; A2196-E2199 WeakPolarHBondContact O-CB 3.25Å; A2196-E2199 PolarHBondContact O-N 3.23Å; A2196-F2200 VanDerWaalsContact O-CD2 3.29Å; A2196-F2200 WeakPolarHBondContact O-CD2 3.39Å; A2196-F2200 PolarHBondContact O-N 3.05Å; A2196-F2200 VanDerWaalsContact O-N 3.15Å; A2196-L2268 HydrophobicContact CB-CD1 4.49Å; A2196-L2268 HydrophobicContact CB-CD2 3.43Å; A2196-L2268 HydrophobicContact CB-CG 4.12Å |
| 2197 | L | 91.4 | Very high | 89.1 | Confident | 27.5 Ų | 27.5 | 61.2 Ų | 61.2 | 14% | 0.144 | 31% | 0.311 | C | S | . | . | H | α-helix | trans | -55.5 | -43 | 174.2 | -174.5 | 64.9 | 0 | 0 | 0 | 112 | V2172 I2175 L2193 R2194 L2195 E2199 F2200 F2201 | V2172-L2197 HydrophobicContact CG1-CD1 3.96Å; I2175-L2197 HydrophobicContact CB-CD1 4.11Å; I2175-L2197 HydrophobicContact CG2-CB 3.81Å; I2175-L2197 HydrophobicContact CG2-CD1 4.07Å; I2175-L2197 HydrophobicContact CG2-CG 4.47Å; L2193-L2197 WeakPolarHBondContact O-CB 3.27Å; L2193-L2197 PolarHBondContact O-N 3.05Å; R2194-L2197 WeakPolarHBondContact O-CB 3.37Å; R2194-L2197 PolarHBondContact O-N 3.23Å; L2195-L2197 VanDerWaalsContact C-N 3.31Å; L2195-L2197 PolarHBondContact O-N 3.03Å; L2197-E2199 VanDerWaalsContact C-N 3.3Å; L2197-E2199 PolarHBondContact O-N 3.23Å; L2197-F2200 PolarHBondContact O-N 3.08Å; L2197-F2201 HydrophobicContact CD1-CE2 4.23Å; L2197-F2201 HydrophobicContact CD1-CZ 4.25Å; L2197-F2201 HydrophobicContact CG-CE2 4Å; L2197-F2201 HydrophobicContact CG-CZ 4.45Å; L2197-F2201 VanDerWaalsContact O-CD2 3.26Å; L2197-F2201 WeakPolarHBondContact O-CD2 3.4Å; L2197-F2201 WeakPolarHBondContact O-CE2 3.35Å |
| 2198 | T | 90.7 | Very high | 89.2 | Confident | 86 Ų | 86 | 56.5 Ų | 56.5 | 53% | 0.528 | 29% | 0.289 | S | S | . | . | H | α-helix | trans | -67.5 | -31.3 | 175.3 | 58.2 | 0 | 0 | 0 | 0 | 113.3 | R2194 L2195 A2196 F2201 | R2194-T2198 WeakPolarHBondContact O-CG2 3.27Å; R2194-T2198 PolarHBondContact O-N 3.21Å; R2194-T2198 VanDerWaalsContact O-N 3.09Å; L2195-T2198 WeakPolarHBondContact O-CA 3.23Å; L2195-T2198 PolarHBondContact O-N 3.24Å; L2195-T2198 VanDerWaalsContact O-N 3.1Å; L2195-T2198 PolarHBondContact O-OG1 3.16Å; A2196-T2198 VanDerWaalsContact C-N 3.29Å; A2196-T2198 PolarHBondContact O-N 3.32Å; T2198-F2201 PolarHBondContact O-N 2.85Å |
| 2199 | E | 91.2 | Very high | 89.3 | Confident | 63.25 Ų | 63.25 | 54.5 Ų | 54.5 | 30% | 0.296 | 27% | 0.268 | S | S | . | . | H | α-helix | trans | -66.3 | -43 | 177.3 | -163.5 | -173.9 | 171.4 | 0 | 0 | 112 | L2195 A2196 L2197 F2201 L2202 K2204 F2205 | L2195-E2199 PolarHBondContact O-N 3.27Å; A2196-E2199 WeakPolarHBondContact O-CA 3.39Å; A2196-E2199 VanDerWaalsContact O-CB 3.25Å; A2196-E2199 WeakPolarHBondContact O-CB 3.25Å; A2196-E2199 PolarHBondContact O-N 3.23Å; L2197-E2199 VanDerWaalsContact C-N 3.3Å; L2197-E2199 PolarHBondContact O-N 3.23Å; E2199-F2201 PolarHBondContact O-N 3.04Å; E2199-F2201 VanDerWaalsContact O-N 3.1Å; E2199-L2202 HydrophobicContact CG-CD1 4.03Å; E2199-L2202 VanDerWaalsContact O-CB 3.26Å; E2199-L2202 WeakPolarHBondContact O-CB 3.43Å; E2199-L2202 VanDerWaalsContact O-CG 3.29Å; E2199-L2202 WeakPolarHBondContact O-CG 3.3Å; E2199-L2202 PolarHBondContact O-N 3.37Å; E2199-K2204 IonicContact OE1-NZ 3.73Å; E2199-F2205 HydrophobicContact CB-CE2 4.46Å; E2199-F2205 HydrophobicContact CG-CD2 4.24Å; E2199-F2205 HydrophobicContact CG-CE2 3.53Å; E2199-F2205 HydrophobicContact CG-CZ 4.03Å; E2199-F2205 VanDerWaalsContact O-CD2 3.22Å; E2199-F2205 WeakPolarHBondContact O-CD2 3.4Å; E2199-F2205 VanDerWaalsContact OE1-CE2 3.29Å; E2199-F2205 WeakPolarHBondContact OE1-CE2 3.35Å; E2199-F2205 WeakPolarHBondContact OE1-CZ 3.36Å |
| 2200 | F | 90.6 | Very high | 89 | Confident | 0.75 Ų | 0.75 | 54.5 Ų | 54.5 | 0% | 0.003 | 27% | 0.269 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -65.7 | -10.9 | 177.3 | -81.4 | -84.5 | 0 | 0 | 0 | 114.2 | H2168 V2171 I2175 A2196 L2197 F2205 F2209 L2265 L2268 | H2168-F2200 PolarHBondContact NE2-O 3.11Å; V2171-F2200 HydrophobicContact CG1-CD1 3.89Å; V2171-F2200 HydrophobicContact CG1-CE1 3.77Å; V2171-F2200 HydrophobicContact CG1-CE2 4.46Å; V2171-F2200 HydrophobicContact CG1-CG 4.3Å; V2171-F2200 HydrophobicContact CG1-CZ 4.09Å; I2175-F2200 HydrophobicContact CD1-CD2 3.46Å; I2175-F2200 VanDerWaalsContact CD1-CD2 3.44Å; I2175-F2200 HydrophobicContact CD1-CE2 3.68Å; I2175-F2200 HydrophobicContact CD1-CG 4.17Å; I2175-F2200 HydrophobicContact CD1-CZ 4.45Å; A2196-F2200 VanDerWaalsContact O-CD2 3.29Å; A2196-F2200 WeakPolarHBondContact O-CD2 3.39Å; A2196-F2200 PolarHBondContact O-N 3.05Å; A2196-F2200 VanDerWaalsContact O-N 3.15Å; L2197-F2200 PolarHBondContact O-N 3.08Å; F2200-F2205 AromaticContact CD1-CD1 3.61Å; F2200-F2205 HydrophobicContact CD1-CD1 3.61Å; F2200-F2205 AromaticContact CD1-CE1 3.98Å; F2200-F2205 HydrophobicContact CD1-CE1 4Å; F2200-F2205 HydrophobicContact CD1-CG 4.19Å; F2200-F2205 AromaticContact CE1-CD1 3.67Å; F2200-F2205 HydrophobicContact CE1-CD1 3.67Å; F2200-F2205 AromaticContact CE1-CE1 3.69Å; F2200-F2205 HydrophobicContact CE1-CE1 3.69Å; F2200-F2205 HydrophobicContact CG-CD1 4.35Å; F2200-F2205 HydrophobicContact CZ-CD1 4.44Å; F2200-F2205 AromaticContact CZ-CE1 4Å; F2200-F2205 HydrophobicContact CZ-CE1 4.02Å; F2200-F2209 HydrophobicContact CD1-CE2 4.1Å; F2200-F2209 HydrophobicContact CD1-CZ 4.29Å; F2200-F2209 AromaticContact CE1-CE2 3.94Å; F2200-F2209 HydrophobicContact CE1-CE2 3.94Å; F2200-F2209 AromaticContact CE1-CZ 3.96Å; F2200-F2209 HydrophobicContact CE1-CZ 4.01Å; F2200-L2265 HydrophobicContact CZ-CD2 3.93Å; F2200-L2268 HydrophobicContact CE2-CD1 3.8Å; F2200-L2268 HydrophobicContact CZ-CD1 4.36Å |
| 2201 | F | 88.3 | Confident | 88.8 | Confident | 75.6667 Ų | 75.6667 | 52.5 Ų | 52.5 | 33% | 0.332 | 26% | 0.261 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -89.5 | -5.8 | 170.4 | -66.7 | -52.6 | 0 | 0 | 0 | 114.2 | V2172 L2197 T2198 E2199 V2216 | V2172-F2201 HydrophobicContact CG1-CE1 3.89Å; V2172-F2201 HydrophobicContact CG1-CE2 4.44Å; V2172-F2201 HydrophobicContact CG1-CZ 3.63Å; V2172-F2201 HydrophobicContact CG2-CE1 4.03Å; V2172-F2201 HydrophobicContact CG2-CZ 4.41Å; L2197-F2201 HydrophobicContact CD1-CE2 4.23Å; L2197-F2201 HydrophobicContact CD1-CZ 4.25Å; L2197-F2201 HydrophobicContact CG-CE2 4Å; L2197-F2201 HydrophobicContact CG-CZ 4.45Å; L2197-F2201 VanDerWaalsContact O-CD2 3.26Å; L2197-F2201 WeakPolarHBondContact O-CD2 3.4Å; L2197-F2201 WeakPolarHBondContact O-CE2 3.35Å; T2198-F2201 PolarHBondContact O-N 2.85Å; E2199-F2201 PolarHBondContact O-N 3.04Å; E2199-F2201 VanDerWaalsContact O-N 3.1Å; F2201-V2216 HydrophobicContact CD1-CG1 4.19Å; F2201-V2216 HydrophobicContact CE1-CG1 3.96Å |
| 2202 | L | 88.3 | Confident | 88 | Confident | 88 Ų | 88 | 51.5 Ų | 51.5 | 46% | 0.461 | 26% | 0.256 | S | S | . | . | S | Bend | trans | -70.7 | 146.3 | 178.8 | -64 | 175.1 | 0 | 0 | 0 | 111.4 | E2199 K2204 F2205 Y2206 | E2199-L2202 HydrophobicContact CG-CD1 4.03Å; E2199-L2202 VanDerWaalsContact O-CB 3.26Å; E2199-L2202 WeakPolarHBondContact O-CB 3.43Å; E2199-L2202 VanDerWaalsContact O-CG 3.29Å; E2199-L2202 WeakPolarHBondContact O-CG 3.3Å; E2199-L2202 PolarHBondContact O-N 3.37Å; L2202-K2204 PolarHBondContact O-N 3.3Å; L2202-F2205 PolarHBondContact O-N 2.91Å; L2202-Y2206 PolarHBondContact O-N 2.94Å |
| 2203 | P | 84.9 | Confident | 86.9 | Confident | 92.6667 Ų | 92.6667 | 55.4 Ų | 55.4 | 60% | 0.602 | 28% | 0.277 | S | S | * | . | H | α-helix | trans | -55.5 | -25.8 | 178 | -27.4 | 35 | 0 | 0 | 0 | 114.6 | Y2206 R2207 | P2203-Y2206 PolarHBondContact O-N 3.06Å; P2203-R2207 PolarHBondContact O-N 3.31Å; P2203-R2207 VanDerWaalsContact O-N 3.09Å |
| 2204 | K | 88 | Confident | 85.6 | Confident | 100 Ų | 100 | 56.5 Ų | 56.5 | 44% | 0.435 | 28% | 0.283 | S | S | . | . | H | α-helix | trans | -54.4 | -53.3 | 171.3 | 179.1 | -169.4 | 171.2 | -163.5 | 0 | 110.6 | E2199 L2202 Y2206 R2207 L2208 | E2199-K2204 IonicContact OE1-NZ 3.73Å; L2202-K2204 PolarHBondContact O-N 3.3Å; K2204-Y2206 VanDerWaalsContact C-N 3.32Å; K2204-Y2206 PolarHBondContact O-N 3.22Å; K2204-R2207 PolarHBondContact O-N 3.2Å; K2204-L2208 HydrophobicContact CG-CD1 4.24Å; K2204-L2208 WeakPolarHBondContact O-CG 3.32Å; K2204-L2208 PolarHBondContact O-N 3.29Å; K2204-L2208 VanDerWaalsContact O-N 3.07Å |
| 2205 | F | 88.8 | Confident | 84.1 | Confident | 0 Ų | 0 | 55.2 Ų | 55.2 | 0% | 0 | 29% | 0.287 | C | S | . | . | H | α-helix | trans | -68.2 | -32.1 | -179.7 | -77.7 | -88.8 | 0 | 0 | 0 | 112.1 | E2199 F2200 L2202 R2207 L2208 F2209 S2264 | E2199-F2205 HydrophobicContact CB-CE2 4.46Å; E2199-F2205 HydrophobicContact CG-CD2 4.24Å; E2199-F2205 HydrophobicContact CG-CE2 3.53Å; E2199-F2205 HydrophobicContact CG-CZ 4.03Å; E2199-F2205 VanDerWaalsContact O-CD2 3.22Å; E2199-F2205 WeakPolarHBondContact O-CD2 3.4Å; E2199-F2205 VanDerWaalsContact OE1-CE2 3.29Å; E2199-F2205 WeakPolarHBondContact OE1-CE2 3.35Å; E2199-F2205 WeakPolarHBondContact OE1-CZ 3.36Å; F2200-F2205 AromaticContact CD1-CD1 3.61Å; F2200-F2205 HydrophobicContact CD1-CD1 3.61Å; F2200-F2205 AromaticContact CD1-CE1 3.98Å; F2200-F2205 HydrophobicContact CD1-CE1 4Å; F2200-F2205 HydrophobicContact CD1-CG 4.19Å; F2200-F2205 AromaticContact CE1-CD1 3.67Å; F2200-F2205 HydrophobicContact CE1-CD1 3.67Å; F2200-F2205 AromaticContact CE1-CE1 3.69Å; F2200-F2205 HydrophobicContact CE1-CE1 3.69Å; F2200-F2205 HydrophobicContact CG-CD1 4.35Å; F2200-F2205 HydrophobicContact CZ-CD1 4.44Å; F2200-F2205 AromaticContact CZ-CE1 4Å; F2200-F2205 HydrophobicContact CZ-CE1 4.02Å; L2202-F2205 PolarHBondContact O-N 2.91Å; F2205-R2207 VanDerWaalsContact C-N 3.31Å; F2205-R2207 PolarHBondContact O-N 3.24Å; F2205-L2208 HydrophobicContact CD1-CD1 4.17Å; F2205-L2208 HydrophobicContact CE1-CD1 4.34Å; F2205-L2208 PolarHBondContact O-N 3.22Å; F2205-L2208 VanDerWaalsContact O-N 3.17Å; F2205-F2209 HydrophobicContact CD1-CE2 4.1Å; F2205-F2209 WeakPolarHBondContact O-CB 3.11Å; F2205-F2209 VanDerWaalsContact O-CD2 3.25Å; F2205-F2209 WeakPolarHBondContact O-CD2 3.38Å; F2205-F2209 PolarHBondContact O-N 3.17Å; F2205-S2264 WeakPolarHBondContact CZ-OG 3.44Å |
| 2206 | Y | 88.1 | Confident | 82.6 | Confident | 12.6667 Ų | 12.6667 | 54.1 Ų | 54.1 | 5% | 0.05 | 29% | 0.285 | C | S | . | . | H | α-helix | trans | -63 | -38.8 | 174 | -68.2 | -1.5 | 0 | 0 | 0 | 112.5 | H2168 L2202 P2203 K2204 G2210 V2211 S2212 L2214 V2216 V2219 | H2168-Y2206 AromaticContact CE1-CE1 3.5Å; H2168-Y2206 VanDerWaalsContact CE1-CE1 3.46Å; H2168-Y2206 WeakPolarHBondContact CE1-CE1 3.4Å; H2168-Y2206 AromaticContact NE2-CD1 3.85Å; H2168-Y2206 AromaticContact NE2-CE1 3.58Å; L2202-Y2206 PolarHBondContact O-N 2.94Å; P2203-Y2206 PolarHBondContact O-N 3.06Å; K2204-Y2206 VanDerWaalsContact C-N 3.32Å; K2204-Y2206 PolarHBondContact O-N 3.22Å; Y2206-G2210 PolarHBondContact O-N 3.05Å; Y2206-V2211 HydrophobicContact CD1-CG2 4.22Å; Y2206-V2211 HydrophobicContact CG-CG2 4.19Å; Y2206-V2211 CarbonylContact O-C 3.32Å; Y2206-V2211 WeakPolarHBondContact O-CA 3.39Å; Y2206-V2211 VanDerWaalsContact O-CG2 3.29Å; Y2206-V2211 WeakPolarHBondContact O-CG2 3.48Å; Y2206-V2211 PolarHBondContact O-N 3.12Å; Y2206-S2212 PolarHBondContact O-N 3.33Å; Y2206-S2212 VanDerWaalsContact O-N 3.17Å; Y2206-L2214 VanDerWaalsContact CD2-O 3.24Å; Y2206-L2214 WeakPolarHBondContact CD2-O 3.38Å; Y2206-L2214 WeakPolarHBondContact CE2-O 3.34Å; Y2206-V2216 HydrophobicContact CE2-CG2 4.32Å; Y2206-V2216 VanDerWaalsContact OH-CA 3.28Å; Y2206-V2216 WeakPolarHBondContact OH-CA 3.33Å; Y2206-V2216 WeakPolarHBondContact OH-CG2 3.33Å; Y2206-V2219 HydrophobicContact CE1-CG2 4.35Å; Y2206-V2219 HydrophobicContact CE2-CG2 4.14Å |
| 2207 | R | 85.2 | Confident | 81.2 | Confident | 170.333 Ų | 170.333 | 62.1 Ų | 62.1 | 64% | 0.643 | 32% | 0.317 | S | S | * | . | H | α-helix | trans | -65.8 | -45.3 | 171.6 | -97 | 177.3 | -149.8 | 172.5 | -1.4 | 111.8 | P2203 K2204 F2205 F2209 G2210 S2212 | P2203-R2207 PolarHBondContact O-N 3.31Å; P2203-R2207 VanDerWaalsContact O-N 3.09Å; K2204-R2207 PolarHBondContact O-N 3.2Å; F2205-R2207 VanDerWaalsContact C-N 3.31Å; F2205-R2207 PolarHBondContact O-N 3.24Å; R2207-F2209 VanDerWaalsContact C-N 3.31Å; R2207-F2209 PolarHBondContact O-N 3.34Å; R2207-G2210 PolarHBondContact O-N 3.41Å; R2207-G2210 VanDerWaalsContact O-N 3.08Å; R2207-S2212 WeakPolarHBondContact CA-OG 3.29Å |
| 2208 | L | 87.7 | Confident | 80.1 | Confident | 10.6667 Ų | 10.6667 | 63 Ų | 63 | 6% | 0.056 | 32% | 0.323 | C | S | . | . | H | α-helix | trans | -60.1 | -38.8 | 179.6 | -67.4 | 173.9 | 0 | 0 | 0 | 112.6 | K2204 F2205 G2210 L2253 N2257 V2260 I2261 | K2204-L2208 HydrophobicContact CG-CD1 4.24Å; K2204-L2208 WeakPolarHBondContact O-CG 3.32Å; K2204-L2208 PolarHBondContact O-N 3.29Å; K2204-L2208 VanDerWaalsContact O-N 3.07Å; F2205-L2208 HydrophobicContact CD1-CD1 4.17Å; F2205-L2208 HydrophobicContact CE1-CD1 4.34Å; F2205-L2208 PolarHBondContact O-N 3.22Å; F2205-L2208 VanDerWaalsContact O-N 3.17Å; L2208-G2210 VanDerWaalsContact C-N 3.31Å; L2208-G2210 PolarHBondContact O-N 2.93Å; L2208-L2253 WeakPolarHBondContact O-CD1 3.37Å; L2208-N2257 HydrophobicContact CD2-CB 3.54Å; L2208-V2260 HydrophobicContact CD1-CB 4.46Å; L2208-V2260 HydrophobicContact CD1-CG1 3.88Å; L2208-I2261 HydrophobicContact CB-CD1 3.98Å; L2208-I2261 HydrophobicContact CB-CG1 4.05Å; L2208-I2261 HydrophobicContact CD1-CG1 4.17Å |
| 2209 | F | 88.7 | Confident | 79.2 | Confident | 1 Ų | 1 | 59.3 Ų | 59.3 | 0% | 0.004 | 30% | 0.301 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -82.7 | -2.2 | 177.7 | -79.8 | -106.7 | 0 | 0 | 0 | 114 | V2152 V2156 V2167 H2168 V2171 F2200 F2205 R2207 V2211 I2261 | V2152-F2209 HydrophobicContact CG1-CE1 4.29Å; V2152-F2209 HydrophobicContact CG1-CZ 4.48Å; V2156-F2209 HydrophobicContact CG2-CB 4.43Å; V2156-F2209 HydrophobicContact CG2-CD1 3.73Å; V2156-F2209 HydrophobicContact CG2-CD2 4.27Å; V2156-F2209 HydrophobicContact CG2-CE1 4.06Å; V2156-F2209 HydrophobicContact CG2-CG 3.97Å; V2156-F2209 HydrophobicContact CG2-CZ 4.36Å; V2167-F2209 HydrophobicContact CG1-CD1 4.48Å; V2167-F2209 HydrophobicContact CG1-CE1 4.32Å; H2168-F2209 HydrophobicContact CB-CB 4.25Å; H2168-F2209 HydrophobicContact CB-CD1 3.7Å; H2168-F2209 HydrophobicContact CB-CE1 4.34Å; H2168-F2209 HydrophobicContact CB-CG 4.13Å; H2168-F2209 AromaticContact CD2-CD1 3.98Å; H2168-F2209 AromaticContact CD2-CG 3.87Å; V2171-F2209 HydrophobicContact CG2-CE1 3.95Å; V2171-F2209 HydrophobicContact CG2-CZ 4.04Å; F2200-F2209 HydrophobicContact CD1-CE2 4.1Å; F2200-F2209 HydrophobicContact CD1-CZ 4.29Å; F2200-F2209 AromaticContact CE1-CE2 3.94Å; F2200-F2209 HydrophobicContact CE1-CE2 3.94Å; F2200-F2209 AromaticContact CE1-CZ 3.96Å; F2200-F2209 HydrophobicContact CE1-CZ 4.01Å; F2205-F2209 HydrophobicContact CD1-CE2 4.1Å; F2205-F2209 WeakPolarHBondContact O-CB 3.11Å; F2205-F2209 VanDerWaalsContact O-CD2 3.25Å; F2205-F2209 WeakPolarHBondContact O-CD2 3.38Å; F2205-F2209 PolarHBondContact O-N 3.17Å; R2207-F2209 VanDerWaalsContact C-N 3.31Å; R2207-F2209 PolarHBondContact O-N 3.34Å; F2209-V2211 HydrophobicContact CB-CG2 4.21Å; F2209-I2261 HydrophobicContact CD2-CD1 4.42Å; F2209-I2261 HydrophobicContact CE2-CD1 4.35Å; F2209-I2261 HydrophobicContact CE2-CG1 4.29Å; F2209-I2261 HydrophobicContact CE2-CG2 4.2Å; F2209-I2261 HydrophobicContact CZ-CG2 4.18Å |
| 2210 | G | 83.8 | Confident | 78.4 | Confident | 3 Ų | 3 | 58.8 Ų | 58.8 | 3% | 0.031 | 31% | 0.308 | C | S | . | . | T | Hydrogen-bonded Turn | trans | 77.7 | 21.6 | 179.8 | 0 | 0 | 0 | 0 | 0 | 115 | N2157 R2164 Y2206 R2207 L2208 | N2157-G2210 WeakPolarHBondContact OD1-CA 3.33Å; R2164-G2210 PolarHBondContact NH1-O 3.25Å; R2164-G2210 VanDerWaalsContact NH1-O 3.1Å; R2164-G2210 PolarHBondContact NH2-O 3.28Å; Y2206-G2210 PolarHBondContact O-N 3.05Å; R2207-G2210 PolarHBondContact O-N 3.41Å; R2207-G2210 VanDerWaalsContact O-N 3.08Å; L2208-G2210 VanDerWaalsContact C-N 3.31Å; L2208-G2210 PolarHBondContact O-N 2.93Å |
| 2211 | V | 83.4 | Confident | 77.5 | Confident | 0.666667 Ų | 0.666667 | 61 Ų | 61 | 0% | 0.004 | 33% | 0.326 | C | S | . | . | trans | -113.1 | 31.6 | 179.3 | -64.7 | 0 | 0 | 0 | 0 | 112.1 | L2161 R2164 A2165 Y2206 F2209 N2213 L2214 V2219 | L2161-V2211 HydrophobicContact CD1-CG1 4.16Å; R2164-V2211 HydrophobicContact CB-CG1 4.17Å; A2165-V2211 HydrophobicContact CB-CG1 4.24Å; Y2206-V2211 HydrophobicContact CD1-CG2 4.22Å; Y2206-V2211 HydrophobicContact CG-CG2 4.19Å; Y2206-V2211 CarbonylContact O-C 3.32Å; Y2206-V2211 WeakPolarHBondContact O-CA 3.39Å; Y2206-V2211 VanDerWaalsContact O-CG2 3.29Å; Y2206-V2211 WeakPolarHBondContact O-CG2 3.48Å; Y2206-V2211 PolarHBondContact O-N 3.12Å; F2209-V2211 HydrophobicContact CB-CG2 4.21Å; V2211-N2213 VanDerWaalsContact C-N 3.28Å; V2211-N2213 PolarHBondContact O-N 3.21Å; V2211-N2213 VanDerWaalsContact O-N 3.17Å; V2211-L2214 HydrophobicContact CB-CD1 4.1Å; V2211-L2214 HydrophobicContact CB-CG 4.48Å; V2211-L2214 HydrophobicContact CG1-CD1 4.28Å; V2211-L2214 WeakPolarHBondContact O-CB 3.26Å; V2211-L2214 PolarHBondContact O-N 3.4Å; V2211-L2214 VanDerWaalsContact O-N 3.08Å; V2211-V2219 HydrophobicContact CG2-CG2 4.41Å | ||
| 2212 | S | 73.4 | Confident | 76.8 | Confident | 42.3333 Ų | 42.3333 | 57.9 Ų | 57.9 | 30% | 0.296 | 31% | 0.313 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -52.5 | -33.9 | -172.3 | 21.4 | 0 | 0 | 0 | 0 | 115.2 | Y2206 R2207 L2214 D2251 | Y2206-S2212 PolarHBondContact O-N 3.33Å; Y2206-S2212 VanDerWaalsContact O-N 3.17Å; R2207-S2212 WeakPolarHBondContact CA-OG 3.29Å; S2212-L2214 VanDerWaalsContact C-N 3.33Å; S2212-L2214 PolarHBondContact O-N 2.92Å; S2212-D2251 PolarHBondContact OG-OD2 3.13Å; S2212-D2251 VanDerWaalsContact OG-OD2 3.08Å |
| 2213 | N | 67.2 | Low | 76.2 | Confident | 156.667 Ų | 156.667 | 53.8 Ų | 53.8 | 84% | 0.838 | 29% | 0.292 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -87.8 | 2.4 | -177.4 | -65.7 | -16.1 | 0 | 0 | 0 | 113.8 | V2211 | V2211-N2213 VanDerWaalsContact C-N 3.28Å; V2211-N2213 PolarHBondContact O-N 3.21Å; V2211-N2213 VanDerWaalsContact O-N 3.17Å |
| 2214 | L | 63.6 | Low | 75.9 | Confident | 23.3333 Ų | 23.3333 | 53.5 Ų | 53.5 | 12% | 0.122 | 28% | 0.282 | C | S | . | . | trans | -104.5 | 131.8 | -177.1 | -57.5 | -177.8 | 0 | 0 | 0 | 111 | L2161 Y2206 V2211 S2212 T2218 V2219 T2222 | L2161-L2214 HydrophobicContact CD1-CD1 4.21Å; L2161-L2214 HydrophobicContact CD2-CD1 4.39Å; L2161-L2214 HydrophobicContact CD2-CD2 4.39Å; L2161-L2214 HydrophobicContact CG-CD1 4.35Å; Y2206-L2214 VanDerWaalsContact CD2-O 3.24Å; Y2206-L2214 WeakPolarHBondContact CD2-O 3.38Å; Y2206-L2214 WeakPolarHBondContact CE2-O 3.34Å; V2211-L2214 HydrophobicContact CB-CD1 4.1Å; V2211-L2214 HydrophobicContact CB-CG 4.48Å; V2211-L2214 HydrophobicContact CG1-CD1 4.28Å; V2211-L2214 WeakPolarHBondContact O-CB 3.26Å; V2211-L2214 PolarHBondContact O-N 3.4Å; V2211-L2214 VanDerWaalsContact O-N 3.08Å; S2212-L2214 VanDerWaalsContact C-N 3.33Å; S2212-L2214 PolarHBondContact O-N 2.92Å; L2214-T2218 VanDerWaalsContact CA-OG1 3.32Å; L2214-T2218 WeakPolarHBondContact CA-OG1 3.41Å; L2214-V2219 HydrophobicContact CB-CG2 3.61Å; L2214-V2219 HydrophobicContact CD1-CG2 4.25Å; L2214-T2222 HydrophobicContact CD1-CG2 4.02Å; L2214-T2222 WeakPolarHBondContact CD2-OG1 3.49Å | ||
| 2215 | T | 60.9 | Low | 74.6 | Confident | 85.6667 Ų | 85.6667 | 57.2 Ų | 57.2 | 53% | 0.526 | 29% | 0.293 | S | S | . | . | trans | -74 | 161.6 | 160.2 | 69.1 | 0 | 0 | 0 | 0 | 111.1 | K2217 T2218 V2219 | T2215-K2217 VanDerWaalsContact C-N 3.27Å; T2215-K2217 PolarHBondContact O-N 2.75Å; T2215-K2217 VanDerWaalsContact O-N 3.14Å; T2215-T2218 WeakPolarHBondContact CA-OG1 3.38Å; T2215-T2218 PolarHBondContact N-OG1 3.14Å; T2215-T2218 CarbonylContact O-C 3.5Å; T2215-T2218 WeakPolarHBondContact O-CA 3.48Å; T2215-T2218 PolarHBondContact O-N 3.19Å; T2215-T2218 PolarHBondContact O-OG1 3.31Å; T2215-T2218 WeakPolarHBondContact OG1-CG2 3.39Å; T2215-T2218 PolarHBondContact OG1-N 3.09Å; T2215-T2218 PolarHBondContact OG1-OG1 3.25Å; T2215-V2219 WeakPolarHBondContact O-CG2 3.49Å; T2215-V2219 PolarHBondContact O-N 3.01Å | ||
| 2216 | V | 59.1 | Low | 73.1 | Confident | 80 Ų | 80 | 59.3 Ų | 59.3 | 49% | 0.485 | 30% | 0.304 | S | S | . | . | H | α-helix | trans | -45.8 | -48.6 | 175.8 | -174.9 | 0 | 0 | 0 | 0 | 112 | F2201 Y2206 T2218 V2219 A2220 | F2201-V2216 HydrophobicContact CD1-CG1 4.19Å; F2201-V2216 HydrophobicContact CE1-CG1 3.96Å; Y2206-V2216 HydrophobicContact CE2-CG2 4.32Å; Y2206-V2216 VanDerWaalsContact OH-CA 3.28Å; Y2206-V2216 WeakPolarHBondContact OH-CA 3.33Å; Y2206-V2216 WeakPolarHBondContact OH-CG2 3.33Å; V2216-T2218 VanDerWaalsContact C-N 3.3Å; V2216-T2218 PolarHBondContact O-N 3.05Å; V2216-V2219 PolarHBondContact O-N 3.16Å; V2216-A2220 PolarHBondContact O-N 2.94Å |
| 2217 | K | 61.2 | Low | 71.1 | Confident | 183.667 Ų | 183.667 | 61 Ų | 61 | 80% | 0.799 | 32% | 0.317 | S | S | * | . | H | α-helix | trans | -63.2 | -36.3 | 179.9 | -66.1 | -175.8 | 178.5 | -178.3 | 0 | 112.3 | T2215 A2221 | T2215-K2217 VanDerWaalsContact C-N 3.27Å; T2215-K2217 PolarHBondContact O-N 2.75Å; T2215-K2217 VanDerWaalsContact O-N 3.14Å; K2217-A2221 WeakPolarHBondContact O-CB 3.37Å; K2217-A2221 PolarHBondContact O-N 3.14Å; K2217-A2221 VanDerWaalsContact O-N 3.13Å |
| 2218 | T | 68.1 | Low | 69.2 | Low | 46 Ų | 46 | 56 Ų | 56 | 28% | 0.282 | 31% | 0.307 | S | S | . | . | H | α-helix | trans | -83.9 | -19.1 | -179.7 | 52.2 | 0 | 0 | 0 | 0 | 113.6 | L2214 T2215 V2216 T2222 | L2214-T2218 VanDerWaalsContact CA-OG1 3.32Å; L2214-T2218 WeakPolarHBondContact CA-OG1 3.41Å; T2215-T2218 WeakPolarHBondContact CA-OG1 3.38Å; T2215-T2218 PolarHBondContact N-OG1 3.14Å; T2215-T2218 CarbonylContact O-C 3.5Å; T2215-T2218 WeakPolarHBondContact O-CA 3.48Å; T2215-T2218 PolarHBondContact O-N 3.19Å; T2215-T2218 PolarHBondContact O-OG1 3.31Å; T2215-T2218 WeakPolarHBondContact OG1-CG2 3.39Å; T2215-T2218 PolarHBondContact OG1-N 3.09Å; T2215-T2218 PolarHBondContact OG1-OG1 3.25Å; V2216-T2218 VanDerWaalsContact C-N 3.3Å; V2216-T2218 PolarHBondContact O-N 3.05Å; T2218-T2222 WeakPolarHBondContact O-CB 3.33Å; T2218-T2222 PolarHBondContact O-N 2.86Å; T2218-T2222 PolarHBondContact O-OG1 3.28Å |
| 2219 | V | 71.7 | Confident | 67.2 | Low | 8 Ų | 8 | 61.6 Ų | 61.6 | 5% | 0.048 | 33% | 0.327 | C | S | . | . | H | α-helix | trans | -65.4 | -53.9 | 173 | 175.3 | 0 | 0 | 0 | 0 | 109.7 | A2165 Y2206 V2211 L2214 T2215 V2216 A2221 T2222 A2223 | A2165-V2219 HydrophobicContact CB-CG1 4.32Å; Y2206-V2219 HydrophobicContact CE1-CG2 4.35Å; Y2206-V2219 HydrophobicContact CE2-CG2 4.14Å; V2211-V2219 HydrophobicContact CG2-CG2 4.41Å; L2214-V2219 HydrophobicContact CB-CG2 3.61Å; L2214-V2219 HydrophobicContact CD1-CG2 4.25Å; T2215-V2219 WeakPolarHBondContact O-CG2 3.49Å; T2215-V2219 PolarHBondContact O-N 3.01Å; V2216-V2219 PolarHBondContact O-N 3.16Å; V2219-A2221 VanDerWaalsContact C-N 3.34Å; V2219-A2221 PolarHBondContact O-N 3.31Å; V2219-T2222 PolarHBondContact O-N 3.05Å; V2219-T2222 VanDerWaalsContact O-N 3.11Å; V2219-A2223 WeakPolarHBondContact O-CB 3.38Å; V2219-A2223 PolarHBondContact O-N 3.24Å |
| 2220 | A | 75 | Confident | 64.9 | Low | 54.6667 Ų | 54.6667 | 69.6 Ų | 69.6 | 45% | 0.452 | 37% | 0.367 | S | S | . | . | H | α-helix | trans | -59.5 | -45.4 | 176.8 | 0 | 0 | 0 | 0 | 0 | 111.7 | V2216 T2222 A2223 F2224 | V2216-A2220 PolarHBondContact O-N 2.94Å; A2220-T2222 VanDerWaalsContact C-N 3.3Å; A2220-T2222 PolarHBondContact O-N 3.25Å; A2220-A2223 PolarHBondContact O-N 3.28Å; A2220-F2224 VanDerWaalsContact O-CD2 3.3Å; A2220-F2224 WeakPolarHBondContact O-CD2 3.39Å; A2220-F2224 PolarHBondContact O-N 3.1Å; A2220-F2224 VanDerWaalsContact O-N 3.13Å |
| 2221 | A | 73 | Confident | 62.3 | Low | 45.3333 Ų | 45.3333 | 75.1 Ų | 75.1 | 38% | 0.375 | 40% | 0.404 | S | S | . | . | H | α-helix | trans | -61 | -37.4 | 176.3 | 0 | 0 | 0 | 0 | 0 | 112.4 | K2217 V2219 F2224 R2225 | K2217-A2221 WeakPolarHBondContact O-CB 3.37Å; K2217-A2221 PolarHBondContact O-N 3.14Å; K2217-A2221 VanDerWaalsContact O-N 3.13Å; V2219-A2221 VanDerWaalsContact C-N 3.34Å; V2219-A2221 PolarHBondContact O-N 3.31Å; A2221-F2224 CarbonylContact O-C 3.56Å; A2221-F2224 PolarHBondContact O-N 3.47Å; A2221-R2225 VanDerWaalsContact O-CA 3.31Å; A2221-R2225 WeakPolarHBondContact O-CA 3.4Å; A2221-R2225 WeakPolarHBondContact O-CB 3.45Å; A2221-R2225 WeakPolarHBondContact O-CG 3.29Å; A2221-R2225 PolarHBondContact O-N 3.17Å |
| 2222 | T | 72.9 | Confident | 59.8 | Low | 10.6667 Ų | 10.6667 | 82.2 Ų | 82.2 | 7% | 0.065 | 44% | 0.442 | C | S | . | . | H | α-helix | trans | -75.4 | -34.6 | 178.6 | -58.1 | 0 | 0 | 0 | 0 | 112.2 | L2161 A2165 L2214 T2218 V2219 A2220 F2224 | L2161-T2222 HydrophobicContact CD2-CG2 4.12Å; L2161-T2222 HydrophobicContact CG-CG2 4.03Å; A2165-T2222 HydrophobicContact CB-CG2 4.38Å; L2214-T2222 HydrophobicContact CD1-CG2 4.02Å; L2214-T2222 WeakPolarHBondContact CD2-OG1 3.49Å; T2218-T2222 WeakPolarHBondContact O-CB 3.33Å; T2218-T2222 PolarHBondContact O-N 2.86Å; T2218-T2222 PolarHBondContact O-OG1 3.28Å; V2219-T2222 PolarHBondContact O-N 3.05Å; V2219-T2222 VanDerWaalsContact O-N 3.11Å; A2220-T2222 VanDerWaalsContact C-N 3.3Å; A2220-T2222 PolarHBondContact O-N 3.25Å; T2222-F2224 VanDerWaalsContact C-N 3.29Å; T2222-F2224 PolarHBondContact O-N 3.2Å |
| 2223 | A | 75.6 | Confident | 57.6 | Low | 3 Ų | 3 | 85 Ų | 85 | 3% | 0.025 | 46% | 0.459 | C | S | . | . | H | α-helix | trans | -66.4 | -35.3 | 175.4 | 0 | 0 | 0 | 0 | 0 | 112.2 | R2128 L2131 A2165 V2219 A2220 | R2128-A2223 VanDerWaalsContact CZ-O 3.28Å; R2128-A2223 PolarHBondContact NH1-O 3.23Å; R2128-A2223 PolarHBondContact NH2-O 3.08Å; L2131-A2223 HydrophobicContact CD2-CB 4.25Å; A2165-A2223 HydrophobicContact CB-CB 4.02Å; V2219-A2223 WeakPolarHBondContact O-CB 3.38Å; V2219-A2223 PolarHBondContact O-N 3.24Å; A2220-A2223 PolarHBondContact O-N 3.28Å |
| 2224 | F | 78 | Confident | 56 | Low | 86.3333 Ų | 86.3333 | 83.4 Ų | 83.4 | 38% | 0.379 | 45% | 0.454 | S | S | . | . | H | α-helix | trans | -106 | 12.2 | 179.8 | -64.4 | -72.3 | 0 | 0 | 0 | 114 | L2131 F2132 A2220 A2221 T2222 I2226 S2227 | L2131-F2224 HydrophobicContact CD1-CZ 4.31Å; L2131-F2224 HydrophobicContact CD2-CD1 4.49Å; L2131-F2224 HydrophobicContact CD2-CE1 3.97Å; L2131-F2224 HydrophobicContact CD2-CE2 4.36Å; L2131-F2224 HydrophobicContact CD2-CZ 3.96Å; L2131-F2224 HydrophobicContact CG-CE1 4.34Å; L2131-F2224 HydrophobicContact CG-CZ 4.17Å; F2132-F2224 HydrophobicContact CD1-CE1 4.3Å; F2132-F2224 HydrophobicContact CE1-CD1 4.19Å; F2132-F2224 AromaticContact CE1-CE1 3.97Å; F2132-F2224 HydrophobicContact CE1-CE1 4.02Å; F2132-F2224 HydrophobicContact CE2-CE1 4.43Å; F2132-F2224 AromaticContact CZ-CD1 3.97Å; F2132-F2224 HydrophobicContact CZ-CD1 4.14Å; F2132-F2224 HydrophobicContact CZ-CE1 4.22Å; A2220-F2224 VanDerWaalsContact O-CD2 3.3Å; A2220-F2224 WeakPolarHBondContact O-CD2 3.39Å; A2220-F2224 PolarHBondContact O-N 3.1Å; A2220-F2224 VanDerWaalsContact O-N 3.13Å; A2221-F2224 CarbonylContact O-C 3.56Å; A2221-F2224 PolarHBondContact O-N 3.47Å; T2222-F2224 VanDerWaalsContact C-N 3.29Å; T2222-F2224 PolarHBondContact O-N 3.2Å; F2224-I2226 PolarHBondContact O-N 3.25Å; F2224-I2226 VanDerWaalsContact O-N 3.12Å; F2224-S2227 WeakPolarHBondContact O-CA 3.28Å; F2224-S2227 VanDerWaalsContact O-CB 3.23Å; F2224-S2227 WeakPolarHBondContact O-CB 3.49Å; F2224-S2227 PolarHBondContact O-N 3.28Å |
| 2225 | R | 62.1 | Low | 54.3 | Low | 176.333 Ų | 176.333 | 90.5 Ų | 90.5 | 67% | 0.665 | 49% | 0.487 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -69.7 | 3.4 | -176 | -120.3 | 176.7 | -159.5 | -179.5 | 3.2 | 114.3 | A2221 S2227 | A2221-R2225 VanDerWaalsContact O-CA 3.31Å; A2221-R2225 WeakPolarHBondContact O-CA 3.4Å; A2221-R2225 WeakPolarHBondContact O-CB 3.45Å; A2221-R2225 WeakPolarHBondContact O-CG 3.29Å; A2221-R2225 PolarHBondContact O-N 3.17Å; R2225-S2227 PolarHBondContact O-N 2.85Å |
| 2226 | I | 55.4 | Low | 52.9 | Low | 46 Ų | 46 | 90.2 Ų | 90.2 | 24% | 0.236 | 49% | 0.493 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -94.8 | 9.9 | 165.4 | -63.3 | 153.4 | 0 | 0 | 0 | 109.2 | G2069 V2071 E2074 A2162 F2224 P2228 | G2069-I2226 WeakPolarHBondContact O-CD1 3.38Å; G2069-I2226 VanDerWaalsContact O-CG2 3.32Å; G2069-I2226 WeakPolarHBondContact O-CG2 3.4Å; V2071-I2226 HydrophobicContact CG2-CG2 4.17Å; E2074-I2226 HydrophobicContact CG-CB 4.26Å; E2074-I2226 HydrophobicContact CG-CD1 3.89Å; E2074-I2226 HydrophobicContact CG-CG2 3.9Å; E2074-I2226 WeakPolarHBondContact OE1-CG2 3.37Å; A2162-I2226 HydrophobicContact CB-CD1 3.48Å; A2162-I2226 VanDerWaalsContact CB-CD1 3.43Å; A2162-I2226 HydrophobicContact CB-CG1 4.08Å; F2224-I2226 PolarHBondContact O-N 3.25Å; F2224-I2226 VanDerWaalsContact O-N 3.12Å; I2226-P2228 WeakPolarHBondContact O-CD 3.42Å |
| 2227 | S | 47.5 | Very low | 51.6 | Low | 46.3333 Ų | 46.3333 | 90.7 Ų | 90.7 | 32% | 0.324 | 50% | 0.499 | S | S | . | . | trans | -80.2 | 120 | 169.2 | -167.3 | 0 | 0 | 0 | 0 | 109.1 | F2224 R2225 R2229 M2230 | F2224-S2227 WeakPolarHBondContact O-CA 3.28Å; F2224-S2227 VanDerWaalsContact O-CB 3.23Å; F2224-S2227 WeakPolarHBondContact O-CB 3.49Å; F2224-S2227 PolarHBondContact O-N 3.28Å; R2225-S2227 PolarHBondContact O-N 2.85Å; S2227-R2229 PolarHBondContact O-N 3.37Å; S2227-R2229 VanDerWaalsContact O-N 3.09Å; S2227-M2230 PolarHBondContact O-N 3.47Å | ||
| 2228 | P | 44.4 | Very low | 50.2 | Low | 65.6667 Ų | 65.6667 | 85.9 Ų | 85.9 | 43% | 0.426 | 49% | 0.489 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -67 | -4.3 | -179.3 | 10.6 | -9.5 | 0 | 0 | 0 | 113.5 | F2031 V2071 I2226 M2230 | F2031-P2228 HydrophobicContact CD2-CB 3.8Å; F2031-P2228 HydrophobicContact CD2-CG 4.29Å; F2031-P2228 HydrophobicContact CE2-CB 3.62Å; F2031-P2228 HydrophobicContact CE2-CG 4Å; F2031-P2228 HydrophobicContact CZ-CB 4.5Å; V2071-P2228 HydrophobicContact CB-CG 4.22Å; V2071-P2228 HydrophobicContact CG1-CG 4.02Å; V2071-P2228 HydrophobicContact CG2-CB 4.33Å; V2071-P2228 HydrophobicContact CG2-CG 3.7Å; V2071-P2228 VanDerWaalsContact CG2-CG 3.43Å; I2226-P2228 WeakPolarHBondContact O-CD 3.42Å; P2228-M2230 VanDerWaalsContact C-N 3.28Å; P2228-M2230 PolarHBondContact O-N 3.05Å; P2228-M2230 VanDerWaalsContact O-N 3.1Å |
| 2229 | R | 47 | Very low | 48.4 | Very low | 128.667 Ų | 128.667 | 91.1 Ų | 91.1 | 49% | 0.486 | 51% | 0.51 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -71.6 | -6.1 | -178.4 | -69.9 | -176.2 | 170 | 162.5 | 0.2 | 114.9 | F2031 Y2034 V2075 D2078 S2227 | F2031-R2229 HydrophobicContact CE1-CG 4.06Å; F2031-R2229 HydrophobicContact CE2-CG 4.36Å; F2031-R2229 HydrophobicContact CZ-CG 4Å; Y2034-R2229 VanDerWaalsContact CZ-NH2 3.34Å; Y2034-R2229 PolarHBondContact OH-NH1 2.91Å; Y2034-R2229 PolarHBondContact OH-NH2 3.1Å; V2075-R2229 VanDerWaalsContact CG1-NH2 3.26Å; V2075-R2229 VanDerWaalsContact CG2-CZ 3.45Å; D2078-R2229 VanDerWaalsContact CG-NH1 3.32Å; D2078-R2229 IonicContact OD1-NH1 3.7Å; D2078-R2229 PolarHBondContact OD1-NH1 3.34Å; D2078-R2229 IonicContact OD2-CZ 2.76Å; D2078-R2229 IonicContact OD2-NH1 2.96Å; D2078-R2229 PolarHBondContact OD2-NH1 2.99Å; D2078-R2229 IonicContact OD2-NH2 3.15Å; D2078-R2229 PolarHBondContact OD2-NH2 3.39Å; S2227-R2229 PolarHBondContact O-N 3.37Å; S2227-R2229 VanDerWaalsContact O-N 3.09Å |
| 2230 | M | 39.3 | Very low | 46.8 | Very low | 169.333 Ų | 169.333 | 100.2 Ų | 100.2 | 83% | 0.834 | 55% | 0.545 | S | S | * | . | S | Bend | trans | -114.7 | 98.2 | 170.8 | -84.8 | -169 | 153.6 | 0 | 0 | 111.2 | S2227 P2228 L2232 | S2227-M2230 PolarHBondContact O-N 3.47Å; P2228-M2230 VanDerWaalsContact C-N 3.28Å; P2228-M2230 PolarHBondContact O-N 3.05Å; P2228-M2230 VanDerWaalsContact O-N 3.1Å; M2230-L2232 PolarHBondContact O-N 3.13Å; M2230-L2232 HydrophobicContact SD-CD1 4.38Å |
| 2231 | S | 30 | Very low | 45.1 | Very low | 118.333 Ų | 118.333 | 106.9 Ų | 106.9 | 83% | 0.828 | 56% | 0.56 | S | S | * | * | trans | -60.3 | 99 | 166.4 | 49.4 | 0 | 0 | 0 | 0 | 112.7 | ||||
| 2232 | L | 29.6 | Very low | 43.2 | Very low | 150 Ų | 150 | 108.5 Ų | 108.5 | 79% | 0.785 | 57% | 0.573 | S | S | * | * | trans | -128 | 138 | 143.6 | -94.5 | 149.5 | 0 | 0 | 0 | 107.1 | M2230 V2234 | M2230-L2232 PolarHBondContact O-N 3.13Å; M2230-L2232 HydrophobicContact SD-CD1 4.38Å; L2232-V2234 PolarHBondContact O-N 3.14Å | ||
| 2233 | P | 28.1 | Very low | 41.1 | Very low | 101.333 Ų | 101.333 | 111.1 Ų | 111.1 | 66% | 0.658 | 59% | 0.592 | S | S | * | * | trans | -68.4 | 134.8 | -168.5 | 13.5 | -12.6 | 0 | 0 | 0 | 111.5 | H2235 | P2233-H2235 VanDerWaalsContact C-N 3.27Å; P2233-H2235 PolarHBondContact O-N 3.41Å | ||
| 2234 | V | 32.7 | Very low | 38.9 | Very low | 122.333 Ų | 122.333 | 114.9 Ų | 114.9 | 74% | 0.741 | 63% | 0.631 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -85.6 | 71.9 | 173.1 | -176.1 | 0 | 0 | 0 | 0 | 111.3 | L2232 A2236 S2237 S2238 | L2232-V2234 PolarHBondContact O-N 3.14Å; V2234-A2236 HydrophobicContact CG1-CB 4.01Å; V2234-A2236 PolarHBondContact O-N 3.19Å; V2234-S2237 PolarHBondContact O-OG 3.43Å; V2234-S2238 PolarHBondContact O-N 3.08Å |
| 2235 | H | 29.7 | Very low | 36.6 | Very low | 173.667 Ų | 173.667 | 116.8 Ų | 116.8 | 80% | 0.804 | 64% | 0.644 | S | S | * | * | H | α-helix | trans | -90.1 | 12.3 | 171.8 | -72.8 | -60 | 0 | 0 | 0 | 114.9 | P2233 S2237 S2238 E2239 | P2233-H2235 VanDerWaalsContact C-N 3.27Å; P2233-H2235 PolarHBondContact O-N 3.41Å; H2235-S2237 VanDerWaalsContact C-N 3.26Å; H2235-S2237 PolarHBondContact O-N 3.28Å; H2235-S2238 WeakPolarHBondContact O-CA 3.5Å; H2235-S2238 WeakPolarHBondContact O-CB 3.48Å; H2235-S2238 PolarHBondContact O-N 2.93Å; H2235-E2239 PolarHBondContact O-N 3.32Å |
| 2236 | A | 29.7 | Very low | 35.2 | Very low | 78.6667 Ų | 78.6667 | 113.9 Ų | 113.9 | 65% | 0.65 | 65% | 0.649 | S | S | * | * | H | α-helix | trans | -123.8 | 20.5 | -179.4 | 0 | 0 | 0 | 0 | 0 | 115 | V2234 | V2234-A2236 HydrophobicContact CG1-CB 4.01Å; V2234-A2236 PolarHBondContact O-N 3.19Å |
| 2237 | S | 33.2 | Very low | 34.3 | Very low | 89.3333 Ų | 89.3333 | 117.1 Ų | 117.1 | 63% | 0.625 | 67% | 0.67 | S | S | * | * | trans | -132.7 | -0.3 | 169.9 | 42.3 | 0 | 0 | 0 | 0 | 114.6 | V2234 H2235 E2239 Y2240 | V2234-S2237 PolarHBondContact O-OG 3.43Å; H2235-S2237 VanDerWaalsContact C-N 3.26Å; H2235-S2237 PolarHBondContact O-N 3.28Å; S2237-E2239 PolarHBondContact O-N 2.97Å; S2237-Y2240 PolarHBondContact O-N 2.88Å | ||
| 2238 | S | 31.1 | Very low | 33.9 | Very low | 83.3333 Ų | 83.3333 | 119.6 Ų | 119.6 | 58% | 0.583 | 69% | 0.685 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -68.8 | -17.6 | 169 | -164.6 | 0 | 0 | 0 | 0 | 112.8 | V2234 H2235 Y2240 Y2241 A2242 | V2234-S2238 PolarHBondContact O-N 3.08Å; H2235-S2238 WeakPolarHBondContact O-CA 3.5Å; H2235-S2238 WeakPolarHBondContact O-CB 3.48Å; H2235-S2238 PolarHBondContact O-N 2.93Å; S2238-Y2240 PolarHBondContact O-N 2.81Å; S2238-Y2241 PolarHBondContact O-N 3.11Å; S2238-A2242 VanDerWaalsContact O-CB 3.25Å; S2238-A2242 WeakPolarHBondContact O-CB 3.32Å; S2238-A2242 PolarHBondContact O-N 3.14Å |
| 2239 | E | 29.7 | Very low | 34.2 | Very low | 155.667 Ų | 155.667 | 123.4 Ų | 123.4 | 73% | 0.727 | 69% | 0.691 | S | S | * | * | H | α-helix | trans | -74.7 | -14.1 | -179.5 | -70.7 | -173.7 | 160.1 | 0 | 0 | 114.7 | H2235 S2237 S2243 | H2235-E2239 PolarHBondContact O-N 3.32Å; S2237-E2239 PolarHBondContact O-N 2.97Å; E2239-S2243 VanDerWaalsContact O-CB 3.28Å; E2239-S2243 WeakPolarHBondContact O-CB 3.34Å; E2239-S2243 PolarHBondContact O-N 3.36Å; E2239-S2243 VanDerWaalsContact O-N 3.17Å; E2239-S2243 PolarHBondContact O-OG 3.01Å |
| 2240 | Y | 39.3 | Very low | 34.3 | Very low | 198.333 Ų | 198.333 | 125.8 Ų | 125.8 | 78% | 0.778 | 71% | 0.708 | S | S | * | * | H | α-helix | trans | -91.4 | -14 | 179.7 | -91.5 | -83.9 | 0 | 0 | 0 | 115.4 | S2237 S2238 | S2237-Y2240 PolarHBondContact O-N 2.88Å; S2238-Y2240 PolarHBondContact O-N 2.81Å |
| 2241 | Y | 39.3 | Very low | 35.1 | Very low | 195.667 Ų | 195.667 | 121.4 Ų | 121.4 | 77% | 0.767 | 69% | 0.688 | S | S | * | * | H | α-helix | trans | -112 | -14.6 | 172 | -78.9 | -81.6 | 0 | 0 | 0 | 113.4 | S2238 | S2238-Y2241 PolarHBondContact O-N 3.11Å |
| 2242 | A | 31.9 | Very low | 36.8 | Very low | 79 Ų | 79 | 125.4 Ų | 125.4 | 65% | 0.653 | 68% | 0.684 | S | S | * | * | H | α-helix | trans | -93.5 | -14 | 180 | 0 | 0 | 0 | 0 | 0 | 114.4 | S2238 G2244 | S2238-A2242 VanDerWaalsContact O-CB 3.25Å; S2238-A2242 WeakPolarHBondContact O-CB 3.32Å; S2238-A2242 PolarHBondContact O-N 3.14Å; A2242-G2244 PolarHBondContact O-N 2.63Å |
| 2243 | S | 28.9 | Very low | 39.1 | Very low | 65.6667 Ų | 65.6667 | 120 Ų | 120 | 46% | 0.459 | 66% | 0.656 | S | S | . | * | trans | -93.1 | 104.1 | 170.7 | 92.9 | 0 | 0 | 0 | 0 | 109.6 | E2239 I2245 | E2239-S2243 VanDerWaalsContact O-CB 3.28Å; E2239-S2243 WeakPolarHBondContact O-CB 3.34Å; E2239-S2243 PolarHBondContact O-N 3.36Å; E2239-S2243 VanDerWaalsContact O-N 3.17Å; E2239-S2243 PolarHBondContact O-OG 3.01Å; S2243-I2245 PolarHBondContact O-N 3.09Å | ||
| 2244 | G | 30 | Very low | 41.5 | Very low | 82.6667 Ų | 82.6667 | 118.2 Ų | 118.2 | 85% | 0.852 | 64% | 0.643 | S | S | * | * | trans | -67.4 | 38.5 | 175.7 | 0 | 0 | 0 | 0 | 0 | 114.6 | A2242 P2246 | A2242-G2244 PolarHBondContact O-N 2.63Å; G2244-P2246 WeakPolarHBondContact O-CD 3.33Å | ||
| 2245 | I | 28.9 | Very low | 43.7 | Very low | 126.333 Ų | 126.333 | 116.7 Ų | 116.7 | 65% | 0.648 | 63% | 0.631 | S | S | * | * | trans | -111.3 | 108.8 | 175.5 | -55.1 | 176.1 | 0 | 0 | 0 | 107 | S2243 V2247 | S2243-I2245 PolarHBondContact O-N 3.09Å; I2245-V2247 PolarHBondContact O-N 3.17Å | ||
| 2246 | P | 33.3 | Very low | 46.1 | Very low | 116.333 Ų | 116.333 | 110.9 Ų | 110.9 | 76% | 0.755 | 61% | 0.613 | S | S | * | * | trans | -67.9 | 102.8 | 173.9 | 27.5 | -30.3 | 0 | 0 | 0 | 107.7 | G2244 P2248 | G2244-P2246 WeakPolarHBondContact O-CD 3.33Å; P2246-P2248 VanDerWaalsContact O-CD 3.29Å; P2246-P2248 WeakPolarHBondContact O-CD 3.4Å; P2246-P2248 VanDerWaalsContact O-N 3.1Å | ||
| 2247 | V | 36.6 | Very low | 48.8 | Very low | 112.333 Ų | 112.333 | 110 Ų | 110 | 68% | 0.681 | 60% | 0.597 | S | S | * | * | trans | -58.7 | 118.5 | 168 | 179 | 0 | 0 | 0 | 0 | 106.3 | I2245 R2249 | I2245-V2247 PolarHBondContact O-N 3.17Å; V2247-R2249 PolarHBondContact O-N 3.04Å; V2247-R2249 VanDerWaalsContact O-N 3.13Å | ||
| 2248 | P | 38.7 | Very low | 51.5 | Low | 99.6667 Ų | 99.6667 | 105.8 Ų | 105.8 | 65% | 0.647 | 57% | 0.568 | S | S | * | * | trans | -58.1 | 125.2 | -176.2 | 5.1 | -8.9 | 0 | 0 | 0 | 109.3 | P2246 Q2250 | P2246-P2248 VanDerWaalsContact O-CD 3.29Å; P2246-P2248 WeakPolarHBondContact O-CD 3.4Å; P2246-P2248 VanDerWaalsContact O-N 3.1Å; P2248-Q2250 VanDerWaalsContact C-N 3.33Å; P2248-Q2250 PolarHBondContact O-N 3.23Å | ||
| 2249 | R | 51.8 | Low | 54.2 | Low | 144.667 Ų | 144.667 | 106.1 Ų | 106.1 | 55% | 0.546 | 56% | 0.56 | S | S | . | * | trans | -57.7 | 99.6 | 178.1 | -73.5 | -179.1 | 176.2 | 161.3 | -2.1 | 109.5 | E2115 V2247 D2251 R2252 | E2115-R2249 VanDerWaalsContact CD-NH1 3.3Å; E2115-R2249 IonicContact OE1-CZ 3.47Å; E2115-R2249 IonicContact OE1-NH1 3.12Å; E2115-R2249 PolarHBondContact OE1-NH1 3.09Å; E2115-R2249 VanDerWaalsContact OE1-NH1 3.15Å; E2115-R2249 IonicContact OE1-NH2 3.52Å; E2115-R2249 PolarHBondContact OE1-NH2 3.02Å; E2115-R2249 IonicContact OE2-CZ 3.26Å; E2115-R2249 VanDerWaalsContact OE2-CZ 3.32Å; E2115-R2249 IonicContact OE2-NH1 3.37Å; E2115-R2249 PolarHBondContact OE2-NH1 2.95Å; E2115-R2249 VanDerWaalsContact OE2-NH1 3.12Å; E2115-R2249 IonicContact OE2-NH2 3.57Å; E2115-R2249 PolarHBondContact OE2-NH2 3.33Å; V2247-R2249 PolarHBondContact O-N 3.04Å; V2247-R2249 VanDerWaalsContact O-N 3.13Å; R2249-D2251 VanDerWaalsContact C-N 3.3Å; R2249-D2251 PolarHBondContact O-N 2.96Å; R2249-R2252 HydrophobicContact CB-CG 4.49Å | ||
| 2250 | Q | 48.2 | Very low | 57.1 | Low | 180 Ų | 180 | 101 Ų | 101 | 84% | 0.841 | 54% | 0.539 | S | S | * | . | S | Bend | trans | -75.2 | -25.8 | -178.1 | -76.7 | -179.6 | -14.8 | 0 | 0 | 113.1 | P2248 | P2248-Q2250 VanDerWaalsContact C-N 3.33Å; P2248-Q2250 PolarHBondContact O-N 3.23Å |
| 2251 | D | 57.4 | Low | 59.6 | Low | 77 Ų | 77 | 91.5 Ų | 91.5 | 41% | 0.412 | 50% | 0.502 | S | S | . | . | trans | -111.7 | 75.3 | -178.2 | -69.4 | -24.2 | 0 | 0 | 0 | 111.2 | N2157 S2212 R2249 | N2157-D2251 PolarHBondContact ND2-O 3.18Å; S2212-D2251 PolarHBondContact OG-OD2 3.13Å; S2212-D2251 VanDerWaalsContact OG-OD2 3.08Å; R2249-D2251 VanDerWaalsContact C-N 3.3Å; R2249-D2251 PolarHBondContact O-N 2.96Å | ||
| 2252 | R | 65.8 | Low | 62.2 | Low | 201 Ų | 201 | 82.2 Ų | 82.2 | 76% | 0.758 | 47% | 0.465 | S | S | * | . | P | Polyproline II helix | trans | -73.6 | 131.9 | 166.8 | -76.2 | -171.6 | 174.9 | -168.1 | -2.9 | 109.4 | R2249 T2254 | R2249-R2252 HydrophobicContact CB-CG 4.49Å; R2252-T2254 PolarHBondContact O-N 3.24Å |
| 2253 | L | 76.1 | Confident | 65 | Low | 36.6667 Ų | 36.6667 | 81.4 Ų | 81.4 | 19% | 0.192 | 45% | 0.45 | C | S | . | . | P | Polyproline II helix | trans | -66.1 | 118.8 | 174 | -174.5 | 70.5 | 0 | 0 | 0 | 109.3 | V2156 N2157 L2208 N2257 L2258 I2261 | V2156-L2253 HydrophobicContact CG1-CD2 3.71Å; N2157-L2253 HydrophobicContact CB-CB 4.07Å; N2157-L2253 HydrophobicContact CB-CD2 4.47Å; N2157-L2253 PolarHBondContact ND2-N 3.23Å; N2157-L2253 VanDerWaalsContact ND2-N 3.19Å; L2208-L2253 WeakPolarHBondContact O-CD1 3.37Å; L2253-N2257 HydrophobicContact CD1-CB 3.56Å; L2253-N2257 HydrophobicContact CG-CB 4.42Å; L2253-L2258 HydrophobicContact CD2-CB 4.24Å; L2253-L2258 HydrophobicContact CD2-CD1 3.95Å; L2253-I2261 HydrophobicContact CD1-CD1 4.44Å |
| 2254 | T | 79.2 | Confident | 68.1 | Low | 63 Ų | 63 | 79 Ų | 79 | 39% | 0.387 | 43% | 0.434 | S | S | . | . | P | Polyproline II helix | trans | -78.6 | 154.1 | 170.2 | 59.9 | 0 | 0 | 0 | 0 | 109.9 | R2252 A2256 N2257 L2258 | R2252-T2254 PolarHBondContact O-N 3.24Å; T2254-A2256 VanDerWaalsContact C-N 3.28Å; T2254-A2256 PolarHBondContact O-N 3.04Å; T2254-N2257 WeakPolarHBondContact O-CB 3.41Å; T2254-N2257 PolarHBondContact O-N 2.98Å; T2254-N2257 WeakPolarHBondContact OG1-CB 3.28Å; T2254-N2257 PolarHBondContact OG1-N 3.01Å; T2254-N2257 PolarHBondContact OG1-ND2 3.13Å; T2254-N2257 PolarHBondContact OG1-OD1 3.17Å; T2254-L2258 PolarHBondContact O-N 2.89Å; T2254-L2258 VanDerWaalsContact O-N 3.12Å |
| 2255 | L | 79.1 | Confident | 71.1 | Confident | 92.6667 Ų | 92.6667 | 75.1 Ų | 75.1 | 49% | 0.485 | 39% | 0.393 | S | S | . | . | H | α-helix | trans | -59.8 | -37.7 | 177.2 | -65.2 | -179.9 | 0 | 0 | 0 | 112 | N2257 L2258 E2259 I2306 | L2255-N2257 VanDerWaalsContact C-N 3.32Å; L2255-N2257 PolarHBondContact O-N 3.12Å; L2255-L2258 WeakPolarHBondContact O-CA 3.27Å; L2255-L2258 VanDerWaalsContact O-CB 3.31Å; L2255-L2258 WeakPolarHBondContact O-CB 3.22Å; L2255-L2258 PolarHBondContact O-N 3.28Å; L2255-L2258 VanDerWaalsContact O-N 3.13Å; L2255-E2259 PolarHBondContact O-N 3.17Å; L2255-I2306 HydrophobicContact CB-CD1 3.69Å; L2255-I2306 VanDerWaalsContact CB-CD1 3.45Å; L2255-I2306 HydrophobicContact CB-CG1 4.06Å; L2255-I2306 HydrophobicContact CD1-CD1 4.15Å; L2255-I2306 HydrophobicContact CD1-CG1 4.17Å; L2255-I2306 HydrophobicContact CD2-CD1 3.33Å; L2255-I2306 HydrophobicContact CD2-CG1 4.13Å; L2255-I2306 HydrophobicContact CG-CD1 3.69Å; L2255-I2306 HydrophobicContact CG-CG1 4.33Å |
| 2256 | A | 80.1 | Confident | 74.1 | Confident | 51.3333 Ų | 51.3333 | 69.9 Ų | 69.9 | 42% | 0.424 | 37% | 0.366 | S | S | . | . | H | α-helix | trans | -62.6 | -34.1 | 172.8 | 0 | 0 | 0 | 0 | 0 | 113.4 | T2254 L2258 E2259 V2260 | T2254-A2256 VanDerWaalsContact C-N 3.28Å; T2254-A2256 PolarHBondContact O-N 3.04Å; A2256-L2258 VanDerWaalsContact C-N 3.3Å; A2256-L2258 PolarHBondContact O-N 3.25Å; A2256-E2259 PolarHBondContact O-N 3.26Å; A2256-V2260 WeakPolarHBondContact O-CG2 3.37Å; A2256-V2260 PolarHBondContact O-N 3.06Å |
| 2257 | N | 86.4 | Confident | 76.9 | Confident | 59 Ų | 59 | 69.6 Ų | 69.6 | 32% | 0.316 | 36% | 0.355 | S | S | . | . | H | α-helix | trans | -69.2 | -31.9 | 173.8 | -74.5 | -8.3 | 0 | 0 | 0 | 111.5 | L2208 L2253 T2254 L2255 I2261 | L2208-N2257 HydrophobicContact CD2-CB 3.54Å; L2253-N2257 HydrophobicContact CD1-CB 3.56Å; L2253-N2257 HydrophobicContact CG-CB 4.42Å; T2254-N2257 WeakPolarHBondContact O-CB 3.41Å; T2254-N2257 PolarHBondContact O-N 2.98Å; T2254-N2257 WeakPolarHBondContact OG1-CB 3.28Å; T2254-N2257 PolarHBondContact OG1-N 3.01Å; T2254-N2257 PolarHBondContact OG1-ND2 3.13Å; T2254-N2257 PolarHBondContact OG1-OD1 3.17Å; L2255-N2257 VanDerWaalsContact C-N 3.32Å; L2255-N2257 PolarHBondContact O-N 3.12Å; N2257-I2261 WeakPolarHBondContact O-CG1 3.35Å; N2257-I2261 PolarHBondContact O-N 3.01Å |
| 2258 | L | 89.3 | Confident | 79.5 | Confident | 1.33333 Ų | 1.33333 | 64.4 Ų | 64.4 | 1% | 0.007 | 32% | 0.323 | C | S | . | . | H | α-helix | trans | -70.7 | -39 | 175.1 | -172.6 | 70.4 | 0 | 0 | 0 | 111.9 | I2153 V2156 L2253 T2254 L2255 A2256 V2260 I2261 T2262 R2303 I2306 V2307 | I2153-L2258 HydrophobicContact CD1-CD1 3.91Å; I2153-L2258 HydrophobicContact CD1-CG 4.4Å; I2153-L2258 HydrophobicContact CG2-CD1 3.97Å; I2153-L2258 HydrophobicContact CG2-CD2 4.27Å; I2153-L2258 HydrophobicContact CG2-CG 4.28Å; V2156-L2258 HydrophobicContact CG1-CD1 3.57Å; L2253-L2258 HydrophobicContact CD2-CB 4.24Å; L2253-L2258 HydrophobicContact CD2-CD1 3.95Å; T2254-L2258 PolarHBondContact O-N 2.89Å; T2254-L2258 VanDerWaalsContact O-N 3.12Å; L2255-L2258 WeakPolarHBondContact O-CA 3.27Å; L2255-L2258 VanDerWaalsContact O-CB 3.31Å; L2255-L2258 WeakPolarHBondContact O-CB 3.22Å; L2255-L2258 PolarHBondContact O-N 3.28Å; L2255-L2258 VanDerWaalsContact O-N 3.13Å; A2256-L2258 VanDerWaalsContact C-N 3.3Å; A2256-L2258 PolarHBondContact O-N 3.25Å; L2258-V2260 VanDerWaalsContact C-N 3.34Å; L2258-V2260 PolarHBondContact O-N 3Å; L2258-I2261 PolarHBondContact O-N 3.04Å; L2258-T2262 WeakPolarHBondContact O-CB 3.28Å; L2258-T2262 PolarHBondContact O-N 3.32Å; L2258-T2262 PolarHBondContact O-OG1 2.95Å; L2258-R2303 HydrophobicContact CD2-CB 3.76Å; L2258-R2303 HydrophobicContact CD2-CG 3.96Å; L2258-I2306 HydrophobicContact CD2-CD1 4.37Å; L2258-V2307 HydrophobicContact CD2-CG2 4.34Å |
| 2259 | E | 87.6 | Confident | 82 | Confident | 90 Ų | 90 | 59.7 Ų | 59.7 | 42% | 0.421 | 29% | 0.292 | S | S | . | . | H | α-helix | trans | -55.1 | -49.6 | 173 | -146.2 | 174.7 | -172.7 | 0 | 0 | 110.8 | L2255 A2256 I2261 T2262 D2263 I2306 | L2255-E2259 PolarHBondContact O-N 3.17Å; A2256-E2259 PolarHBondContact O-N 3.26Å; E2259-I2261 VanDerWaalsContact C-N 3.32Å; E2259-I2261 PolarHBondContact O-N 3.13Å; E2259-T2262 CarbonylContact O-C 3.38Å; E2259-T2262 WeakPolarHBondContact O-CA 3.44Å; E2259-T2262 WeakPolarHBondContact O-CB 3.47Å; E2259-T2262 PolarHBondContact O-N 3.13Å; E2259-D2263 PolarHBondContact O-N 3.24Å; E2259-I2306 HydrophobicContact CB-CG2 4.34Å; E2259-I2306 HydrophobicContact CG-CG2 3.4Å; E2259-I2306 VanDerWaalsContact CG-CG2 3.4Å |
| 2260 | V | 91.2 | Very high | 83.7 | Confident | 47.6667 Ų | 47.6667 | 55.9 Ų | 55.9 | 29% | 0.289 | 28% | 0.281 | S | S | . | . | H | α-helix | trans | -58.4 | -40.1 | 177.7 | 175.3 | 0 | 0 | 0 | 0 | 112.7 | L2208 A2256 L2258 T2262 S2264 | L2208-V2260 HydrophobicContact CD1-CB 4.46Å; L2208-V2260 HydrophobicContact CD1-CG1 3.88Å; A2256-V2260 WeakPolarHBondContact O-CG2 3.37Å; A2256-V2260 PolarHBondContact O-N 3.06Å; L2258-V2260 VanDerWaalsContact C-N 3.34Å; L2258-V2260 PolarHBondContact O-N 3Å; V2260-T2262 VanDerWaalsContact C-N 3.34Å; V2260-S2264 PolarHBondContact O-N 3.1Å; V2260-S2264 PolarHBondContact O-OG 2.98Å |
| 2261 | I | 92.4 | Very high | 85.6 | Confident | 0 Ų | 0 | 47.8 Ų | 47.8 | 0% | 0 | 24% | 0.244 | C | C | . | . | H | α-helix | trans | -67.3 | -43.3 | 175.7 | -61.5 | 162.8 | 0 | 0 | 0 | 109.9 | I2153 V2156 L2208 F2209 L2253 N2257 L2258 E2259 S2264 L2265 | I2153-I2261 HydrophobicContact CD1-CB 4.42Å; I2153-I2261 HydrophobicContact CD1-CG2 3.95Å; V2156-I2261 HydrophobicContact CG1-CD1 4.3Å; V2156-I2261 HydrophobicContact CG2-CD1 3.88Å; L2208-I2261 HydrophobicContact CB-CD1 3.98Å; L2208-I2261 HydrophobicContact CB-CG1 4.05Å; L2208-I2261 HydrophobicContact CD1-CG1 4.17Å; F2209-I2261 HydrophobicContact CD2-CD1 4.42Å; F2209-I2261 HydrophobicContact CE2-CD1 4.35Å; F2209-I2261 HydrophobicContact CE2-CG1 4.29Å; F2209-I2261 HydrophobicContact CE2-CG2 4.2Å; F2209-I2261 HydrophobicContact CZ-CG2 4.18Å; L2253-I2261 HydrophobicContact CD1-CD1 4.44Å; N2257-I2261 WeakPolarHBondContact O-CG1 3.35Å; N2257-I2261 PolarHBondContact O-N 3.01Å; L2258-I2261 PolarHBondContact O-N 3.04Å; E2259-I2261 VanDerWaalsContact C-N 3.32Å; E2259-I2261 PolarHBondContact O-N 3.13Å; I2261-S2264 WeakPolarHBondContact O-CB 3.36Å; I2261-S2264 PolarHBondContact O-N 3.26Å; I2261-L2265 HydrophobicContact CG2-CD1 4.16Å; I2261-L2265 HydrophobicContact CG2-CG 4.43Å; I2261-L2265 WeakPolarHBondContact O-CG 3.34Å; I2261-L2265 PolarHBondContact O-N 3.18Å; I2261-L2265 VanDerWaalsContact O-N 3.08Å |
| 2262 | T | 92.7 | Very high | 87.1 | Confident | 0 Ų | 0 | 44.1 Ų | 44.1 | 0% | 0 | 22% | 0.224 | C | C | . | . | H | α-helix | trans | -62.3 | -47.4 | -178.4 | -52.9 | 0 | 0 | 0 | 0 | 111.1 | I2153 L2258 E2259 V2260 S2264 L2265 I2266 W2285 V2307 C2310 | I2153-T2262 WeakPolarHBondContact CD1-OG1 3.3Å; L2258-T2262 WeakPolarHBondContact O-CB 3.28Å; L2258-T2262 PolarHBondContact O-N 3.32Å; L2258-T2262 PolarHBondContact O-OG1 2.95Å; E2259-T2262 CarbonylContact O-C 3.38Å; E2259-T2262 WeakPolarHBondContact O-CA 3.44Å; E2259-T2262 WeakPolarHBondContact O-CB 3.47Å; E2259-T2262 PolarHBondContact O-N 3.13Å; V2260-T2262 VanDerWaalsContact C-N 3.34Å; T2262-S2264 VanDerWaalsContact C-N 3.28Å; T2262-S2264 PolarHBondContact O-N 3.06Å; T2262-L2265 CarbonylContact O-C 3.48Å; T2262-L2265 WeakPolarHBondContact O-CA 3.49Å; T2262-L2265 WeakPolarHBondContact O-CB 3.47Å; T2262-L2265 PolarHBondContact O-N 2.96Å; T2262-L2265 VanDerWaalsContact O-N 3.09Å; T2262-I2266 HydrophobicContact CG2-CD1 3.96Å; T2262-I2266 HydrophobicContact CG2-CG1 4.36Å; T2262-I2266 VanDerWaalsContact O-CG1 3.31Å; T2262-I2266 WeakPolarHBondContact O-CG1 3.24Å; T2262-I2266 PolarHBondContact O-N 3.02Å; T2262-W2285 HydrophobicContact CG2-CH2 4.18Å; T2262-V2307 HydrophobicContact CG2-CB 4.3Å; T2262-V2307 HydrophobicContact CG2-CG1 4.07Å; T2262-V2307 HydrophobicContact CG2-CG2 4.05Å; T2262-V2307 VanDerWaalsContact OG1-CG2 3.27Å; T2262-V2307 WeakPolarHBondContact OG1-CG2 3.44Å; T2262-C2310 HydrophobicContact CG2-CB 3.8Å |
| 2263 | D | 92.2 | Very high | 88.1 | Confident | 63 Ų | 63 | 36.1 Ų | 36.1 | 34% | 0.337 | 20% | 0.197 | S | C | . | . | H | α-helix | trans | -58.2 | -42.6 | 177.2 | -71.5 | -17.6 | 0 | 0 | 0 | 111.9 | E2259 L2265 I2266 E2267 | E2259-D2263 PolarHBondContact O-N 3.24Å; D2263-L2265 VanDerWaalsContact C-N 3.3Å; D2263-L2265 PolarHBondContact O-N 3.3Å; D2263-I2266 WeakPolarHBondContact O-CB 3.48Å; D2263-I2266 PolarHBondContact O-N 3.04Å; D2263-E2267 PolarHBondContact O-N 3.23Å |
| 2264 | S | 92.9 | Very high | 88.4 | Confident | 15.3333 Ų | 15.3333 | 40.7 Ų | 40.7 | 11% | 0.107 | 22% | 0.217 | C | C | . | . | H | α-helix | trans | -63.3 | -35.2 | 176.4 | -54.9 | 0 | 0 | 0 | 0 | 112.3 | F2205 V2260 I2261 T2262 L2268 | F2205-S2264 WeakPolarHBondContact CZ-OG 3.44Å; V2260-S2264 PolarHBondContact O-N 3.1Å; V2260-S2264 PolarHBondContact O-OG 2.98Å; I2261-S2264 WeakPolarHBondContact O-CB 3.36Å; I2261-S2264 PolarHBondContact O-N 3.26Å; T2262-S2264 VanDerWaalsContact C-N 3.28Å; T2262-S2264 PolarHBondContact O-N 3.06Å; S2264-L2268 WeakPolarHBondContact O-CG 3.38Å; S2264-L2268 PolarHBondContact O-N 3.22Å |
| 2265 | L | 93.8 | Very high | 88.7 | Confident | 0 Ų | 0 | 39.6 Ų | 39.6 | 0% | 0 | 21% | 0.209 | C | C | . | . | H | α-helix | trans | -76.6 | -31.3 | 175.3 | -66.2 | 179.4 | 0 | 0 | 0 | 112.5 | F2149 V2152 I2153 V2171 F2200 I2261 T2262 D2263 L2268 I2269 W2285 | F2149-L2265 HydrophobicContact CB-CD1 4.35Å; F2149-L2265 HydrophobicContact CD1-CD2 4.24Å; F2149-L2265 HydrophobicContact CD2-CB 3.86Å; F2149-L2265 HydrophobicContact CD2-CD1 4.43Å; F2149-L2265 HydrophobicContact CD2-CD2 4.1Å; F2149-L2265 HydrophobicContact CD2-CG 4.34Å; F2149-L2265 HydrophobicContact CE1-CD2 4.01Å; F2149-L2265 HydrophobicContact CE2-CB 4.07Å; F2149-L2265 HydrophobicContact CE2-CD2 3.89Å; F2149-L2265 HydrophobicContact CE2-CG 4.43Å; F2149-L2265 HydrophobicContact CG-CB 4.49Å; F2149-L2265 HydrophobicContact CG-CD1 4.27Å; F2149-L2265 HydrophobicContact CG-CD2 4.29Å; F2149-L2265 HydrophobicContact CZ-CD2 3.84Å; V2152-L2265 HydrophobicContact CG1-CD1 4.21Å; I2153-L2265 HydrophobicContact CD1-CD1 3.94Å; I2153-L2265 HydrophobicContact CG1-CD1 4.17Å; V2171-L2265 HydrophobicContact CG1-CD2 4.31Å; F2200-L2265 HydrophobicContact CZ-CD2 3.93Å; I2261-L2265 HydrophobicContact CG2-CD1 4.16Å; I2261-L2265 HydrophobicContact CG2-CG 4.43Å; I2261-L2265 WeakPolarHBondContact O-CG 3.34Å; I2261-L2265 PolarHBondContact O-N 3.18Å; I2261-L2265 VanDerWaalsContact O-N 3.08Å; T2262-L2265 CarbonylContact O-C 3.48Å; T2262-L2265 WeakPolarHBondContact O-CA 3.49Å; T2262-L2265 WeakPolarHBondContact O-CB 3.47Å; T2262-L2265 PolarHBondContact O-N 2.96Å; T2262-L2265 VanDerWaalsContact O-N 3.09Å; D2263-L2265 VanDerWaalsContact C-N 3.3Å; D2263-L2265 PolarHBondContact O-N 3.3Å; L2265-L2268 HydrophobicContact CD2-CD1 4.08Å; L2265-L2268 WeakPolarHBondContact O-CB 3.18Å; L2265-L2268 PolarHBondContact O-N 2.97Å; L2265-I2269 PolarHBondContact O-N 3.23Å; L2265-I2269 VanDerWaalsContact O-N 3.1Å; L2265-W2285 HydrophobicContact CB-CH2 3.77Å; L2265-W2285 HydrophobicContact CB-CZ3 4.1Å; L2265-W2285 HydrophobicContact CD1-CH2 4.15Å |
| 2266 | I | 92.2 | Very high | 88.8 | Confident | 17.3333 Ų | 17.3333 | 37 Ų | 37 | 9% | 0.089 | 20% | 0.195 | C | C | . | . | H | α-helix | trans | -65.1 | -47.1 | 173.2 | -71.2 | 171.6 | 0 | 0 | 0 | 110 | T2262 D2263 L2268 I2269 E2270 I2282 W2285 C2310 L2311 | T2262-I2266 HydrophobicContact CG2-CD1 3.96Å; T2262-I2266 HydrophobicContact CG2-CG1 4.36Å; T2262-I2266 VanDerWaalsContact O-CG1 3.31Å; T2262-I2266 WeakPolarHBondContact O-CG1 3.24Å; T2262-I2266 PolarHBondContact O-N 3.02Å; D2263-I2266 WeakPolarHBondContact O-CB 3.48Å; D2263-I2266 PolarHBondContact O-N 3.04Å; I2266-L2268 PolarHBondContact O-N 3.31Å; I2266-I2269 PolarHBondContact O-N 3.01Å; I2266-I2269 VanDerWaalsContact O-N 3.11Å; I2266-E2270 HydrophobicContact CG2-CG 4.25Å; I2266-E2270 WeakPolarHBondContact O-CB 3.43Å; I2266-E2270 WeakPolarHBondContact O-CG 3.41Å; I2266-E2270 PolarHBondContact O-N 3.25Å; I2266-I2282 HydrophobicContact CG2-CD1 4.08Å; I2266-W2285 HydrophobicContact CG1-CZ3 3.93Å; I2266-C2310 HydrophobicContact CD1-CB 3.63Å; I2266-L2311 HydrophobicContact CD1-CD2 3.71Å; I2266-L2311 HydrophobicContact CD1-CG 4.07Å; I2266-L2311 HydrophobicContact CG1-CD2 3.59Å; I2266-L2311 HydrophobicContact CG1-CG 4.41Å |
| 2267 | E | 91 | Very high | 88.5 | Confident | 108.667 Ų | 108.667 | 43.1 Ų | 43.1 | 51% | 0.508 | 21% | 0.212 | S | C | . | . | H | α-helix | trans | -57.9 | -38.7 | 177 | -175.8 | 175.5 | 178.3 | 0 | 0 | 111.8 | D2263 E2270 T2271 C2582 | D2263-E2267 PolarHBondContact O-N 3.23Å; E2267-E2270 PolarHBondContact O-N 3.31Å; E2267-T2271 VanDerWaalsContact O-CB 3.23Å; E2267-T2271 WeakPolarHBondContact O-CB 3.24Å; E2267-T2271 PolarHBondContact O-N 3.03Å; E2267-T2271 PolarHBondContact O-OG1 3.22Å; E2267-C2582 PolarHBondContact OE1-SG 3.48Å |
| 2268 | L | 91.6 | Very high | 88.1 | Confident | 4.33333 Ų | 4.33333 | 48.5 Ų | 48.5 | 2% | 0.023 | 24% | 0.241 | C | C | . | . | H | α-helix | trans | -62.1 | -46.6 | 173.3 | -80.3 | 170.7 | 0 | 0 | 0 | 112.6 | F2149 I2175 L2193 A2196 F2200 S2264 L2265 I2266 T2271 C2272 | F2149-L2268 HydrophobicContact CE2-CB 4.23Å; F2149-L2268 HydrophobicContact CZ-CB 4.49Å; F2149-L2268 HydrophobicContact CZ-CD1 4.28Å; I2175-L2268 HydrophobicContact CD1-CD1 3.65Å; I2175-L2268 HydrophobicContact CG1-CD1 3.84Å; I2175-L2268 HydrophobicContact CG1-CD2 4.44Å; I2175-L2268 HydrophobicContact CG2-CD2 4.39Å; L2193-L2268 HydrophobicContact CD2-CD2 3.57Å; A2196-L2268 HydrophobicContact CB-CD1 4.49Å; A2196-L2268 HydrophobicContact CB-CD2 3.43Å; A2196-L2268 HydrophobicContact CB-CG 4.12Å; F2200-L2268 HydrophobicContact CE2-CD1 3.8Å; F2200-L2268 HydrophobicContact CZ-CD1 4.36Å; S2264-L2268 WeakPolarHBondContact O-CG 3.38Å; S2264-L2268 PolarHBondContact O-N 3.22Å; L2265-L2268 HydrophobicContact CD2-CD1 4.08Å; L2265-L2268 WeakPolarHBondContact O-CB 3.18Å; L2265-L2268 PolarHBondContact O-N 2.97Å; I2266-L2268 PolarHBondContact O-N 3.31Å; L2268-T2271 WeakPolarHBondContact O-CB 3.41Å; L2268-T2271 PolarHBondContact O-N 2.94Å; L2268-C2272 PolarHBondContact O-N 3.05Å; L2268-C2272 PolarHBondContact O-SG 3.34Å; L2268-C2272 VanDerWaalsContact O-SG 3.38Å |
| 2269 | I | 90.5 | Very high | 87.8 | Confident | 0 Ų | 0 | 51.2 Ų | 51.2 | 0% | 0 | 25% | 0.251 | C | S | . | . | H | α-helix | trans | -66.4 | -43.9 | 177.2 | -71.1 | 176.3 | 0 | 0 | 0 | 111 | L2145 F2149 L2265 I2266 T2271 C2272 N2273 M2281 I2282 W2285 | L2145-I2269 HydrophobicContact CD2-CG1 4.02Å; L2145-I2269 HydrophobicContact CG-CG1 4.36Å; F2149-I2269 HydrophobicContact CD2-CD1 3.59Å; F2149-I2269 HydrophobicContact CD2-CG1 3.81Å; F2149-I2269 HydrophobicContact CE2-CD1 4.1Å; F2149-I2269 HydrophobicContact CE2-CG1 3.76Å; L2265-I2269 PolarHBondContact O-N 3.23Å; L2265-I2269 VanDerWaalsContact O-N 3.1Å; I2266-I2269 PolarHBondContact O-N 3.01Å; I2266-I2269 VanDerWaalsContact O-N 3.11Å; I2269-T2271 VanDerWaalsContact C-N 3.26Å; I2269-T2271 PolarHBondContact O-N 3.2Å; I2269-C2272 PolarHBondContact O-N 3.19Å; I2269-C2272 VanDerWaalsContact O-N 3.13Å; I2269-N2273 WeakPolarHBondContact O-CB 3.34Å; I2269-N2273 PolarHBondContact O-N 3.25Å; I2269-M2281 HydrophobicContact CG2-CB 3.63Å; I2269-M2281 HydrophobicContact CG2-CE 4.38Å; I2269-I2282 HydrophobicContact CB-CD1 3.84Å; I2269-I2282 HydrophobicContact CB-CG1 4.48Å; I2269-I2282 HydrophobicContact CG2-CD1 4.11Å; I2269-I2282 HydrophobicContact CG2-CG1 3.62Å; I2269-W2285 HydrophobicContact CD1-CD2 4.31Å; I2269-W2285 HydrophobicContact CD1-CE3 3.45Å; I2269-W2285 VanDerWaalsContact CD1-CE3 3.45Å; I2269-W2285 HydrophobicContact CD1-CZ3 3.84Å |
| 2270 | E | 89 | Confident | 87.7 | Confident | 65.3333 Ų | 65.3333 | 50.7 Ų | 50.7 | 31% | 0.305 | 25% | 0.251 | S | S | . | . | H | α-helix | trans | -59.8 | -38.1 | 177 | -76.6 | -169.6 | 154.2 | 0 | 0 | 111.3 | I2266 E2267 Q2274 I2282 K2313 | I2266-E2270 HydrophobicContact CG2-CG 4.25Å; I2266-E2270 WeakPolarHBondContact O-CB 3.43Å; I2266-E2270 WeakPolarHBondContact O-CG 3.41Å; I2266-E2270 PolarHBondContact O-N 3.25Å; E2267-E2270 PolarHBondContact O-N 3.31Å; E2270-Q2274 WeakPolarHBondContact O-CG 3.24Å; E2270-Q2274 PolarHBondContact O-NE2 3.08Å; E2270-I2282 HydrophobicContact CG-CD1 3.65Å; E2270-I2282 VanDerWaalsContact CG-CD1 3.42Å; E2270-I2282 HydrophobicContact CG-CG1 4.24Å; E2270-K2313 IonicContact OE1-NZ 3.2Å; E2270-K2313 PolarHBondContact OE1-NZ 3.21Å |
| 2271 | T | 87.7 | Confident | 87.6 | Confident | 9.66667 Ų | 9.66667 | 48.5 Ų | 48.5 | 6% | 0.059 | 24% | 0.238 | C | C | . | . | H | α-helix | trans | -63.6 | -45.9 | 173.3 | -58.7 | 0 | 0 | 0 | 0 | 111.4 | T2189 N2192 L2193 E2267 L2268 I2269 Q2274 | T2189-T2271 HydrophobicContact CG2-CG2 3.78Å; N2192-T2271 HydrophobicContact CB-CG2 3.7Å; L2193-T2271 HydrophobicContact CD2-CG2 4.31Å; L2193-T2271 HydrophobicContact CG-CG2 4.32Å; E2267-T2271 VanDerWaalsContact O-CB 3.23Å; E2267-T2271 WeakPolarHBondContact O-CB 3.24Å; E2267-T2271 PolarHBondContact O-N 3.03Å; E2267-T2271 PolarHBondContact O-OG1 3.22Å; L2268-T2271 WeakPolarHBondContact O-CB 3.41Å; L2268-T2271 PolarHBondContact O-N 2.94Å; I2269-T2271 VanDerWaalsContact C-N 3.26Å; I2269-T2271 PolarHBondContact O-N 3.2Å; T2271-Q2274 PolarHBondContact O-N 3.43Å |
| 2272 | C | 87.6 | Confident | 87.4 | Confident | 0 Ų | 0 | 49.5 Ų | 49.5 | 0% | 0 | 24% | 0.243 | C | C | . | . | H | α-helix | trans | -68.3 | -36.8 | 178.3 | -67.6 | 0 | 0 | 0 | 0 | 113.5 | F2185 L2268 I2269 Q2274 D2275 I2276 M2281 | F2185-C2272 HydrophobicContact CE1-CB 4.26Å; L2268-C2272 PolarHBondContact O-N 3.05Å; L2268-C2272 PolarHBondContact O-SG 3.34Å; L2268-C2272 VanDerWaalsContact O-SG 3.38Å; I2269-C2272 PolarHBondContact O-N 3.19Å; I2269-C2272 VanDerWaalsContact O-N 3.13Å; C2272-Q2274 PolarHBondContact O-N 3.37Å; C2272-D2275 PolarHBondContact O-N 3.03Å; C2272-I2276 HydrophobicContact CB-CD1 4.45Å; C2272-I2276 WeakPolarHBondContact O-CG1 3.38Å; C2272-I2276 PolarHBondContact O-N 3.07Å; C2272-M2281 HydrophobicContact CB-CE 3.73Å |
| 2273 | N | 86.6 | Confident | 87.2 | Confident | 33.6667 Ų | 33.6667 | 54.6 Ų | 54.6 | 18% | 0.18 | 27% | 0.267 | C | S | . | . | H | α-helix | trans | -62.2 | -25.2 | 179.7 | -87.8 | -7.8 | 0 | 0 | 0 | 113 | I2269 D2275 I2276 M2281 | I2269-N2273 WeakPolarHBondContact O-CB 3.34Å; I2269-N2273 PolarHBondContact O-N 3.25Å; N2273-D2275 PolarHBondContact O-N 3.29Å; N2273-I2276 PolarHBondContact O-N 3.29Å; N2273-M2281 WeakPolarHBondContact OD1-CB 3.29Å; N2273-M2281 WeakPolarHBondContact OD1-CE 3.35Å; N2273-M2281 WeakPolarHBondContact OD1-CG 3.27Å; N2273-M2281 PolarHBondContact OD1-N 2.77Å |
| 2274 | Q | 83.8 | Confident | 87.1 | Confident | 132 Ų | 132 | 54.5 Ų | 54.5 | 62% | 0.617 | 26% | 0.264 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -61 | -32.9 | 178 | -70.7 | 171.6 | 32.3 | 0 | 0 | 112.5 | E2270 T2271 C2272 | E2270-Q2274 WeakPolarHBondContact O-CG 3.24Å; E2270-Q2274 PolarHBondContact O-NE2 3.08Å; T2271-Q2274 PolarHBondContact O-N 3.43Å; C2272-Q2274 PolarHBondContact O-N 3.37Å |
| 2275 | D | 84.4 | Confident | 87.1 | Confident | 41 Ų | 41 | 53.8 Ų | 53.8 | 22% | 0.219 | 26% | 0.259 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -98.6 | -27.9 | -178.1 | -66.1 | -25.6 | 0 | 0 | 0 | 112.6 | F2185 T2186 T2189 C2272 N2273 K2277 | F2185-D2275 VanDerWaalsContact CA-OD2 3.28Å; F2185-D2275 WeakPolarHBondContact CA-OD2 3.35Å; F2185-D2275 HydrophobicContact CD1-CB 3.84Å; F2185-D2275 HydrophobicContact CE1-CB 4.42Å; T2186-D2275 VanDerWaalsContact CG2-OD1 3.23Å; T2186-D2275 WeakPolarHBondContact CG2-OD1 3.34Å; T2186-D2275 PolarHBondContact N-OD2 3.28Å; T2186-D2275 PolarHBondContact OG1-OD1 3.42Å; T2186-D2275 PolarHBondContact OG1-OD2 3.3Å; T2189-D2275 WeakPolarHBondContact CB-OD2 3.19Å; T2189-D2275 WeakPolarHBondContact CG2-OD2 3.27Å; T2189-D2275 PolarHBondContact OG1-OD2 3.11Å; C2272-D2275 PolarHBondContact O-N 3.03Å; N2273-D2275 PolarHBondContact O-N 3.29Å; D2275-K2277 PolarHBondContact O-N 3.34Å |
| 2276 | I | 82.9 | Confident | 86.9 | Confident | 36.3333 Ų | 36.3333 | 54.3 Ų | 54.3 | 19% | 0.186 | 26% | 0.264 | C | S | . | . | S | Bend | trans | -88.9 | 87.2 | -179.2 | -57.5 | 168.1 | 0 | 0 | 0 | 110.2 | I2142 F2185 C2272 N2273 N2278 R2279 M2281 | I2142-I2276 HydrophobicContact CG2-CD1 4.06Å; F2185-I2276 HydrophobicContact CE1-CD1 3.98Å; F2185-I2276 HydrophobicContact CE1-CG1 4.08Å; F2185-I2276 HydrophobicContact CZ-CD1 4.14Å; C2272-I2276 HydrophobicContact CB-CD1 4.45Å; C2272-I2276 WeakPolarHBondContact O-CG1 3.38Å; C2272-I2276 PolarHBondContact O-N 3.07Å; N2273-I2276 PolarHBondContact O-N 3.29Å; I2276-N2278 VanDerWaalsContact C-N 3.28Å; I2276-N2278 PolarHBondContact O-N 3.08Å; I2276-N2278 VanDerWaalsContact O-N 3.12Å; I2276-R2279 HydrophobicContact CG2-CB 4.08Å; I2276-M2281 HydrophobicContact CD1-CE 3.72Å; I2276-M2281 HydrophobicContact CD1-SD 4.33Å |
| 2277 | K | 72.1 | Confident | 86.8 | Confident | 180 Ų | 180 | 59.3 Ų | 59.3 | 78% | 0.783 | 28% | 0.284 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -69.1 | 124.1 | -178.8 | -60.6 | -177.3 | -178.2 | 179.8 | 0 | 112.9 | D2275 | D2275-K2277 PolarHBondContact O-N 3.34Š|
| 2278 | N | 78 | Confident | 86.8 | Confident | 173.667 Ų | 173.667 | 55.4 Ų | 55.4 | 93% | 0.929 | 27% | 0.267 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 83.2 | 9.1 | -179.6 | -57.5 | -17.7 | 0 | 0 | 0 | 116.3 | I2276 | I2276-N2278 VanDerWaalsContact C-N 3.28Å; I2276-N2278 PolarHBondContact O-N 3.08Å; I2276-N2278 VanDerWaalsContact O-N 3.12Å |
| 2279 | R | 84.3 | Confident | 86.8 | Confident | 57 Ų | 57 | 55.2 Ų | 55.2 | 22% | 0.215 | 27% | 0.266 | C | S | . | . | trans | -135.5 | 129.4 | 177.4 | -165.5 | -177.4 | -179.1 | -162.1 | 10.3 | 110.8 | I2142 T2143 I2276 M2281 E2284 | I2142-R2279 PolarHBondContact O-NH1 2.9Å; T2143-R2279 VanDerWaalsContact O-CZ 3.27Å; T2143-R2279 PolarHBondContact O-NH1 3.11Å; T2143-R2279 PolarHBondContact O-NH2 3.26Å; I2276-R2279 HydrophobicContact CG2-CB 4.08Å; R2279-M2281 HydrophobicContact CG-CG 4.06Å; R2279-E2284 WeakPolarHBondContact CG-OE1 3.24Å; R2279-E2284 IonicContact CZ-OE1 2.98Å; R2279-E2284 IonicContact CZ-OE2 3Å; R2279-E2284 VanDerWaalsContact CZ-OE2 3.28Å; R2279-E2284 VanDerWaalsContact NE-CD 3.3Å; R2279-E2284 IonicContact NE-OE1 3.32Å; R2279-E2284 PolarHBondContact NE-OE1 3.28Å; R2279-E2284 IonicContact NE-OE2 3.18Å; R2279-E2284 PolarHBondContact NE-OE2 3.28Å; R2279-E2284 VanDerWaalsContact NE-OE2 3.13Å; R2279-E2284 IonicContact NH2-OE1 3.42Å; R2279-E2284 IonicContact NH2-OE2 2.8Å; R2279-E2284 PolarHBondContact NH2-OE2 3.06Å | ||
| 2280 | D | 85.5 | Confident | 86.7 | Confident | 80.6667 Ų | 80.6667 | 57.3 Ų | 57.3 | 43% | 0.431 | 28% | 0.276 | S | S | . | . | trans | -102.4 | 87 | 170.8 | -171.5 | -13.1 | 0 | 0 | 0 | 109.7 | I2282 Q2283 E2284 | D2280-I2282 PolarHBondContact O-N 2.98Å; D2280-I2282 WeakPolarHBondContact OD1-CB 3.28Å; D2280-I2282 PolarHBondContact OD1-N 3.03Å; D2280-I2282 VanDerWaalsContact OD1-N 3.13Å; D2280-Q2283 HydrophobicContact CB-CB 4.05Å; D2280-Q2283 PolarHBondContact O-N 2.94Å; D2280-Q2283 PolarHBondContact OD1-N 3.15Å; D2280-Q2283 VanDerWaalsContact OD1-N 3.16Å; D2280-E2284 PolarHBondContact O-N 3.24Å; D2280-E2284 VanDerWaalsContact O-N 3.12Å | ||
| 2281 | M | 88.2 | Confident | 86.6 | Confident | 0 Ų | 0 | 55.8 Ų | 55.8 | 0% | 0 | 27% | 0.269 | C | S | . | . | H | α-helix | trans | -63.9 | -23.3 | -179.5 | -67.8 | -170.8 | -70.8 | 0 | 0 | 113.1 | L2145 P2146 I2269 C2272 N2273 I2276 R2279 W2285 | L2145-M2281 HydrophobicContact CB-SD 4.12Å; L2145-M2281 HydrophobicContact CD2-CE 4.2Å; L2145-M2281 HydrophobicContact CD2-SD 4Å; P2146-M2281 HydrophobicContact CG-CB 3.96Å; P2146-M2281 HydrophobicContact CG-CG 4.2Å; I2269-M2281 HydrophobicContact CG2-CB 3.63Å; I2269-M2281 HydrophobicContact CG2-CE 4.38Å; C2272-M2281 HydrophobicContact CB-CE 3.73Å; N2273-M2281 WeakPolarHBondContact OD1-CB 3.29Å; N2273-M2281 WeakPolarHBondContact OD1-CE 3.35Å; N2273-M2281 WeakPolarHBondContact OD1-CG 3.27Å; N2273-M2281 PolarHBondContact OD1-N 2.77Å; I2276-M2281 HydrophobicContact CD1-CE 3.72Å; I2276-M2281 HydrophobicContact CD1-SD 4.33Å; R2279-M2281 HydrophobicContact CG-CG 4.06Å; M2281-W2285 WeakPolarHBondContact O-CB 3.5Å; M2281-W2285 PolarHBondContact O-N 3.21Å |
| 2282 | I | 89.2 | Confident | 86.7 | Confident | 22.3333 Ų | 22.3333 | 55.4 Ų | 55.4 | 12% | 0.115 | 27% | 0.266 | C | S | . | . | H | α-helix | trans | -72.6 | -46.4 | 177 | -64.2 | -157.7 | 0 | 0 | 0 | 109 | I2266 I2269 E2270 D2280 E2284 W2285 A2286 L2311 | I2266-I2282 HydrophobicContact CG2-CD1 4.08Å; I2269-I2282 HydrophobicContact CB-CD1 3.84Å; I2269-I2282 HydrophobicContact CB-CG1 4.48Å; I2269-I2282 HydrophobicContact CG2-CD1 4.11Å; I2269-I2282 HydrophobicContact CG2-CG1 3.62Å; E2270-I2282 HydrophobicContact CG-CD1 3.65Å; E2270-I2282 VanDerWaalsContact CG-CD1 3.42Å; E2270-I2282 HydrophobicContact CG-CG1 4.24Å; D2280-I2282 PolarHBondContact O-N 2.98Å; D2280-I2282 WeakPolarHBondContact OD1-CB 3.28Å; D2280-I2282 PolarHBondContact OD1-N 3.03Å; D2280-I2282 VanDerWaalsContact OD1-N 3.13Å; I2282-E2284 VanDerWaalsContact C-N 3.3Å; I2282-E2284 PolarHBondContact O-N 3.15Å; I2282-W2285 PolarHBondContact O-N 3.12Å; I2282-A2286 VanDerWaalsContact O-CB 3.31Å; I2282-A2286 WeakPolarHBondContact O-CB 3.25Å; I2282-A2286 PolarHBondContact O-N 3.16Å; I2282-L2311 HydrophobicContact CD1-CD2 4.04Å; I2282-L2311 HydrophobicContact CG2-CD2 3.98Å |
| 2283 | Q | 88.3 | Confident | 86.6 | Confident | 106.667 Ų | 106.667 | 55.5 Ų | 55.5 | 50% | 0.498 | 27% | 0.267 | S | S | . | . | H | α-helix | trans | -64.2 | -36.6 | 177.5 | -164.2 | 161.7 | 26.6 | 0 | 0 | 112 | D2280 A2286 K2287 | D2280-Q2283 HydrophobicContact CB-CB 4.05Å; D2280-Q2283 PolarHBondContact O-N 2.94Å; D2280-Q2283 PolarHBondContact OD1-N 3.15Å; D2280-Q2283 VanDerWaalsContact OD1-N 3.16Å; Q2283-A2286 PolarHBondContact O-N 2.93Å; Q2283-K2287 WeakPolarHBondContact O-CD 3.5Å; Q2283-K2287 VanDerWaalsContact O-CG 3.32Å; Q2283-K2287 WeakPolarHBondContact O-CG 3.35Å; Q2283-K2287 PolarHBondContact O-N 3.15Å; Q2283-K2287 VanDerWaalsContact O-N 3.14Å |
| 2284 | E | 90 | Very high | 86.3 | Confident | 61 Ų | 61 | 56.1 Ų | 56.1 | 29% | 0.285 | 27% | 0.27 | S | S | . | . | H | α-helix | trans | -63.2 | -46 | 173.2 | -72.3 | -178.9 | -140.8 | 0 | 0 | 112 | P2146 R2279 D2280 I2282 A2286 K2287 L2288 | P2146-E2284 HydrophobicContact CB-CB 4.22Å; P2146-E2284 HydrophobicContact CG-CB 4.08Å; R2279-E2284 WeakPolarHBondContact CG-OE1 3.24Å; R2279-E2284 IonicContact CZ-OE1 2.98Å; R2279-E2284 IonicContact CZ-OE2 3Å; R2279-E2284 VanDerWaalsContact CZ-OE2 3.28Å; R2279-E2284 VanDerWaalsContact NE-CD 3.3Å; R2279-E2284 IonicContact NE-OE1 3.32Å; R2279-E2284 PolarHBondContact NE-OE1 3.28Å; R2279-E2284 IonicContact NE-OE2 3.18Å; R2279-E2284 PolarHBondContact NE-OE2 3.28Å; R2279-E2284 VanDerWaalsContact NE-OE2 3.13Å; R2279-E2284 IonicContact NH2-OE1 3.42Å; R2279-E2284 IonicContact NH2-OE2 2.8Å; R2279-E2284 PolarHBondContact NH2-OE2 3.06Å; D2280-E2284 PolarHBondContact O-N 3.24Å; D2280-E2284 VanDerWaalsContact O-N 3.12Å; I2282-E2284 VanDerWaalsContact C-N 3.3Å; I2282-E2284 PolarHBondContact O-N 3.15Å; E2284-A2286 VanDerWaalsContact C-N 3.34Å; E2284-A2286 PolarHBondContact O-N 3.26Å; E2284-K2287 PolarHBondContact O-N 2.89Å; E2284-L2288 PolarHBondContact O-N 3.2Å |
| 2285 | W | 93.1 | Very high | 86.3 | Confident | 0 Ų | 0 | 53.4 Ų | 53.4 | 0% | 0 | 25% | 0.254 | C | S | . | . | H | α-helix | trans | -65.7 | -39.2 | 176.9 | -166.4 | 14.1 | 0 | 0 | 0 | 112 | P2146 F2149 H2150 I2153 T2262 L2265 I2266 I2269 M2281 I2282 K2287 L2288 A2289 V2307 L2311 | P2146-W2285 HydrophobicContact CB-CB 3.98Å; F2149-W2285 HydrophobicContact CB-CH2 4.05Å; F2149-W2285 HydrophobicContact CB-CZ2 3.86Å; F2149-W2285 HydrophobicContact CB-CZ3 4.45Å; F2149-W2285 HydrophobicContact CD2-CH2 4.46Å; F2149-W2285 HydrophobicContact CD2-CZ3 4.37Å; H2150-W2285 AromaticContact ND1-NE1 3.9Å; I2153-W2285 HydrophobicContact CG1-CH2 4.41Å; I2153-W2285 HydrophobicContact CG1-CZ2 3.84Å; T2262-W2285 HydrophobicContact CG2-CH2 4.18Å; L2265-W2285 HydrophobicContact CB-CH2 3.77Å; L2265-W2285 HydrophobicContact CB-CZ3 4.1Å; L2265-W2285 HydrophobicContact CD1-CH2 4.15Å; I2266-W2285 HydrophobicContact CG1-CZ3 3.93Å; I2269-W2285 HydrophobicContact CD1-CD2 4.31Å; I2269-W2285 HydrophobicContact CD1-CE3 3.45Å; I2269-W2285 VanDerWaalsContact CD1-CE3 3.45Å; I2269-W2285 HydrophobicContact CD1-CZ3 3.84Å; M2281-W2285 WeakPolarHBondContact O-CB 3.5Å; M2281-W2285 PolarHBondContact O-N 3.21Å; I2282-W2285 PolarHBondContact O-N 3.12Å; W2285-K2287 VanDerWaalsContact C-N 3.3Å; W2285-K2287 PolarHBondContact O-N 3.13Å; W2285-L2288 WeakPolarHBondContact O-CB 3.34Å; W2285-L2288 PolarHBondContact O-N 3.42Å; W2285-L2288 VanDerWaalsContact O-N 3.14Å; W2285-A2289 PolarHBondContact O-N 3.15Å; W2285-V2307 HydrophobicContact CD2-CG1 4.5Å; W2285-V2307 HydrophobicContact CH2-CG1 4.5Å; W2285-V2307 HydrophobicContact CZ2-CG1 3.89Å; W2285-L2311 HydrophobicContact CB-CD1 3.99Å; W2285-L2311 HydrophobicContact CD2-CD1 3.63Å; W2285-L2311 HydrophobicContact CD2-CD2 4.09Å; W2285-L2311 HydrophobicContact CD2-CG 4.42Å; W2285-L2311 HydrophobicContact CE3-CD1 3.9Å; W2285-L2311 HydrophobicContact CE3-CD2 3.49Å; W2285-L2311 VanDerWaalsContact CE3-CD2 3.47Å; W2285-L2311 HydrophobicContact CE3-CG 4.25Å; W2285-L2311 HydrophobicContact CG-CD1 3.66Å; W2285-L2311 HydrophobicContact CZ3-CD2 4Å |
| 2286 | A | 89.9 | Confident | 86.1 | Confident | 11.6667 Ų | 11.6667 | 57.8 Ų | 57.8 | 10% | 0.096 | 27% | 0.272 | C | S | . | . | H | α-helix | trans | -60.4 | -39.7 | 177.2 | 0 | 0 | 0 | 0 | 0 | 111.5 | I2282 Q2283 E2284 L2288 A2289 H2290 Y2308 L2311 | I2282-A2286 VanDerWaalsContact O-CB 3.31Å; I2282-A2286 WeakPolarHBondContact O-CB 3.25Å; I2282-A2286 PolarHBondContact O-N 3.16Å; Q2283-A2286 PolarHBondContact O-N 2.93Å; E2284-A2286 VanDerWaalsContact C-N 3.34Å; E2284-A2286 PolarHBondContact O-N 3.26Å; A2286-L2288 PolarHBondContact O-N 3.38Å; A2286-A2289 PolarHBondContact O-N 3.18Å; A2286-H2290 WeakPolarHBondContact O-CB 3.38Å; A2286-H2290 PolarHBondContact O-N 3.09Å; A2286-Y2308 HydrophobicContact CB-CD2 4.49Å; A2286-Y2308 HydrophobicContact CB-CE2 4.45Å; A2286-Y2308 WeakPolarHBondContact O-CD2 3.28Å; A2286-L2311 HydrophobicContact CB-CB 4.06Å; A2286-L2311 HydrophobicContact CB-CD1 4.43Å |
| 2287 | K | 89.5 | Confident | 86.2 | Confident | 120.667 Ų | 120.667 | 56.3 Ų | 56.3 | 53% | 0.525 | 26% | 0.263 | S | S | . | . | H | α-helix | trans | -62.5 | -41.3 | 174.5 | -73.3 | 169.1 | -176 | 170.9 | 0 | 112.4 | Q2283 E2284 W2285 H2290 H2291 | Q2283-K2287 WeakPolarHBondContact O-CD 3.5Å; Q2283-K2287 VanDerWaalsContact O-CG 3.32Å; Q2283-K2287 WeakPolarHBondContact O-CG 3.35Å; Q2283-K2287 PolarHBondContact O-N 3.15Å; Q2283-K2287 VanDerWaalsContact O-N 3.14Å; E2284-K2287 PolarHBondContact O-N 2.89Å; W2285-K2287 VanDerWaalsContact C-N 3.3Å; W2285-K2287 PolarHBondContact O-N 3.13Å; K2287-H2290 PolarHBondContact O-N 3.27Å; K2287-H2291 WeakPolarHBondContact O-CB 3.37Å; K2287-H2291 PolarHBondContact O-N 3.09Å |
| 2288 | L | 90.9 | Very high | 86.6 | Confident | 28 Ų | 28 | 50.7 Ų | 50.7 | 15% | 0.147 | 25% | 0.245 | C | C | . | . | H | α-helix | trans | -65.1 | -49.4 | 175.9 | -63.9 | 172.7 | 0 | 0 | 0 | 111.2 | M2100 P2146 V2147 H2150 E2284 W2285 A2286 H2290 H2291 F2292 L2784 | M2100-L2288 HydrophobicContact CE-CD2 4.23Å; P2146-L2288 HydrophobicContact CB-CD1 4.43Å; V2147-L2288 HydrophobicContact CB-CD1 4.44Å; V2147-L2288 HydrophobicContact CG2-CD1 3.79Å; H2150-L2288 HydrophobicContact CB-CD1 4.34Å; E2284-L2288 PolarHBondContact O-N 3.2Å; W2285-L2288 WeakPolarHBondContact O-CB 3.34Å; W2285-L2288 PolarHBondContact O-N 3.42Å; W2285-L2288 VanDerWaalsContact O-N 3.14Å; A2286-L2288 PolarHBondContact O-N 3.38Å; L2288-H2290 VanDerWaalsContact C-N 3.3Å; L2288-H2290 PolarHBondContact O-N 3.19Å; L2288-H2291 WeakPolarHBondContact O-CB 3.34Å; L2288-H2291 PolarHBondContact O-N 3.12Å; L2288-F2292 WeakPolarHBondContact O-CD2 3.35Å; L2288-F2292 PolarHBondContact O-N 3.12Å; L2288-L2784 HydrophobicContact CD2-CD1 3.73Å; L2288-L2784 HydrophobicContact CD2-CD2 4.44Å |
| 2289 | A | 90.9 | Very high | 86.9 | Confident | 0 Ų | 0 | 43.2 Ų | 43.2 | 0% | 0 | 21% | 0.208 | C | C | . | . | H | α-helix | trans | -60.2 | -41.5 | 177.7 | 0 | 0 | 0 | 0 | 0 | 111.6 | W2285 A2286 H2291 F2292 S2293 V2307 L2311 | W2285-A2289 PolarHBondContact O-N 3.15Å; A2286-A2289 PolarHBondContact O-N 3.18Å; A2289-H2291 PolarHBondContact O-N 3.04Å; A2289-F2292 PolarHBondContact O-N 3.02Å; A2289-S2293 WeakPolarHBondContact O-CB 3.27Å; A2289-S2293 PolarHBondContact O-N 3.18Å; A2289-S2293 PolarHBondContact O-OG 3.39Å; A2289-V2307 HydrophobicContact CB-CB 4.17Å; A2289-V2307 HydrophobicContact CB-CG1 3.9Å; A2289-L2311 HydrophobicContact CB-CD1 4.29Å |
| 2290 | H | 88.2 | Confident | 87.1 | Confident | 44.3333 Ų | 44.3333 | 40.6 Ų | 40.6 | 21% | 0.205 | 20% | 0.198 | C | C | . | . | H | α-helix | trans | -59.7 | -47.2 | 175 | -175.2 | 52.8 | 0 | 0 | 0 | 111.9 | A2286 K2287 L2288 F2292 S2293 L2294 Y2308 T2319 | A2286-H2290 WeakPolarHBondContact O-CB 3.38Å; A2286-H2290 PolarHBondContact O-N 3.09Å; K2287-H2290 PolarHBondContact O-N 3.27Å; L2288-H2290 VanDerWaalsContact C-N 3.3Å; L2288-H2290 PolarHBondContact O-N 3.19Å; H2290-F2292 VanDerWaalsContact C-N 3.34Å; H2290-F2292 PolarHBondContact O-N 2.98Å; H2290-S2293 WeakPolarHBondContact CA-OG 3.31Å; H2290-S2293 PolarHBondContact O-N 3.27Å; H2290-S2293 VanDerWaalsContact O-N 3.14Å; H2290-S2293 PolarHBondContact O-OG 3.2Å; H2290-L2294 VanDerWaalsContact CE1-CD1 3.43Å; H2290-L2294 WeakPolarHBondContact CE1-CD1 3.46Å; H2290-L2294 WeakPolarHBondContact NE2-CD1 3.46Å; H2290-L2294 PolarHBondContact O-N 3.22Å; H2290-Y2308 HydrophobicContact CB-CD2 3.68Å; H2290-Y2308 HydrophobicContact CB-CE2 3.68Å; H2290-Y2308 HydrophobicContact CB-CG 4.43Å; H2290-Y2308 AromaticContact ND1-CE2 3.97Å; H2290-Y2308 AromaticContact ND1-CZ 3.84Å; H2290-T2319 VanDerWaalsContact CE1-CG2 3.44Å; H2290-T2319 WeakPolarHBondContact CE1-CG2 3.43Å |
| 2291 | H | 88.2 | Confident | 87.1 | Confident | 32.3333 Ų | 32.3333 | 38.3 Ų | 38.3 | 15% | 0.15 | 19% | 0.185 | C | C | . | . | H | α-helix | trans | -55.8 | -47.1 | 178.4 | -176 | 93.7 | 0 | 0 | 0 | 112.6 | E2104 K2287 L2288 A2289 L2294 R2295 P2782 L2784 | E2104-H2291 IonicContact OE1-NE2 3.17Å; K2287-H2291 WeakPolarHBondContact O-CB 3.37Å; K2287-H2291 PolarHBondContact O-N 3.09Å; L2288-H2291 WeakPolarHBondContact O-CB 3.34Å; L2288-H2291 PolarHBondContact O-N 3.12Å; A2289-H2291 PolarHBondContact O-N 3.04Å; H2291-L2294 PolarHBondContact O-N 3.14Å; H2291-R2295 PolarHBondContact CE1-NH2 3.18Å; H2291-R2295 PolarHBondContact NE2-NE 3.2Å; H2291-P2782 PolarHBondContact CE1-O 3.37Å; H2291-L2784 HydrophobicContact CB-CD1 3.64Å |
| 2292 | F | 88.7 | Confident | 86.8 | Confident | 2.33333 Ų | 2.33333 | 39.9 Ų | 39.9 | 1% | 0.01 | 20% | 0.202 | C | C | . | . | H | α-helix | trans | -75.6 | -24.8 | 178.3 | -76.8 | -83 | 0 | 0 | 0 | 113.5 | M2100 L2103 E2104 H2150 L2288 A2289 H2290 L2294 L2300 A2304 | M2100-F2292 HydrophobicContact SD-CE2 3.67Å; M2100-F2292 HydrophobicContact SD-CZ 3.81Å; L2103-F2292 HydrophobicContact CB-CE1 4.13Å; L2103-F2292 HydrophobicContact CB-CZ 4.05Å; E2104-F2292 HydrophobicContact CG-CE1 4.42Å; E2104-F2292 HydrophobicContact CG-CZ 3.9Å; H2150-F2292 AromaticContact CE1-CD2 3.59Å; H2150-F2292 AromaticContact NE2-CD2 3.24Å; H2150-F2292 VanDerWaalsContact NE2-CD2 3.26Å; H2150-F2292 WeakPolarHBondContact NE2-CD2 3.4Å; H2150-F2292 AromaticContact NE2-CE2 3.44Å; H2150-F2292 WeakPolarHBondContact NE2-CE2 3.37Å; H2150-F2292 AromaticContact NE2-CG 3.93Å; L2288-F2292 WeakPolarHBondContact O-CD2 3.35Å; L2288-F2292 PolarHBondContact O-N 3.12Å; A2289-F2292 PolarHBondContact O-N 3.02Å; H2290-F2292 VanDerWaalsContact C-N 3.34Å; H2290-F2292 PolarHBondContact O-N 2.98Å; F2292-L2294 VanDerWaalsContact C-N 3.31Å; F2292-L2294 PolarHBondContact O-N 3.47Å; F2292-L2300 HydrophobicContact CD1-CD1 4.23Å; F2292-L2300 HydrophobicContact CE1-CD1 4.31Å; F2292-A2304 HydrophobicContact CB-CB 3.59Å |
| 2293 | S | 85.1 | Confident | 86.8 | Confident | 1.33333 Ų | 1.33333 | 40.9 Ų | 40.9 | 1% | 0.009 | 20% | 0.204 | C | C | . | . | H | α-helix | trans | -68.4 | -31.6 | 175 | 74.9 | 0 | 0 | 0 | 0 | 113 | A2289 H2290 Q2301 L2323 | A2289-S2293 WeakPolarHBondContact O-CB 3.27Å; A2289-S2293 PolarHBondContact O-N 3.18Å; A2289-S2293 PolarHBondContact O-OG 3.39Å; H2290-S2293 WeakPolarHBondContact CA-OG 3.31Å; H2290-S2293 PolarHBondContact O-N 3.27Å; H2290-S2293 VanDerWaalsContact O-N 3.14Å; H2290-S2293 PolarHBondContact O-OG 3.2Å; S2293-Q2301 WeakPolarHBondContact O-CG 3.39Å; S2293-Q2301 PolarHBondContact O-NE2 3.05Å; S2293-Q2301 VanDerWaalsContact O-NE2 3.12Å; S2293-L2323 VanDerWaalsContact OG-CD2 3.31Å; S2293-L2323 WeakPolarHBondContact OG-CD2 3.46Å |
| 2294 | L | 81.4 | Confident | 86.9 | Confident | 46.3333 Ų | 46.3333 | 36 Ų | 36 | 24% | 0.243 | 18% | 0.182 | C | C | . | . | S | Bend | trans | -87.2 | -12 | -178.5 | -67.3 | -174 | 0 | 0 | 0 | 114.1 | H2290 H2291 F2292 Q2322 L2323 L2326 L2779 | H2290-L2294 VanDerWaalsContact CE1-CD1 3.43Å; H2290-L2294 WeakPolarHBondContact CE1-CD1 3.46Å; H2290-L2294 WeakPolarHBondContact NE2-CD1 3.46Å; H2290-L2294 PolarHBondContact O-N 3.22Å; H2291-L2294 PolarHBondContact O-N 3.14Å; F2292-L2294 VanDerWaalsContact C-N 3.31Å; F2292-L2294 PolarHBondContact O-N 3.47Å; L2294-Q2322 HydrophobicContact CD2-CB 4.01Å; L2294-L2323 HydrophobicContact CD2-CD2 4.06Å; L2294-L2323 HydrophobicContact CD2-CG 4.47Å; L2294-L2326 VanDerWaalsContact CA-CD1 3.49Å; L2294-L2326 HydrophobicContact CB-CD1 4.26Å; L2294-L2326 HydrophobicContact CD2-CD1 4.08Å; L2294-L2326 HydrophobicContact CG-CD1 4.49Å; L2294-L2779 HydrophobicContact CD1-CD2 4.08Å; L2294-L2779 HydrophobicContact CD2-CD2 4.39Å |
| 2295 | R | 82.8 | Confident | 86.7 | Confident | 75.3333 Ų | 75.3333 | 36 Ų | 36 | 28% | 0.284 | 18% | 0.183 | S | C | . | . | S | Bend | trans | -97.3 | 132.7 | 177.3 | -71.5 | -169.7 | 174.5 | -169.1 | 3.7 | 110.5 | C2107 H2291 N2297 P2781 | C2107-R2295 HydrophobicContact CB-CB 4.3Å; H2291-R2295 PolarHBondContact CE1-NH2 3.18Å; H2291-R2295 PolarHBondContact NE2-NE 3.2Å; R2295-N2297 PolarHBondContact O-N 3.01Å; R2295-N2297 VanDerWaalsContact O-N 3.09Å; R2295-P2781 HydrophobicContact CG-CG 4.38Å; R2295-P2781 PolarHBondContact NH2-O 3.47Å; R2295-P2781 VanDerWaalsContact NH2-O 3.12Å |
| 2296 | F | 81.2 | Confident | 86.4 | Confident | 134.667 Ų | 134.667 | 37.2 Ų | 37.2 | 59% | 0.591 | 19% | 0.189 | S | C | * | . | trans | -67.9 | 109.6 | 177.2 | -179 | -104.7 | 0 | 0 | 0 | 110.6 | P2110 P2298 | P2110-F2296 HydrophobicContact CB-CD1 4.13Å; P2110-F2296 HydrophobicContact CB-CE1 4.11Å; P2110-F2296 HydrophobicContact CG-CD1 3.79Å; P2110-F2296 HydrophobicContact CG-CE1 3.8Å; F2296-P2298 HydrophobicContact CE1-CG 4.15Å; F2296-P2298 HydrophobicContact CE2-CG 4.17Å; F2296-P2298 HydrophobicContact CZ-CG 3.71Å | ||
| 2297 | N | 85.3 | Confident | 86.3 | Confident | 3.33333 Ų | 3.33333 | 36.6 Ų | 36.6 | 2% | 0.018 | 19% | 0.185 | C | C | . | . | trans | -154.6 | 99.8 | 171.5 | -176.7 | -30 | 0 | 0 | 0 | 107.9 | S2106 C2107 R2295 A2299 L2300 Q2301 | S2106-N2297 PolarHBondContact O-ND2 2.66Å; S2106-N2297 PolarHBondContact OG-ND2 3.37Å; S2106-N2297 VanDerWaalsContact OG-ND2 3.13Å; C2107-N2297 HydrophobicContact CB-CB 4.43Å; C2107-N2297 PolarHBondContact SG-ND2 3.22Å; C2107-N2297 VanDerWaalsContact SG-ND2 3.37Å; R2295-N2297 PolarHBondContact O-N 3.01Å; R2295-N2297 VanDerWaalsContact O-N 3.09Å; N2297-A2299 PolarHBondContact O-N 3.22Å; N2297-A2299 PolarHBondContact OD1-N 3.17Å; N2297-L2300 HydrophobicContact CB-CB 4.21Å; N2297-L2300 WeakPolarHBondContact ND2-CD1 3.42Å; N2297-L2300 PolarHBondContact O-N 3.08Å; N2297-L2300 PolarHBondContact OD1-N 2.78Å; N2297-Q2301 WeakPolarHBondContact O-CB 3.43Å; N2297-Q2301 PolarHBondContact O-N 3.36Å | ||
| 2298 | P | 80.4 | Confident | 86.3 | Confident | 62.3333 Ų | 62.3333 | 32 Ų | 32 | 41% | 0.405 | 16% | 0.164 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -54.2 | -31.9 | -172.8 | -28 | 35.4 | 0 | 0 | 0 | 114.3 | F2296 | F2296-P2298 HydrophobicContact CE1-CG 4.15Å; F2296-P2298 HydrophobicContact CE2-CG 4.17Å; F2296-P2298 HydrophobicContact CZ-CG 3.71Å |
| 2299 | A | 83.6 | Confident | 85.9 | Confident | 16.3333 Ų | 16.3333 | 34.2 Ų | 34.2 | 14% | 0.135 | 18% | 0.182 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -74.2 | -31.1 | 179 | 0 | 0 | 0 | 0 | 0 | 113.9 | Q2111 L2114 N2297 | Q2111-A2299 PolarHBondContact O-N 3.42Å; L2114-A2299 HydrophobicContact CB-CB 4.18Å; N2297-A2299 PolarHBondContact O-N 3.22Å; N2297-A2299 PolarHBondContact OD1-N 3.17Å |
| 2300 | L | 87.9 | Confident | 85.7 | Confident | 2.66667 Ų | 2.66667 | 35.5 Ų | 35.5 | 1% | 0.014 | 19% | 0.191 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -108.2 | -37.6 | -172 | -59.7 | -171.8 | 0 | 0 | 0 | 113.7 | L2103 L2114 V2154 F2292 N2297 G2302 R2303 A2304 | L2103-L2300 HydrophobicContact CD2-CD1 4.43Å; L2114-L2300 HydrophobicContact CD1-CD2 4.4Å; L2114-L2300 HydrophobicContact CD2-CD2 4.18Å; V2154-L2300 HydrophobicContact CB-CD2 4.47Å; V2154-L2300 HydrophobicContact CG1-CD2 3.5Å; V2154-L2300 VanDerWaalsContact CG1-CD2 3.47Å; V2154-L2300 HydrophobicContact CG2-CD2 4.48Å; F2292-L2300 HydrophobicContact CD1-CD1 4.23Å; F2292-L2300 HydrophobicContact CE1-CD1 4.31Å; N2297-L2300 HydrophobicContact CB-CB 4.21Å; N2297-L2300 WeakPolarHBondContact ND2-CD1 3.42Å; N2297-L2300 PolarHBondContact O-N 3.08Å; N2297-L2300 PolarHBondContact OD1-N 2.78Å; L2300-G2302 PolarHBondContact O-N 3.17Å; L2300-R2303 WeakPolarHBondContact O-CB 3.39Å; L2300-R2303 PolarHBondContact O-N 3.13Å; L2300-A2304 PolarHBondContact O-N 3.2Å |
| 2301 | Q | 85.3 | Confident | 85.6 | Confident | 33 Ų | 33 | 33.7 Ų | 33.7 | 15% | 0.154 | 18% | 0.183 | C | C | . | . | H | α-helix | trans | -59.8 | -46.2 | -167.5 | -171.3 | 178.7 | 15.2 | 0 | 0 | 112.1 | S2293 N2297 R2303 A2304 L2305 | S2293-Q2301 WeakPolarHBondContact O-CG 3.39Å; S2293-Q2301 PolarHBondContact O-NE2 3.05Å; S2293-Q2301 VanDerWaalsContact O-NE2 3.12Å; N2297-Q2301 WeakPolarHBondContact O-CB 3.43Å; N2297-Q2301 PolarHBondContact O-N 3.36Å; Q2301-R2303 VanDerWaalsContact C-N 3.31Å; Q2301-R2303 PolarHBondContact O-N 3.2Å; Q2301-A2304 PolarHBondContact O-N 3.31Å; Q2301-L2305 VanDerWaalsContact O-CB 3.31Å; Q2301-L2305 WeakPolarHBondContact O-CB 3.34Å; Q2301-L2305 PolarHBondContact O-N 3.09Å |
| 2302 | G | 82.6 | Confident | 85.2 | Confident | 34 Ų | 34 | 33.4 Ų | 33.4 | 35% | 0.351 | 18% | 0.184 | S | C | . | . | H | α-helix | trans | -63.3 | -34.6 | 177.1 | 0 | 0 | 0 | 0 | 0 | 113.3 | L2300 I2306 | L2300-G2302 PolarHBondContact O-N 3.17Å; G2302-I2306 WeakPolarHBondContact O-CD1 3.45Å; G2302-I2306 WeakPolarHBondContact O-CG1 3.32Å; G2302-I2306 PolarHBondContact O-N 3.19Å |
| 2303 | R | 89.7 | Confident | 84.2 | Confident | 42.6667 Ų | 42.6667 | 40.9 Ų | 40.9 | 16% | 0.161 | 22% | 0.217 | C | C | . | . | H | α-helix | trans | -69.5 | -47.3 | 175 | -59.6 | -177.3 | 176.6 | -136 | -2.7 | 110.9 | I2153 V2154 V2156 L2258 L2300 Q2301 L2305 I2306 V2307 | I2153-R2303 PolarHBondContact O-NH1 3.39Å; V2154-R2303 PolarHBondContact O-NH1 3.49Å; V2156-R2303 PolarHBondContact O-NH1 3.32Å; V2156-R2303 PolarHBondContact O-NH2 3.1Å; V2156-R2303 VanDerWaalsContact O-NH2 3.09Å; L2258-R2303 HydrophobicContact CD2-CB 3.76Å; L2258-R2303 HydrophobicContact CD2-CG 3.96Å; L2300-R2303 WeakPolarHBondContact O-CB 3.39Å; L2300-R2303 PolarHBondContact O-N 3.13Å; Q2301-R2303 VanDerWaalsContact C-N 3.31Å; Q2301-R2303 PolarHBondContact O-N 3.2Å; R2303-L2305 VanDerWaalsContact C-N 3.33Å; R2303-L2305 PolarHBondContact O-N 3.06Å; R2303-I2306 PolarHBondContact O-N 3.31Å; R2303-V2307 VanDerWaalsContact O-CG2 3.28Å; R2303-V2307 WeakPolarHBondContact O-CG2 3.25Å; R2303-V2307 PolarHBondContact O-N 3.17Å; R2303-V2307 VanDerWaalsContact O-N 3.12Å |
| 2304 | A | 89.6 | Confident | 83.3 | Confident | 4.33333 Ų | 4.33333 | 46.9 Ų | 46.9 | 4% | 0.036 | 25% | 0.253 | C | S | . | . | H | α-helix | trans | -63.6 | -37.6 | -179.7 | 0 | 0 | 0 | 0 | 0 | 112.4 | F2292 L2300 Q2301 V2307 Y2308 | F2292-A2304 HydrophobicContact CB-CB 3.59Å; L2300-A2304 PolarHBondContact O-N 3.2Å; Q2301-A2304 PolarHBondContact O-N 3.31Å; A2304-V2307 PolarHBondContact O-N 3.26Å; A2304-Y2308 WeakPolarHBondContact O-CB 3.41Å; A2304-Y2308 PolarHBondContact O-N 3.04Å |
| 2305 | L | 85.9 | Confident | 82.5 | Confident | 60.6667 Ų | 60.6667 | 47.4 Ų | 47.4 | 32% | 0.318 | 26% | 0.258 | S | S | . | . | H | α-helix | trans | -60.6 | -47.5 | 176 | -175.8 | 69.3 | 0 | 0 | 0 | 112 | Q2301 R2303 V2307 Y2308 S2309 L2323 L2327 | Q2301-L2305 VanDerWaalsContact O-CB 3.31Å; Q2301-L2305 WeakPolarHBondContact O-CB 3.34Å; Q2301-L2305 PolarHBondContact O-N 3.09Å; R2303-L2305 VanDerWaalsContact C-N 3.33Å; R2303-L2305 PolarHBondContact O-N 3.06Å; L2305-V2307 VanDerWaalsContact C-N 3.35Å; L2305-V2307 PolarHBondContact O-N 3.33Å; L2305-Y2308 PolarHBondContact O-N 3.08Å; L2305-S2309 PolarHBondContact O-N 3.11Å; L2305-S2309 PolarHBondContact O-OG 3.36Å; L2305-L2323 HydrophobicContact CD1-CB 4.21Å; L2305-L2323 HydrophobicContact CD1-CD1 4.17Å; L2305-L2323 HydrophobicContact CD1-CD2 3.56Å; L2305-L2323 VanDerWaalsContact CD1-CD2 3.45Å; L2305-L2323 HydrophobicContact CD1-CG 4.35Å; L2305-L2327 HydrophobicContact CD2-CD1 4.34Å |
| 2306 | I | 86.4 | Confident | 81.6 | Confident | 24.3333 Ų | 24.3333 | 50.5 Ų | 50.5 | 13% | 0.125 | 28% | 0.276 | C | S | . | . | H | α-helix | trans | -61.3 | -47.1 | 177.6 | -68.8 | -164 | 0 | 0 | 0 | 110.4 | L2255 L2258 E2259 G2302 R2303 Y2308 S2309 C2310 | L2255-I2306 HydrophobicContact CB-CD1 3.69Å; L2255-I2306 VanDerWaalsContact CB-CD1 3.45Å; L2255-I2306 HydrophobicContact CB-CG1 4.06Å; L2255-I2306 HydrophobicContact CD1-CD1 4.15Å; L2255-I2306 HydrophobicContact CD1-CG1 4.17Å; L2255-I2306 HydrophobicContact CD2-CD1 3.33Å; L2255-I2306 HydrophobicContact CD2-CG1 4.13Å; L2255-I2306 HydrophobicContact CG-CD1 3.69Å; L2255-I2306 HydrophobicContact CG-CG1 4.33Å; L2258-I2306 HydrophobicContact CD2-CD1 4.37Å; E2259-I2306 HydrophobicContact CB-CG2 4.34Å; E2259-I2306 HydrophobicContact CG-CG2 3.4Å; E2259-I2306 VanDerWaalsContact CG-CG2 3.4Å; G2302-I2306 WeakPolarHBondContact O-CD1 3.45Å; G2302-I2306 WeakPolarHBondContact O-CG1 3.32Å; G2302-I2306 PolarHBondContact O-N 3.19Å; R2303-I2306 PolarHBondContact O-N 3.31Å; I2306-Y2308 VanDerWaalsContact C-N 3.32Å; I2306-Y2308 PolarHBondContact O-N 3.35Å; I2306-S2309 WeakPolarHBondContact CA-OG 3.41Å; I2306-S2309 WeakPolarHBondContact O-CA 3.41Å; I2306-S2309 WeakPolarHBondContact O-CB 3.31Å; I2306-S2309 PolarHBondContact O-N 2.95Å; I2306-S2309 PolarHBondContact O-OG 3.24Å; I2306-C2310 PolarHBondContact O-N 3.42Å; I2306-C2310 PolarHBondContact O-SG 3.16Å |
| 2307 | V | 89.5 | Confident | 80.5 | Confident | 0.333333 Ų | 0.333333 | 49.1 Ų | 49.1 | 0% | 0.002 | 27% | 0.271 | C | S | . | . | H | α-helix | trans | -63.2 | -41.4 | 179.9 | 174.8 | 0 | 0 | 0 | 0 | 111.7 | I2153 L2258 T2262 W2285 A2289 R2303 A2304 L2305 S2309 C2310 L2311 | I2153-V2307 HydrophobicContact CB-CG2 4.21Å; I2153-V2307 HydrophobicContact CD1-CG2 4.19Å; I2153-V2307 HydrophobicContact CG1-CG2 4.14Å; I2153-V2307 HydrophobicContact CG2-CB 4.19Å; I2153-V2307 HydrophobicContact CG2-CG1 4.41Å; I2153-V2307 HydrophobicContact CG2-CG2 3.25Å; L2258-V2307 HydrophobicContact CD2-CG2 4.34Å; T2262-V2307 HydrophobicContact CG2-CB 4.3Å; T2262-V2307 HydrophobicContact CG2-CG1 4.07Å; T2262-V2307 HydrophobicContact CG2-CG2 4.05Å; T2262-V2307 VanDerWaalsContact OG1-CG2 3.27Å; T2262-V2307 WeakPolarHBondContact OG1-CG2 3.44Å; W2285-V2307 HydrophobicContact CD2-CG1 4.5Å; W2285-V2307 HydrophobicContact CH2-CG1 4.5Å; W2285-V2307 HydrophobicContact CZ2-CG1 3.89Å; A2289-V2307 HydrophobicContact CB-CB 4.17Å; A2289-V2307 HydrophobicContact CB-CG1 3.9Å; R2303-V2307 VanDerWaalsContact O-CG2 3.28Å; R2303-V2307 WeakPolarHBondContact O-CG2 3.25Å; R2303-V2307 PolarHBondContact O-N 3.17Å; R2303-V2307 VanDerWaalsContact O-N 3.12Å; A2304-V2307 PolarHBondContact O-N 3.26Å; L2305-V2307 VanDerWaalsContact C-N 3.35Å; L2305-V2307 PolarHBondContact O-N 3.33Å; V2307-S2309 VanDerWaalsContact C-N 3.3Å; V2307-S2309 PolarHBondContact O-N 3.22Å; V2307-C2310 PolarHBondContact O-N 3.15Å; V2307-L2311 HydrophobicContact CG1-CD1 3.62Å; V2307-L2311 HydrophobicContact CG1-CG 4.3Å; V2307-L2311 WeakPolarHBondContact O-CB 3.41Å; V2307-L2311 WeakPolarHBondContact O-CD1 3.47Å; V2307-L2311 VanDerWaalsContact O-CG 3.29Å; V2307-L2311 WeakPolarHBondContact O-CG 3.22Å; V2307-L2311 PolarHBondContact O-N 3.06Å; V2307-L2311 VanDerWaalsContact O-N 3.1Å |
| 2308 | Y | 88.5 | Confident | 79.6 | Confident | 23.3333 Ų | 23.3333 | 52.6 Ų | 52.6 | 9% | 0.092 | 29% | 0.293 | C | S | . | . | H | α-helix | trans | -60.9 | -40.6 | 173.7 | -179 | -107.1 | 0 | 0 | 0 | 111.6 | A2286 H2290 A2304 L2305 I2306 C2310 L2311 S2312 T2315 T2319 L2323 | A2286-Y2308 HydrophobicContact CB-CD2 4.49Å; A2286-Y2308 HydrophobicContact CB-CE2 4.45Å; A2286-Y2308 WeakPolarHBondContact O-CD2 3.28Å; H2290-Y2308 HydrophobicContact CB-CD2 3.68Å; H2290-Y2308 HydrophobicContact CB-CE2 3.68Å; H2290-Y2308 HydrophobicContact CB-CG 4.43Å; H2290-Y2308 AromaticContact ND1-CE2 3.97Å; H2290-Y2308 AromaticContact ND1-CZ 3.84Å; A2304-Y2308 WeakPolarHBondContact O-CB 3.41Å; A2304-Y2308 PolarHBondContact O-N 3.04Å; L2305-Y2308 PolarHBondContact O-N 3.08Å; I2306-Y2308 VanDerWaalsContact C-N 3.32Å; I2306-Y2308 PolarHBondContact O-N 3.35Å; Y2308-C2310 PolarHBondContact O-N 3.17Å; Y2308-L2311 PolarHBondContact O-N 2.91Å; Y2308-S2312 WeakPolarHBondContact O-CB 3.36Å; Y2308-S2312 PolarHBondContact O-N 3.19Å; Y2308-S2312 PolarHBondContact OH-OG 2.97Å; Y2308-T2315 HydrophobicContact CE1-CG2 4.26Å; Y2308-T2319 HydrophobicContact CE1-CG2 3.87Å; Y2308-T2319 WeakPolarHBondContact OH-CG2 3.43Å; Y2308-L2323 HydrophobicContact CD1-CD1 3.68Å; Y2308-L2323 HydrophobicContact CE1-CD1 3.86Å |
| 2309 | S | 82.9 | Confident | 78.9 | Confident | 73.6667 Ų | 73.6667 | 50.1 Ų | 50.1 | 52% | 0.515 | 28% | 0.276 | S | S | . | . | H | α-helix | trans | -66.7 | -34.5 | 177.2 | 69.8 | 0 | 0 | 0 | 0 | 113.6 | L2305 I2306 V2307 | L2305-S2309 PolarHBondContact O-N 3.11Å; L2305-S2309 PolarHBondContact O-OG 3.36Å; I2306-S2309 WeakPolarHBondContact CA-OG 3.41Å; I2306-S2309 WeakPolarHBondContact O-CA 3.41Å; I2306-S2309 WeakPolarHBondContact O-CB 3.31Å; I2306-S2309 PolarHBondContact O-N 2.95Å; I2306-S2309 PolarHBondContact O-OG 3.24Å; V2307-S2309 VanDerWaalsContact C-N 3.3Å; V2307-S2309 PolarHBondContact O-N 3.22Å |
| 2310 | C | 86.2 | Confident | 78 | Confident | 27.3333 Ų | 27.3333 | 51 Ų | 51 | 19% | 0.185 | 28% | 0.28 | C | S | . | . | H | α-helix | trans | -70.6 | -36.8 | 174.5 | -60.5 | 0 | 0 | 0 | 0 | 111.9 | T2262 I2266 I2306 V2307 Y2308 | T2262-C2310 HydrophobicContact CG2-CB 3.8Å; I2266-C2310 HydrophobicContact CD1-CB 3.63Å; I2306-C2310 PolarHBondContact O-N 3.42Å; I2306-C2310 PolarHBondContact O-SG 3.16Å; V2307-C2310 PolarHBondContact O-N 3.15Å; Y2308-C2310 PolarHBondContact O-N 3.17Å |
| 2311 | L | 86.1 | Confident | 76.6 | Confident | 7.66667 Ų | 7.66667 | 53.2 Ų | 53.2 | 4% | 0.04 | 29% | 0.29 | C | S | . | . | H | α-helix | trans | -80.7 | -35.1 | -177.5 | -69.4 | 166.6 | 0 | 0 | 0 | 113.6 | I2266 I2282 W2285 A2286 A2289 V2307 Y2308 K2313 | I2266-L2311 HydrophobicContact CD1-CD2 3.71Å; I2266-L2311 HydrophobicContact CD1-CG 4.07Å; I2266-L2311 HydrophobicContact CG1-CD2 3.59Å; I2266-L2311 HydrophobicContact CG1-CG 4.41Å; I2282-L2311 HydrophobicContact CD1-CD2 4.04Å; I2282-L2311 HydrophobicContact CG2-CD2 3.98Å; W2285-L2311 HydrophobicContact CB-CD1 3.99Å; W2285-L2311 HydrophobicContact CD2-CD1 3.63Å; W2285-L2311 HydrophobicContact CD2-CD2 4.09Å; W2285-L2311 HydrophobicContact CD2-CG 4.42Å; W2285-L2311 HydrophobicContact CE3-CD1 3.9Å; W2285-L2311 HydrophobicContact CE3-CD2 3.49Å; W2285-L2311 VanDerWaalsContact CE3-CD2 3.47Å; W2285-L2311 HydrophobicContact CE3-CG 4.25Å; W2285-L2311 HydrophobicContact CG-CD1 3.66Å; W2285-L2311 HydrophobicContact CZ3-CD2 4Å; A2286-L2311 HydrophobicContact CB-CB 4.06Å; A2286-L2311 HydrophobicContact CB-CD1 4.43Å; A2289-L2311 HydrophobicContact CB-CD1 4.29Å; V2307-L2311 HydrophobicContact CG1-CD1 3.62Å; V2307-L2311 HydrophobicContact CG1-CG 4.3Å; V2307-L2311 WeakPolarHBondContact O-CB 3.41Å; V2307-L2311 WeakPolarHBondContact O-CD1 3.47Å; V2307-L2311 VanDerWaalsContact O-CG 3.29Å; V2307-L2311 WeakPolarHBondContact O-CG 3.22Å; V2307-L2311 PolarHBondContact O-N 3.06Å; V2307-L2311 VanDerWaalsContact O-N 3.1Å; Y2308-L2311 PolarHBondContact O-N 2.91Å; L2311-K2313 PolarHBondContact O-N 2.76Å |
| 2312 | S | 79.2 | Confident | 75.5 | Confident | 25.6667 Ų | 25.6667 | 54.2 Ų | 54.2 | 18% | 0.179 | 29% | 0.294 | C | S | . | . | trans | -79 | 103.3 | -173.9 | -171.4 | 0 | 0 | 0 | 0 | 111.4 | Y2308 T2314 T2315 | Y2308-S2312 WeakPolarHBondContact O-CB 3.36Å; Y2308-S2312 PolarHBondContact O-N 3.19Å; Y2308-S2312 PolarHBondContact OH-OG 2.97Å; S2312-T2314 VanDerWaalsContact C-N 3.3Å; S2312-T2314 PolarHBondContact OG-O 3Å; S2312-T2314 VanDerWaalsContact OG-O 3.07Å; S2312-T2315 PolarHBondContact OG-OG1 3.19Å | ||
| 2313 | K | 69.6 | Low | 74.6 | Confident | 159.667 Ų | 159.667 | 53.8 Ų | 53.8 | 69% | 0.694 | 28% | 0.284 | S | S | * | . | S | Bend | trans | -78.3 | -20.4 | 170.9 | -63.9 | -178.4 | -176.9 | 173.2 | 0 | 112.8 | E2270 L2311 | E2270-K2313 IonicContact OE1-NZ 3.2Å; E2270-K2313 PolarHBondContact OE1-NZ 3.21Å; L2311-K2313 PolarHBondContact O-N 2.76Å |
| 2314 | T | 64.7 | Low | 73.1 | Confident | 127 Ų | 127 | 53.5 Ų | 53.5 | 78% | 0.779 | 29% | 0.285 | S | S | * | . | S | Bend | trans | -144.5 | 117.7 | 178.5 | 53.3 | 0 | 0 | 0 | 0 | 108.9 | S2312 | S2312-T2314 VanDerWaalsContact C-N 3.3Å; S2312-T2314 PolarHBondContact OG-O 3Å; S2312-T2314 VanDerWaalsContact OG-O 3.07Å |
| 2315 | T | 64.6 | Low | 71.3 | Confident | 57.3333 Ų | 57.3333 | 55.9 Ų | 55.9 | 35% | 0.352 | 30% | 0.297 | S | S | . | . | trans | -107.4 | 129.3 | 177.9 | -50.4 | 0 | 0 | 0 | 0 | 109.2 | Y2308 S2312 T2319 V2320 L2323 | Y2308-T2315 HydrophobicContact CE1-CG2 4.26Å; S2312-T2315 PolarHBondContact OG-OG1 3.19Å; T2315-T2319 HydrophobicContact CG2-CG2 3.73Å; T2315-V2320 HydrophobicContact CG2-CB 4.41Å; T2315-V2320 HydrophobicContact CG2-CG2 3.44Å; T2315-V2320 VanDerWaalsContact CG2-CG2 3.46Å; T2315-L2323 HydrophobicContact CG2-CD1 4.46Å | ||
| 2316 | E | 64 | Low | 69.7 | Low | 139.667 Ų | 139.667 | 56.8 Ų | 56.8 | 65% | 0.653 | 30% | 0.302 | S | S | * | . | trans | -63.1 | 145.4 | 174.4 | -64.9 | -177.4 | -177.2 | 0 | 0 | 110.3 | V2318 T2319 V2320 | E2316-V2318 PolarHBondContact O-N 3.19Å; E2316-V2318 VanDerWaalsContact O-N 3.12Å; E2316-T2319 CarbonylContact O-C 3.59Å; E2316-T2319 WeakPolarHBondContact O-CA 3.48Å; E2316-T2319 WeakPolarHBondContact O-CB 3.37Å; E2316-T2319 PolarHBondContact O-N 2.92Å; E2316-V2320 PolarHBondContact O-N 3.37Å | ||
| 2317 | E | 58.9 | Low | 68 | Low | 105 Ų | 105 | 61.2 Ų | 61.2 | 49% | 0.491 | 33% | 0.326 | S | S | . | . | H | α-helix | trans | -52.8 | -38.3 | 176.7 | -148.2 | -165.4 | 146.1 | 0 | 0 | 110.6 | T2319 V2320 K2321 E2330 C2332 M2334 | E2317-T2319 VanDerWaalsContact C-N 3.32Å; E2317-T2319 PolarHBondContact O-N 3.26Å; E2317-V2320 CarbonylContact O-C 3.51Å; E2317-V2320 PolarHBondContact O-N 3.23Å; E2317-K2321 HydrophobicContact CG-CD 4.26Å; E2317-K2321 WeakPolarHBondContact O-CA 3.4Å; E2317-K2321 VanDerWaalsContact O-CB 3.28Å; E2317-K2321 WeakPolarHBondContact O-CB 3.37Å; E2317-K2321 WeakPolarHBondContact O-CD 3.46Å; E2317-K2321 VanDerWaalsContact O-CG 3.24Å; E2317-K2321 WeakPolarHBondContact O-CG 3.29Å; E2317-K2321 PolarHBondContact O-N 3.24Å; E2317-K2321 WeakPolarHBondContact OE1-CE 3.36Å; E2317-K2321 IonicContact OE1-NZ 3.02Å; E2317-K2321 PolarHBondContact OE1-NZ 3.18Å; E2317-K2321 IonicContact OE2-NZ 3.61Å; E2317-K2321 PolarHBondContact OE2-NZ 3.47Å; E2317-E2330 WeakPolarHBondContact CB-OE2 3.46Å; E2317-E2330 WeakPolarHBondContact CG-OE1 3.35Å; E2317-E2330 WeakPolarHBondContact CG-OE2 3.24Å; E2317-C2332 VanDerWaalsContact OE1-CB 3.29Å; E2317-C2332 WeakPolarHBondContact OE1-CB 3.38Å; E2317-M2334 HydrophobicContact CG-SD 4.36Å |
| 2318 | V | 65.2 | Low | 66 | Low | 76.6667 Ų | 76.6667 | 63.2 Ų | 63.2 | 47% | 0.465 | 34% | 0.336 | S | S | . | . | H | α-helix | trans | -62.5 | -38.5 | 176.9 | -178.3 | 0 | 0 | 0 | 0 | 111.9 | E2316 K2321 Q2322 | E2316-V2318 PolarHBondContact O-N 3.19Å; E2316-V2318 VanDerWaalsContact O-N 3.12Å; V2318-K2321 CarbonylContact O-C 3.51Å; V2318-K2321 VanDerWaalsContact O-CB 3.24Å; V2318-K2321 WeakPolarHBondContact O-CB 3.32Å; V2318-K2321 PolarHBondContact O-N 3.06Å; V2318-Q2322 HydrophobicContact CG1-CG 4.45Å; V2318-Q2322 VanDerWaalsContact O-CB 3.27Å; V2318-Q2322 WeakPolarHBondContact O-CB 3.38Å; V2318-Q2322 VanDerWaalsContact O-CG 3.27Å; V2318-Q2322 WeakPolarHBondContact O-CG 3.44Å; V2318-Q2322 PolarHBondContact O-N 3.07Å |
| 2319 | T | 65.9 | Low | 63.9 | Low | 11 Ų | 11 | 67 Ų | 67 | 7% | 0.067 | 36% | 0.355 | C | S | . | . | H | α-helix | trans | -75.2 | -40.4 | 177.2 | -55.7 | 0 | 0 | 0 | 0 | 111.6 | H2290 Y2308 T2315 E2316 E2317 K2321 Q2322 L2323 | H2290-T2319 VanDerWaalsContact CE1-CG2 3.44Å; H2290-T2319 WeakPolarHBondContact CE1-CG2 3.43Å; Y2308-T2319 HydrophobicContact CE1-CG2 3.87Å; Y2308-T2319 WeakPolarHBondContact OH-CG2 3.43Å; T2315-T2319 HydrophobicContact CG2-CG2 3.73Å; E2316-T2319 CarbonylContact O-C 3.59Å; E2316-T2319 WeakPolarHBondContact O-CA 3.48Å; E2316-T2319 WeakPolarHBondContact O-CB 3.37Å; E2316-T2319 PolarHBondContact O-N 2.92Å; E2317-T2319 VanDerWaalsContact C-N 3.32Å; E2317-T2319 PolarHBondContact O-N 3.26Å; T2319-K2321 VanDerWaalsContact C-N 3.32Å; T2319-K2321 PolarHBondContact O-N 3.39Å; T2319-Q2322 PolarHBondContact O-N 3.16Å; T2319-Q2322 VanDerWaalsContact O-N 3.14Å; T2319-L2323 HydrophobicContact CG2-CD1 3.95Å; T2319-L2323 HydrophobicContact CG2-CG 4.27Å; T2319-L2323 WeakPolarHBondContact O-CB 3.3Å; T2319-L2323 VanDerWaalsContact O-CG 3.26Å; T2319-L2323 WeakPolarHBondContact O-CG 3.3Å; T2319-L2323 PolarHBondContact O-N 3.24Å |
| 2320 | V | 64.4 | Low | 62 | Low | 36 Ų | 36 | 66.1 Ų | 66.1 | 22% | 0.218 | 34% | 0.342 | C | S | . | . | H | α-helix | trans | -60.2 | -45.2 | 171.9 | 179.5 | 0 | 0 | 0 | 0 | 109.6 | T2315 E2316 E2317 Q2322 L2323 L2324 M2334 | T2315-V2320 HydrophobicContact CG2-CB 4.41Å; T2315-V2320 HydrophobicContact CG2-CG2 3.44Å; T2315-V2320 VanDerWaalsContact CG2-CG2 3.46Å; E2316-V2320 PolarHBondContact O-N 3.37Å; E2317-V2320 CarbonylContact O-C 3.51Å; E2317-V2320 PolarHBondContact O-N 3.23Å; V2320-Q2322 VanDerWaalsContact C-N 3.35Å; V2320-Q2322 PolarHBondContact O-N 3.13Å; V2320-L2323 PolarHBondContact O-N 2.92Å; V2320-L2324 HydrophobicContact CG1-CD1 3.69Å; V2320-L2324 HydrophobicContact CG1-CG 4.18Å; V2320-L2324 VanDerWaalsContact O-CA 3.31Å; V2320-L2324 WeakPolarHBondContact O-CA 3.27Å; V2320-L2324 VanDerWaalsContact O-CB 3.23Å; V2320-L2324 WeakPolarHBondContact O-CB 3.27Å; V2320-L2324 VanDerWaalsContact O-CG 3.27Å; V2320-L2324 WeakPolarHBondContact O-CG 3.31Å; V2320-L2324 PolarHBondContact O-N 3.13Å; V2320-M2334 HydrophobicContact CB-SD 4.16Å; V2320-M2334 HydrophobicContact CG1-CE 4.2Å; V2320-M2334 HydrophobicContact CG1-CG 4.16Å; V2320-M2334 HydrophobicContact CG1-SD 4.02Å |
| 2321 | K | 59.2 | Low | 59.9 | Low | 47.6667 Ų | 47.6667 | 71 Ų | 71 | 21% | 0.207 | 36% | 0.362 | C | S | . | . | H | α-helix | trans | -55.5 | -45.1 | 169.7 | -82.8 | 172.2 | 172.8 | 144.7 | 0 | 112.8 | E2317 V2318 T2319 L2323 L2324 N2325 Q2329 E2330 H2331 | E2317-K2321 HydrophobicContact CG-CD 4.26Å; E2317-K2321 WeakPolarHBondContact O-CA 3.4Å; E2317-K2321 VanDerWaalsContact O-CB 3.28Å; E2317-K2321 WeakPolarHBondContact O-CB 3.37Å; E2317-K2321 WeakPolarHBondContact O-CD 3.46Å; E2317-K2321 VanDerWaalsContact O-CG 3.24Å; E2317-K2321 WeakPolarHBondContact O-CG 3.29Å; E2317-K2321 PolarHBondContact O-N 3.24Å; E2317-K2321 WeakPolarHBondContact OE1-CE 3.36Å; E2317-K2321 IonicContact OE1-NZ 3.02Å; E2317-K2321 PolarHBondContact OE1-NZ 3.18Å; E2317-K2321 IonicContact OE2-NZ 3.61Å; E2317-K2321 PolarHBondContact OE2-NZ 3.47Å; V2318-K2321 CarbonylContact O-C 3.51Å; V2318-K2321 VanDerWaalsContact O-CB 3.24Å; V2318-K2321 WeakPolarHBondContact O-CB 3.32Å; V2318-K2321 PolarHBondContact O-N 3.06Å; T2319-K2321 VanDerWaalsContact C-N 3.32Å; T2319-K2321 PolarHBondContact O-N 3.39Å; K2321-L2323 VanDerWaalsContact C-N 3.25Å; K2321-L2323 PolarHBondContact O-N 2.85Å; K2321-L2324 CarbonylContact O-C 3.57Å; K2321-L2324 VanDerWaalsContact O-C 3.29Å; K2321-L2324 VanDerWaalsContact O-CA 3.3Å; K2321-L2324 WeakPolarHBondContact O-CA 3.42Å; K2321-L2324 VanDerWaalsContact O-CB 3.27Å; K2321-L2324 WeakPolarHBondContact O-CB 3.36Å; K2321-L2324 PolarHBondContact O-N 3.08Å; K2321-N2325 VanDerWaalsContact O-CA 3.28Å; K2321-N2325 WeakPolarHBondContact O-CA 3.32Å; K2321-N2325 WeakPolarHBondContact O-CB 3.35Å; K2321-N2325 PolarHBondContact O-N 3.22Å; K2321-N2325 PolarHBondContact O-OD1 2.86Å; K2321-Q2329 HydrophobicContact CB-CG 4.46Å; K2321-Q2329 WeakPolarHBondContact O-CG 2.94Å; K2321-E2330 VanDerWaalsContact C-CD 3.4Å; K2321-E2330 HydrophobicContact CB-CB 4.15Å; K2321-E2330 HydrophobicContact CB-CG 3.94Å; K2321-E2330 VanDerWaalsContact CB-CG 3.5Å; K2321-E2330 VanDerWaalsContact CB-OE2 3.26Å; K2321-E2330 WeakPolarHBondContact CB-OE2 3.47Å; K2321-E2330 HydrophobicContact CD-CB 4.29Å; K2321-E2330 HydrophobicContact CD-CG 4.32Å; K2321-E2330 VanDerWaalsContact CD-OE2 3.29Å; K2321-E2330 WeakPolarHBondContact CD-OE2 3.46Å; K2321-E2330 WeakPolarHBondContact CE-OE2 3.21Å; K2321-E2330 HydrophobicContact CG-CB 3.71Å; K2321-E2330 HydrophobicContact CG-CG 3.55Å; K2321-E2330 WeakPolarHBondContact CG-OE2 3.34Å; K2321-E2330 IonicContact NZ-OE2 2.71Å; K2321-E2330 PolarHBondContact NZ-OE2 3.35Å; K2321-E2330 WeakPolarHBondContact O-CG 3.19Å; K2321-H2331 VanDerWaalsContact CE-CA 3.45Å; K2321-H2331 VanDerWaalsContact CE-CD2 3.43Å; K2321-H2331 WeakPolarHBondContact CE-CD2 3.34Å; K2321-H2331 PolarHBondContact NZ-CE1 2.78Å; K2321-H2331 PolarHBondContact NZ-ND1 2.83Å; K2321-H2331 VanDerWaalsContact NZ-ND1 3.11Å; K2321-H2331 PolarHBondContact NZ-NE2 3.36Å |
| 2322 | Q | 62.9 | Low | 57.8 | Low | 53.6667 Ų | 53.6667 | 74.7 Ų | 74.7 | 25% | 0.251 | 39% | 0.388 | S | S | . | . | H | α-helix | trans | -68.8 | -40.8 | 180 | -78.1 | 168.6 | -5.8 | 0 | 0 | 112.6 | L2294 V2318 T2319 V2320 L2324 N2325 L2326 E2330 L2779 | L2294-Q2322 HydrophobicContact CD2-CB 4.01Å; V2318-Q2322 HydrophobicContact CG1-CG 4.45Å; V2318-Q2322 VanDerWaalsContact O-CB 3.27Å; V2318-Q2322 WeakPolarHBondContact O-CB 3.38Å; V2318-Q2322 VanDerWaalsContact O-CG 3.27Å; V2318-Q2322 WeakPolarHBondContact O-CG 3.44Å; V2318-Q2322 PolarHBondContact O-N 3.07Å; T2319-Q2322 PolarHBondContact O-N 3.16Å; T2319-Q2322 VanDerWaalsContact O-N 3.14Å; V2320-Q2322 VanDerWaalsContact C-N 3.35Å; V2320-Q2322 PolarHBondContact O-N 3.13Å; Q2322-L2324 VanDerWaalsContact C-N 3.35Å; Q2322-N2325 WeakPolarHBondContact O-CA 3.5Å; Q2322-N2325 VanDerWaalsContact O-CB 3.27Å; Q2322-N2325 WeakPolarHBondContact O-CB 3.48Å; Q2322-N2325 PolarHBondContact O-N 3.19Å; Q2322-L2326 WeakPolarHBondContact O-CG 2.98Å; Q2322-L2326 PolarHBondContact O-N 2.91Å; Q2322-L2326 VanDerWaalsContact O-N 3.11Å; Q2322-E2330 WeakPolarHBondContact CA-OE1 3.35Å; Q2322-E2330 WeakPolarHBondContact CG-OE1 3.39Å; Q2322-E2330 PolarHBondContact N-OE1 3.29Å; Q2322-E2330 VanDerWaalsContact N-OE1 3.07Å; Q2322-L2779 HydrophobicContact CG-CD2 4.25Å |
| 2323 | L | 62.8 | Low | 56.6 | Low | 26.3333 Ų | 26.3333 | 76.7 Ų | 76.7 | 14% | 0.138 | 40% | 0.402 | C | S | . | . | H | α-helix | trans | -70.4 | -37.8 | 175.3 | -65.3 | 172 | 0 | 0 | 0 | 111.6 | S2293 L2294 L2305 Y2308 T2315 T2319 V2320 K2321 L2326 L2327 | S2293-L2323 VanDerWaalsContact OG-CD2 3.31Å; S2293-L2323 WeakPolarHBondContact OG-CD2 3.46Å; L2294-L2323 HydrophobicContact CD2-CD2 4.06Å; L2294-L2323 HydrophobicContact CD2-CG 4.47Å; L2305-L2323 HydrophobicContact CD1-CB 4.21Å; L2305-L2323 HydrophobicContact CD1-CD1 4.17Å; L2305-L2323 HydrophobicContact CD1-CD2 3.56Å; L2305-L2323 VanDerWaalsContact CD1-CD2 3.45Å; L2305-L2323 HydrophobicContact CD1-CG 4.35Å; Y2308-L2323 HydrophobicContact CD1-CD1 3.68Å; Y2308-L2323 HydrophobicContact CE1-CD1 3.86Å; T2315-L2323 HydrophobicContact CG2-CD1 4.46Å; T2319-L2323 HydrophobicContact CG2-CD1 3.95Å; T2319-L2323 HydrophobicContact CG2-CG 4.27Å; T2319-L2323 WeakPolarHBondContact O-CB 3.3Å; T2319-L2323 VanDerWaalsContact O-CG 3.26Å; T2319-L2323 WeakPolarHBondContact O-CG 3.3Å; T2319-L2323 PolarHBondContact O-N 3.24Å; V2320-L2323 PolarHBondContact O-N 2.92Å; K2321-L2323 VanDerWaalsContact C-N 3.25Å; K2321-L2323 PolarHBondContact O-N 2.85Å; L2323-L2326 HydrophobicContact CD2-CD1 4.36Å; L2323-L2326 CarbonylContact O-C 3.55Å; L2323-L2326 WeakPolarHBondContact O-CB 3.35Å; L2323-L2326 PolarHBondContact O-N 3.18Å; L2323-L2327 WeakPolarHBondContact O-CB 3.26Å; L2323-L2327 PolarHBondContact O-N 2.86Å; L2323-L2327 VanDerWaalsContact O-N 3.09Å |
| 2324 | L | 58 | Low | 56.4 | Low | 36 Ų | 36 | 71.5 Ų | 71.5 | 19% | 0.188 | 38% | 0.381 | C | S | . | . | H | α-helix | trans | -69 | -30.9 | 165 | -66.5 | 169.7 | 0 | 0 | 0 | 110.3 | V2320 K2321 Q2322 L2326 L2327 L2328 Q2329 M2334 L2338 I2341 | V2320-L2324 HydrophobicContact CG1-CD1 3.69Å; V2320-L2324 HydrophobicContact CG1-CG 4.18Å; V2320-L2324 VanDerWaalsContact O-CA 3.31Å; V2320-L2324 WeakPolarHBondContact O-CA 3.27Å; V2320-L2324 VanDerWaalsContact O-CB 3.23Å; V2320-L2324 WeakPolarHBondContact O-CB 3.27Å; V2320-L2324 VanDerWaalsContact O-CG 3.27Å; V2320-L2324 WeakPolarHBondContact O-CG 3.31Å; V2320-L2324 PolarHBondContact O-N 3.13Å; K2321-L2324 CarbonylContact O-C 3.57Å; K2321-L2324 VanDerWaalsContact O-C 3.29Å; K2321-L2324 VanDerWaalsContact O-CA 3.3Å; K2321-L2324 WeakPolarHBondContact O-CA 3.42Å; K2321-L2324 VanDerWaalsContact O-CB 3.27Å; K2321-L2324 WeakPolarHBondContact O-CB 3.36Å; K2321-L2324 PolarHBondContact O-N 3.08Å; Q2322-L2324 VanDerWaalsContact C-N 3.35Å; L2324-L2326 VanDerWaalsContact C-N 3.26Å; L2324-L2326 PolarHBondContact O-N 3.38Å; L2324-L2327 VanDerWaalsContact C-C 3.47Å; L2324-L2327 VanDerWaalsContact CA-C 3.44Å; L2324-L2327 VanDerWaalsContact CD2-O 3.29Å; L2324-L2327 WeakPolarHBondContact CD2-O 3.42Å; L2324-L2327 CarbonylContact O-C 3.56Å; L2324-L2327 VanDerWaalsContact O-CA 3.25Å; L2324-L2327 WeakPolarHBondContact O-CA 3.41Å; L2324-L2327 WeakPolarHBondContact O-CB 3.25Å; L2324-L2327 PolarHBondContact O-N 3.01Å; L2324-L2328 VanDerWaalsContact C-C 3.5Å; L2324-L2328 CarbonylContact C-O 3.48Å; L2324-L2328 WeakPolarHBondContact CA-O 3.46Å; L2324-L2328 WeakPolarHBondContact CB-O 3.4Å; L2324-L2328 CarbonylContact O-C 3.44Å; L2324-L2328 VanDerWaalsContact O-C 3.3Å; L2324-L2328 WeakPolarHBondContact O-CA 3.37Å; L2324-L2328 PolarHBondContact O-N 2.96Å; L2324-Q2329 PolarHBondContact O-N 2.84Å; L2324-M2334 HydrophobicContact CD1-CE 3.75Å; L2324-M2334 HydrophobicContact CD1-CG 4.16Å; L2324-M2334 HydrophobicContact CD1-SD 4.21Å; L2324-L2338 HydrophobicContact CD2-CD2 4.17Å; L2324-I2341 HydrophobicContact CD2-CD1 4.24Å |
| 2325 | N | 52.9 | Low | 56.7 | Low | 54 Ų | 54 | 69 Ų | 69 | 29% | 0.289 | 36% | 0.359 | S | S | . | . | H | α-helix | trans | -62.7 | -35.8 | 172.4 | -113.8 | 1.9 | 0 | 0 | 0 | 112.6 | K2321 Q2322 L2327 L2328 Q2329 E2330 | K2321-N2325 VanDerWaalsContact O-CA 3.28Å; K2321-N2325 WeakPolarHBondContact O-CA 3.32Å; K2321-N2325 WeakPolarHBondContact O-CB 3.35Å; K2321-N2325 PolarHBondContact O-N 3.22Å; K2321-N2325 PolarHBondContact O-OD1 2.86Å; Q2322-N2325 WeakPolarHBondContact O-CA 3.5Å; Q2322-N2325 VanDerWaalsContact O-CB 3.27Å; Q2322-N2325 WeakPolarHBondContact O-CB 3.48Å; Q2322-N2325 PolarHBondContact O-N 3.19Å; N2325-L2327 VanDerWaalsContact C-N 3.25Å; N2325-L2327 PolarHBondContact O-N 3.12Å; N2325-L2328 VanDerWaalsContact CA-O 3.28Å; N2325-L2328 WeakPolarHBondContact CA-O 3.41Å; N2325-L2328 PolarHBondContact N-O 2.9Å; N2325-Q2329 HydrophobicContact CB-CG 4.2Å; N2325-Q2329 PolarHBondContact ND2-NE2 3.13Å; N2325-Q2329 WeakPolarHBondContact OD1-CA 3.18Å; N2325-Q2329 WeakPolarHBondContact OD1-CB 3.42Å; N2325-Q2329 VanDerWaalsContact OD1-CD 3.32Å; N2325-Q2329 WeakPolarHBondContact OD1-CG 3.3Å; N2325-Q2329 PolarHBondContact OD1-NE2 3.25Å; N2325-Q2329 PolarHBondContact OD1-OE1 2.81Å; N2325-E2330 HydrophobicContact CB-CG 3.86Å; N2325-E2330 VanDerWaalsContact CB-OE1 3.31Å; N2325-E2330 WeakPolarHBondContact CB-OE1 3.44Å; N2325-E2330 PolarHBondContact ND2-OE1 2.67Å; N2325-E2330 VanDerWaalsContact ND2-OE1 3.12Å; N2325-E2330 WeakPolarHBondContact OD1-CG 3.3Å |
| 2326 | L | 52.7 | Low | 57.3 | Low | 79.6667 Ų | 79.6667 | 67.2 Ų | 67.2 | 42% | 0.417 | 35% | 0.348 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -68.8 | -16.7 | 168.7 | -69.9 | 162.3 | 0 | 0 | 0 | 112.8 | L2294 Q2322 L2323 L2324 L2779 | L2294-L2326 VanDerWaalsContact CA-CD1 3.49Å; L2294-L2326 HydrophobicContact CB-CD1 4.26Å; L2294-L2326 HydrophobicContact CD2-CD1 4.08Å; L2294-L2326 HydrophobicContact CG-CD1 4.49Å; Q2322-L2326 WeakPolarHBondContact O-CG 2.98Å; Q2322-L2326 PolarHBondContact O-N 2.91Å; Q2322-L2326 VanDerWaalsContact O-N 3.11Å; L2323-L2326 HydrophobicContact CD2-CD1 4.36Å; L2323-L2326 CarbonylContact O-C 3.55Å; L2323-L2326 WeakPolarHBondContact O-CB 3.35Å; L2323-L2326 PolarHBondContact O-N 3.18Å; L2324-L2326 VanDerWaalsContact C-N 3.26Å; L2324-L2326 PolarHBondContact O-N 3.38Å; L2326-L2779 HydrophobicContact CD1-CD1 4.28Å; L2326-L2779 HydrophobicContact CD2-CD1 4.23Å; L2326-L2779 HydrophobicContact CG-CD1 4.18Å |
| 2327 | L | 48.8 | Very low | 57.9 | Low | 117.667 Ų | 117.667 | 61.6 Ų | 61.6 | 62% | 0.616 | 33% | 0.325 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -123.7 | -6.3 | 179.4 | -62.2 | 171.2 | 0 | 0 | 0 | 114.3 | L2305 L2323 L2324 N2325 | L2305-L2327 HydrophobicContact CD2-CD1 4.34Å; L2323-L2327 WeakPolarHBondContact O-CB 3.26Å; L2323-L2327 PolarHBondContact O-N 2.86Å; L2323-L2327 VanDerWaalsContact O-N 3.09Å; L2324-L2327 VanDerWaalsContact C-C 3.47Å; L2324-L2327 VanDerWaalsContact CA-C 3.44Å; L2324-L2327 VanDerWaalsContact CD2-O 3.29Å; L2324-L2327 WeakPolarHBondContact CD2-O 3.42Å; L2324-L2327 CarbonylContact O-C 3.56Å; L2324-L2327 VanDerWaalsContact O-CA 3.25Å; L2324-L2327 WeakPolarHBondContact O-CA 3.41Å; L2324-L2327 WeakPolarHBondContact O-CB 3.25Å; L2324-L2327 PolarHBondContact O-N 3.01Å; N2325-L2327 VanDerWaalsContact C-N 3.25Å; N2325-L2327 PolarHBondContact O-N 3.12Å |
| 2328 | L | 49.1 | Very low | 58.9 | Low | 42.3333 Ų | 42.3333 | 57.9 Ų | 57.9 | 22% | 0.222 | 31% | 0.308 | C | S | . | . | trans | 165.9 | 109.8 | -171 | -63.4 | 135.5 | 0 | 0 | 0 | 115.7 | L2324 N2325 E2330 I2341 L2766 I2770 | L2324-L2328 VanDerWaalsContact C-C 3.5Å; L2324-L2328 CarbonylContact C-O 3.48Å; L2324-L2328 WeakPolarHBondContact CA-O 3.46Å; L2324-L2328 WeakPolarHBondContact CB-O 3.4Å; L2324-L2328 CarbonylContact O-C 3.44Å; L2324-L2328 VanDerWaalsContact O-C 3.3Å; L2324-L2328 WeakPolarHBondContact O-CA 3.37Å; L2324-L2328 PolarHBondContact O-N 2.96Å; N2325-L2328 VanDerWaalsContact CA-O 3.28Å; N2325-L2328 WeakPolarHBondContact CA-O 3.41Å; N2325-L2328 PolarHBondContact N-O 2.9Å; L2328-E2330 PolarHBondContact O-N 3.5Å; L2328-I2341 HydrophobicContact CB-CD1 4.34Å; L2328-I2341 HydrophobicContact CD1-CD1 3.37Å; L2328-I2341 HydrophobicContact CD1-CG1 3.78Å; L2328-I2341 HydrophobicContact CD1-CG2 4.09Å; L2328-I2341 HydrophobicContact CD2-CD1 4.17Å; L2328-I2341 HydrophobicContact CD2-CG1 4.15Å; L2328-I2341 HydrophobicContact CG-CD1 4.05Å; L2328-L2766 HydrophobicContact CD2-CB 3.68Å; L2328-L2766 HydrophobicContact CD2-CD2 3.85Å; L2328-L2766 HydrophobicContact CD2-CG 4.24Å; L2328-I2770 VanDerWaalsContact CA-CD1 3.43Å; L2328-I2770 HydrophobicContact CB-CD1 3.71Å; L2328-I2770 HydrophobicContact CB-CG1 3.58Å; L2328-I2770 HydrophobicContact CD2-CD1 3.76Å; L2328-I2770 HydrophobicContact CD2-CG1 3.8Å; L2328-I2770 HydrophobicContact CG-CD1 3.71Å; L2328-I2770 HydrophobicContact CG-CG1 3.99Å | ||
| 2329 | Q | 43 | Very low | 60 | Low | 103 Ų | 103 | 54.3 Ų | 54.3 | 48% | 0.481 | 29% | 0.286 | S | S | . | . | trans | -63.4 | 157.8 | -176.6 | -72.9 | -172.8 | -56.1 | 0 | 0 | 117.7 | K2321 L2324 N2325 I2770 L2773 | K2321-Q2329 HydrophobicContact CB-CG 4.46Å; K2321-Q2329 WeakPolarHBondContact O-CG 2.94Å; L2324-Q2329 PolarHBondContact O-N 2.84Å; N2325-Q2329 HydrophobicContact CB-CG 4.2Å; N2325-Q2329 PolarHBondContact ND2-NE2 3.13Å; N2325-Q2329 WeakPolarHBondContact OD1-CA 3.18Å; N2325-Q2329 WeakPolarHBondContact OD1-CB 3.42Å; N2325-Q2329 VanDerWaalsContact OD1-CD 3.32Å; N2325-Q2329 WeakPolarHBondContact OD1-CG 3.3Å; N2325-Q2329 PolarHBondContact OD1-NE2 3.25Å; N2325-Q2329 PolarHBondContact OD1-OE1 2.81Å; Q2329-I2770 HydrophobicContact CB-CG2 3.43Å; Q2329-I2770 VanDerWaalsContact CB-CG2 3.43Å; Q2329-I2770 HydrophobicContact CG-CG2 3.79Å; Q2329-I2770 VanDerWaalsContact N-CG2 3.27Å; Q2329-L2773 WeakPolarHBondContact O-CD1 3.45Å | ||
| 2330 | E | 44.7 | Very low | 61 | Low | 55 Ų | 55 | 54 Ų | 54 | 26% | 0.257 | 28% | 0.284 | S | S | . | . | trans | -118.4 | 142.4 | -153.8 | -74.6 | -152.4 | 172.8 | 0 | 0 | 117 | E2317 K2321 Q2322 N2325 L2328 C2332 M2334 L2773 G2774 V2776 | E2317-E2330 WeakPolarHBondContact CB-OE2 3.46Å; E2317-E2330 WeakPolarHBondContact CG-OE1 3.35Å; E2317-E2330 WeakPolarHBondContact CG-OE2 3.24Å; K2321-E2330 VanDerWaalsContact C-CD 3.4Å; K2321-E2330 HydrophobicContact CB-CB 4.15Å; K2321-E2330 HydrophobicContact CB-CG 3.94Å; K2321-E2330 VanDerWaalsContact CB-CG 3.5Å; K2321-E2330 VanDerWaalsContact CB-OE2 3.26Å; K2321-E2330 WeakPolarHBondContact CB-OE2 3.47Å; K2321-E2330 HydrophobicContact CD-CB 4.29Å; K2321-E2330 HydrophobicContact CD-CG 4.32Å; K2321-E2330 VanDerWaalsContact CD-OE2 3.29Å; K2321-E2330 WeakPolarHBondContact CD-OE2 3.46Å; K2321-E2330 WeakPolarHBondContact CE-OE2 3.21Å; K2321-E2330 HydrophobicContact CG-CB 3.71Å; K2321-E2330 HydrophobicContact CG-CG 3.55Å; K2321-E2330 WeakPolarHBondContact CG-OE2 3.34Å; K2321-E2330 IonicContact NZ-OE2 2.71Å; K2321-E2330 PolarHBondContact NZ-OE2 3.35Å; K2321-E2330 WeakPolarHBondContact O-CG 3.19Å; Q2322-E2330 WeakPolarHBondContact CA-OE1 3.35Å; Q2322-E2330 WeakPolarHBondContact CG-OE1 3.39Å; Q2322-E2330 PolarHBondContact N-OE1 3.29Å; Q2322-E2330 VanDerWaalsContact N-OE1 3.07Å; N2325-E2330 HydrophobicContact CB-CG 3.86Å; N2325-E2330 VanDerWaalsContact CB-OE1 3.31Å; N2325-E2330 WeakPolarHBondContact CB-OE1 3.44Å; N2325-E2330 PolarHBondContact ND2-OE1 2.67Å; N2325-E2330 VanDerWaalsContact ND2-OE1 3.12Å; N2325-E2330 WeakPolarHBondContact OD1-CG 3.3Å; L2328-E2330 PolarHBondContact O-N 3.5Å; E2330-C2332 PolarHBondContact O-N 2.97Å; E2330-M2334 HydrophobicContact CG-SD 4.2Å; E2330-L2773 CarbonylContact O-C 3.56Å; E2330-L2773 WeakPolarHBondContact O-CA 3.46Å; E2330-L2773 WeakPolarHBondContact O-CB 3.33Å; E2330-G2774 PolarHBondContact O-N 3.37Å; E2330-V2776 HydrophobicContact CB-CG2 3.9Å; E2330-V2776 HydrophobicContact CG-CG2 3.91Å; E2330-V2776 WeakPolarHBondContact OE2-CG2 3.16Å | ||
| 2331 | H | 40.5 | Very low | 62 | Low | 130.333 Ų | 130.333 | 53.3 Ų | 53.3 | 60% | 0.603 | 28% | 0.279 | S | S | * | . | trans | -144.4 | 130.4 | 151.1 | -79.7 | -79.6 | 0 | 0 | 0 | 111.9 | K2321 S2333 L2773 | K2321-H2331 VanDerWaalsContact CE-CA 3.45Å; K2321-H2331 VanDerWaalsContact CE-CD2 3.43Å; K2321-H2331 WeakPolarHBondContact CE-CD2 3.34Å; K2321-H2331 PolarHBondContact NZ-CE1 2.78Å; K2321-H2331 PolarHBondContact NZ-ND1 2.83Å; K2321-H2331 VanDerWaalsContact NZ-ND1 3.11Å; K2321-H2331 PolarHBondContact NZ-NE2 3.36Å; H2331-S2333 VanDerWaalsContact C-N 3.27Å; H2331-S2333 PolarHBondContact O-N 3.13Å; H2331-L2773 HydrophobicContact CB-CB 3.85Å; H2331-L2773 VanDerWaalsContact CB-O 3.26Å; H2331-L2773 WeakPolarHBondContact CB-O 3.27Å; H2331-L2773 VanDerWaalsContact N-CB 3.3Å; H2331-L2773 WeakPolarHBondContact O-CD2 3.35Å | ||
| 2332 | C | 41.8 | Very low | 63.4 | Low | 85 Ų | 85 | 51 Ų | 51 | 57% | 0.574 | 27% | 0.269 | S | S | * | . | S | Bend | trans | -77.4 | 112.5 | -178.7 | -151.1 | 0 | 0 | 0 | 0 | 115.1 | E2317 E2330 M2334 S2337 | E2317-C2332 VanDerWaalsContact OE1-CB 3.29Å; E2317-C2332 WeakPolarHBondContact OE1-CB 3.38Å; E2330-C2332 PolarHBondContact O-N 2.97Å; C2332-M2334 VanDerWaalsContact CA-N 3.34Å; C2332-M2334 HydrophobicContact CB-CB 4.05Å; C2332-M2334 PolarHBondContact O-N 2.82Å; C2332-M2334 VanDerWaalsContact O-N 3.17Å; C2332-M2334 VanDerWaalsContact SG-CB 3.56Å; C2332-M2334 PolarHBondContact SG-N 2.94Å; C2332-S2337 WeakPolarHBondContact CB-OG 3.47Å; C2332-S2337 PolarHBondContact SG-OG 3.49Å |
| 2333 | S | 55.9 | Low | 64.6 | Low | 68.6667 Ų | 68.6667 | 48.5 Ų | 48.5 | 48% | 0.48 | 26% | 0.257 | S | S | . | . | trans | -100.7 | 76 | 139.5 | 62.2 | 0 | 0 | 0 | 0 | 111.6 | H2331 F2335 P2336 S2337 | H2331-S2333 VanDerWaalsContact C-N 3.27Å; H2331-S2333 PolarHBondContact O-N 3.13Å; S2333-F2335 PolarHBondContact O-N 3.37Å; S2333-P2336 WeakPolarHBondContact O-CD 3.34Å; S2333-S2337 PolarHBondContact O-N 3.36Å; S2333-S2337 PolarHBondContact O-OG 3.4Å | ||
| 2334 | M | 64.1 | Low | 65.8 | Low | 49.3333 Ų | 49.3333 | 48.1 Ų | 48.1 | 24% | 0.243 | 26% | 0.255 | C | S | . | . | H | α-helix | trans | -50.2 | -51.2 | -165.1 | -119.4 | -174.2 | 23.2 | 0 | 0 | 114.7 | E2317 V2320 L2324 E2330 C2332 S2337 L2338 | E2317-M2334 HydrophobicContact CG-SD 4.36Å; V2320-M2334 HydrophobicContact CB-SD 4.16Å; V2320-M2334 HydrophobicContact CG1-CE 4.2Å; V2320-M2334 HydrophobicContact CG1-CG 4.16Å; V2320-M2334 HydrophobicContact CG1-SD 4.02Å; L2324-M2334 HydrophobicContact CD1-CE 3.75Å; L2324-M2334 HydrophobicContact CD1-CG 4.16Å; L2324-M2334 HydrophobicContact CD1-SD 4.21Å; E2330-M2334 HydrophobicContact CG-SD 4.2Å; C2332-M2334 VanDerWaalsContact CA-N 3.34Å; C2332-M2334 HydrophobicContact CB-CB 4.05Å; C2332-M2334 PolarHBondContact O-N 2.82Å; C2332-M2334 VanDerWaalsContact O-N 3.17Å; C2332-M2334 VanDerWaalsContact SG-CB 3.56Å; C2332-M2334 PolarHBondContact SG-N 2.94Å; M2334-S2337 PolarHBondContact O-N 3.09Å; M2334-S2337 VanDerWaalsContact O-N 3.14Å; M2334-L2338 HydrophobicContact CE-CD1 3.94Å; M2334-L2338 HydrophobicContact CG-CD1 3.69Å; M2334-L2338 HydrophobicContact CG-CG 4.11Å; M2334-L2338 WeakPolarHBondContact O-CB 3.39Å; M2334-L2338 VanDerWaalsContact O-CG 3.28Å; M2334-L2338 WeakPolarHBondContact O-CG 3.35Å; M2334-L2338 PolarHBondContact O-N 2.85Å; M2334-L2338 HydrophobicContact SD-CD1 4.07Å |
| 2335 | F | 71.7 | Confident | 67.2 | Low | 74 Ų | 74 | 48.2 Ų | 48.2 | 33% | 0.325 | 26% | 0.255 | S | S | . | . | H | α-helix | trans | -70 | -45.8 | -170.2 | -64.9 | -74.1 | 0 | 0 | 0 | 114.1 | S2333 S2337 L2338 F2339 V2364 T2367 L2368 | S2333-F2335 PolarHBondContact O-N 3.37Å; F2335-S2337 VanDerWaalsContact C-N 3.31Å; F2335-S2337 PolarHBondContact O-N 3.21Å; F2335-L2338 HydrophobicContact CD1-CD1 4.34Å; F2335-L2338 PolarHBondContact O-N 2.99Å; F2335-F2339 PolarHBondContact O-N 3.29Å; F2335-F2339 VanDerWaalsContact O-N 3.09Å; F2335-V2364 HydrophobicContact CB-CG1 4.35Å; F2335-V2364 WeakPolarHBondContact O-CG1 3.28Å; F2335-T2367 HydrophobicContact CD1-CG2 4.34Å; F2335-T2367 HydrophobicContact CE1-CG2 3.62Å; F2335-T2367 HydrophobicContact CE2-CG2 4.33Å; F2335-T2367 HydrophobicContact CZ-CG2 3.7Å; F2335-L2368 HydrophobicContact CB-CD1 4.12Å; F2335-L2368 HydrophobicContact CB-CD2 3.66Å; F2335-L2368 HydrophobicContact CB-CG 3.9Å; F2335-L2368 HydrophobicContact CD2-CD2 4.37Å; F2335-L2368 HydrophobicContact CG-CD2 4.21Å; F2335-L2368 HydrophobicContact CG-CG 4.29Å |
| 2336 | P | 76.5 | Confident | 69 | Low | 19.3333 Ų | 19.3333 | 45.7 Ų | 45.7 | 13% | 0.126 | 24% | 0.241 | C | C | . | . | H | α-helix | trans | -57.9 | -36.3 | 170.1 | -28 | 34.8 | 0 | 0 | 0 | 114 | S2333 F2339 W2340 I2382 M2383 A2386 | S2333-P2336 WeakPolarHBondContact O-CD 3.34Å; P2336-F2339 WeakPolarHBondContact O-CB 3.43Å; P2336-F2339 PolarHBondContact O-N 3.23Å; P2336-W2340 VanDerWaalsContact O-CD1 3.23Å; P2336-W2340 PolarHBondContact O-N 3.29Å; P2336-I2382 HydrophobicContact CG-CG2 4.25Å; P2336-M2383 HydrophobicContact CB-SD 4.39Å; P2336-A2386 HydrophobicContact CB-CB 3.38Å; P2336-A2386 VanDerWaalsContact CB-CB 3.48Å; P2336-A2386 HydrophobicContact CG-CB 4.39Å |
| 2337 | S | 76.8 | Confident | 70.6 | Confident | 23 Ų | 23 | 43.2 Ų | 43.2 | 16% | 0.161 | 23% | 0.228 | C | C | . | . | H | α-helix | trans | -69.1 | -41.5 | 175.6 | -53.7 | 0 | 0 | 0 | 0 | 112 | C2332 S2333 M2334 F2335 F2339 W2340 I2341 | C2332-S2337 WeakPolarHBondContact CB-OG 3.47Å; C2332-S2337 PolarHBondContact SG-OG 3.49Å; S2333-S2337 PolarHBondContact O-N 3.36Å; S2333-S2337 PolarHBondContact O-OG 3.4Å; M2334-S2337 PolarHBondContact O-N 3.09Å; M2334-S2337 VanDerWaalsContact O-N 3.14Å; F2335-S2337 VanDerWaalsContact C-N 3.31Å; F2335-S2337 PolarHBondContact O-N 3.21Å; S2337-F2339 VanDerWaalsContact C-N 3.28Å; S2337-F2339 PolarHBondContact O-N 2.98Å; S2337-W2340 PolarHBondContact O-N 3.26Å; S2337-W2340 VanDerWaalsContact O-N 3.1Å; S2337-I2341 WeakPolarHBondContact O-CD1 3.32Å; S2337-I2341 VanDerWaalsContact O-CG1 3.3Å; S2337-I2341 WeakPolarHBondContact O-CG1 3.28Å; S2337-I2341 PolarHBondContact O-N 3.11Å |
| 2338 | L | 80.4 | Confident | 72.2 | Confident | 28 Ų | 28 | 41.1 Ų | 41.1 | 15% | 0.147 | 21% | 0.214 | C | C | . | . | H | α-helix | trans | -63 | -32.1 | 174.4 | -73.2 | 171.9 | 0 | 0 | 0 | 112.7 | L2324 M2334 F2335 I2341 S2342 V2364 | L2324-L2338 HydrophobicContact CD2-CD2 4.17Å; M2334-L2338 HydrophobicContact CE-CD1 3.94Å; M2334-L2338 HydrophobicContact CG-CD1 3.69Å; M2334-L2338 HydrophobicContact CG-CG 4.11Å; M2334-L2338 WeakPolarHBondContact O-CB 3.39Å; M2334-L2338 VanDerWaalsContact O-CG 3.28Å; M2334-L2338 WeakPolarHBondContact O-CG 3.35Å; M2334-L2338 PolarHBondContact O-N 2.85Å; M2334-L2338 HydrophobicContact SD-CD1 4.07Å; F2335-L2338 HydrophobicContact CD1-CD1 4.34Å; F2335-L2338 PolarHBondContact O-N 2.99Å; L2338-I2341 HydrophobicContact CD2-CD1 4.15Å; L2338-I2341 PolarHBondContact O-N 3.44Å; L2338-S2342 WeakPolarHBondContact O-CB 3.43Å; L2338-S2342 PolarHBondContact O-N 3.27Å; L2338-S2342 PolarHBondContact O-OG 3.19Å; L2338-V2364 HydrophobicContact CB-CG2 3.72Å; L2338-V2364 HydrophobicContact CD1-CG2 4.4Å |
| 2339 | F | 88.2 | Confident | 73.8 | Confident | 0 Ų | 0 | 43.9 Ų | 43.9 | 0% | 0 | 23% | 0.226 | C | C | . | . | H | α-helix | trans | -58.9 | -52.1 | 169.7 | 169.5 | -89.6 | 0 | 0 | 0 | 110.4 | F2335 P2336 S2337 I2341 S2342 I2343 L2361 V2364 I2365 F2379 M2383 F2409 L2413 | F2335-F2339 PolarHBondContact O-N 3.29Å; F2335-F2339 VanDerWaalsContact O-N 3.09Å; P2336-F2339 WeakPolarHBondContact O-CB 3.43Å; P2336-F2339 PolarHBondContact O-N 3.23Å; S2337-F2339 VanDerWaalsContact C-N 3.28Å; S2337-F2339 PolarHBondContact O-N 2.98Å; F2339-I2341 VanDerWaalsContact C-N 3.33Å; F2339-I2341 PolarHBondContact O-N 3.24Å; F2339-S2342 WeakPolarHBondContact O-CA 3.35Å; F2339-S2342 VanDerWaalsContact O-CB 3.3Å; F2339-S2342 WeakPolarHBondContact O-CB 3.29Å; F2339-S2342 PolarHBondContact O-N 3.44Å; F2339-S2342 VanDerWaalsContact O-N 3.11Å; F2339-I2343 HydrophobicContact CD1-CG1 4.38Å; F2339-I2343 HydrophobicContact CE1-CG1 3.97Å; F2339-I2343 HydrophobicContact CE2-CD1 4.43Å; F2339-I2343 HydrophobicContact CZ-CD1 4.2Å; F2339-I2343 HydrophobicContact CZ-CG1 4.11Å; F2339-I2343 WeakPolarHBondContact O-CG1 3.24Å; F2339-I2343 PolarHBondContact O-N 3.17Å; F2339-L2361 HydrophobicContact CD2-CD1 3.38Å; F2339-L2361 VanDerWaalsContact CD2-CD1 3.4Å; F2339-L2361 HydrophobicContact CE2-CD1 3.67Å; F2339-L2361 HydrophobicContact CG-CD1 4.37Å; F2339-V2364 HydrophobicContact CB-CG1 4.18Å; F2339-I2365 HydrophobicContact CD2-CD1 4.26Å; F2339-F2379 HydrophobicContact CD2-CZ 4.48Å; F2339-F2379 AromaticContact CE2-CZ 3.91Å; F2339-F2379 HydrophobicContact CE2-CZ 4Å; F2339-F2379 HydrophobicContact CZ-CZ 4.49Å; F2339-M2383 HydrophobicContact CB-CE 4.19Å; F2339-M2383 HydrophobicContact CB-SD 3.7Å; F2339-M2383 HydrophobicContact CD1-CB 4.12Å; F2339-M2383 HydrophobicContact CD1-CG 4.01Å; F2339-M2383 HydrophobicContact CD1-SD 3.74Å; F2339-M2383 HydrophobicContact CD2-CE 3.96Å; F2339-M2383 HydrophobicContact CD2-CG 4.36Å; F2339-M2383 HydrophobicContact CD2-SD 3.96Å; F2339-M2383 HydrophobicContact CE1-CB 4Å; F2339-M2383 HydrophobicContact CE1-CG 4.04Å; F2339-M2383 HydrophobicContact CE1-SD 4.38Å; F2339-M2383 HydrophobicContact CE2-CE 4.47Å; F2339-M2383 HydrophobicContact CE2-CG 4.39Å; F2339-M2383 HydrophobicContact CG-CE 4.08Å; F2339-M2383 HydrophobicContact CG-CG 4.19Å; F2339-M2383 HydrophobicContact CG-SD 3.52Å; F2339-M2383 VanDerWaalsContact CG-SD 3.54Å; F2339-M2383 WeakPolarHBondContact CG-SD 3.45Å; F2339-M2383 HydrophobicContact CZ-CG 4.24Å; F2339-F2409 HydrophobicContact CE1-CE2 4.29Å; F2339-F2409 HydrophobicContact CE1-CZ 4.24Å; F2339-F2409 HydrophobicContact CZ-CE2 4.24Å; F2339-F2409 AromaticContact CZ-CZ 3.8Å; F2339-F2409 HydrophobicContact CZ-CZ 3.8Å; F2339-L2413 HydrophobicContact CE2-CD1 4.11Å; F2339-L2413 HydrophobicContact CE2-CD2 4.26Å; F2339-L2413 HydrophobicContact CZ-CD1 4.06Å; F2339-L2413 HydrophobicContact CZ-CD2 4.39Å |
| 2340 | W | 87.7 | Confident | 75.8 | Confident | 6 Ų | 6 | 41.6 Ų | 41.6 | 2% | 0.023 | 22% | 0.217 | C | C | . | . | H | α-helix | trans | -65.6 | -37 | 179.1 | -70.9 | 114 | 0 | 0 | 0 | 113.1 | P2336 S2337 S2342 I2343 I2344 M2383 M2384 R2387 F2394 F2405 F2409 | P2336-W2340 VanDerWaalsContact O-CD1 3.23Å; P2336-W2340 PolarHBondContact O-N 3.29Å; S2337-W2340 PolarHBondContact O-N 3.26Å; S2337-W2340 VanDerWaalsContact O-N 3.1Å; W2340-S2342 VanDerWaalsContact C-N 3.29Å; W2340-S2342 PolarHBondContact O-N 3.05Å; W2340-I2343 HydrophobicContact CE3-CB 4.45Å; W2340-I2343 HydrophobicContact CE3-CG1 4.39Å; W2340-I2343 WeakPolarHBondContact O-CB 3.33Å; W2340-I2343 PolarHBondContact O-N 3.37Å; W2340-I2343 VanDerWaalsContact O-N 3.13Å; W2340-I2344 VanDerWaalsContact O-CG1 3.3Å; W2340-I2344 WeakPolarHBondContact O-CG1 3.25Å; W2340-I2344 PolarHBondContact O-N 3.07Å; W2340-M2383 HydrophobicContact CZ2-CB 4.47Å; W2340-M2383 PolarHBondContact NE1-O 2.96Å; W2340-M2384 HydrophobicContact CH2-SD 4.08Å; W2340-M2384 HydrophobicContact CZ2-SD 3.95Å; W2340-R2387 HydrophobicContact CH2-CG 4.24Å; W2340-R2387 HydrophobicContact CZ2-CB 4.04Å; W2340-R2387 HydrophobicContact CZ2-CG 3.97Å; W2340-F2394 HydrophobicContact CB-CE1 4.06Å; W2340-F2394 HydrophobicContact CB-CE2 4.46Å; W2340-F2394 HydrophobicContact CB-CZ 3.7Å; W2340-F2394 HydrophobicContact CD2-CE1 4.16Å; W2340-F2394 HydrophobicContact CD2-CE2 4.47Å; W2340-F2394 HydrophobicContact CD2-CZ 4.13Å; W2340-F2394 HydrophobicContact CE3-CD1 4.28Å; W2340-F2394 AromaticContact CE3-CE1 3.88Å; W2340-F2394 HydrophobicContact CE3-CE1 3.95Å; W2340-F2394 HydrophobicContact CE3-CZ 4.25Å; W2340-F2394 HydrophobicContact CG-CE1 4.26Å; W2340-F2394 HydrophobicContact CG-CE2 4.36Å; W2340-F2394 AromaticContact CG-CZ 3.82Å; W2340-F2394 HydrophobicContact CG-CZ 3.91Å; W2340-F2405 HydrophobicContact CH2-CB 4.12Å; W2340-F2405 AromaticContact CH2-CD1 3.94Å; W2340-F2405 HydrophobicContact CH2-CD1 4Å; W2340-F2405 HydrophobicContact CH2-CD2 4.05Å; W2340-F2405 HydrophobicContact CH2-CE1 4.4Å; W2340-F2405 HydrophobicContact CH2-CE2 4.42Å; W2340-F2405 AromaticContact CH2-CG 3.8Å; W2340-F2405 HydrophobicContact CH2-CG 3.8Å; W2340-F2405 HydrophobicContact CZ3-CD1 4.23Å; W2340-F2405 AromaticContact CZ3-CD2 3.74Å; W2340-F2405 HydrophobicContact CZ3-CD2 3.74Å; W2340-F2405 HydrophobicContact CZ3-CE1 4.26Å; W2340-F2405 AromaticContact CZ3-CE2 3.75Å; W2340-F2405 HydrophobicContact CZ3-CE2 3.75Å; W2340-F2405 AromaticContact CZ3-CG 3.92Å; W2340-F2405 HydrophobicContact CZ3-CG 3.97Å; W2340-F2405 AromaticContact CZ3-CZ 3.97Å; W2340-F2405 HydrophobicContact CZ3-CZ 4.03Å; W2340-F2409 HydrophobicContact CH2-CE2 4.43Å; W2340-F2409 HydrophobicContact CZ2-CE2 4.47Å |
| 2341 | I | 84.2 | Confident | 77.8 | Confident | 20 Ų | 20 | 41 Ų | 41 | 10% | 0.103 | 22% | 0.218 | C | C | . | . | H | α-helix | trans | -59.5 | -42.3 | 171.3 | -67.9 | 161.6 | 0 | 0 | 0 | 110.4 | L2324 L2328 S2337 L2338 F2339 I2343 I2344 I2345 L2360 L2766 I2769 | L2324-I2341 HydrophobicContact CD2-CD1 4.24Å; L2328-I2341 HydrophobicContact CB-CD1 4.34Å; L2328-I2341 HydrophobicContact CD1-CD1 3.37Å; L2328-I2341 HydrophobicContact CD1-CG1 3.78Å; L2328-I2341 HydrophobicContact CD1-CG2 4.09Å; L2328-I2341 HydrophobicContact CD2-CD1 4.17Å; L2328-I2341 HydrophobicContact CD2-CG1 4.15Å; L2328-I2341 HydrophobicContact CG-CD1 4.05Å; S2337-I2341 WeakPolarHBondContact O-CD1 3.32Å; S2337-I2341 VanDerWaalsContact O-CG1 3.3Å; S2337-I2341 WeakPolarHBondContact O-CG1 3.28Å; S2337-I2341 PolarHBondContact O-N 3.11Å; L2338-I2341 HydrophobicContact CD2-CD1 4.15Å; L2338-I2341 PolarHBondContact O-N 3.44Å; F2339-I2341 VanDerWaalsContact C-N 3.33Å; F2339-I2341 PolarHBondContact O-N 3.24Å; I2341-I2343 VanDerWaalsContact C-N 3.32Å; I2341-I2343 PolarHBondContact O-N 3.13Å; I2341-I2344 WeakPolarHBondContact O-CB 3.44Å; I2341-I2344 PolarHBondContact O-N 3.26Å; I2341-I2345 HydrophobicContact CG2-CD1 3.85Å; I2341-I2345 HydrophobicContact CG2-CG1 4.38Å; I2341-I2345 VanDerWaalsContact O-CG1 3.28Å; I2341-I2345 WeakPolarHBondContact O-CG1 3.39Å; I2341-I2345 PolarHBondContact O-N 3.08Å; I2341-L2360 HydrophobicContact CG2-CD2 4.46Å; I2341-L2766 HydrophobicContact CG1-CD2 4.26Å; I2341-I2769 HydrophobicContact CD1-CG2 4.12Å; I2341-I2769 HydrophobicContact CG1-CG2 4.12Å |
| 2342 | S | 88.2 | Confident | 79.8 | Confident | 0 Ų | 0 | 40.6 Ų | 40.6 | 0% | 0 | 22% | 0.218 | C | C | . | . | H | α-helix | trans | -61.4 | -43.2 | 175.9 | -53.1 | 0 | 0 | 0 | 0 | 111.2 | L2338 F2339 W2340 I2344 I2345 L2346 L2360 L2361 | L2338-S2342 WeakPolarHBondContact O-CB 3.43Å; L2338-S2342 PolarHBondContact O-N 3.27Å; L2338-S2342 PolarHBondContact O-OG 3.19Å; F2339-S2342 WeakPolarHBondContact O-CA 3.35Å; F2339-S2342 VanDerWaalsContact O-CB 3.3Å; F2339-S2342 WeakPolarHBondContact O-CB 3.29Å; F2339-S2342 PolarHBondContact O-N 3.44Å; F2339-S2342 VanDerWaalsContact O-N 3.11Å; W2340-S2342 VanDerWaalsContact C-N 3.29Å; W2340-S2342 PolarHBondContact O-N 3.05Å; S2342-I2344 VanDerWaalsContact C-N 3.33Å; S2342-I2344 PolarHBondContact O-N 3.02Å; S2342-I2345 PolarHBondContact O-N 3.24Å; S2342-L2346 WeakPolarHBondContact O-CB 3.31Å; S2342-L2346 VanDerWaalsContact O-CG 3.3Å; S2342-L2346 WeakPolarHBondContact O-CG 3.39Å; S2342-L2346 PolarHBondContact O-N 3.13Å; S2342-L2360 WeakPolarHBondContact OG-CD2 3.34Å; S2342-L2360 VanDerWaalsContact OG-CG 3.28Å; S2342-L2360 WeakPolarHBondContact OG-CG 3.35Å; S2342-L2361 PolarHBondContact OG-N 3.03Å |
| 2343 | I | 89.8 | Confident | 82 | Confident | 1.33333 Ų | 1.33333 | 39.9 Ų | 39.9 | 1% | 0.007 | 21% | 0.208 | C | C | . | . | H | α-helix | trans | -59.7 | -45.1 | 174.3 | -60.8 | -54.4 | 0 | 0 | 0 | 111.1 | F2339 W2340 I2341 I2345 L2346 Q2347 L2361 F2405 L2413 Y2416 | F2339-I2343 HydrophobicContact CD1-CG1 4.38Å; F2339-I2343 HydrophobicContact CE1-CG1 3.97Å; F2339-I2343 HydrophobicContact CE2-CD1 4.43Å; F2339-I2343 HydrophobicContact CZ-CD1 4.2Å; F2339-I2343 HydrophobicContact CZ-CG1 4.11Å; F2339-I2343 WeakPolarHBondContact O-CG1 3.24Å; F2339-I2343 PolarHBondContact O-N 3.17Å; W2340-I2343 HydrophobicContact CE3-CB 4.45Å; W2340-I2343 HydrophobicContact CE3-CG1 4.39Å; W2340-I2343 WeakPolarHBondContact O-CB 3.33Å; W2340-I2343 PolarHBondContact O-N 3.37Å; W2340-I2343 VanDerWaalsContact O-N 3.13Å; I2341-I2343 VanDerWaalsContact C-N 3.32Å; I2341-I2343 PolarHBondContact O-N 3.13Å; I2343-I2345 VanDerWaalsContact C-N 3.32Å; I2343-I2345 PolarHBondContact O-N 3.33Å; I2343-L2346 HydrophobicContact CD1-CD1 4.41Å; I2343-L2346 WeakPolarHBondContact O-CB 3.26Å; I2343-L2346 PolarHBondContact O-N 3.31Å; I2343-L2346 VanDerWaalsContact O-N 3.16Å; I2343-Q2347 VanDerWaalsContact O-CG 3.31Å; I2343-Q2347 WeakPolarHBondContact O-CG 3.37Å; I2343-Q2347 PolarHBondContact O-N 2.93Å; I2343-Q2347 VanDerWaalsContact O-N 3.15Å; I2343-L2361 HydrophobicContact CD1-CD2 4.34Å; I2343-F2405 HydrophobicContact CD1-CZ 4.29Å; I2343-F2405 HydrophobicContact CG1-CZ 4.24Å; I2343-F2405 HydrophobicContact CG2-CE2 3.94Å; I2343-F2405 HydrophobicContact CG2-CZ 3.85Å; I2343-L2413 HydrophobicContact CD1-CD1 3.72Å; I2343-Y2416 HydrophobicContact CG2-CD2 4.35Å; I2343-Y2416 HydrophobicContact CG2-CE2 4.28Å; I2343-Y2416 HydrophobicContact CG2-CG 4.49Å |
| 2344 | I | 86.8 | Confident | 83.6 | Confident | 17 Ų | 17 | 36.8 Ų | 36.8 | 9% | 0.087 | 19% | 0.185 | C | C | . | . | H | α-helix | trans | -60.4 | -42.4 | 176.2 | -65.9 | 164.6 | 0 | 0 | 0 | 110.9 | W2340 I2341 S2342 L2346 Q2347 F2348 F2394 M2397 T2762 L2766 I2769 | W2340-I2344 VanDerWaalsContact O-CG1 3.3Å; W2340-I2344 WeakPolarHBondContact O-CG1 3.25Å; W2340-I2344 PolarHBondContact O-N 3.07Å; I2341-I2344 WeakPolarHBondContact O-CB 3.44Å; I2341-I2344 PolarHBondContact O-N 3.26Å; S2342-I2344 VanDerWaalsContact C-N 3.33Å; S2342-I2344 PolarHBondContact O-N 3.02Å; I2344-L2346 VanDerWaalsContact C-N 3.31Å; I2344-L2346 PolarHBondContact O-N 3.36Å; I2344-Q2347 WeakPolarHBondContact O-CB 3.45Å; I2344-Q2347 PolarHBondContact O-N 3.37Å; I2344-Q2347 VanDerWaalsContact O-N 3.14Å; I2344-F2348 HydrophobicContact CG2-CE2 4.13Å; I2344-F2348 HydrophobicContact CG2-CZ 4.22Å; I2344-F2348 WeakPolarHBondContact O-CD2 3.35Å; I2344-F2394 HydrophobicContact CD1-CE1 4.07Å; I2344-F2394 HydrophobicContact CD1-CZ 4.14Å; I2344-F2394 HydrophobicContact CG1-CE1 4.1Å; I2344-M2397 HydrophobicContact CB-CE 4.47Å; I2344-M2397 HydrophobicContact CD1-CE 4.23Å; I2344-M2397 HydrophobicContact CG1-CE 3.7Å; I2344-M2397 VanDerWaalsContact CG1-CE 3.5Å; I2344-M2397 HydrophobicContact CG2-CE 4.31Å; I2344-T2762 HydrophobicContact CG2-CG2 3.51Å; I2344-L2766 HydrophobicContact CB-CD2 4.01Å; I2344-L2766 HydrophobicContact CD1-CD2 3.62Å; I2344-L2766 HydrophobicContact CD1-CG 4.02Å; I2344-L2766 HydrophobicContact CG1-CD2 4.39Å; I2344-L2766 HydrophobicContact CG2-CD1 4.27Å; I2344-L2766 HydrophobicContact CG2-CD2 3.67Å; I2344-L2766 HydrophobicContact CG2-CG 4.05Å; I2344-I2769 HydrophobicContact CD1-CD1 3.34Å |
| 2345 | I | 87.3 | Confident | 84.8 | Confident | 39 Ų | 39 | 36.5 Ų | 36.5 | 20% | 0.2 | 18% | 0.183 | C | C | . | . | H | α-helix | trans | -61.7 | -41.4 | 177.5 | -67.8 | 166.9 | 0 | 0 | 0 | 111.2 | I2341 S2342 I2343 Q2347 F2348 L2353 L2360 | I2341-I2345 HydrophobicContact CG2-CD1 3.85Å; I2341-I2345 HydrophobicContact CG2-CG1 4.38Å; I2341-I2345 VanDerWaalsContact O-CG1 3.28Å; I2341-I2345 WeakPolarHBondContact O-CG1 3.39Å; I2341-I2345 PolarHBondContact O-N 3.08Å; S2342-I2345 PolarHBondContact O-N 3.24Å; I2343-I2345 VanDerWaalsContact C-N 3.32Å; I2343-I2345 PolarHBondContact O-N 3.33Å; I2345-Q2347 VanDerWaalsContact C-N 3.26Å; I2345-Q2347 PolarHBondContact O-N 3.13Å; I2345-F2348 PolarHBondContact O-N 3.11Å; I2345-L2353 HydrophobicContact CG2-CB 4.1Å; I2345-L2353 WeakPolarHBondContact CG2-O 3.36Å; I2345-L2360 HydrophobicContact CD1-CD2 4.26Å |
| 2346 | L | 90.1 | Very high | 85.5 | Confident | 0 Ų | 0 | 38.4 Ų | 38.4 | 0% | 0 | 19% | 0.193 | C | C | . | . | H | α-helix | trans | -64.8 | -24.4 | 176.8 | -64.1 | 174.8 | 0 | 0 | 0 | 112.7 | S2342 I2343 I2344 F2348 E2349 Y2354 L2358 L2361 L2417 F2744 | S2342-L2346 WeakPolarHBondContact O-CB 3.31Å; S2342-L2346 VanDerWaalsContact O-CG 3.3Å; S2342-L2346 WeakPolarHBondContact O-CG 3.39Å; S2342-L2346 PolarHBondContact O-N 3.13Å; I2343-L2346 HydrophobicContact CD1-CD1 4.41Å; I2343-L2346 WeakPolarHBondContact O-CB 3.26Å; I2343-L2346 PolarHBondContact O-N 3.31Å; I2343-L2346 VanDerWaalsContact O-N 3.16Å; I2344-L2346 VanDerWaalsContact C-N 3.31Å; I2344-L2346 PolarHBondContact O-N 3.36Å; L2346-F2348 VanDerWaalsContact C-N 3.3Å; L2346-F2348 PolarHBondContact O-N 3.13Å; L2346-E2349 PolarHBondContact O-N 3.03Å; L2346-Y2354 HydrophobicContact CB-CD2 4.12Å; L2346-Y2354 HydrophobicContact CB-CE2 4.02Å; L2346-Y2354 HydrophobicContact CD2-CD1 4.21Å; L2346-Y2354 HydrophobicContact CD2-CD2 3.58Å; L2346-Y2354 HydrophobicContact CD2-CE1 4.2Å; L2346-Y2354 HydrophobicContact CD2-CE2 3.56Å; L2346-Y2354 HydrophobicContact CD2-CG 3.9Å; L2346-Y2354 WeakPolarHBondContact CD2-O 3.27Å; L2346-Y2354 HydrophobicContact CG-CD2 4.37Å; L2346-Y2354 HydrophobicContact CG-CE2 4.3Å; L2346-L2358 HydrophobicContact CD1-CD2 4.31Å; L2346-L2358 HydrophobicContact CD2-CB 4.14Å; L2346-L2358 HydrophobicContact CD2-CD2 3.97Å; L2346-L2358 HydrophobicContact CD2-CG 3.8Å; L2346-L2361 HydrophobicContact CD1-CD2 4.06Å; L2346-L2417 HydrophobicContact CD1-CD2 4.38Å; L2346-F2744 WeakPolarHBondContact O-CZ 3.37Å |
| 2347 | Q | 87 | Confident | 86.1 | Confident | 28.6667 Ų | 28.6667 | 37.5 Ų | 37.5 | 13% | 0.134 | 19% | 0.187 | C | C | . | . | H | α-helix | trans | -75.1 | -20.7 | 179.3 | -70 | 175.2 | 2 | 0 | 0 | 113.9 | I2343 I2344 I2345 E2349 M2397 I2401 Y2416 | I2343-Q2347 VanDerWaalsContact O-CG 3.31Å; I2343-Q2347 WeakPolarHBondContact O-CG 3.37Å; I2343-Q2347 PolarHBondContact O-N 2.93Å; I2343-Q2347 VanDerWaalsContact O-N 3.15Å; I2344-Q2347 WeakPolarHBondContact O-CB 3.45Å; I2344-Q2347 PolarHBondContact O-N 3.37Å; I2344-Q2347 VanDerWaalsContact O-N 3.14Å; I2345-Q2347 VanDerWaalsContact C-N 3.26Å; I2345-Q2347 PolarHBondContact O-N 3.13Å; Q2347-E2349 PolarHBondContact O-N 3.2Å; Q2347-M2397 VanDerWaalsContact OE1-CE 3.24Å; Q2347-I2401 HydrophobicContact CB-CD1 4.06Å; Q2347-I2401 HydrophobicContact CG-CD1 3.42Å; Q2347-I2401 VanDerWaalsContact CG-CD1 3.46Å; Q2347-I2401 VanDerWaalsContact NE2-CD1 3.32Å; Q2347-Y2416 HydrophobicContact CG-CD1 4.29Å; Q2347-Y2416 HydrophobicContact CG-CE1 3.61Å; Q2347-Y2416 PolarHBondContact NE2-OH 3.23Å; Q2347-Y2416 VanDerWaalsContact NE2-OH 3.11Å |
| 2348 | F | 83.1 | Confident | 86.8 | Confident | 73 Ų | 73 | 36.4 Ų | 36.4 | 32% | 0.32 | 18% | 0.18 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -66.7 | 7.9 | 175.9 | -67.4 | -60.9 | 0 | 0 | 0 | 112.5 | I2344 I2345 L2346 D2350 L2353 L2756 I2758 T2762 | I2344-F2348 HydrophobicContact CG2-CE2 4.13Å; I2344-F2348 HydrophobicContact CG2-CZ 4.22Å; I2344-F2348 WeakPolarHBondContact O-CD2 3.35Å; I2345-F2348 PolarHBondContact O-N 3.11Å; L2346-F2348 VanDerWaalsContact C-N 3.3Å; L2346-F2348 PolarHBondContact O-N 3.13Å; F2348-D2350 PolarHBondContact O-N 3.17Å; F2348-L2353 HydrophobicContact CB-CD1 4.18Å; F2348-L2353 HydrophobicContact CD2-CD1 4.17Å; F2348-L2353 HydrophobicContact CG-CD1 4.33Å; F2348-L2756 HydrophobicContact CB-CD2 3.79Å; F2348-L2756 HydrophobicContact CD1-CD2 4.25Å; F2348-L2756 HydrophobicContact CG-CD2 4.02Å; F2348-I2758 HydrophobicContact CD1-CG1 4.33Å; F2348-I2758 HydrophobicContact CE1-CB 4.28Å; F2348-I2758 HydrophobicContact CE1-CD1 4.39Å; F2348-I2758 HydrophobicContact CE1-CG1 3.74Å; F2348-I2758 HydrophobicContact CE1-CG2 4.03Å; F2348-I2758 HydrophobicContact CZ-CG1 4.34Å; F2348-T2762 HydrophobicContact CE1-CG2 3.79Å; F2348-T2762 HydrophobicContact CZ-CG2 4.05Å |
| 2349 | E | 82.9 | Confident | 87.2 | Confident | 100.667 Ų | 100.667 | 36.6 Ų | 36.6 | 47% | 0.47 | 19% | 0.186 | S | C | . | . | trans | 23.6 | 21.6 | -178.9 | -51.2 | -162.2 | 155.7 | 0 | 0 | 114.2 | L2346 Q2347 K2419 F2744 F2748 | L2346-E2349 PolarHBondContact O-N 3.03Å; Q2347-E2349 PolarHBondContact O-N 3.2Å; E2349-K2419 IonicContact OE1-NZ 3.65Å; E2349-K2419 PolarHBondContact OE1-NZ 3.03Å; E2349-K2419 IonicContact OE2-NZ 2.99Å; E2349-K2419 PolarHBondContact OE2-NZ 3.2Å; E2349-F2744 HydrophobicContact CG-CE2 4.06Å; E2349-F2744 WeakPolarHBondContact OE1-CD2 3.41Å; E2349-F2744 VanDerWaalsContact OE1-CE2 3.29Å; E2349-F2744 WeakPolarHBondContact OE1-CE2 3.07Å; E2349-F2748 VanDerWaalsContact O-CD1 3.3Å; E2349-F2748 WeakPolarHBondContact O-CD1 3.43Å | ||
| 2350 | D | 84.2 | Confident | 87.2 | Confident | 55.3333 Ų | 55.3333 | 39.3 Ų | 39.3 | 30% | 0.296 | 20% | 0.2 | S | C | . | . | trans | -89.2 | 125.3 | 172.4 | 178.7 | -40.5 | 0 | 0 | 0 | 109.6 | F2348 M2352 L2353 Y2354 L2756 | F2348-D2350 PolarHBondContact O-N 3.17Å; D2350-M2352 VanDerWaalsContact C-N 3.32Å; D2350-M2352 PolarHBondContact O-N 3Å; D2350-M2352 WeakPolarHBondContact OD1-CA 3.32Å; D2350-M2352 WeakPolarHBondContact OD1-CB 3.4Å; D2350-M2352 PolarHBondContact OD1-N 3.47Å; D2350-M2352 WeakPolarHBondContact OD2-CA 3.39Å; D2350-M2352 WeakPolarHBondContact OD2-CB 3.49Å; D2350-M2352 PolarHBondContact OD2-N 3.37Å; D2350-L2353 HydrophobicContact CB-CB 4.09Å; D2350-L2353 HydrophobicContact CB-CD1 4.1Å; D2350-L2353 HydrophobicContact CB-CG 4.13Å; D2350-L2353 PolarHBondContact O-N 3.09Å; D2350-L2353 PolarHBondContact OD1-N 3.19Å; D2350-L2353 PolarHBondContact OD2-N 3.35Å; D2350-Y2354 WeakPolarHBondContact O-CB 3.34Å; D2350-Y2354 PolarHBondContact O-N 3.24Å; D2350-L2756 HydrophobicContact CB-CD2 4.49Å | ||
| 2351 | P | 86.2 | Confident | 87.4 | Confident | 43 Ų | 43 | 39 Ų | 39 | 28% | 0.279 | 20% | 0.199 | S | C | . | . | H | α-helix | trans | -56 | -43 | -179.9 | -25.9 | 34 | 0 | 0 | 0 | 113.6 | Y2354 E2355 H2423 P2424 F2748 | P2351-Y2354 PolarHBondContact O-N 2.87Å; P2351-E2355 PolarHBondContact O-N 3.23Å; P2351-E2355 VanDerWaalsContact O-N 3.12Å; P2351-H2423 WeakPolarHBondContact CA-NE2 3.37Å; P2351-H2423 PolarHBondContact O-NE2 3.09Å; P2351-P2424 HydrophobicContact CB-CG 3.93Å; P2351-P2424 HydrophobicContact CG-CG 4.33Å; P2351-F2748 HydrophobicContact CB-CD1 4.4Å; P2351-F2748 HydrophobicContact CG-CB 4.23Å; P2351-F2748 HydrophobicContact CG-CD1 3.79Å; P2351-F2748 HydrophobicContact CG-CE1 4.45Å; P2351-F2748 HydrophobicContact CG-CG 4.09Å |
| 2352 | M | 83.4 | Confident | 87.7 | Confident | 121.333 Ų | 121.333 | 38.8 Ų | 38.8 | 60% | 0.598 | 20% | 0.197 | S | C | * | . | H | α-helix | trans | -66.6 | -47.3 | -179 | -71.4 | -136.1 | 139.7 | 0 | 0 | 110.9 | D2350 Y2354 E2355 H2356 | D2350-M2352 VanDerWaalsContact C-N 3.32Å; D2350-M2352 PolarHBondContact O-N 3Å; D2350-M2352 WeakPolarHBondContact OD1-CA 3.32Å; D2350-M2352 WeakPolarHBondContact OD1-CB 3.4Å; D2350-M2352 PolarHBondContact OD1-N 3.47Å; D2350-M2352 WeakPolarHBondContact OD2-CA 3.39Å; D2350-M2352 WeakPolarHBondContact OD2-CB 3.49Å; D2350-M2352 PolarHBondContact OD2-N 3.37Å; M2352-Y2354 VanDerWaalsContact C-N 3.32Å; M2352-Y2354 PolarHBondContact O-N 3.14Å; M2352-E2355 PolarHBondContact O-N 3.2Å; M2352-H2356 PolarHBondContact O-N 3Å; M2352-H2356 PolarHBondContact O-ND1 3.06Å |
| 2353 | L | 86.8 | Confident | 87.5 | Confident | 69.3333 Ų | 69.3333 | 43.7 Ų | 43.7 | 36% | 0.363 | 22% | 0.22 | S | C | . | . | H | α-helix | trans | -62.9 | -39.9 | 177.1 | -66.4 | -179.5 | 0 | 0 | 0 | 111.7 | I2345 F2348 D2350 E2355 H2356 G2357 L2756 | I2345-L2353 HydrophobicContact CG2-CB 4.1Å; I2345-L2353 WeakPolarHBondContact CG2-O 3.36Å; F2348-L2353 HydrophobicContact CB-CD1 4.18Å; F2348-L2353 HydrophobicContact CD2-CD1 4.17Å; F2348-L2353 HydrophobicContact CG-CD1 4.33Å; D2350-L2353 HydrophobicContact CB-CB 4.09Å; D2350-L2353 HydrophobicContact CB-CD1 4.1Å; D2350-L2353 HydrophobicContact CB-CG 4.13Å; D2350-L2353 PolarHBondContact O-N 3.09Å; D2350-L2353 PolarHBondContact OD1-N 3.19Å; D2350-L2353 PolarHBondContact OD2-N 3.35Å; L2353-E2355 PolarHBondContact O-N 3.16Å; L2353-H2356 PolarHBondContact O-N 3.12Å; L2353-G2357 PolarHBondContact O-N 3.2Å; L2353-L2756 HydrophobicContact CD1-CD1 4.06Å; L2353-L2756 HydrophobicContact CD1-CD2 3.81Å |
| 2354 | Y | 91 | Very high | 87.4 | Confident | 3.66667 Ų | 3.66667 | 43.8 Ų | 43.8 | 1% | 0.014 | 22% | 0.221 | C | C | . | . | H | α-helix | trans | -60.9 | -42.1 | 178.6 | -170.5 | -83.3 | 0 | 0 | 0 | 112.1 | L2346 D2350 P2351 M2352 H2356 G2357 L2358 Y2416 L2417 K2419 G2420 F2748 | L2346-Y2354 HydrophobicContact CB-CD2 4.12Å; L2346-Y2354 HydrophobicContact CB-CE2 4.02Å; L2346-Y2354 HydrophobicContact CD2-CD1 4.21Å; L2346-Y2354 HydrophobicContact CD2-CD2 3.58Å; L2346-Y2354 HydrophobicContact CD2-CE1 4.2Å; L2346-Y2354 HydrophobicContact CD2-CE2 3.56Å; L2346-Y2354 HydrophobicContact CD2-CG 3.9Å; L2346-Y2354 WeakPolarHBondContact CD2-O 3.27Å; L2346-Y2354 HydrophobicContact CG-CD2 4.37Å; L2346-Y2354 HydrophobicContact CG-CE2 4.3Å; D2350-Y2354 WeakPolarHBondContact O-CB 3.34Å; D2350-Y2354 PolarHBondContact O-N 3.24Å; P2351-Y2354 PolarHBondContact O-N 2.87Å; M2352-Y2354 VanDerWaalsContact C-N 3.32Å; M2352-Y2354 PolarHBondContact O-N 3.14Å; Y2354-H2356 PolarHBondContact O-N 3.13Å; Y2354-G2357 PolarHBondContact O-N 3.28Å; Y2354-L2358 HydrophobicContact CD1-CD1 3.85Å; Y2354-L2358 HydrophobicContact CD1-CG 4.12Å; Y2354-L2358 HydrophobicContact CE1-CD1 3.41Å; Y2354-L2358 VanDerWaalsContact CE1-CD1 3.44Å; Y2354-L2358 HydrophobicContact CE1-CD2 4.35Å; Y2354-L2358 HydrophobicContact CE1-CG 3.79Å; Y2354-L2358 VanDerWaalsContact O-CB 3.3Å; Y2354-L2358 WeakPolarHBondContact O-CB 3.37Å; Y2354-L2358 WeakPolarHBondContact O-CG 3.36Å; Y2354-L2358 PolarHBondContact O-N 3.23Å; Y2354-Y2416 PolarHBondContact OH-O 3.08Å; Y2354-L2417 PolarHBondContact OH-O 3.24Å; Y2354-K2419 HydrophobicContact CE2-CB 4Å; Y2354-K2419 HydrophobicContact CE2-CD 4.34Å; Y2354-G2420 PolarHBondContact OH-N 3.41Å; Y2354-F2748 HydrophobicContact CD1-CE1 4.41Å; Y2354-F2748 AromaticContact CD1-CZ 3.78Å; Y2354-F2748 HydrophobicContact CD1-CZ 3.78Å; Y2354-F2748 HydrophobicContact CD2-CE1 4.21Å; Y2354-F2748 HydrophobicContact CD2-CZ 4.11Å; Y2354-F2748 HydrophobicContact CE1-CZ 4.2Å; Y2354-F2748 AromaticContact CG-CE1 3.94Å; Y2354-F2748 HydrophobicContact CG-CE1 3.94Å; Y2354-F2748 AromaticContact CG-CZ 3.74Å; Y2354-F2748 HydrophobicContact CG-CZ 3.74Å |
| 2355 | E | 89.1 | Confident | 87.4 | Confident | 43 Ų | 43 | 43 Ų | 43 | 20% | 0.201 | 22% | 0.217 | C | C | . | . | H | α-helix | trans | -60.9 | -42.6 | 175.3 | 177 | 161.9 | -166.7 | 0 | 0 | 112.4 | P2351 M2352 L2353 A2359 H2423 S2427 V2428 R2431 | P2351-E2355 PolarHBondContact O-N 3.23Å; P2351-E2355 VanDerWaalsContact O-N 3.12Å; M2352-E2355 PolarHBondContact O-N 3.2Å; L2353-E2355 PolarHBondContact O-N 3.16Å; E2355-A2359 PolarHBondContact O-N 3.05Å; E2355-A2359 VanDerWaalsContact O-N 3.13Å; E2355-H2423 IonicContact OE2-CE1 3.56Å; E2355-S2427 PolarHBondContact OE1-OG 2.95Å; E2355-V2428 HydrophobicContact CB-CG2 3.86Å; E2355-V2428 HydrophobicContact CG-CG2 3.6Å; E2355-R2431 IonicContact OE1-NH1 3.81Å; E2355-R2431 PolarHBondContact OE1-NH1 3.38Å |
| 2356 | H | 86.1 | Confident | 87.3 | Confident | 115 Ų | 115 | 43.8 Ų | 43.8 | 53% | 0.532 | 22% | 0.221 | S | C | . | . | H | α-helix | trans | -73.1 | -38.6 | 178.5 | -66.5 | 83 | 0 | 0 | 0 | 112.1 | M2352 L2353 Y2354 L2358 A2359 L2360 | M2352-H2356 PolarHBondContact O-N 3Å; M2352-H2356 PolarHBondContact O-ND1 3.06Å; L2353-H2356 PolarHBondContact O-N 3.12Å; Y2354-H2356 PolarHBondContact O-N 3.13Å; H2356-L2358 VanDerWaalsContact C-N 3.32Å; H2356-L2358 PolarHBondContact O-N 3.4Å; H2356-A2359 PolarHBondContact O-N 3.37Å; H2356-A2359 VanDerWaalsContact O-N 3.16Å; H2356-L2360 WeakPolarHBondContact O-CB 3.23Å; H2356-L2360 PolarHBondContact O-N 3.26Å |
| 2357 | G | 88.8 | Confident | 86.8 | Confident | 0 Ų | 0 | 45.3 Ų | 45.3 | 0% | 0 | 23% | 0.23 | C | C | . | . | H | α-helix | trans | -61.8 | -39.3 | 174.2 | 0 | 0 | 0 | 0 | 0 | 112.2 | L2353 Y2354 L2360 L2361 | L2353-G2357 PolarHBondContact O-N 3.2Å; Y2354-G2357 PolarHBondContact O-N 3.28Å; G2357-L2360 PolarHBondContact O-N 2.72Å; G2357-L2361 VanDerWaalsContact O-CB 3.26Å; G2357-L2361 WeakPolarHBondContact O-CB 3.43Å; G2357-L2361 PolarHBondContact O-N 3.26Å |
| 2358 | L | 92 | Very high | 86.5 | Confident | 0 Ų | 0 | 44.3 Ų | 44.3 | 0% | 0 | 23% | 0.226 | C | C | . | . | H | α-helix | trans | -65.6 | -41.4 | 173.1 | -105.6 | 152.3 | 0 | 0 | 0 | 112.3 | L2346 Y2354 H2356 L2361 E2362 L2417 V2428 L2435 | L2346-L2358 HydrophobicContact CD1-CD2 4.31Å; L2346-L2358 HydrophobicContact CD2-CB 4.14Å; L2346-L2358 HydrophobicContact CD2-CD2 3.97Å; L2346-L2358 HydrophobicContact CD2-CG 3.8Å; Y2354-L2358 HydrophobicContact CD1-CD1 3.85Å; Y2354-L2358 HydrophobicContact CD1-CG 4.12Å; Y2354-L2358 HydrophobicContact CE1-CD1 3.41Å; Y2354-L2358 VanDerWaalsContact CE1-CD1 3.44Å; Y2354-L2358 HydrophobicContact CE1-CD2 4.35Å; Y2354-L2358 HydrophobicContact CE1-CG 3.79Å; Y2354-L2358 VanDerWaalsContact O-CB 3.3Å; Y2354-L2358 WeakPolarHBondContact O-CB 3.37Å; Y2354-L2358 WeakPolarHBondContact O-CG 3.36Å; Y2354-L2358 PolarHBondContact O-N 3.23Å; H2356-L2358 VanDerWaalsContact C-N 3.32Å; H2356-L2358 PolarHBondContact O-N 3.4Å; L2358-L2361 PolarHBondContact O-N 3.26Å; L2358-E2362 VanDerWaalsContact O-CB 3.3Å; L2358-E2362 WeakPolarHBondContact O-CB 3.4Å; L2358-E2362 PolarHBondContact O-N 3.25Å; L2358-L2417 HydrophobicContact CD2-CD2 3.39Å; L2358-L2417 VanDerWaalsContact CD2-CD2 3.4Å; L2358-V2428 HydrophobicContact CD1-CG1 3.54Å; L2358-L2435 HydrophobicContact CD2-CD2 3.95Å |
| 2359 | A | 87.9 | Confident | 86.3 | Confident | 32.6667 Ų | 32.6667 | 41.6 Ų | 41.6 | 27% | 0.27 | 22% | 0.215 | S | C | . | . | H | α-helix | trans | -65.2 | -42.4 | 177.4 | 0 | 0 | 0 | 0 | 0 | 111.8 | E2355 H2356 E2362 Q2363 | E2355-A2359 PolarHBondContact O-N 3.05Å; E2355-A2359 VanDerWaalsContact O-N 3.13Å; H2356-A2359 PolarHBondContact O-N 3.37Å; H2356-A2359 VanDerWaalsContact O-N 3.16Å; A2359-E2362 PolarHBondContact O-N 3.11Å; A2359-Q2363 WeakPolarHBondContact O-CB 3.38Å; A2359-Q2363 PolarHBondContact O-N 3.15Å |
| 2360 | L | 88.2 | Confident | 86.1 | Confident | 57 Ų | 57 | 40.2 Ų | 40.2 | 30% | 0.298 | 22% | 0.217 | S | C | . | . | H | α-helix | trans | -61.7 | -47.5 | 174.5 | -178.3 | 62.6 | 0 | 0 | 0 | 111 | I2341 S2342 I2345 H2356 G2357 E2362 Q2363 V2364 | I2341-L2360 HydrophobicContact CG2-CD2 4.46Å; S2342-L2360 WeakPolarHBondContact OG-CD2 3.34Å; S2342-L2360 VanDerWaalsContact OG-CG 3.28Å; S2342-L2360 WeakPolarHBondContact OG-CG 3.35Å; I2345-L2360 HydrophobicContact CD1-CD2 4.26Å; H2356-L2360 WeakPolarHBondContact O-CB 3.23Å; H2356-L2360 PolarHBondContact O-N 3.26Å; G2357-L2360 PolarHBondContact O-N 2.72Å; L2360-E2362 VanDerWaalsContact C-N 3.35Å; L2360-E2362 PolarHBondContact O-N 3.09Å; L2360-Q2363 PolarHBondContact O-N 3.31Å; L2360-V2364 HydrophobicContact CD1-CG2 4.27Å; L2360-V2364 HydrophobicContact CG-CG2 4.4Å; L2360-V2364 WeakPolarHBondContact O-CB 3.45Å; L2360-V2364 VanDerWaalsContact O-CG2 3.26Å; L2360-V2364 WeakPolarHBondContact O-CG2 3.33Å; L2360-V2364 PolarHBondContact O-N 3.33Å |
| 2361 | L | 91.4 | Very high | 85.6 | Confident | 0 Ų | 0 | 40.9 Ų | 40.9 | 0% | 0 | 23% | 0.225 | C | C | . | . | H | α-helix | trans | -59.2 | -46.7 | 178.1 | -177.2 | 55.9 | 0 | 0 | 0 | 111.8 | F2339 S2342 I2343 L2346 G2357 L2358 Q2363 V2364 I2365 L2413 L2417 L2435 | F2339-L2361 HydrophobicContact CD2-CD1 3.38Å; F2339-L2361 VanDerWaalsContact CD2-CD1 3.4Å; F2339-L2361 HydrophobicContact CE2-CD1 3.67Å; F2339-L2361 HydrophobicContact CG-CD1 4.37Å; S2342-L2361 PolarHBondContact OG-N 3.03Å; I2343-L2361 HydrophobicContact CD1-CD2 4.34Å; L2346-L2361 HydrophobicContact CD1-CD2 4.06Å; G2357-L2361 VanDerWaalsContact O-CB 3.26Å; G2357-L2361 WeakPolarHBondContact O-CB 3.43Å; G2357-L2361 PolarHBondContact O-N 3.26Å; L2358-L2361 PolarHBondContact O-N 3.26Å; L2361-Q2363 VanDerWaalsContact C-N 3.32Å; L2361-Q2363 PolarHBondContact O-N 3.06Å; L2361-V2364 PolarHBondContact O-N 3.32Å; L2361-I2365 HydrophobicContact CD1-CD1 3.74Å; L2361-I2365 HydrophobicContact CD1-CG1 4.31Å; L2361-I2365 HydrophobicContact CG-CD1 3.91Å; L2361-I2365 WeakPolarHBondContact O-CD1 3.31Å; L2361-I2365 VanDerWaalsContact O-CG1 3.24Å; L2361-I2365 WeakPolarHBondContact O-CG1 3.33Å; L2361-I2365 PolarHBondContact O-N 3.06Å; L2361-L2413 HydrophobicContact CD2-CD1 4.33Å; L2361-L2417 HydrophobicContact CD2-CD2 3.9Å; L2361-L2435 HydrophobicContact CB-CD2 4.43Å; L2361-L2435 HydrophobicContact CD2-CD2 4.02Å; L2361-L2435 HydrophobicContact CG-CD2 4.11Å |
| 2362 | E | 90.7 | Very high | 85 | Confident | 15.3333 Ų | 15.3333 | 42.8 Ų | 42.8 | 7% | 0.072 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -56.3 | -49.4 | 175.4 | 178.3 | 172.8 | -140.4 | 0 | 0 | 111.3 | L2358 A2359 L2360 V2364 I2365 I2366 R2431 R2434 L2435 | L2358-E2362 VanDerWaalsContact O-CB 3.3Å; L2358-E2362 WeakPolarHBondContact O-CB 3.4Å; L2358-E2362 PolarHBondContact O-N 3.25Å; A2359-E2362 PolarHBondContact O-N 3.11Å; L2360-E2362 VanDerWaalsContact C-N 3.35Å; L2360-E2362 PolarHBondContact O-N 3.09Å; E2362-V2364 PolarHBondContact O-N 3.13Å; E2362-I2365 PolarHBondContact O-N 3.06Å; E2362-I2366 HydrophobicContact CG-CD1 3.86Å; E2362-I2366 VanDerWaalsContact O-CG1 3.29Å; E2362-I2366 WeakPolarHBondContact O-CG1 3.4Å; E2362-I2366 PolarHBondContact O-N 3.23Å; E2362-R2431 WeakPolarHBondContact OE2-CD 3.25Å; E2362-R2431 WeakPolarHBondContact OE2-CG 3.47Å; E2362-R2431 IonicContact OE2-NE 2.93Å; E2362-R2431 PolarHBondContact OE2-NE 2.88Å; E2362-R2434 VanDerWaalsContact CD-NH2 3.29Å; E2362-R2434 IonicContact OE1-CZ 3.42Å; E2362-R2434 VanDerWaalsContact OE1-CZ 3.27Å; E2362-R2434 IonicContact OE1-NE 3.08Å; E2362-R2434 PolarHBondContact OE1-NE 3.38Å; E2362-R2434 IonicContact OE1-NH2 3.17Å; E2362-R2434 PolarHBondContact OE1-NH2 2.91Å; E2362-R2434 IonicContact OE2-CZ 3.05Å; E2362-R2434 IonicContact OE2-NE 3.62Å; E2362-R2434 IonicContact OE2-NH2 2.88Å; E2362-R2434 PolarHBondContact OE2-NH2 3.22Å; E2362-L2435 HydrophobicContact CB-CD1 4.03Å; E2362-L2435 HydrophobicContact CG-CD1 4.46Å |
| 2363 | Q | 85.8 | Confident | 84.6 | Confident | 102 Ų | 102 | 39.9 Ų | 39.9 | 48% | 0.477 | 22% | 0.222 | S | C | . | . | H | α-helix | trans | -66 | -39.4 | -179.2 | -171.4 | 59.3 | 25.6 | 0 | 0 | 112.6 | A2359 L2360 L2361 I2365 I2366 T2367 | A2359-Q2363 WeakPolarHBondContact O-CB 3.38Å; A2359-Q2363 PolarHBondContact O-N 3.15Å; L2360-Q2363 PolarHBondContact O-N 3.31Å; L2361-Q2363 VanDerWaalsContact C-N 3.32Å; L2361-Q2363 PolarHBondContact O-N 3.06Å; Q2363-I2365 VanDerWaalsContact C-N 3.3Å; Q2363-I2365 PolarHBondContact O-N 2.87Å; Q2363-I2366 PolarHBondContact O-N 3.05Å; Q2363-T2367 PolarHBondContact NE2-OG1 3.32Å; Q2363-T2367 WeakPolarHBondContact O-CB 3.3Å; Q2363-T2367 PolarHBondContact O-N 3.32Å; Q2363-T2367 PolarHBondContact O-OG1 3.06Å; Q2363-T2367 VanDerWaalsContact O-OG1 3.08Å |
| 2364 | V | 85.9 | Confident | 84.1 | Confident | 4.66667 Ų | 4.66667 | 36.7 Ų | 36.7 | 3% | 0.028 | 21% | 0.206 | C | C | . | . | H | α-helix | trans | -59.7 | -45.4 | 175.1 | 168.3 | 0 | 0 | 0 | 0 | 110.6 | F2335 L2338 F2339 L2360 L2361 E2362 T2367 L2368 | F2335-V2364 HydrophobicContact CB-CG1 4.35Å; F2335-V2364 WeakPolarHBondContact O-CG1 3.28Å; L2338-V2364 HydrophobicContact CB-CG2 3.72Å; L2338-V2364 HydrophobicContact CD1-CG2 4.4Å; F2339-V2364 HydrophobicContact CB-CG1 4.18Å; L2360-V2364 HydrophobicContact CD1-CG2 4.27Å; L2360-V2364 HydrophobicContact CG-CG2 4.4Å; L2360-V2364 WeakPolarHBondContact O-CB 3.45Å; L2360-V2364 VanDerWaalsContact O-CG2 3.26Å; L2360-V2364 WeakPolarHBondContact O-CG2 3.33Å; L2360-V2364 PolarHBondContact O-N 3.33Å; L2361-V2364 PolarHBondContact O-N 3.32Å; E2362-V2364 PolarHBondContact O-N 3.13Å; V2364-T2367 PolarHBondContact O-N 3.34Å; V2364-L2368 HydrophobicContact CG1-CD1 3.94Å; V2364-L2368 HydrophobicContact CG1-CG 4.48Å; V2364-L2368 WeakPolarHBondContact O-CB 3.3Å; V2364-L2368 VanDerWaalsContact O-CG 3.3Å; V2364-L2368 WeakPolarHBondContact O-CG 3.41Å; V2364-L2368 PolarHBondContact O-N 3.01Å |
| 2365 | I | 87.6 | Confident | 83.2 | Confident | 0 Ų | 0 | 41.7 Ų | 41.7 | 0% | 0 | 23% | 0.229 | C | C | . | . | H | α-helix | trans | -67.8 | -42 | 179.4 | -64.9 | -173.4 | 0 | 0 | 0 | 111.2 | F2339 L2361 E2362 Q2363 T2367 L2368 T2369 F2379 L2435 L2438 L2439 | F2339-I2365 HydrophobicContact CD2-CD1 4.26Å; L2361-I2365 HydrophobicContact CD1-CD1 3.74Å; L2361-I2365 HydrophobicContact CD1-CG1 4.31Å; L2361-I2365 HydrophobicContact CG-CD1 3.91Å; L2361-I2365 WeakPolarHBondContact O-CD1 3.31Å; L2361-I2365 VanDerWaalsContact O-CG1 3.24Å; L2361-I2365 WeakPolarHBondContact O-CG1 3.33Å; L2361-I2365 PolarHBondContact O-N 3.06Å; E2362-I2365 PolarHBondContact O-N 3.06Å; Q2363-I2365 VanDerWaalsContact C-N 3.3Å; Q2363-I2365 PolarHBondContact O-N 2.87Å; I2365-T2367 VanDerWaalsContact C-N 3.33Å; I2365-T2367 PolarHBondContact O-N 3.22Å; I2365-L2368 PolarHBondContact O-N 3.31Å; I2365-T2369 WeakPolarHBondContact O-CB 3.37Å; I2365-T2369 PolarHBondContact O-N 3.04Å; I2365-T2369 PolarHBondContact O-OG1 3.36Å; I2365-F2379 HydrophobicContact CD1-CE2 3.35Å; I2365-F2379 HydrophobicContact CD1-CZ 4.11Å; I2365-F2379 VanDerWaalsContact CD1-CZ 3.49Å; I2365-F2379 HydrophobicContact CG1-CE2 4.26Å; I2365-F2379 HydrophobicContact CG1-CZ 4.31Å; I2365-L2435 HydrophobicContact CD1-CD1 3.74Å; I2365-L2438 HydrophobicContact CB-CD2 4.18Å; I2365-L2438 HydrophobicContact CG2-CD2 3.7Å; I2365-L2438 HydrophobicContact CG2-CG 3.91Å; I2365-L2439 HydrophobicContact CD1-CD1 4.32Å; I2365-L2439 HydrophobicContact CD1-CD2 3.6Å; I2365-L2439 HydrophobicContact CD1-CG 4Å; I2365-L2439 HydrophobicContact CG1-CD2 4.39Å; I2365-L2439 HydrophobicContact CG2-CD2 4.48Å |
| 2366 | I | 85.1 | Confident | 82.4 | Confident | 54.3333 Ų | 54.3333 | 49.1 Ų | 49.1 | 28% | 0.279 | 26% | 0.256 | S | S | . | . | H | α-helix | trans | -58.6 | -47.5 | 174.9 | -69.4 | 169.8 | 0 | 0 | 0 | 110.3 | E2362 Q2363 T2369 S2370 L2438 | E2362-I2366 HydrophobicContact CG-CD1 3.86Å; E2362-I2366 VanDerWaalsContact O-CG1 3.29Å; E2362-I2366 WeakPolarHBondContact O-CG1 3.4Å; E2362-I2366 PolarHBondContact O-N 3.23Å; Q2363-I2366 PolarHBondContact O-N 3.05Å; I2366-T2369 WeakPolarHBondContact O-CB 3.29Å; I2366-T2369 PolarHBondContact O-N 2.91Å; I2366-S2370 PolarHBondContact O-N 2.98Å; I2366-S2370 PolarHBondContact O-OG 3Å; I2366-L2438 HydrophobicContact CD1-CD2 4.4Å; I2366-L2438 HydrophobicContact CG1-CD2 3.54Å |
| 2367 | T | 79.8 | Confident | 82 | Confident | 32.6667 Ų | 32.6667 | 50.1 Ų | 50.1 | 20% | 0.2 | 26% | 0.256 | C | S | . | . | H | α-helix | trans | -66.2 | -43.8 | -177.3 | -54.2 | 0 | 0 | 0 | 0 | 111.9 | F2335 Q2363 V2364 I2365 T2369 S2370 S2371 | F2335-T2367 HydrophobicContact CD1-CG2 4.34Å; F2335-T2367 HydrophobicContact CE1-CG2 3.62Å; F2335-T2367 HydrophobicContact CE2-CG2 4.33Å; F2335-T2367 HydrophobicContact CZ-CG2 3.7Å; Q2363-T2367 PolarHBondContact NE2-OG1 3.32Å; Q2363-T2367 WeakPolarHBondContact O-CB 3.3Å; Q2363-T2367 PolarHBondContact O-N 3.32Å; Q2363-T2367 PolarHBondContact O-OG1 3.06Å; Q2363-T2367 VanDerWaalsContact O-OG1 3.08Å; V2364-T2367 PolarHBondContact O-N 3.34Å; I2365-T2367 VanDerWaalsContact C-N 3.33Å; I2365-T2367 PolarHBondContact O-N 3.22Å; T2367-T2369 VanDerWaalsContact C-N 3.29Å; T2367-T2369 PolarHBondContact O-N 2.93Å; T2367-S2370 WeakPolarHBondContact CA-OG 3.41Å; T2367-S2370 PolarHBondContact O-N 3.22Å; T2367-S2370 VanDerWaalsContact O-N 3.08Å; T2367-S2370 PolarHBondContact O-OG 3.24Å; T2367-S2371 VanDerWaalsContact O-CB 3.32Å; T2367-S2371 WeakPolarHBondContact O-CB 3.32Å; T2367-S2371 PolarHBondContact O-N 3.11Å; T2367-S2371 PolarHBondContact O-OG 3.13Å |
| 2368 | L | 80.2 | Confident | 81.8 | Confident | 8 Ų | 8 | 52.6 Ų | 52.6 | 4% | 0.042 | 27% | 0.273 | C | S | . | . | H | α-helix | trans | -64.9 | -34.9 | 174.4 | -74.2 | 172 | 0 | 0 | 0 | 112.4 | F2335 V2364 I2365 S2371 V2373 F2374 M2383 | F2335-L2368 HydrophobicContact CB-CD1 4.12Å; F2335-L2368 HydrophobicContact CB-CD2 3.66Å; F2335-L2368 HydrophobicContact CB-CG 3.9Å; F2335-L2368 HydrophobicContact CD2-CD2 4.37Å; F2335-L2368 HydrophobicContact CG-CD2 4.21Å; F2335-L2368 HydrophobicContact CG-CG 4.29Å; V2364-L2368 HydrophobicContact CG1-CD1 3.94Å; V2364-L2368 HydrophobicContact CG1-CG 4.48Å; V2364-L2368 WeakPolarHBondContact O-CB 3.3Å; V2364-L2368 VanDerWaalsContact O-CG 3.3Å; V2364-L2368 WeakPolarHBondContact O-CG 3.41Å; V2364-L2368 PolarHBondContact O-N 3.01Å; I2365-L2368 PolarHBondContact O-N 3.31Å; L2368-S2371 PolarHBondContact O-N 2.82Å; L2368-V2373 HydrophobicContact CD2-CG2 4.11Å; L2368-F2374 HydrophobicContact CB-CD2 4.49Å; L2368-F2374 HydrophobicContact CB-CE2 3.52Å; L2368-F2374 VanDerWaalsContact CB-CE2 3.48Å; L2368-F2374 HydrophobicContact CB-CZ 3.54Å; L2368-F2374 HydrophobicContact CD1-CZ 4.05Å; L2368-F2374 HydrophobicContact CG-CZ 4.39Å; L2368-M2383 HydrophobicContact CD1-CE 3.4Å; L2368-M2383 VanDerWaalsContact CD1-CE 3.45Å |
| 2369 | T | 80.4 | Confident | 81.5 | Confident | 15.3333 Ų | 15.3333 | 52.7 Ų | 52.7 | 9% | 0.094 | 27% | 0.274 | C | S | . | . | H | α-helix | trans | -67.2 | -40 | 176.3 | -70.9 | 0 | 0 | 0 | 0 | 112 | I2365 I2366 T2367 S2371 N2372 T2442 R2445 L2593 | I2365-T2369 WeakPolarHBondContact O-CB 3.37Å; I2365-T2369 PolarHBondContact O-N 3.04Å; I2365-T2369 PolarHBondContact O-OG1 3.36Å; I2366-T2369 WeakPolarHBondContact O-CB 3.29Å; I2366-T2369 PolarHBondContact O-N 2.91Å; T2367-T2369 VanDerWaalsContact C-N 3.29Å; T2367-T2369 PolarHBondContact O-N 2.93Å; T2369-S2371 VanDerWaalsContact C-N 3.32Å; T2369-N2372 PolarHBondContact O-N 2.97Å; T2369-T2442 PolarHBondContact OG1-OG1 3.27Å; T2369-R2445 PolarHBondContact O-NH2 3.1Å; T2369-R2445 PolarHBondContact OG1-NH2 3.35Å; T2369-L2593 HydrophobicContact CG2-CD1 3.79Å; T2369-L2593 HydrophobicContact CG2-CD2 3.91Å |
| 2370 | S | 78.7 | Confident | 81.6 | Confident | 72 Ų | 72 | 54.5 Ų | 54.5 | 50% | 0.503 | 28% | 0.276 | S | S | . | . | H | α-helix | trans | -74.9 | -26.9 | 177.2 | 65.9 | 0 | 0 | 0 | 0 | 113.2 | I2366 T2367 N2372 | I2366-S2370 PolarHBondContact O-N 2.98Å; I2366-S2370 PolarHBondContact O-OG 3Å; T2367-S2370 WeakPolarHBondContact CA-OG 3.41Å; T2367-S2370 PolarHBondContact O-N 3.22Å; T2367-S2370 VanDerWaalsContact O-N 3.08Å; T2367-S2370 PolarHBondContact O-OG 3.24Å; S2370-N2372 VanDerWaalsContact C-N 3.26Å; S2370-N2372 PolarHBondContact O-N 3.16Å |
| 2371 | S | 73.4 | Confident | 81.5 | Confident | 69 Ų | 69 | 56.9 Ų | 56.9 | 48% | 0.483 | 29% | 0.285 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -80.3 | 6.5 | 176.5 | -58 | 0 | 0 | 0 | 0 | 113.8 | T2367 L2368 T2369 V2373 | T2367-S2371 VanDerWaalsContact O-CB 3.32Å; T2367-S2371 WeakPolarHBondContact O-CB 3.32Å; T2367-S2371 PolarHBondContact O-N 3.11Å; T2367-S2371 PolarHBondContact O-OG 3.13Å; L2368-S2371 PolarHBondContact O-N 2.82Å; T2369-S2371 VanDerWaalsContact C-N 3.32Å; S2371-V2373 PolarHBondContact O-N 3.2Å |
| 2372 | N | 73.5 | Confident | 81.2 | Confident | 83 Ų | 83 | 57.7 Ų | 57.7 | 44% | 0.444 | 29% | 0.288 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 53.4 | 20.5 | 179.3 | -67 | -23 | 0 | 0 | 0 | 116 | T2369 S2370 F2374 E2375 | T2369-N2372 PolarHBondContact O-N 2.97Å; S2370-N2372 VanDerWaalsContact C-N 3.26Å; S2370-N2372 PolarHBondContact O-N 3.16Å; N2372-F2374 PolarHBondContact O-N 3.04Å; N2372-E2375 HydrophobicContact CB-CG 4.19Å; N2372-E2375 PolarHBondContact O-N 3.18Å; N2372-E2375 VanDerWaalsContact O-N 3.15Å |
| 2373 | V | 74.4 | Confident | 81 | Confident | 60.6667 Ų | 60.6667 | 57 Ų | 57 | 37% | 0.368 | 29% | 0.285 | S | S | . | . | G | 310 helix | trans | -60.9 | -29.3 | -178.6 | -170.4 | 0 | 0 | 0 | 0 | 111.8 | L2368 S2371 E2375 I2382 | L2368-V2373 HydrophobicContact CD2-CG2 4.11Å; S2371-V2373 PolarHBondContact O-N 3.2Å; V2373-E2375 VanDerWaalsContact C-N 3.33Å; V2373-E2375 PolarHBondContact O-N 2.99Å; V2373-I2382 HydrophobicContact CG1-CD1 3.83Å |
| 2374 | F | 76.2 | Confident | 81.2 | Confident | 3.33333 Ų | 3.33333 | 54 Ų | 54 | 2% | 0.015 | 27% | 0.272 | C | S | . | . | G | 310 helix | trans | -81.2 | 0.3 | -176.8 | -61.4 | -48.2 | 0 | 0 | 0 | 115.2 | L2368 N2372 Y2376 F2379 I2382 M2383 T2442 | L2368-F2374 HydrophobicContact CB-CD2 4.49Å; L2368-F2374 HydrophobicContact CB-CE2 3.52Å; L2368-F2374 VanDerWaalsContact CB-CE2 3.48Å; L2368-F2374 HydrophobicContact CB-CZ 3.54Å; L2368-F2374 HydrophobicContact CD1-CZ 4.05Å; L2368-F2374 HydrophobicContact CG-CZ 4.39Å; N2372-F2374 PolarHBondContact O-N 3.04Å; F2374-Y2376 VanDerWaalsContact C-N 3.33Å; F2374-Y2376 PolarHBondContact O-N 3.42Å; F2374-F2379 HydrophobicContact CD1-CD2 4.33Å; F2374-F2379 HydrophobicContact CE1-CB 4.44Å; F2374-F2379 AromaticContact CE1-CD2 3.55Å; F2374-F2379 HydrophobicContact CE1-CD2 3.55Å; F2374-F2379 HydrophobicContact CE1-CE2 4.31Å; F2374-F2379 HydrophobicContact CE1-CG 4.46Å; F2374-F2379 HydrophobicContact CE2-CD2 4.39Å; F2374-F2379 AromaticContact CZ-CD2 3.58Å; F2374-F2379 HydrophobicContact CZ-CD2 3.58Å; F2374-F2379 AromaticContact CZ-CE2 3.96Å; F2374-F2379 HydrophobicContact CZ-CE2 3.96Å; F2374-I2382 HydrophobicContact CD1-CD1 3.44Å; F2374-I2382 VanDerWaalsContact CD1-CD1 3.44Å; F2374-I2382 HydrophobicContact CE1-CD1 3.6Å; F2374-M2383 HydrophobicContact CE1-CE 4.26Å; F2374-M2383 HydrophobicContact CZ-CE 4.2Å; F2374-T2442 HydrophobicContact CD2-CG2 3.6Å; F2374-T2442 HydrophobicContact CE2-CG2 3.76Å; F2374-T2442 HydrophobicContact CG-CG2 4.12Å; F2374-T2442 HydrophobicContact CZ-CG2 4.42Å |
| 2375 | E | 72.2 | Confident | 81.1 | Confident | 108.667 Ų | 108.667 | 57.6 Ų | 57.6 | 51% | 0.508 | 29% | 0.291 | S | S | . | . | G | 310 helix | trans | -70.7 | -28.6 | 177.7 | -102.7 | -178 | 176.6 | 0 | 0 | 113.1 | N2372 V2373 | N2372-E2375 HydrophobicContact CB-CG 4.19Å; N2372-E2375 PolarHBondContact O-N 3.18Å; N2372-E2375 VanDerWaalsContact O-N 3.15Å; V2373-E2375 VanDerWaalsContact C-N 3.33Å; V2373-E2375 PolarHBondContact O-N 2.99Å |
| 2376 | Y | 71.9 | Confident | 80.7 | Confident | 197.333 Ų | 197.333 | 58.5 Ų | 58.5 | 77% | 0.774 | 30% | 0.299 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -116.7 | -13.3 | -171.1 | -55.3 | -78.9 | 0 | 0 | 0 | 114.6 | F2374 | F2374-Y2376 VanDerWaalsContact C-N 3.33Å; F2374-Y2376 PolarHBondContact O-N 3.42Å |
| 2377 | R | 78.4 | Confident | 80.6 | Confident | 135.667 Ų | 135.667 | 56.1 Ų | 56.1 | 51% | 0.512 | 29% | 0.286 | S | S | . | . | S | Bend | trans | -139.9 | 146.9 | -179 | -65.4 | -172.1 | -176.3 | -166.3 | 7 | 110.4 | I2382 D2385 | R2377-I2382 HydrophobicContact CB-CD1 3.84Å; R2377-I2382 HydrophobicContact CB-CG1 3.81Å; R2377-D2385 IonicContact CZ-OD2 3.48Å; R2377-D2385 IonicContact NH1-OD2 3.61Å; R2377-D2385 PolarHBondContact NH1-OD2 2.87Å; R2377-D2385 VanDerWaalsContact NH1-OD2 3.09Å |
| 2378 | S | 84.4 | Confident | 80.6 | Confident | 53 Ų | 53 | 58.5 Ų | 58.5 | 37% | 0.371 | 30% | 0.302 | S | S | . | . | trans | -65.9 | 150.4 | 174.9 | 62.4 | 0 | 0 | 0 | 0 | 111.4 | E2380 K2381 I2382 | S2378-E2380 VanDerWaalsContact C-N 3.31Å; S2378-E2380 PolarHBondContact O-N 3.24Å; S2378-K2381 PolarHBondContact O-N 3.19Å; S2378-K2381 VanDerWaalsContact O-N 3.16Å; S2378-K2381 VanDerWaalsContact OG-CB 3.28Å; S2378-K2381 WeakPolarHBondContact OG-CB 3.34Å; S2378-K2381 PolarHBondContact OG-N 3.09Å; S2378-I2382 PolarHBondContact O-N 3.09Å | ||
| 2379 | F | 86.7 | Confident | 80.3 | Confident | 2.33333 Ų | 2.33333 | 62.4 Ų | 62.4 | 1% | 0.01 | 33% | 0.328 | C | S | . | . | H | α-helix | trans | -54.5 | -47.5 | 177.4 | 178.9 | -109.6 | 0 | 0 | 0 | 112 | F2339 I2365 F2374 K2381 I2382 M2383 F2409 L2413 L2439 T2442 V2443 | F2339-F2379 HydrophobicContact CD2-CZ 4.48Å; F2339-F2379 AromaticContact CE2-CZ 3.91Å; F2339-F2379 HydrophobicContact CE2-CZ 4Å; F2339-F2379 HydrophobicContact CZ-CZ 4.49Å; I2365-F2379 HydrophobicContact CD1-CE2 3.35Å; I2365-F2379 HydrophobicContact CD1-CZ 4.11Å; I2365-F2379 VanDerWaalsContact CD1-CZ 3.49Å; I2365-F2379 HydrophobicContact CG1-CE2 4.26Å; I2365-F2379 HydrophobicContact CG1-CZ 4.31Å; F2374-F2379 HydrophobicContact CD1-CD2 4.33Å; F2374-F2379 HydrophobicContact CE1-CB 4.44Å; F2374-F2379 AromaticContact CE1-CD2 3.55Å; F2374-F2379 HydrophobicContact CE1-CD2 3.55Å; F2374-F2379 HydrophobicContact CE1-CE2 4.31Å; F2374-F2379 HydrophobicContact CE1-CG 4.46Å; F2374-F2379 HydrophobicContact CE2-CD2 4.39Å; F2374-F2379 AromaticContact CZ-CD2 3.58Å; F2374-F2379 HydrophobicContact CZ-CD2 3.58Å; F2374-F2379 AromaticContact CZ-CE2 3.96Å; F2374-F2379 HydrophobicContact CZ-CE2 3.96Å; F2379-K2381 PolarHBondContact O-N 2.95Å; F2379-I2382 PolarHBondContact O-N 3.27Å; F2379-M2383 HydrophobicContact CD2-CE 4.22Å; F2379-M2383 HydrophobicContact CE2-CE 3.58Å; F2379-M2383 HydrophobicContact CE2-CG 4.33Å; F2379-M2383 HydrophobicContact CZ-CE 4.17Å; F2379-M2383 HydrophobicContact CZ-CG 4.31Å; F2379-M2383 WeakPolarHBondContact O-CG 3.25Å; F2379-M2383 PolarHBondContact O-N 3.02Å; F2379-F2409 AromaticContact CD1-CE1 3.61Å; F2379-F2409 HydrophobicContact CD1-CE1 3.61Å; F2379-F2409 HydrophobicContact CD1-CZ 4.24Å; F2379-F2409 AromaticContact CE1-CE1 3.56Å; F2379-F2409 HydrophobicContact CE1-CE1 3.56Å; F2379-F2409 AromaticContact CE1-CZ 3.91Å; F2379-F2409 HydrophobicContact CE1-CZ 3.91Å; F2379-L2413 HydrophobicContact CE1-CD2 3.76Å; F2379-L2413 HydrophobicContact CZ-CD2 4.28Å; F2379-L2439 HydrophobicContact CD1-CD2 4.38Å; F2379-L2439 HydrophobicContact CE1-CD2 3.61Å; F2379-L2439 HydrophobicContact CE2-CD2 4.21Å; F2379-L2439 HydrophobicContact CZ-CD2 3.48Å; F2379-L2439 VanDerWaalsContact CZ-CD2 3.48Å; F2379-T2442 HydrophobicContact CD2-CG2 4.27Å; F2379-V2443 HydrophobicContact CB-CG2 4.37Å; F2379-V2443 HydrophobicContact CD1-CG2 4.39Å |
| 2380 | E | 89.1 | Confident | 80.1 | Confident | 69.6667 Ų | 69.6667 | 63.3 Ų | 63.3 | 33% | 0.326 | 33% | 0.332 | S | S | . | . | H | α-helix | trans | -54.6 | -50.3 | 174.9 | 173.6 | -178.5 | -173 | 0 | 0 | 111.7 | S2378 I2382 M2383 M2384 F2409 | S2378-E2380 VanDerWaalsContact C-N 3.31Å; S2378-E2380 PolarHBondContact O-N 3.24Å; E2380-I2382 VanDerWaalsContact C-N 3.34Å; E2380-I2382 PolarHBondContact O-N 3.19Å; E2380-M2383 PolarHBondContact O-N 3.06Å; E2380-M2383 VanDerWaalsContact O-N 3.14Å; E2380-M2384 HydrophobicContact CG-CG 4.02Å; E2380-M2384 VanDerWaalsContact O-CB 3.3Å; E2380-M2384 WeakPolarHBondContact O-CB 3.03Å; E2380-M2384 VanDerWaalsContact O-CG 3.27Å; E2380-M2384 WeakPolarHBondContact O-CG 3.31Å; E2380-M2384 PolarHBondContact O-N 2.92Å; E2380-F2409 HydrophobicContact CB-CB 4.31Å; E2380-F2409 HydrophobicContact CB-CD1 3.81Å; E2380-F2409 HydrophobicContact CB-CE1 4.34Å; E2380-F2409 HydrophobicContact CB-CG 4.01Å; E2380-F2409 HydrophobicContact CG-CB 3.67Å; E2380-F2409 HydrophobicContact CG-CD1 4.06Å; E2380-F2409 HydrophobicContact CG-CD2 4.21Å; E2380-F2409 HydrophobicContact CG-CG 3.71Å |
| 2381 | K | 86.3 | Confident | 80.3 | Confident | 108.667 Ų | 108.667 | 62.1 Ų | 62.1 | 47% | 0.472 | 32% | 0.318 | S | S | . | . | H | α-helix | trans | -61.9 | -42.3 | -174.4 | -175.7 | 169.4 | -175.6 | 170.4 | 0 | 112 | S2378 F2379 M2383 M2384 D2385 | S2378-K2381 PolarHBondContact O-N 3.19Å; S2378-K2381 VanDerWaalsContact O-N 3.16Å; S2378-K2381 VanDerWaalsContact OG-CB 3.28Å; S2378-K2381 WeakPolarHBondContact OG-CB 3.34Å; S2378-K2381 PolarHBondContact OG-N 3.09Å; F2379-K2381 PolarHBondContact O-N 2.95Å; K2381-M2383 VanDerWaalsContact C-N 3.34Å; K2381-M2383 PolarHBondContact O-N 2.92Å; K2381-M2384 PolarHBondContact O-N 2.92Å; K2381-D2385 VanDerWaalsContact O-CB 3.25Å; K2381-D2385 WeakPolarHBondContact O-CB 3.39Å; K2381-D2385 PolarHBondContact O-N 3.1Å |
| 2382 | I | 84.1 | Confident | 80.7 | Confident | 16 Ų | 16 | 68.9 Ų | 68.9 | 8% | 0.082 | 33% | 0.334 | C | S | . | . | H | α-helix | trans | -63 | -41.6 | 179.4 | -69.9 | 157.3 | 0 | 0 | 0 | 111.6 | P2336 V2373 F2374 R2377 S2378 F2379 E2380 | P2336-I2382 HydrophobicContact CG-CG2 4.25Å; V2373-I2382 HydrophobicContact CG1-CD1 3.83Å; F2374-I2382 HydrophobicContact CD1-CD1 3.44Å; F2374-I2382 VanDerWaalsContact CD1-CD1 3.44Å; F2374-I2382 HydrophobicContact CE1-CD1 3.6Å; R2377-I2382 HydrophobicContact CB-CD1 3.84Å; R2377-I2382 HydrophobicContact CB-CG1 3.81Å; S2378-I2382 PolarHBondContact O-N 3.09Å; F2379-I2382 PolarHBondContact O-N 3.27Å; E2380-I2382 VanDerWaalsContact C-N 3.34Å; E2380-I2382 PolarHBondContact O-N 3.19Å |
| 2383 | M | 87.9 | Confident | 81.1 | Confident | 0 Ų | 0 | 67.1 Ų | 67.1 | 0% | 0 | 32% | 0.323 | C | S | . | . | H | α-helix | trans | -74.3 | -41 | -179.5 | -60.4 | -54.2 | 168.4 | 0 | 0 | 111.6 | P2336 F2339 W2340 L2368 F2374 F2379 E2380 K2381 D2385 A2386 R2387 F2409 | P2336-M2383 HydrophobicContact CB-SD 4.39Å; F2339-M2383 HydrophobicContact CB-CE 4.19Å; F2339-M2383 HydrophobicContact CB-SD 3.7Å; F2339-M2383 HydrophobicContact CD1-CB 4.12Å; F2339-M2383 HydrophobicContact CD1-CG 4.01Å; F2339-M2383 HydrophobicContact CD1-SD 3.74Å; F2339-M2383 HydrophobicContact CD2-CE 3.96Å; F2339-M2383 HydrophobicContact CD2-CG 4.36Å; F2339-M2383 HydrophobicContact CD2-SD 3.96Å; F2339-M2383 HydrophobicContact CE1-CB 4Å; F2339-M2383 HydrophobicContact CE1-CG 4.04Å; F2339-M2383 HydrophobicContact CE1-SD 4.38Å; F2339-M2383 HydrophobicContact CE2-CE 4.47Å; F2339-M2383 HydrophobicContact CE2-CG 4.39Å; F2339-M2383 HydrophobicContact CG-CE 4.08Å; F2339-M2383 HydrophobicContact CG-CG 4.19Å; F2339-M2383 HydrophobicContact CG-SD 3.52Å; F2339-M2383 VanDerWaalsContact CG-SD 3.54Å; F2339-M2383 WeakPolarHBondContact CG-SD 3.45Å; F2339-M2383 HydrophobicContact CZ-CG 4.24Å; W2340-M2383 HydrophobicContact CZ2-CB 4.47Å; W2340-M2383 PolarHBondContact NE1-O 2.96Å; L2368-M2383 HydrophobicContact CD1-CE 3.4Å; L2368-M2383 VanDerWaalsContact CD1-CE 3.45Å; F2374-M2383 HydrophobicContact CE1-CE 4.26Å; F2374-M2383 HydrophobicContact CZ-CE 4.2Å; F2379-M2383 HydrophobicContact CD2-CE 4.22Å; F2379-M2383 HydrophobicContact CE2-CE 3.58Å; F2379-M2383 HydrophobicContact CE2-CG 4.33Å; F2379-M2383 HydrophobicContact CZ-CE 4.17Å; F2379-M2383 HydrophobicContact CZ-CG 4.31Å; F2379-M2383 WeakPolarHBondContact O-CG 3.25Å; F2379-M2383 PolarHBondContact O-N 3.02Å; E2380-M2383 PolarHBondContact O-N 3.06Å; E2380-M2383 VanDerWaalsContact O-N 3.14Å; K2381-M2383 VanDerWaalsContact C-N 3.34Å; K2381-M2383 PolarHBondContact O-N 2.92Å; M2383-D2385 VanDerWaalsContact C-N 3.34Å; M2383-A2386 PolarHBondContact O-N 3.17Å; M2383-R2387 PolarHBondContact O-N 3.18Å; M2383-F2409 HydrophobicContact CB-CE2 3.81Å; M2383-F2409 HydrophobicContact CB-CZ 3.8Å; M2383-F2409 HydrophobicContact CG-CE2 4.49Å; M2383-F2409 HydrophobicContact CG-CZ 4.01Å |
| 2384 | M | 88.3 | Confident | 81.6 | Confident | 39.3333 Ų | 39.3333 | 64.5 Ų | 64.5 | 19% | 0.194 | 31% | 0.306 | C | S | . | . | H | α-helix | trans | -71.6 | -26.8 | 178.1 | -68.3 | -61.1 | -70.1 | 0 | 0 | 112.8 | W2340 E2380 K2381 A2386 R2387 P2388 F2405 K2406 F2409 | W2340-M2384 HydrophobicContact CH2-SD 4.08Å; W2340-M2384 HydrophobicContact CZ2-SD 3.95Å; E2380-M2384 HydrophobicContact CG-CG 4.02Å; E2380-M2384 VanDerWaalsContact O-CB 3.3Å; E2380-M2384 WeakPolarHBondContact O-CB 3.03Å; E2380-M2384 VanDerWaalsContact O-CG 3.27Å; E2380-M2384 WeakPolarHBondContact O-CG 3.31Å; E2380-M2384 PolarHBondContact O-N 2.92Å; K2381-M2384 PolarHBondContact O-N 2.92Å; M2384-A2386 PolarHBondContact O-N 3.12Å; M2384-R2387 PolarHBondContact O-N 3.28Å; M2384-P2388 VanDerWaalsContact O-CD 3.28Å; M2384-P2388 WeakPolarHBondContact O-CD 3.36Å; M2384-F2405 HydrophobicContact SD-CB 4.21Å; M2384-K2406 HydrophobicContact CE-CB 4.4Å; M2384-F2409 HydrophobicContact CG-CD2 3.81Å; M2384-F2409 HydrophobicContact CG-CE2 4.25Å; M2384-F2409 HydrophobicContact SD-CD2 3.83Å; M2384-F2409 HydrophobicContact SD-CE2 4.31Å |
| 2385 | D | 83.8 | Confident | 82 | Confident | 79.6667 Ų | 79.6667 | 69.4 Ų | 69.4 | 43% | 0.426 | 33% | 0.328 | S | S | . | . | H | α-helix | trans | -65.2 | -23.6 | 172.9 | -78.1 | -11.8 | 0 | 0 | 0 | 112 | R2377 K2381 M2383 P2388 | R2377-D2385 IonicContact CZ-OD2 3.48Å; R2377-D2385 IonicContact NH1-OD2 3.61Å; R2377-D2385 PolarHBondContact NH1-OD2 2.87Å; R2377-D2385 VanDerWaalsContact NH1-OD2 3.09Å; K2381-D2385 VanDerWaalsContact O-CB 3.25Å; K2381-D2385 WeakPolarHBondContact O-CB 3.39Å; K2381-D2385 PolarHBondContact O-N 3.1Å; M2383-D2385 VanDerWaalsContact C-N 3.34Å; D2385-P2388 WeakPolarHBondContact O-CD 3.47Å |
| 2386 | A | 79.2 | Confident | 82.6 | Confident | 20.6667 Ų | 20.6667 | 66 Ų | 66 | 17% | 0.171 | 32% | 0.318 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -89.9 | -12 | 179.3 | 0 | 0 | 0 | 0 | 0 | 114.4 | P2336 M2383 M2384 P2388 P2389 | P2336-A2386 HydrophobicContact CB-CB 3.38Å; P2336-A2386 VanDerWaalsContact CB-CB 3.48Å; P2336-A2386 HydrophobicContact CG-CB 4.39Å; M2383-A2386 PolarHBondContact O-N 3.17Å; M2384-A2386 PolarHBondContact O-N 3.12Å; A2386-P2388 VanDerWaalsContact C-CD 3.49Å; A2386-P2389 WeakPolarHBondContact O-CD 3.42Å |
| 2387 | R | 82.9 | Confident | 83.1 | Confident | 2.66667 Ų | 2.66667 | 57.3 Ų | 57.3 | 1% | 0.01 | 29% | 0.285 | C | S | . | . | S | Bend | trans | -77.6 | -31.2 | -178.9 | -164.5 | 175 | 170.7 | 160.1 | -1.1 | 116.3 | W2340 M2383 M2384 P2389 L2390 E2391 F2394 D2398 | W2340-R2387 HydrophobicContact CH2-CG 4.24Å; W2340-R2387 HydrophobicContact CZ2-CB 4.04Å; W2340-R2387 HydrophobicContact CZ2-CG 3.97Å; M2383-R2387 PolarHBondContact O-N 3.18Å; M2384-R2387 PolarHBondContact O-N 3.28Å; R2387-P2389 VanDerWaalsContact C-CD 3.4Å; R2387-P2389 VanDerWaalsContact O-N 3.17Å; R2387-L2390 CarbonylContact O-C 3.5Å; R2387-L2390 PolarHBondContact O-N 3.03Å; R2387-E2391 WeakPolarHBondContact CD-OE2 3.44Å; R2387-E2391 IonicContact CZ-OE2 3.17Å; R2387-E2391 IonicContact NE-OE2 3.47Å; R2387-E2391 PolarHBondContact NE-OE2 3.3Å; R2387-E2391 IonicContact NH2-OE2 3.3Å; R2387-E2391 PolarHBondContact NH2-OE2 2.9Å; R2387-E2391 PolarHBondContact O-N 2.9Å; R2387-E2391 VanDerWaalsContact O-N 3.12Å; R2387-F2394 HydrophobicContact CG-CB 4.27Å; R2387-F2394 HydrophobicContact CG-CD2 3.6Å; R2387-F2394 HydrophobicContact CG-CE2 4.21Å; R2387-F2394 HydrophobicContact CG-CG 4.12Å; R2387-F2394 VanDerWaalsContact CZ-CB 3.46Å; R2387-D2398 IonicContact CZ-OD1 3.79Å; R2387-D2398 IonicContact CZ-OD2 3.33Å; R2387-D2398 VanDerWaalsContact CZ-OD2 3.3Å; R2387-D2398 IonicContact NH1-OD1 2.7Å; R2387-D2398 PolarHBondContact NH1-OD1 3.17Å; R2387-D2398 IonicContact NH1-OD2 3.25Å; R2387-D2398 PolarHBondContact NH1-OD2 2.88Å; R2387-D2398 VanDerWaalsContact NH1-OD2 3.08Å; R2387-D2398 VanDerWaalsContact NH2-CG 3.3Å; R2387-D2398 IonicContact NH2-OD1 3.4Å; R2387-D2398 PolarHBondContact NH2-OD1 3.46Å; R2387-D2398 IonicContact NH2-OD2 2.96Å; R2387-D2398 PolarHBondContact NH2-OD2 3.02Å |
| 2388 | P | 80.6 | Confident | 83.6 | Confident | 83.6667 Ų | 83.6667 | 51.3 Ų | 51.3 | 54% | 0.543 | 26% | 0.263 | S | S | . | . | G | 310 helix | trans | -54.3 | -37 | -171.9 | -27.2 | 35.1 | 0 | 0 | 0 | 116.6 | M2384 D2385 A2386 L2390 E2391 | M2384-P2388 VanDerWaalsContact O-CD 3.28Å; M2384-P2388 WeakPolarHBondContact O-CD 3.36Å; D2385-P2388 WeakPolarHBondContact O-CD 3.47Å; A2386-P2388 VanDerWaalsContact C-CD 3.49Å; P2388-L2390 PolarHBondContact O-N 2.9Å; P2388-L2390 VanDerWaalsContact O-N 3.13Å; P2388-E2391 PolarHBondContact O-N 3.36Å |
| 2389 | P | 74.8 | Confident | 83.7 | Confident | 90.3333 Ų | 90.3333 | 55.3 Ų | 55.3 | 59% | 0.587 | 28% | 0.276 | S | S | * | . | G | 310 helix | trans | -60.4 | -20.4 | 177.9 | -24 | 34.7 | 0 | 0 | 0 | 114.2 | A2386 R2387 N2772 | A2386-P2389 WeakPolarHBondContact O-CD 3.42Å; R2387-P2389 VanDerWaalsContact C-CD 3.4Å; R2387-P2389 VanDerWaalsContact O-N 3.17Å; P2389-N2772 WeakPolarHBondContact CB-ND2 3.23Å; P2389-N2772 PolarHBondContact O-ND2 3.19Å |
| 2390 | L | 75.9 | Confident | 83.6 | Confident | 33.6667 Ų | 33.6667 | 61.6 Ų | 61.6 | 18% | 0.176 | 31% | 0.305 | C | S | . | . | G | 310 helix | trans | -129.9 | 20.9 | -173.2 | -63.4 | 166.2 | 0 | 0 | 0 | 111.6 | R2387 P2388 W2392 E2393 F2394 R2768 I2769 N2772 | R2387-L2390 CarbonylContact O-C 3.5Å; R2387-L2390 PolarHBondContact O-N 3.03Å; P2388-L2390 PolarHBondContact O-N 2.9Å; P2388-L2390 VanDerWaalsContact O-N 3.13Å; L2390-W2392 PolarHBondContact O-N 2.97Å; L2390-E2393 VanDerWaalsContact C-OE2 3.23Å; L2390-E2393 VanDerWaalsContact CA-OE2 3.28Å; L2390-E2393 WeakPolarHBondContact CA-OE2 3.43Å; L2390-E2393 PolarHBondContact O-N 2.93Å; L2390-E2393 VanDerWaalsContact O-OE2 3.1Å; L2390-F2394 HydrophobicContact CB-CD2 3.64Å; L2390-F2394 HydrophobicContact CB-CE2 3.59Å; L2390-F2394 HydrophobicContact CD1-CE2 4.01Å; L2390-F2394 HydrophobicContact CD1-CZ 4.47Å; L2390-F2394 HydrophobicContact CG-CE2 4.42Å; L2390-F2394 WeakPolarHBondContact O-CB 3.33Å; L2390-F2394 VanDerWaalsContact O-CD2 3.23Å; L2390-F2394 WeakPolarHBondContact O-CD2 3.24Å; L2390-F2394 PolarHBondContact O-N 3.14Å; L2390-R2768 HydrophobicContact CD2-CB 3.36Å; L2390-I2769 HydrophobicContact CD1-CB 4.12Å; L2390-I2769 HydrophobicContact CD1-CG1 3.51Å; L2390-N2772 VanDerWaalsContact CD2-ND2 3.29Å; L2390-N2772 WeakPolarHBondContact CD2-ND2 3.17Å; L2390-N2772 WeakPolarHBondContact CG-ND2 3.22Å |
| 2391 | E | 82.3 | Confident | 83.4 | Confident | 46.3333 Ų | 46.3333 | 60 Ų | 60 | 22% | 0.217 | 30% | 0.299 | C | S | . | . | H | α-helix | trans | -63.1 | -27.7 | -172.8 | 176.7 | 68 | 175 | 0 | 0 | 112.1 | R2387 P2388 K2395 K2406 | R2387-E2391 WeakPolarHBondContact CD-OE2 3.44Å; R2387-E2391 IonicContact CZ-OE2 3.17Å; R2387-E2391 IonicContact NE-OE2 3.47Å; R2387-E2391 PolarHBondContact NE-OE2 3.3Å; R2387-E2391 IonicContact NH2-OE2 3.3Å; R2387-E2391 PolarHBondContact NH2-OE2 2.9Å; R2387-E2391 PolarHBondContact O-N 2.9Å; R2387-E2391 VanDerWaalsContact O-N 3.12Å; P2388-E2391 PolarHBondContact O-N 3.36Å; E2391-K2395 WeakPolarHBondContact O-CB 3.34Å; E2391-K2395 PolarHBondContact O-N 3.23Å; E2391-K2406 WeakPolarHBondContact OE1-CD 3.31Å; E2391-K2406 IonicContact OE1-NZ 3.31Å; E2391-K2406 PolarHBondContact OE1-NZ 2.76Å |
| 2392 | W | 82.3 | Confident | 83.5 | Confident | 211.667 Ų | 211.667 | 55.2 Ų | 55.2 | 80% | 0.802 | 28% | 0.28 | S | S | * | . | H | α-helix | trans | -68.4 | -46.5 | 177.6 | -107.8 | 91.3 | 0 | 0 | 0 | 111.7 | L2390 K2395 A2396 | L2390-W2392 PolarHBondContact O-N 2.97Å; W2392-K2395 PolarHBondContact O-N 2.98Å; W2392-A2396 PolarHBondContact O-N 3.09Å; W2392-A2396 VanDerWaalsContact O-N 3.08Å |
| 2393 | E | 81.3 | Confident | 83.9 | Confident | 46.6667 Ų | 46.6667 | 54.4 Ų | 54.4 | 22% | 0.218 | 28% | 0.276 | C | S | . | . | H | α-helix | trans | -67 | -49.7 | 179.1 | -61.9 | 75.2 | -169.4 | 0 | 0 | 110.2 | L2390 K2395 A2396 M2397 C2765 R2768 | L2390-E2393 VanDerWaalsContact C-OE2 3.23Å; L2390-E2393 VanDerWaalsContact CA-OE2 3.28Å; L2390-E2393 WeakPolarHBondContact CA-OE2 3.43Å; L2390-E2393 PolarHBondContact O-N 2.93Å; L2390-E2393 VanDerWaalsContact O-OE2 3.1Å; E2393-K2395 VanDerWaalsContact C-N 3.29Å; E2393-K2395 PolarHBondContact O-N 3.14Å; E2393-A2396 WeakPolarHBondContact O-CB 3.08Å; E2393-A2396 PolarHBondContact O-N 3.07Å; E2393-A2396 VanDerWaalsContact O-N 3.09Å; E2393-M2397 VanDerWaalsContact O-CG 3.28Å; E2393-M2397 WeakPolarHBondContact O-CG 3.32Å; E2393-M2397 PolarHBondContact O-N 3.26Å; E2393-C2765 HydrophobicContact CB-CB 3.89Å; E2393-R2768 WeakPolarHBondContact OE1-CD 3.25Å; E2393-R2768 IonicContact OE1-CZ 2.67Å; E2393-R2768 IonicContact OE1-NE 3.48Å; E2393-R2768 IonicContact OE1-NH1 3.19Å; E2393-R2768 PolarHBondContact OE1-NH1 2.96Å |
| 2394 | F | 84.9 | Confident | 84.1 | Confident | 4.66667 Ų | 4.66667 | 55.2 Ų | 55.2 | 2% | 0.02 | 28% | 0.281 | C | S | . | . | H | α-helix | trans | -63.2 | -34.3 | 177.1 | -77.4 | -59.4 | 0 | 0 | 0 | 112.7 | W2340 I2344 R2387 L2390 A2396 M2397 D2398 I2769 | W2340-F2394 HydrophobicContact CB-CE1 4.06Å; W2340-F2394 HydrophobicContact CB-CE2 4.46Å; W2340-F2394 HydrophobicContact CB-CZ 3.7Å; W2340-F2394 HydrophobicContact CD2-CE1 4.16Å; W2340-F2394 HydrophobicContact CD2-CE2 4.47Å; W2340-F2394 HydrophobicContact CD2-CZ 4.13Å; W2340-F2394 HydrophobicContact CE3-CD1 4.28Å; W2340-F2394 AromaticContact CE3-CE1 3.88Å; W2340-F2394 HydrophobicContact CE3-CE1 3.95Å; W2340-F2394 HydrophobicContact CE3-CZ 4.25Å; W2340-F2394 HydrophobicContact CG-CE1 4.26Å; W2340-F2394 HydrophobicContact CG-CE2 4.36Å; W2340-F2394 AromaticContact CG-CZ 3.82Å; W2340-F2394 HydrophobicContact CG-CZ 3.91Å; I2344-F2394 HydrophobicContact CD1-CE1 4.07Å; I2344-F2394 HydrophobicContact CD1-CZ 4.14Å; I2344-F2394 HydrophobicContact CG1-CE1 4.1Å; R2387-F2394 HydrophobicContact CG-CB 4.27Å; R2387-F2394 HydrophobicContact CG-CD2 3.6Å; R2387-F2394 HydrophobicContact CG-CE2 4.21Å; R2387-F2394 HydrophobicContact CG-CG 4.12Å; R2387-F2394 VanDerWaalsContact CZ-CB 3.46Å; L2390-F2394 HydrophobicContact CB-CD2 3.64Å; L2390-F2394 HydrophobicContact CB-CE2 3.59Å; L2390-F2394 HydrophobicContact CD1-CE2 4.01Å; L2390-F2394 HydrophobicContact CD1-CZ 4.47Å; L2390-F2394 HydrophobicContact CG-CE2 4.42Å; L2390-F2394 WeakPolarHBondContact O-CB 3.33Å; L2390-F2394 VanDerWaalsContact O-CD2 3.23Å; L2390-F2394 WeakPolarHBondContact O-CD2 3.24Å; L2390-F2394 PolarHBondContact O-N 3.14Å; F2394-A2396 VanDerWaalsContact C-N 3.34Å; F2394-M2397 HydrophobicContact CD1-CE 3.96Å; F2394-M2397 HydrophobicContact CD1-SD 4.19Å; F2394-M2397 HydrophobicContact CE1-CE 4.14Å; F2394-M2397 HydrophobicContact CE1-SD 4.44Å; F2394-M2397 PolarHBondContact O-N 2.77Å; F2394-D2398 WeakPolarHBondContact O-CB 3.4Å; F2394-D2398 VanDerWaalsContact O-CG 3.29Å; F2394-D2398 PolarHBondContact O-N 3.3Å; F2394-I2769 HydrophobicContact CE1-CD1 4.28Å; F2394-I2769 HydrophobicContact CE2-CG1 4.5Å; F2394-I2769 HydrophobicContact CZ-CD1 3.72Å; F2394-I2769 HydrophobicContact CZ-CG1 4.13Å |
| 2395 | K | 85.2 | Confident | 84.2 | Confident | 107 Ų | 107 | 53.4 Ų | 53.4 | 47% | 0.465 | 27% | 0.272 | S | S | . | . | H | α-helix | trans | -66.1 | -39.2 | 174.2 | -177.8 | -178 | 178.6 | -171.8 | 0 | 111.8 | E2391 W2392 E2393 M2397 Q2399 | E2391-K2395 WeakPolarHBondContact O-CB 3.34Å; E2391-K2395 PolarHBondContact O-N 3.23Å; W2392-K2395 PolarHBondContact O-N 2.98Å; E2393-K2395 VanDerWaalsContact C-N 3.29Å; E2393-K2395 PolarHBondContact O-N 3.14Å; K2395-M2397 VanDerWaalsContact C-N 3.35Å; K2395-Q2399 WeakPolarHBondContact O-CB 3.36Å; K2395-Q2399 VanDerWaalsContact O-CG 3.24Å; K2395-Q2399 WeakPolarHBondContact O-CG 3.28Å; K2395-Q2399 PolarHBondContact O-N 3.16Å; K2395-Q2399 VanDerWaalsContact O-N 3.11Å |
| 2396 | A | 84.1 | Confident | 84.4 | Confident | 37 Ų | 37 | 56.2 Ų | 56.2 | 31% | 0.306 | 28% | 0.28 | S | S | . | . | H | α-helix | trans | -64.1 | -43 | 174.7 | 0 | 0 | 0 | 0 | 0 | 111.3 | W2392 E2393 F2394 Q2399 Q2400 E2761 | W2392-A2396 PolarHBondContact O-N 3.09Å; W2392-A2396 VanDerWaalsContact O-N 3.08Å; E2393-A2396 WeakPolarHBondContact O-CB 3.08Å; E2393-A2396 PolarHBondContact O-N 3.07Å; E2393-A2396 VanDerWaalsContact O-N 3.09Å; F2394-A2396 VanDerWaalsContact C-N 3.34Å; A2396-Q2399 PolarHBondContact O-N 3.1Å; A2396-Q2400 WeakPolarHBondContact O-CB 3.4Å; A2396-Q2400 WeakPolarHBondContact O-CG 3.44Å; A2396-Q2400 PolarHBondContact O-N 3.15Å; A2396-E2761 HydrophobicContact CB-CG 4.3Å |
| 2397 | M | 83.4 | Confident | 84.8 | Confident | 15 Ų | 15 | 60.1 Ų | 60.1 | 7% | 0.074 | 30% | 0.295 | C | S | . | . | H | α-helix | trans | -64.1 | -47.3 | 176.2 | -69.3 | 163.1 | 61.7 | 0 | 0 | 112.6 | I2344 Q2347 E2393 F2394 K2395 Q2399 Q2400 I2401 C2765 | I2344-M2397 HydrophobicContact CB-CE 4.47Å; I2344-M2397 HydrophobicContact CD1-CE 4.23Å; I2344-M2397 HydrophobicContact CG1-CE 3.7Å; I2344-M2397 VanDerWaalsContact CG1-CE 3.5Å; I2344-M2397 HydrophobicContact CG2-CE 4.31Å; Q2347-M2397 VanDerWaalsContact OE1-CE 3.24Å; E2393-M2397 VanDerWaalsContact O-CG 3.28Å; E2393-M2397 WeakPolarHBondContact O-CG 3.32Å; E2393-M2397 PolarHBondContact O-N 3.26Å; F2394-M2397 HydrophobicContact CD1-CE 3.96Å; F2394-M2397 HydrophobicContact CD1-SD 4.19Å; F2394-M2397 HydrophobicContact CE1-CE 4.14Å; F2394-M2397 HydrophobicContact CE1-SD 4.44Å; F2394-M2397 PolarHBondContact O-N 2.77Å; K2395-M2397 VanDerWaalsContact C-N 3.35Å; M2397-Q2399 VanDerWaalsContact C-N 3.25Å; M2397-Q2399 PolarHBondContact O-N 3.2Å; M2397-Q2400 PolarHBondContact O-N 3.06Å; M2397-Q2400 VanDerWaalsContact O-N 3.15Å; M2397-I2401 PolarHBondContact O-N 3.11Å; M2397-C2765 HydrophobicContact SD-CB 3.51Å; M2397-C2765 VanDerWaalsContact SD-CB 3.51Å; M2397-C2765 PolarHBondContact SD-SG 3.04Å |
| 2398 | D | 88.2 | Confident | 85.2 | Confident | 8.33333 Ų | 8.33333 | 62 Ų | 62 | 5% | 0.045 | 30% | 0.304 | C | S | . | . | H | α-helix | trans | -56.7 | -38.9 | 176.1 | -79.2 | 11.5 | 0 | 0 | 0 | 111.1 | R2387 F2394 G2402 I2403 S2404 F2405 | R2387-D2398 IonicContact CZ-OD1 3.79Å; R2387-D2398 IonicContact CZ-OD2 3.33Å; R2387-D2398 VanDerWaalsContact CZ-OD2 3.3Å; R2387-D2398 IonicContact NH1-OD1 2.7Å; R2387-D2398 PolarHBondContact NH1-OD1 3.17Å; R2387-D2398 IonicContact NH1-OD2 3.25Å; R2387-D2398 PolarHBondContact NH1-OD2 2.88Å; R2387-D2398 VanDerWaalsContact NH1-OD2 3.08Å; R2387-D2398 VanDerWaalsContact NH2-CG 3.3Å; R2387-D2398 IonicContact NH2-OD1 3.4Å; R2387-D2398 PolarHBondContact NH2-OD1 3.46Å; R2387-D2398 IonicContact NH2-OD2 2.96Å; R2387-D2398 PolarHBondContact NH2-OD2 3.02Å; F2394-D2398 WeakPolarHBondContact O-CB 3.4Å; F2394-D2398 VanDerWaalsContact O-CG 3.29Å; F2394-D2398 PolarHBondContact O-N 3.3Å; D2398-G2402 CarbonylContact O-C 3.6Å; D2398-G2402 VanDerWaalsContact O-CA 3.29Å; D2398-G2402 WeakPolarHBondContact O-CA 3.44Å; D2398-G2402 PolarHBondContact O-N 2.85Å; D2398-I2403 WeakPolarHBondContact CA-O 3.36Å; D2398-I2403 WeakPolarHBondContact CB-O 3.36Å; D2398-I2403 VanDerWaalsContact CG-O 3.31Å; D2398-I2403 PolarHBondContact O-N 3.04Å; D2398-I2403 VanDerWaalsContact O-N 3.13Å; D2398-S2404 WeakPolarHBondContact OD2-CA 3.24Å; D2398-F2405 PolarHBondContact OD2-N 3.17Å |
| 2399 | Q | 87.1 | Confident | 85.8 | Confident | 139 Ų | 139 | 58.1 Ų | 58.1 | 65% | 0.65 | 28% | 0.278 | S | S | * | . | H | α-helix | trans | -71.1 | -39.8 | 176.9 | -75.4 | 178.3 | -6.5 | 0 | 0 | 113 | K2395 A2396 M2397 G2402 | K2395-Q2399 WeakPolarHBondContact O-CB 3.36Å; K2395-Q2399 VanDerWaalsContact O-CG 3.24Å; K2395-Q2399 WeakPolarHBondContact O-CG 3.28Å; K2395-Q2399 PolarHBondContact O-N 3.16Å; K2395-Q2399 VanDerWaalsContact O-N 3.11Å; A2396-Q2399 PolarHBondContact O-N 3.1Å; M2397-Q2399 VanDerWaalsContact C-N 3.25Å; M2397-Q2399 PolarHBondContact O-N 3.2Å; Q2399-G2402 PolarHBondContact O-N 3.32Å |
| 2400 | Q | 84 | Confident | 86.8 | Confident | 133.667 Ų | 133.667 | 54.4 Ų | 54.4 | 63% | 0.625 | 25% | 0.253 | S | S | * | . | H | α-helix | trans | -65.4 | -42 | 178.5 | -147.3 | -176.2 | -12.8 | 0 | 0 | 111.7 | A2396 M2397 S2759 | A2396-Q2400 WeakPolarHBondContact O-CB 3.4Å; A2396-Q2400 WeakPolarHBondContact O-CG 3.44Å; A2396-Q2400 PolarHBondContact O-N 3.15Å; M2397-Q2400 PolarHBondContact O-N 3.06Å; M2397-Q2400 VanDerWaalsContact O-N 3.15Å; Q2400-S2759 PolarHBondContact OE1-OG 3.02Å |
| 2401 | I | 86 | Confident | 87.6 | Confident | 37 Ų | 37 | 52.9 Ų | 52.9 | 19% | 0.19 | 25% | 0.245 | C | C | . | . | H | α-helix | trans | -81.7 | -31.1 | 179.5 | -64.6 | 162.8 | 0 | 0 | 0 | 110.9 | Q2347 M2397 I2403 Y2416 G2740 F2744 | Q2347-I2401 HydrophobicContact CB-CD1 4.06Å; Q2347-I2401 HydrophobicContact CG-CD1 3.42Å; Q2347-I2401 VanDerWaalsContact CG-CD1 3.46Å; Q2347-I2401 VanDerWaalsContact NE2-CD1 3.32Å; M2397-I2401 PolarHBondContact O-N 3.11Å; I2401-I2403 HydrophobicContact CG2-CB 4.25Å; I2401-I2403 HydrophobicContact CG2-CD1 3.76Å; I2401-I2403 HydrophobicContact CG2-CG1 3.98Å; I2401-Y2416 HydrophobicContact CD1-CE1 4.19Å; I2401-Y2416 WeakPolarHBondContact CD1-OH 3.31Å; I2401-Y2416 HydrophobicContact CG2-CE1 4.31Å; I2401-G2740 WeakPolarHBondContact O-CA 3.48Å; I2401-F2744 HydrophobicContact CG2-CD2 4.13Å |
| 2402 | G | 88.3 | Confident | 88.2 | Confident | 7 Ų | 7 | 50.7 Ų | 50.7 | 7% | 0.072 | 24% | 0.235 | C | C | . | . | T | Hydrogen-bonded Turn | trans | 79.2 | 35.4 | -175.6 | 0 | 0 | 0 | 0 | 0 | 112.9 | D2398 Q2399 G2737 F2738 S2739 G2740 | D2398-G2402 CarbonylContact O-C 3.6Å; D2398-G2402 VanDerWaalsContact O-CA 3.29Å; D2398-G2402 WeakPolarHBondContact O-CA 3.44Å; D2398-G2402 PolarHBondContact O-N 2.85Å; Q2399-G2402 PolarHBondContact O-N 3.32Å; G2402-G2737 CarbonylContact C-O 3.5Å; G2402-G2737 VanDerWaalsContact C-O 3.27Å; G2402-G2737 VanDerWaalsContact O-O 3.12Å; G2402-F2738 CarbonylContact O-C 3.32Å; G2402-F2738 WeakPolarHBondContact O-CA 3.31Å; G2402-S2739 PolarHBondContact O-N 3.46Å; G2402-S2739 VanDerWaalsContact O-N 3.15Å; G2402-G2740 PolarHBondContact O-N 3Å |
| 2403 | I | 91 | Very high | 88.8 | Confident | 0 Ų | 0 | 40.6 Ų | 40.6 | 0% | 0 | 20% | 0.197 | C | C | . | . | trans | -133.4 | 115.5 | 175.1 | -63.5 | 171 | 0 | 0 | 0 | 107.8 | D2398 I2401 A2412 Y2416 G2737 F2738 F2744 | D2398-I2403 WeakPolarHBondContact CA-O 3.36Å; D2398-I2403 WeakPolarHBondContact CB-O 3.36Å; D2398-I2403 VanDerWaalsContact CG-O 3.31Å; D2398-I2403 PolarHBondContact O-N 3.04Å; D2398-I2403 VanDerWaalsContact O-N 3.13Å; I2401-I2403 HydrophobicContact CG2-CB 4.25Å; I2401-I2403 HydrophobicContact CG2-CD1 3.76Å; I2401-I2403 HydrophobicContact CG2-CG1 3.98Å; I2403-A2412 HydrophobicContact CG2-CB 3.6Å; I2403-Y2416 HydrophobicContact CB-CE2 4.31Å; I2403-Y2416 HydrophobicContact CD1-CE1 4.36Å; I2403-Y2416 HydrophobicContact CD1-CE2 4.43Å; I2403-Y2416 HydrophobicContact CG2-CD2 4.49Å; I2403-Y2416 HydrophobicContact CG2-CE2 3.81Å; I2403-G2737 CarbonylContact C-O 3.52Å; I2403-G2737 WeakPolarHBondContact CA-O 3.38Å; I2403-G2737 PolarHBondContact N-O 3.08Å; I2403-F2738 HydrophobicContact CG2-CD1 4.23Å; I2403-F2738 HydrophobicContact CG2-CE1 3.96Å; I2403-F2744 HydrophobicContact CD1-CB 3.89Å; I2403-F2744 HydrophobicContact CD1-CG 4.2Å | ||
| 2404 | S | 91.7 | Very high | 89.4 | Confident | 16.5 Ų | 16.5 | 38.4 Ų | 38.4 | 12% | 0.115 | 19% | 0.186 | C | C | . | . | trans | -106.6 | 111.6 | -174.8 | -173 | 0 | 0 | 0 | 0 | 112.9 | D2398 K2406 H2407 H2408 G2737 F2738 | D2398-S2404 WeakPolarHBondContact OD2-CA 3.24Å; S2404-K2406 PolarHBondContact O-N 3.43Å; S2404-K2406 PolarHBondContact OG-N 2.74Å; S2404-H2407 WeakPolarHBondContact CB-ND1 3.45Å; S2404-H2407 PolarHBondContact O-N 3.08Å; S2404-H2407 PolarHBondContact OG-CD2 3.37Å; S2404-H2407 PolarHBondContact OG-N 3.2Å; S2404-H2407 PolarHBondContact OG-ND1 3.39Å; S2404-H2408 PolarHBondContact O-N 2.89Å; S2404-G2737 PolarHBondContact N-O 3.03Å; S2404-F2738 VanDerWaalsContact O-CZ 3.31Å; S2404-F2738 WeakPolarHBondContact O-CZ 3.42Å | ||
| 2405 | F | 90.9 | Very high | 89.8 | Confident | 0.5 Ų | 0.5 | 38.1 Ų | 38.1 | 0% | 0.002 | 19% | 0.185 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -65.4 | -24.9 | 173.1 | -74.3 | -87 | 0 | 0 | 0 | 112.9 | W2340 I2343 M2384 D2398 F2409 A2412 L2413 Y2416 | W2340-F2405 HydrophobicContact CH2-CB 4.12Å; W2340-F2405 AromaticContact CH2-CD1 3.94Å; W2340-F2405 HydrophobicContact CH2-CD1 4Å; W2340-F2405 HydrophobicContact CH2-CD2 4.05Å; W2340-F2405 HydrophobicContact CH2-CE1 4.4Å; W2340-F2405 HydrophobicContact CH2-CE2 4.42Å; W2340-F2405 AromaticContact CH2-CG 3.8Å; W2340-F2405 HydrophobicContact CH2-CG 3.8Å; W2340-F2405 HydrophobicContact CZ3-CD1 4.23Å; W2340-F2405 AromaticContact CZ3-CD2 3.74Å; W2340-F2405 HydrophobicContact CZ3-CD2 3.74Å; W2340-F2405 HydrophobicContact CZ3-CE1 4.26Å; W2340-F2405 AromaticContact CZ3-CE2 3.75Å; W2340-F2405 HydrophobicContact CZ3-CE2 3.75Å; W2340-F2405 AromaticContact CZ3-CG 3.92Å; W2340-F2405 HydrophobicContact CZ3-CG 3.97Å; W2340-F2405 AromaticContact CZ3-CZ 3.97Å; W2340-F2405 HydrophobicContact CZ3-CZ 4.03Å; I2343-F2405 HydrophobicContact CD1-CZ 4.29Å; I2343-F2405 HydrophobicContact CG1-CZ 4.24Å; I2343-F2405 HydrophobicContact CG2-CE2 3.94Å; I2343-F2405 HydrophobicContact CG2-CZ 3.85Å; M2384-F2405 HydrophobicContact SD-CB 4.21Å; D2398-F2405 PolarHBondContact OD2-N 3.17Å; F2405-F2409 HydrophobicContact CB-CD2 4.4Å; F2405-F2409 AromaticContact CD1-CD2 3.74Å; F2405-F2409 HydrophobicContact CD1-CD2 3.74Å; F2405-F2409 AromaticContact CD1-CE2 3.97Å; F2405-F2409 HydrophobicContact CD1-CE2 3.97Å; F2405-F2409 HydrophobicContact CD1-CG 4.45Å; F2405-F2409 HydrophobicContact CE1-CE2 4.45Å; F2405-F2409 WeakPolarHBondContact O-CA 3.35Å; F2405-F2409 PolarHBondContact O-N 2.94Å; F2405-A2412 HydrophobicContact CB-CB 4.3Å; F2405-A2412 HydrophobicContact CD1-CB 3.5Å; F2405-A2412 VanDerWaalsContact CD1-CB 3.47Å; F2405-A2412 HydrophobicContact CD2-CB 4.18Å; F2405-A2412 HydrophobicContact CE1-CB 3.78Å; F2405-A2412 HydrophobicContact CE2-CB 4.44Å; F2405-A2412 HydrophobicContact CG-CB 3.72Å; F2405-A2412 HydrophobicContact CZ-CB 4.26Å; F2405-L2413 HydrophobicContact CE1-CB 4.25Å; F2405-Y2416 HydrophobicContact CD2-CE2 4.39Å; F2405-Y2416 HydrophobicContact CE1-CD2 4.45Å; F2405-Y2416 AromaticContact CE2-CD2 3.98Å; F2405-Y2416 HydrophobicContact CE2-CD2 3.98Å; F2405-Y2416 AromaticContact CE2-CE2 3.33Å; F2405-Y2416 HydrophobicContact CE2-CE2 3.33Å; F2405-Y2416 AromaticContact CZ-CD2 3.56Å; F2405-Y2416 HydrophobicContact CZ-CD2 3.56Å; F2405-Y2416 AromaticContact CZ-CE2 3.44Å; F2405-Y2416 HydrophobicContact CZ-CE2 3.44Å; F2405-Y2416 VanDerWaalsContact CZ-CE2 3.48Å |
| 2406 | K | 88.7 | Confident | 90.2 | Very high | 138.5 Ų | 138.5 | 33 Ų | 33 | 60% | 0.602 | 16% | 0.163 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -74.6 | -26.3 | 179.2 | -169.1 | 172.7 | -169.3 | 161.9 | 0 | 113.6 | M2384 E2391 S2404 | M2384-K2406 HydrophobicContact CE-CB 4.4Å; E2391-K2406 WeakPolarHBondContact OE1-CD 3.31Å; E2391-K2406 IonicContact OE1-NZ 3.31Å; E2391-K2406 PolarHBondContact OE1-NZ 2.76Å; S2404-K2406 PolarHBondContact O-N 3.43Å; S2404-K2406 PolarHBondContact OG-N 2.74Å |
| 2407 | H | 88 | Confident | 90.8 | Very high | 103.5 Ų | 103.5 | 31.3 Ų | 31.3 | 48% | 0.479 | 15% | 0.149 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -82.6 | -49.3 | 177.1 | -78.5 | 15.8 | 0 | 0 | 0 | 111.8 | S2404 Y2736 F2738 | S2404-H2407 WeakPolarHBondContact CB-ND1 3.45Å; S2404-H2407 PolarHBondContact O-N 3.08Å; S2404-H2407 PolarHBondContact OG-CD2 3.37Å; S2404-H2407 PolarHBondContact OG-N 3.2Å; S2404-H2407 PolarHBondContact OG-ND1 3.39Å; H2407-Y2736 VanDerWaalsContact CB-O 3.29Å; H2407-Y2736 WeakPolarHBondContact CB-O 3.17Å; H2407-F2738 HydrophobicContact CB-CE2 3.89Å |
| 2408 | H | 91.3 | Very high | 91.3 | Very high | 41 Ų | 41 | 30.9 Ų | 30.9 | 19% | 0.19 | 15% | 0.147 | C | C | . | . | trans | -150 | 93.7 | 177.2 | -84 | -70.4 | 0 | 0 | 0 | 110.5 | S2404 H2410 F2411 A2412 S2641 I2642 L2645 F2738 | S2404-H2408 PolarHBondContact O-N 2.89Å; H2408-H2410 VanDerWaalsContact C-N 3.34Å; H2408-H2410 PolarHBondContact O-N 3.39Å; H2408-F2411 HydrophobicContact CB-CB 4.09Å; H2408-F2411 HydrophobicContact CB-CD2 4.13Å; H2408-F2411 PolarHBondContact O-N 3.36Å; H2408-A2412 WeakPolarHBondContact O-CB 3.39Å; H2408-A2412 PolarHBondContact O-N 3Å; H2408-S2641 PolarHBondContact NE2-OG 3.09Å; H2408-I2642 VanDerWaalsContact CE1-CG1 3.44Å; H2408-I2642 WeakPolarHBondContact CE1-CG1 3.32Å; H2408-L2645 HydrophobicContact CB-CD1 3.84Å; H2408-L2645 VanDerWaalsContact CD2-CD1 3.42Å; H2408-L2645 WeakPolarHBondContact CD2-CD1 3.39Å; H2408-F2738 HydrophobicContact CB-CE2 3.9Å; H2408-F2738 HydrophobicContact CB-CZ 3.81Å; H2408-F2738 WeakPolarHBondContact O-CZ 3.34Å | ||
| 2409 | F | 93.4 | Very high | 91.5 | Very high | 2.5 Ų | 2.5 | 30.5 Ų | 30.5 | 1% | 0.011 | 15% | 0.145 | C | C | . | . | H | α-helix | trans | -55.1 | -46.3 | -174.3 | 176.8 | -89.5 | 0 | 0 | 0 | 113.2 | F2339 W2340 F2379 E2380 M2383 M2384 F2405 A2412 L2413 | F2339-F2409 HydrophobicContact CE1-CE2 4.29Å; F2339-F2409 HydrophobicContact CE1-CZ 4.24Å; F2339-F2409 HydrophobicContact CZ-CE2 4.24Å; F2339-F2409 AromaticContact CZ-CZ 3.8Å; F2339-F2409 HydrophobicContact CZ-CZ 3.8Å; W2340-F2409 HydrophobicContact CH2-CE2 4.43Å; W2340-F2409 HydrophobicContact CZ2-CE2 4.47Å; F2379-F2409 AromaticContact CD1-CE1 3.61Å; F2379-F2409 HydrophobicContact CD1-CE1 3.61Å; F2379-F2409 HydrophobicContact CD1-CZ 4.24Å; F2379-F2409 AromaticContact CE1-CE1 3.56Å; F2379-F2409 HydrophobicContact CE1-CE1 3.56Å; F2379-F2409 AromaticContact CE1-CZ 3.91Å; F2379-F2409 HydrophobicContact CE1-CZ 3.91Å; E2380-F2409 HydrophobicContact CB-CB 4.31Å; E2380-F2409 HydrophobicContact CB-CD1 3.81Å; E2380-F2409 HydrophobicContact CB-CE1 4.34Å; E2380-F2409 HydrophobicContact CB-CG 4.01Å; E2380-F2409 HydrophobicContact CG-CB 3.67Å; E2380-F2409 HydrophobicContact CG-CD1 4.06Å; E2380-F2409 HydrophobicContact CG-CD2 4.21Å; E2380-F2409 HydrophobicContact CG-CG 3.71Å; M2383-F2409 HydrophobicContact CB-CE2 3.81Å; M2383-F2409 HydrophobicContact CB-CZ 3.8Å; M2383-F2409 HydrophobicContact CG-CE2 4.49Å; M2383-F2409 HydrophobicContact CG-CZ 4.01Å; M2384-F2409 HydrophobicContact CG-CD2 3.81Å; M2384-F2409 HydrophobicContact CG-CE2 4.25Å; M2384-F2409 HydrophobicContact SD-CD2 3.83Å; M2384-F2409 HydrophobicContact SD-CE2 4.31Å; F2405-F2409 HydrophobicContact CB-CD2 4.4Å; F2405-F2409 AromaticContact CD1-CD2 3.74Å; F2405-F2409 HydrophobicContact CD1-CD2 3.74Å; F2405-F2409 AromaticContact CD1-CE2 3.97Å; F2405-F2409 HydrophobicContact CD1-CE2 3.97Å; F2405-F2409 HydrophobicContact CD1-CG 4.45Å; F2405-F2409 HydrophobicContact CE1-CE2 4.45Å; F2405-F2409 WeakPolarHBondContact O-CA 3.35Å; F2405-F2409 PolarHBondContact O-N 2.94Å; F2409-A2412 PolarHBondContact O-N 3.11Å; F2409-L2413 HydrophobicContact CE1-CD2 4.41Å; F2409-L2413 PolarHBondContact O-N 3.17Å |
| 2410 | H | 94.3 | Very high | 91.7 | Very high | 13 Ų | 13 | 23.9 Ų | 23.9 | 6% | 0.06 | 11% | 0.114 | C | C | . | . | H | α-helix | trans | -67.4 | -41.6 | -176.6 | -64.6 | -63.6 | 0 | 0 | 0 | 112.6 | H2408 L2413 V2414 D2457 Y2461 | H2408-H2410 VanDerWaalsContact C-N 3.34Å; H2408-H2410 PolarHBondContact O-N 3.39Å; H2410-L2413 PolarHBondContact O-N 2.79Å; H2410-V2414 WeakPolarHBondContact O-CG2 3.39Å; H2410-V2414 PolarHBondContact O-N 3.22Å; H2410-V2414 VanDerWaalsContact O-N 3.08Å; H2410-D2457 IonicContact CD2-OD1 2.76Å; H2410-D2457 IonicContact NE2-OD1 3.64Å; H2410-Y2461 HydrophobicContact CB-CE2 3.86Å; H2410-Y2461 AromaticContact CG-CE2 3.88Å; H2410-Y2461 AromaticContact ND1-CE2 3.48Å; H2410-Y2461 WeakPolarHBondContact ND1-CE2 3.39Å; H2410-Y2461 AromaticContact ND1-CZ 3.59Å; H2410-Y2461 PolarHBondContact ND1-OH 2.99Å |
| 2411 | F | 94.4 | Very high | 92.1 | Very high | 1.5 Ų | 1.5 | 18.9 Ų | 18.9 | 1% | 0.007 | 9% | 0.089 | C | C | . | . | H | α-helix | trans | -65.9 | -38.8 | 173.8 | -81 | -84.9 | 0 | 0 | 0 | 112.1 | H2408 V2414 S2415 V2459 A2460 I2642 L2645 L2649 F2738 | H2408-F2411 HydrophobicContact CB-CB 4.09Å; H2408-F2411 HydrophobicContact CB-CD2 4.13Å; H2408-F2411 PolarHBondContact O-N 3.36Å; F2411-V2414 PolarHBondContact O-N 3.01Å; F2411-S2415 WeakPolarHBondContact O-CB 3.34Å; F2411-S2415 PolarHBondContact O-N 3.22Å; F2411-S2415 PolarHBondContact O-OG 3.04Å; F2411-V2459 HydrophobicContact CE2-CG1 4.02Å; F2411-V2459 HydrophobicContact CZ-CG1 3.85Å; F2411-A2460 HydrophobicContact CD1-CB 3.81Å; F2411-A2460 HydrophobicContact CD2-CB 4.11Å; F2411-A2460 HydrophobicContact CE1-CB 3.88Å; F2411-A2460 HydrophobicContact CE2-CB 4.17Å; F2411-A2460 HydrophobicContact CG-CB 3.93Å; F2411-A2460 HydrophobicContact CZ-CB 4.07Å; F2411-I2642 HydrophobicContact CE2-CG2 4.17Å; F2411-I2642 HydrophobicContact CZ-CG2 4.33Å; F2411-L2645 HydrophobicContact CB-CD1 4.14Å; F2411-L2645 HydrophobicContact CD1-CB 3.68Å; F2411-L2645 HydrophobicContact CD2-CB 4.26Å; F2411-L2645 HydrophobicContact CD2-CD1 4.01Å; F2411-L2645 HydrophobicContact CE1-CB 3.67Å; F2411-L2645 HydrophobicContact CE2-CB 4.25Å; F2411-L2645 HydrophobicContact CG-CB 3.98Å; F2411-L2645 HydrophobicContact CG-CD1 3.97Å; F2411-L2645 HydrophobicContact CZ-CB 3.96Å; F2411-L2649 HydrophobicContact CD1-CD2 4.17Å; F2411-L2649 HydrophobicContact CE1-CD2 4.02Å; F2411-F2738 HydrophobicContact CB-CE1 4.05Å; F2411-F2738 HydrophobicContact CB-CZ 4.18Å |
| 2412 | A | 93.7 | Very high | 92.3 | Very high | 0 Ų | 0 | 20 Ų | 20 | 0% | 0 | 9% | 0.091 | C | C | . | . | H | α-helix | trans | -60.8 | -50 | 176.2 | 0 | 0 | 0 | 0 | 0 | 111.2 | I2403 F2405 H2408 F2409 V2414 S2415 Y2416 F2738 | I2403-A2412 HydrophobicContact CG2-CB 3.6Å; F2405-A2412 HydrophobicContact CB-CB 4.3Å; F2405-A2412 HydrophobicContact CD1-CB 3.5Å; F2405-A2412 VanDerWaalsContact CD1-CB 3.47Å; F2405-A2412 HydrophobicContact CD2-CB 4.18Å; F2405-A2412 HydrophobicContact CE1-CB 3.78Å; F2405-A2412 HydrophobicContact CE2-CB 4.44Å; F2405-A2412 HydrophobicContact CG-CB 3.72Å; F2405-A2412 HydrophobicContact CZ-CB 4.26Å; H2408-A2412 WeakPolarHBondContact O-CB 3.39Å; H2408-A2412 PolarHBondContact O-N 3Å; F2409-A2412 PolarHBondContact O-N 3.11Å; A2412-V2414 PolarHBondContact O-N 2.92Å; A2412-S2415 WeakPolarHBondContact O-CB 3.34Å; A2412-S2415 PolarHBondContact O-N 2.89Å; A2412-S2415 VanDerWaalsContact O-N 3.16Å; A2412-Y2416 WeakPolarHBondContact O-CD2 3.41Å; A2412-Y2416 PolarHBondContact O-N 3.2Å; A2412-F2738 HydrophobicContact CB-CE1 3.99Å; A2412-F2738 HydrophobicContact CB-CZ 4.16Å |
| 2413 | L | 94.6 | Very high | 92.4 | Very high | 0 Ų | 0 | 20.7 Ų | 20.7 | 0% | 0 | 9% | 0.093 | C | C | . | . | H | α-helix | trans | -59 | -47 | 177.7 | -177.2 | 56.9 | 0 | 0 | 0 | 112.1 | F2339 I2343 L2361 F2379 F2405 F2409 H2410 S2415 Y2416 L2417 L2439 | F2339-L2413 HydrophobicContact CE2-CD1 4.11Å; F2339-L2413 HydrophobicContact CE2-CD2 4.26Å; F2339-L2413 HydrophobicContact CZ-CD1 4.06Å; F2339-L2413 HydrophobicContact CZ-CD2 4.39Å; I2343-L2413 HydrophobicContact CD1-CD1 3.72Å; L2361-L2413 HydrophobicContact CD2-CD1 4.33Å; F2379-L2413 HydrophobicContact CE1-CD2 3.76Å; F2379-L2413 HydrophobicContact CZ-CD2 4.28Å; F2405-L2413 HydrophobicContact CE1-CB 4.25Å; F2409-L2413 HydrophobicContact CE1-CD2 4.41Å; F2409-L2413 PolarHBondContact O-N 3.17Å; H2410-L2413 PolarHBondContact O-N 2.79Å; L2413-S2415 VanDerWaalsContact C-N 3.29Å; L2413-S2415 PolarHBondContact O-N 3.1Å; L2413-Y2416 PolarHBondContact O-N 3.33Å; L2413-L2417 HydrophobicContact CD1-CD1 4.41Å; L2413-L2417 HydrophobicContact CG-CD1 4.25Å; L2413-L2417 WeakPolarHBondContact O-CG 3.31Å; L2413-L2417 PolarHBondContact O-N 3.28Å; L2413-L2417 VanDerWaalsContact O-N 3.16Å; L2413-L2439 HydrophobicContact CD2-CD1 3.8Å; L2413-L2439 HydrophobicContact CD2-CD2 3.8Å; L2413-L2439 HydrophobicContact CD2-CG 4.46Å; L2413-L2439 HydrophobicContact CG-CD1 4.29Å |
| 2414 | V | 95.2 | Very high | 92.2 | Very high | 0 Ų | 0 | 25.4 Ų | 25.4 | 0% | 0 | 12% | 0.123 | C | C | . | . | H | α-helix | trans | -60.7 | -39.1 | 177.3 | 169.5 | 0 | 0 | 0 | 0 | 111.7 | H2410 F2411 A2412 Y2416 L2417 L2418 L2436 A2460 Y2461 A2464 L2649 | H2410-V2414 WeakPolarHBondContact O-CG2 3.39Å; H2410-V2414 PolarHBondContact O-N 3.22Å; H2410-V2414 VanDerWaalsContact O-N 3.08Å; F2411-V2414 PolarHBondContact O-N 3.01Å; A2412-V2414 PolarHBondContact O-N 2.92Å; V2414-Y2416 VanDerWaalsContact C-N 3.29Å; V2414-Y2416 PolarHBondContact O-N 3.2Å; V2414-L2417 PolarHBondContact O-N 3.03Å; V2414-L2418 HydrophobicContact CG1-CD2 4.37Å; V2414-L2418 HydrophobicContact CG1-CG 4.3Å; V2414-L2418 WeakPolarHBondContact O-CG 3.42Å; V2414-L2418 PolarHBondContact O-N 3.18Å; V2414-L2436 HydrophobicContact CG2-CD2 4.06Å; V2414-A2460 HydrophobicContact CB-CB 4.33Å; V2414-A2460 HydrophobicContact CG2-CB 3.89Å; V2414-Y2461 HydrophobicContact CG2-CD1 3.48Å; V2414-Y2461 VanDerWaalsContact CG2-CD1 3.44Å; V2414-Y2461 HydrophobicContact CG2-CE1 3.55Å; V2414-Y2461 HydrophobicContact CG2-CG 4.14Å; V2414-A2464 HydrophobicContact CG1-CB 3.61Å; V2414-L2649 HydrophobicContact CG1-CD1 3.98Å; V2414-L2649 HydrophobicContact CG1-CD2 4.02Å |
| 2415 | S | 93.5 | Very high | 91.9 | Very high | 0 Ų | 0 | 26.6 Ų | 26.6 | 0% | 0 | 13% | 0.131 | C | C | . | . | H | α-helix | trans | -58.8 | -40.6 | 177.9 | -56.5 | 0 | 0 | 0 | 0 | 112.1 | F2411 A2412 L2413 L2741 | F2411-S2415 WeakPolarHBondContact O-CB 3.34Å; F2411-S2415 PolarHBondContact O-N 3.22Å; F2411-S2415 PolarHBondContact O-OG 3.04Å; A2412-S2415 WeakPolarHBondContact O-CB 3.34Å; A2412-S2415 PolarHBondContact O-N 2.89Å; A2412-S2415 VanDerWaalsContact O-N 3.16Å; L2413-S2415 VanDerWaalsContact C-N 3.29Å; L2413-S2415 PolarHBondContact O-N 3.1Å; S2415-L2741 WeakPolarHBondContact OG-CD1 3.47Å; S2415-L2741 WeakPolarHBondContact OG-CG 3.13Å |
| 2416 | Y | 93.6 | Very high | 91.7 | Very high | 0 Ų | 0 | 35.4 Ų | 35.4 | 0% | 0 | 17% | 0.172 | C | C | . | . | H | α-helix | trans | -67.8 | -35.2 | 174.8 | -74.2 | -70.8 | 0 | 0 | 0 | 112.9 | I2343 Q2347 Y2354 I2401 I2403 F2405 A2412 L2413 V2414 F2744 | I2343-Y2416 HydrophobicContact CG2-CD2 4.35Å; I2343-Y2416 HydrophobicContact CG2-CE2 4.28Å; I2343-Y2416 HydrophobicContact CG2-CG 4.49Å; Q2347-Y2416 HydrophobicContact CG-CD1 4.29Å; Q2347-Y2416 HydrophobicContact CG-CE1 3.61Å; Q2347-Y2416 PolarHBondContact NE2-OH 3.23Å; Q2347-Y2416 VanDerWaalsContact NE2-OH 3.11Å; Y2354-Y2416 PolarHBondContact OH-O 3.08Å; I2401-Y2416 HydrophobicContact CD1-CE1 4.19Å; I2401-Y2416 WeakPolarHBondContact CD1-OH 3.31Å; I2401-Y2416 HydrophobicContact CG2-CE1 4.31Å; I2403-Y2416 HydrophobicContact CB-CE2 4.31Å; I2403-Y2416 HydrophobicContact CD1-CE1 4.36Å; I2403-Y2416 HydrophobicContact CD1-CE2 4.43Å; I2403-Y2416 HydrophobicContact CG2-CD2 4.49Å; I2403-Y2416 HydrophobicContact CG2-CE2 3.81Å; F2405-Y2416 HydrophobicContact CD2-CE2 4.39Å; F2405-Y2416 HydrophobicContact CE1-CD2 4.45Å; F2405-Y2416 AromaticContact CE2-CD2 3.98Å; F2405-Y2416 HydrophobicContact CE2-CD2 3.98Å; F2405-Y2416 AromaticContact CE2-CE2 3.33Å; F2405-Y2416 HydrophobicContact CE2-CE2 3.33Å; F2405-Y2416 AromaticContact CZ-CD2 3.56Å; F2405-Y2416 HydrophobicContact CZ-CD2 3.56Å; F2405-Y2416 AromaticContact CZ-CE2 3.44Å; F2405-Y2416 HydrophobicContact CZ-CE2 3.44Å; F2405-Y2416 VanDerWaalsContact CZ-CE2 3.48Å; A2412-Y2416 WeakPolarHBondContact O-CD2 3.41Å; A2412-Y2416 PolarHBondContact O-N 3.2Å; L2413-Y2416 PolarHBondContact O-N 3.33Å; V2414-Y2416 VanDerWaalsContact C-N 3.29Å; V2414-Y2416 PolarHBondContact O-N 3.2Å; Y2416-F2744 HydrophobicContact CD1-CD1 4.08Å; Y2416-F2744 AromaticContact CD1-CE1 3.6Å; Y2416-F2744 HydrophobicContact CD1-CE1 3.6Å; Y2416-F2744 HydrophobicContact CD1-CE2 4.06Å; Y2416-F2744 AromaticContact CD1-CZ 3.59Å; Y2416-F2744 HydrophobicContact CD1-CZ 3.59Å; Y2416-F2744 HydrophobicContact CE1-CD2 4.33Å; Y2416-F2744 HydrophobicContact CE1-CE1 4.33Å; Y2416-F2744 HydrophobicContact CE1-CE2 4.06Å; Y2416-F2744 HydrophobicContact CE1-CZ 4.07Å; Y2416-F2744 HydrophobicContact CG-CE1 4.4Å |
| 2417 | L | 95.4 | Very high | 91.6 | Very high | 0 Ų | 0 | 31.3 Ų | 31.3 | 0% | 0 | 16% | 0.161 | C | C | . | . | H | α-helix | trans | -76.9 | -28.6 | -178.4 | -65 | 177.3 | 0 | 0 | 0 | 113.5 | L2346 Y2354 L2358 L2361 L2413 V2414 K2419 G2420 T2432 L2435 L2436 L2439 | L2346-L2417 HydrophobicContact CD1-CD2 4.38Å; Y2354-L2417 PolarHBondContact OH-O 3.24Å; L2358-L2417 HydrophobicContact CD2-CD2 3.39Å; L2358-L2417 VanDerWaalsContact CD2-CD2 3.4Å; L2361-L2417 HydrophobicContact CD2-CD2 3.9Å; L2413-L2417 HydrophobicContact CD1-CD1 4.41Å; L2413-L2417 HydrophobicContact CG-CD1 4.25Å; L2413-L2417 WeakPolarHBondContact O-CG 3.31Å; L2413-L2417 PolarHBondContact O-N 3.28Å; L2413-L2417 VanDerWaalsContact O-N 3.16Å; V2414-L2417 PolarHBondContact O-N 3.03Å; L2417-K2419 PolarHBondContact O-N 3.34Å; L2417-K2419 VanDerWaalsContact O-N 3.16Å; L2417-G2420 PolarHBondContact O-N 3.31Å; L2417-G2420 VanDerWaalsContact O-N 3.07Å; L2417-T2432 HydrophobicContact CB-CG2 4.36Å; L2417-T2432 VanDerWaalsContact O-CG2 3.24Å; L2417-T2432 WeakPolarHBondContact O-CG2 3.37Å; L2417-L2435 HydrophobicContact CD1-CD2 4.42Å; L2417-L2435 HydrophobicContact CD1-CG 4.45Å; L2417-L2435 HydrophobicContact CD2-CD2 3.66Å; L2417-L2435 HydrophobicContact CD2-CG 4.46Å; L2417-L2436 HydrophobicContact CB-CD2 4.18Å; L2417-L2436 HydrophobicContact CD1-CD2 3.62Å; L2417-L2436 HydrophobicContact CD1-CG 4.17Å; L2417-L2439 HydrophobicContact CD1-CD1 3.52Å |
| 2418 | L | 93.6 | Very high | 91.8 | Very high | 6 Ų | 6 | 26.4 Ų | 26.4 | 3% | 0.031 | 14% | 0.139 | C | C | . | . | H | α-helix | trans | -56.8 | -33.7 | -177.7 | -79.2 | -164.6 | 0 | 0 | 0 | 113.7 | V2414 G2420 Y2421 A2464 L2649 T2652 L2653 A2745 | V2414-L2418 HydrophobicContact CG1-CD2 4.37Å; V2414-L2418 HydrophobicContact CG1-CG 4.3Å; V2414-L2418 WeakPolarHBondContact O-CG 3.42Å; V2414-L2418 PolarHBondContact O-N 3.18Å; L2418-G2420 PolarHBondContact O-N 3.1Å; L2418-G2420 VanDerWaalsContact O-N 3.14Å; L2418-Y2421 HydrophobicContact CD2-CD2 4.19Å; L2418-Y2421 HydrophobicContact CD2-CE2 4.22Å; L2418-Y2421 PolarHBondContact O-N 3.23Å; L2418-Y2421 VanDerWaalsContact O-N 3.12Å; L2418-A2464 HydrophobicContact CD2-CB 3.93Å; L2418-L2649 HydrophobicContact CD1-CD1 3.55Å; L2418-L2649 HydrophobicContact CG-CD1 4.28Å; L2418-T2652 HydrophobicContact CD1-CG2 4.37Å; L2418-L2653 HydrophobicContact CD1-CD2 3.96Å; L2418-L2653 HydrophobicContact CD1-CG 4.2Å; L2418-L2653 HydrophobicContact CD2-CD2 3.72Å; L2418-L2653 HydrophobicContact CG-CD2 4.47Å; L2418-A2745 HydrophobicContact CB-CB 3.82Å; L2418-A2745 HydrophobicContact CD1-CB 4.19Å |
| 2419 | K | 92.8 | Very high | 91.7 | Very high | 1.5 Ų | 1.5 | 26 Ų | 26 | 1% | 0.007 | 14% | 0.142 | C | C | . | . | G | 310 helix | trans | -60.4 | -25.2 | 178.9 | -153 | -177.8 | -168.9 | 114 | 0 | 112.2 | E2349 Y2354 L2417 Y2421 R2422 F2744 G2746 F2748 | E2349-K2419 IonicContact OE1-NZ 3.65Å; E2349-K2419 PolarHBondContact OE1-NZ 3.03Å; E2349-K2419 IonicContact OE2-NZ 2.99Å; E2349-K2419 PolarHBondContact OE2-NZ 3.2Å; Y2354-K2419 HydrophobicContact CE2-CB 4Å; Y2354-K2419 HydrophobicContact CE2-CD 4.34Å; L2417-K2419 PolarHBondContact O-N 3.34Å; L2417-K2419 VanDerWaalsContact O-N 3.16Å; K2419-Y2421 VanDerWaalsContact C-N 3.27Å; K2419-Y2421 PolarHBondContact O-N 3.25Å; K2419-R2422 WeakPolarHBondContact O-CA 3.46Å; K2419-R2422 WeakPolarHBondContact O-CB 3.3Å; K2419-R2422 PolarHBondContact O-N 3.25Å; K2419-F2744 HydrophobicContact CB-CE1 4.13Å; K2419-F2744 HydrophobicContact CD-CE1 4.04Å; K2419-F2744 HydrophobicContact CD-CZ 4.2Å; K2419-F2744 WeakPolarHBondContact CD-O 3.41Å; K2419-F2744 WeakPolarHBondContact CG-O 3.43Å; K2419-F2744 PolarHBondContact NZ-O 3.44Å; K2419-G2746 WeakPolarHBondContact CG-O 3.34Å; K2419-F2748 HydrophobicContact CD-CE1 4.1Å; K2419-F2748 HydrophobicContact CD-CE2 4.36Å; K2419-F2748 HydrophobicContact CD-CZ 3.97Å; K2419-F2748 HydrophobicContact CG-CE2 3.98Å; K2419-F2748 HydrophobicContact CG-CZ 3.99Å; K2419-F2748 WeakPolarHBondContact O-CE2 2.97Å |
| 2420 | G | 91.8 | Very high | 91.7 | Very high | 0 Ų | 0 | 29.4 Ų | 29.4 | 0% | 0 | 17% | 0.165 | C | C | . | . | G | 310 helix | trans | -62.9 | -26.1 | 176.2 | 0 | 0 | 0 | 0 | 0 | 114.6 | Y2354 L2417 L2418 R2422 H2423 T2432 | Y2354-G2420 PolarHBondContact OH-N 3.41Å; L2417-G2420 PolarHBondContact O-N 3.31Å; L2417-G2420 VanDerWaalsContact O-N 3.07Å; L2418-G2420 PolarHBondContact O-N 3.1Å; L2418-G2420 VanDerWaalsContact O-N 3.14Å; G2420-R2422 PolarHBondContact O-N 3.27Å; G2420-H2423 WeakPolarHBondContact O-CB 3.28Å; G2420-H2423 PolarHBondContact O-N 3.04Å; G2420-T2432 WeakPolarHBondContact CA-OG1 3.4Å |
| 2421 | Y | 91.7 | Very high | 91.6 | Very high | 28.5 Ų | 28.5 | 31.7 Ų | 31.7 | 11% | 0.112 | 17% | 0.173 | C | C | . | . | G | 310 helix | trans | -72.6 | -5.3 | 170.8 | -67.2 | -61 | 0 | 0 | 0 | 113.8 | L2418 K2419 A2429 T2432 M2433 L2436 A2464 V2468 | L2418-Y2421 HydrophobicContact CD2-CD2 4.19Å; L2418-Y2421 HydrophobicContact CD2-CE2 4.22Å; L2418-Y2421 PolarHBondContact O-N 3.23Å; L2418-Y2421 VanDerWaalsContact O-N 3.12Å; K2419-Y2421 VanDerWaalsContact C-N 3.27Å; K2419-Y2421 PolarHBondContact O-N 3.25Å; Y2421-A2429 HydrophobicContact CD1-CB 4.18Å; Y2421-T2432 HydrophobicContact CD2-CG2 4.29Å; Y2421-T2432 HydrophobicContact CE1-CG2 4.31Å; Y2421-T2432 HydrophobicContact CE2-CG2 4.12Å; Y2421-T2432 HydrophobicContact CG-CG2 4.42Å; Y2421-M2433 HydrophobicContact CE1-CB 4.36Å; Y2421-L2436 HydrophobicContact CE2-CD1 3.83Å; Y2421-L2436 WeakPolarHBondContact OH-CD1 3.41Å; Y2421-A2464 WeakPolarHBondContact CE2-O 3.16Å; Y2421-A2464 PolarHBondContact OH-O 3.1Å; Y2421-V2468 HydrophobicContact CE1-CG1 4.01Å; Y2421-V2468 HydrophobicContact CE1-CG2 4.16Å; Y2421-V2468 WeakPolarHBondContact OH-CG2 3.37Å |
| 2422 | R | 89.6 | Confident | 91.6 | Very high | 61 Ų | 61 | 31.7 Ų | 31.7 | 23% | 0.23 | 17% | 0.173 | C | C | . | . | G | 310 helix | trans | -116.2 | 10.7 | 178.9 | -51.9 | -60.1 | 170.8 | -117.7 | 6 | 112.4 | K2419 G2420 Y2656 F2748 | K2419-R2422 WeakPolarHBondContact O-CA 3.46Å; K2419-R2422 WeakPolarHBondContact O-CB 3.3Å; K2419-R2422 PolarHBondContact O-N 3.25Å; G2420-R2422 PolarHBondContact O-N 3.27Å; R2422-Y2656 PolarHBondContact NE-O 3.36Å; R2422-Y2656 VanDerWaalsContact NE-O 3.12Å; R2422-Y2656 PolarHBondContact NH2-O 3.26Å; R2422-F2748 WeakPolarHBondContact O-CD2 3.46Å |
| 2423 | H | 90.6 | Very high | 91.6 | Very high | 21.5 Ų | 21.5 | 34.8 Ų | 34.8 | 10% | 0.1 | 19% | 0.188 | C | C | . | . | trans | -72.7 | 140.3 | -178.4 | -169 | -89 | 0 | 0 | 0 | 111.8 | P2351 E2355 G2420 S2425 V2428 F2748 | P2351-H2423 WeakPolarHBondContact CA-NE2 3.37Å; P2351-H2423 PolarHBondContact O-NE2 3.09Å; E2355-H2423 IonicContact OE2-CE1 3.56Å; G2420-H2423 WeakPolarHBondContact O-CB 3.28Å; G2420-H2423 PolarHBondContact O-N 3.04Å; H2423-S2425 VanDerWaalsContact C-N 3.28Å; H2423-S2425 VanDerWaalsContact CE1-CB 3.45Å; H2423-S2425 WeakPolarHBondContact CE1-CB 3.32Å; H2423-S2425 VanDerWaalsContact ND1-CB 3.31Å; H2423-S2425 WeakPolarHBondContact ND1-CB 3.38Å; H2423-S2425 PolarHBondContact ND1-N 3.04Å; H2423-S2425 PolarHBondContact O-N 3.44Å; H2423-V2428 HydrophobicContact CB-CB 3.81Å; H2423-V2428 HydrophobicContact CB-CG1 3.68Å; H2423-V2428 HydrophobicContact CB-CG2 4.47Å; H2423-V2428 VanDerWaalsContact ND1-CG2 3.29Å; H2423-V2428 WeakPolarHBondContact ND1-CG2 3.39Å; H2423-F2748 HydrophobicContact CB-CE2 3.96Å; H2423-F2748 HydrophobicContact CB-CZ 4.49Å; H2423-F2748 AromaticContact CD2-CE2 3.95Å; H2423-F2748 AromaticContact CD2-CZ 3.76Å | ||
| 2424 | P | 87.3 | Confident | 91.5 | Very high | 97.5 Ų | 97.5 | 39.9 Ų | 39.9 | 63% | 0.633 | 21% | 0.207 | S | C | * | . | S | Bend | trans | -66.9 | -25.1 | -178.6 | 25.2 | -35.1 | 0 | 0 | 0 | 114.1 | P2351 | P2351-P2424 HydrophobicContact CB-CG 3.93Å; P2351-P2424 HydrophobicContact CG-CG 4.33Å |
| 2425 | S | 85.7 | Confident | 91.4 | Very high | 41.5 Ų | 41.5 | 39.9 Ų | 39.9 | 29% | 0.29 | 21% | 0.207 | S | C | . | . | S | Bend | trans | -83 | 127.2 | 175.3 | -173.4 | 0 | 0 | 0 | 0 | 111.6 | H2423 S2427 V2428 | H2423-S2425 VanDerWaalsContact C-N 3.28Å; H2423-S2425 VanDerWaalsContact CE1-CB 3.45Å; H2423-S2425 WeakPolarHBondContact CE1-CB 3.32Å; H2423-S2425 VanDerWaalsContact ND1-CB 3.31Å; H2423-S2425 WeakPolarHBondContact ND1-CB 3.38Å; H2423-S2425 PolarHBondContact ND1-N 3.04Å; H2423-S2425 PolarHBondContact O-N 3.44Å; S2425-S2427 PolarHBondContact O-N 3.01Å; S2425-S2427 VanDerWaalsContact O-N 3.14Å; S2425-S2427 PolarHBondContact OG-OG 3.29Å; S2425-V2428 PolarHBondContact O-N 3.2Å; S2425-V2428 VanDerWaalsContact O-N 3.14Å |
| 2426 | Q | 86.1 | Confident | 91.5 | Very high | 185 Ų | 185 | 39.9 Ų | 39.9 | 86% | 0.864 | 21% | 0.207 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -66.1 | -14.7 | 179.7 | -63 | -179.3 | -1.1 | 0 | 0 | 113.6 | V2428 P2430 | Q2426-V2428 VanDerWaalsContact C-N 3.34Å; Q2426-P2430 VanDerWaalsContact O-CD 3.23Å; Q2426-P2430 WeakPolarHBondContact O-CD 3.43Å |
| 2427 | S | 86.7 | Confident | 91.5 | Very high | 53.5 Ų | 53.5 | 41 Ų | 41 | 37% | 0.374 | 21% | 0.214 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -72.8 | -27 | 175 | 55.2 | 0 | 0 | 0 | 0 | 113.3 | E2355 S2425 R2431 | E2355-S2427 PolarHBondContact OE1-OG 2.95Å; S2425-S2427 PolarHBondContact O-N 3.01Å; S2425-S2427 VanDerWaalsContact O-N 3.14Å; S2425-S2427 PolarHBondContact OG-OG 3.29Å; S2427-R2431 PolarHBondContact O-N 3.31Å |
| 2428 | V | 91.9 | Very high | 91.4 | Very high | 0 Ų | 0 | 41.9 Ų | 41.9 | 0% | 0 | 22% | 0.219 | C | C | . | . | H | α-helix | trans | -82.7 | -40.2 | -165.1 | 174.8 | 0 | 0 | 0 | 0 | 112.8 | E2355 L2358 H2423 S2425 Q2426 R2431 T2432 | E2355-V2428 HydrophobicContact CB-CG2 3.86Å; E2355-V2428 HydrophobicContact CG-CG2 3.6Å; L2358-V2428 HydrophobicContact CD1-CG1 3.54Å; H2423-V2428 HydrophobicContact CB-CB 3.81Å; H2423-V2428 HydrophobicContact CB-CG1 3.68Å; H2423-V2428 HydrophobicContact CB-CG2 4.47Å; H2423-V2428 VanDerWaalsContact ND1-CG2 3.29Å; H2423-V2428 WeakPolarHBondContact ND1-CG2 3.39Å; S2425-V2428 PolarHBondContact O-N 3.2Å; S2425-V2428 VanDerWaalsContact O-N 3.14Å; Q2426-V2428 VanDerWaalsContact C-N 3.34Å; V2428-R2431 CarbonylContact O-C 3.53Å; V2428-R2431 WeakPolarHBondContact O-CA 3.3Å; V2428-R2431 WeakPolarHBondContact O-CB 3.41Å; V2428-R2431 PolarHBondContact O-N 3.09Å; V2428-T2432 WeakPolarHBondContact O-CB 3.23Å; V2428-T2432 PolarHBondContact O-N 3.07Å; V2428-T2432 PolarHBondContact O-OG1 3.08Å |
| 2429 | A | 91 | Very high | 91.3 | Very high | 32 Ų | 32 | 41.6 Ų | 41.6 | 26% | 0.264 | 22% | 0.218 | S | C | . | . | H | α-helix | trans | -60.1 | -44.2 | 177.5 | 0 | 0 | 0 | 0 | 0 | 113 | Y2421 R2431 T2432 M2433 | Y2421-A2429 HydrophobicContact CD1-CB 4.18Å; A2429-R2431 VanDerWaalsContact C-N 3.34Å; A2429-R2431 PolarHBondContact O-N 2.96Å; A2429-T2432 WeakPolarHBondContact O-CB 3.42Å; A2429-T2432 PolarHBondContact O-N 3.06Å; A2429-M2433 PolarHBondContact O-N 3.18Å |
| 2430 | P | 92 | Very high | 91.3 | Very high | 75.5 Ų | 75.5 | 41.5 Ų | 41.5 | 49% | 0.49 | 22% | 0.217 | S | C | . | . | H | α-helix | trans | -60.5 | -38.8 | 170 | -25.4 | 34.9 | 0 | 0 | 0 | 113.9 | Q2426 M2433 R2434 | Q2426-P2430 VanDerWaalsContact O-CD 3.23Å; Q2426-P2430 WeakPolarHBondContact O-CD 3.43Å; P2430-M2433 PolarHBondContact O-N 3.26Å; P2430-R2434 WeakPolarHBondContact O-CB 3.45Å; P2430-R2434 PolarHBondContact O-N 2.94Å |
| 2431 | R | 92.4 | Very high | 91.2 | Very high | 61.5 Ų | 61.5 | 43.2 Ų | 43.2 | 23% | 0.232 | 23% | 0.229 | C | C | . | . | H | α-helix | trans | -63.5 | -43.1 | 174.8 | -179 | 178.8 | -78.6 | 141.6 | 1.8 | 111.2 | E2355 E2362 S2427 V2428 A2429 M2433 R2434 L2435 | E2355-R2431 IonicContact OE1-NH1 3.81Å; E2355-R2431 PolarHBondContact OE1-NH1 3.38Å; E2362-R2431 WeakPolarHBondContact OE2-CD 3.25Å; E2362-R2431 WeakPolarHBondContact OE2-CG 3.47Å; E2362-R2431 IonicContact OE2-NE 2.93Å; E2362-R2431 PolarHBondContact OE2-NE 2.88Å; S2427-R2431 PolarHBondContact O-N 3.31Å; V2428-R2431 CarbonylContact O-C 3.53Å; V2428-R2431 WeakPolarHBondContact O-CA 3.3Å; V2428-R2431 WeakPolarHBondContact O-CB 3.41Å; V2428-R2431 PolarHBondContact O-N 3.09Å; A2429-R2431 VanDerWaalsContact C-N 3.34Å; A2429-R2431 PolarHBondContact O-N 2.96Å; R2431-M2433 PolarHBondContact O-N 3.44Å; R2431-R2434 PolarHBondContact O-N 2.98Å; R2431-L2435 WeakPolarHBondContact O-CB 3.34Å; R2431-L2435 PolarHBondContact O-N 2.97Å |
| 2432 | T | 94.5 | Very high | 91 | Very high | 0 Ų | 0 | 41.8 Ų | 41.8 | 0% | 0 | 22% | 0.223 | C | C | . | . | H | α-helix | trans | -59.3 | -46.3 | 175.7 | -59 | 0 | 0 | 0 | 0 | 111.3 | L2417 G2420 Y2421 V2428 A2429 R2434 L2435 L2436 | L2417-T2432 HydrophobicContact CB-CG2 4.36Å; L2417-T2432 VanDerWaalsContact O-CG2 3.24Å; L2417-T2432 WeakPolarHBondContact O-CG2 3.37Å; G2420-T2432 WeakPolarHBondContact CA-OG1 3.4Å; Y2421-T2432 HydrophobicContact CD2-CG2 4.29Å; Y2421-T2432 HydrophobicContact CE1-CG2 4.31Å; Y2421-T2432 HydrophobicContact CE2-CG2 4.12Å; Y2421-T2432 HydrophobicContact CG-CG2 4.42Å; V2428-T2432 WeakPolarHBondContact O-CB 3.23Å; V2428-T2432 PolarHBondContact O-N 3.07Å; V2428-T2432 PolarHBondContact O-OG1 3.08Å; A2429-T2432 WeakPolarHBondContact O-CB 3.42Å; A2429-T2432 PolarHBondContact O-N 3.06Å; T2432-R2434 PolarHBondContact O-N 3.44Å; T2432-L2435 PolarHBondContact O-N 3.34Å; T2432-L2436 HydrophobicContact CG2-CD1 4.09Å; T2432-L2436 WeakPolarHBondContact O-CB 3.35Å; T2432-L2436 WeakPolarHBondContact O-CG 3.18Å; T2432-L2436 PolarHBondContact O-N 3.17Å |
| 2433 | M | 93 | Very high | 91 | Very high | 66 Ų | 66 | 39.1 Ų | 39.1 | 33% | 0.325 | 21% | 0.213 | S | C | . | . | H | α-helix | trans | -59.7 | -45.8 | 174.9 | -179.9 | -175.4 | 120.9 | 0 | 0 | 111.9 | Y2421 A2429 P2430 R2431 L2435 L2436 T2437 L2465 V2468 | Y2421-M2433 HydrophobicContact CE1-CB 4.36Å; A2429-M2433 PolarHBondContact O-N 3.18Å; P2430-M2433 PolarHBondContact O-N 3.26Å; R2431-M2433 PolarHBondContact O-N 3.44Å; M2433-L2435 VanDerWaalsContact C-N 3.34Å; M2433-L2435 PolarHBondContact O-N 3.31Å; M2433-L2436 PolarHBondContact O-N 3.17Å; M2433-T2437 VanDerWaalsContact O-CB 3.27Å; M2433-T2437 WeakPolarHBondContact O-CB 3.41Å; M2433-T2437 PolarHBondContact O-N 3.07Å; M2433-T2437 PolarHBondContact O-OG1 3.02Å; M2433-L2465 HydrophobicContact CG-CD2 3.88Å; M2433-V2468 HydrophobicContact CB-CG2 4.4Å; M2433-V2468 HydrophobicContact CG-CG2 3.93Å; M2433-V2468 HydrophobicContact SD-CB 4.21Å; M2433-V2468 HydrophobicContact SD-CG2 3.96Å |
| 2434 | R | 93.1 | Very high | 90.8 | Very high | 106 Ų | 106 | 38.2 Ų | 38.2 | 40% | 0.4 | 21% | 0.21 | S | C | . | . | H | α-helix | trans | -62.9 | -41.4 | 177.8 | -172.1 | 172.9 | 65.3 | -160.4 | 1.4 | 111.8 | E2362 P2430 R2431 T2432 T2437 L2438 Y2594 | E2362-R2434 VanDerWaalsContact CD-NH2 3.29Å; E2362-R2434 IonicContact OE1-CZ 3.42Å; E2362-R2434 VanDerWaalsContact OE1-CZ 3.27Å; E2362-R2434 IonicContact OE1-NE 3.08Å; E2362-R2434 PolarHBondContact OE1-NE 3.38Å; E2362-R2434 IonicContact OE1-NH2 3.17Å; E2362-R2434 PolarHBondContact OE1-NH2 2.91Å; E2362-R2434 IonicContact OE2-CZ 3.05Å; E2362-R2434 IonicContact OE2-NE 3.62Å; E2362-R2434 IonicContact OE2-NH2 2.88Å; E2362-R2434 PolarHBondContact OE2-NH2 3.22Å; P2430-R2434 WeakPolarHBondContact O-CB 3.45Å; P2430-R2434 PolarHBondContact O-N 2.94Å; R2431-R2434 PolarHBondContact O-N 2.98Å; T2432-R2434 PolarHBondContact O-N 3.44Å; R2434-T2437 WeakPolarHBondContact O-CB 3.41Å; R2434-T2437 PolarHBondContact O-N 3.35Å; R2434-L2438 WeakPolarHBondContact O-CB 3.41Å; R2434-L2438 PolarHBondContact O-N 3.07Å; R2434-Y2594 WeakPolarHBondContact CG-OH 3.48Å |
| 2435 | L | 94.1 | Very high | 90.6 | Very high | 0 Ų | 0 | 38.6 Ų | 38.6 | 0% | 0 | 20% | 0.199 | C | C | . | . | H | α-helix | trans | -66 | -45.4 | 177.5 | -179.1 | 54.4 | 0 | 0 | 0 | 112.5 | L2358 L2361 E2362 I2365 L2417 R2431 T2432 M2433 T2437 L2438 L2439 | L2358-L2435 HydrophobicContact CD2-CD2 3.95Å; L2361-L2435 HydrophobicContact CB-CD2 4.43Å; L2361-L2435 HydrophobicContact CD2-CD2 4.02Å; L2361-L2435 HydrophobicContact CG-CD2 4.11Å; E2362-L2435 HydrophobicContact CB-CD1 4.03Å; E2362-L2435 HydrophobicContact CG-CD1 4.46Å; I2365-L2435 HydrophobicContact CD1-CD1 3.74Å; L2417-L2435 HydrophobicContact CD1-CD2 4.42Å; L2417-L2435 HydrophobicContact CD1-CG 4.45Å; L2417-L2435 HydrophobicContact CD2-CD2 3.66Å; L2417-L2435 HydrophobicContact CD2-CG 4.46Å; R2431-L2435 WeakPolarHBondContact O-CB 3.34Å; R2431-L2435 PolarHBondContact O-N 2.97Å; T2432-L2435 PolarHBondContact O-N 3.34Å; M2433-L2435 VanDerWaalsContact C-N 3.34Å; M2433-L2435 PolarHBondContact O-N 3.31Å; L2435-T2437 VanDerWaalsContact C-N 3.27Å; L2435-T2437 PolarHBondContact O-N 2.86Å; L2435-L2438 HydrophobicContact CD1-CD2 4.5Å; L2435-L2438 PolarHBondContact O-N 3.3Å; L2435-L2439 HydrophobicContact CD1-CD1 4.33Å; L2435-L2439 HydrophobicContact CD1-CG 4.46Å; L2435-L2439 HydrophobicContact CG-CD1 4.21Å; L2435-L2439 WeakPolarHBondContact O-CB 3.26Å; L2435-L2439 WeakPolarHBondContact O-CG 3.14Å; L2435-L2439 PolarHBondContact O-N 2.88Å |
| 2436 | L | 94.8 | Very high | 90.5 | Very high | 0 Ų | 0 | 37.7 Ų | 37.7 | 0% | 0 | 19% | 0.192 | C | C | . | . | H | α-helix | trans | -60 | -39.5 | 173.5 | -75.3 | 167.8 | 0 | 0 | 0 | 111.6 | V2414 L2417 Y2421 T2432 M2433 L2439 L2440 Y2461 A2464 L2465 | V2414-L2436 HydrophobicContact CG2-CD2 4.06Å; L2417-L2436 HydrophobicContact CB-CD2 4.18Å; L2417-L2436 HydrophobicContact CD1-CD2 3.62Å; L2417-L2436 HydrophobicContact CD1-CG 4.17Å; Y2421-L2436 HydrophobicContact CE2-CD1 3.83Å; Y2421-L2436 WeakPolarHBondContact OH-CD1 3.41Å; T2432-L2436 HydrophobicContact CG2-CD1 4.09Å; T2432-L2436 WeakPolarHBondContact O-CB 3.35Å; T2432-L2436 WeakPolarHBondContact O-CG 3.18Å; T2432-L2436 PolarHBondContact O-N 3.17Å; M2433-L2436 PolarHBondContact O-N 3.17Å; L2436-L2439 PolarHBondContact O-N 3.3Å; L2436-L2440 WeakPolarHBondContact O-CB 3.39Å; L2436-L2440 PolarHBondContact O-N 3.46Å; L2436-Y2461 HydrophobicContact CD2-CD1 4.04Å; L2436-A2464 HydrophobicContact CD1-CB 3.85Å; L2436-A2464 HydrophobicContact CD2-CB 4.14Å; L2436-L2465 HydrophobicContact CB-CD1 4.36Å; L2436-L2465 HydrophobicContact CB-CD2 3.77Å; L2436-L2465 HydrophobicContact CB-CG 3.99Å; L2436-L2465 HydrophobicContact CD1-CD2 4.43Å |
| 2437 | T | 93.6 | Very high | 90.3 | Very high | 23.5 Ų | 23.5 | 31.1 Ų | 31.1 | 14% | 0.144 | 17% | 0.165 | C | C | . | . | H | α-helix | trans | -66.5 | -41.9 | 176.6 | -59.2 | 0 | 0 | 0 | 0 | 112 | M2433 R2434 L2435 L2440 S2441 | M2433-T2437 VanDerWaalsContact O-CB 3.27Å; M2433-T2437 WeakPolarHBondContact O-CB 3.41Å; M2433-T2437 PolarHBondContact O-N 3.07Å; M2433-T2437 PolarHBondContact O-OG1 3.02Å; R2434-T2437 WeakPolarHBondContact O-CB 3.41Å; R2434-T2437 PolarHBondContact O-N 3.35Å; L2435-T2437 VanDerWaalsContact C-N 3.27Å; L2435-T2437 PolarHBondContact O-N 2.86Å; T2437-L2440 PolarHBondContact O-N 2.82Å; T2437-S2441 WeakPolarHBondContact O-CB 3.5Å; T2437-S2441 PolarHBondContact O-N 2.95Å; T2437-S2441 PolarHBondContact O-OG 3.22Å |
| 2438 | L | 92.3 | Very high | 90 | Very high | 19.5 Ų | 19.5 | 37.3 Ų | 37.3 | 10% | 0.102 | 19% | 0.185 | C | C | . | . | H | α-helix | trans | -63 | -45.4 | 174.5 | 176.7 | 64.8 | 0 | 0 | 0 | 111 | I2365 I2366 R2434 L2435 S2441 T2442 | I2365-L2438 HydrophobicContact CB-CD2 4.18Å; I2365-L2438 HydrophobicContact CG2-CD2 3.7Å; I2365-L2438 HydrophobicContact CG2-CG 3.91Å; I2366-L2438 HydrophobicContact CD1-CD2 4.4Å; I2366-L2438 HydrophobicContact CG1-CD2 3.54Å; R2434-L2438 WeakPolarHBondContact O-CB 3.41Å; R2434-L2438 PolarHBondContact O-N 3.07Å; L2435-L2438 HydrophobicContact CD1-CD2 4.5Å; L2435-L2438 PolarHBondContact O-N 3.3Å; L2438-S2441 PolarHBondContact O-N 3.22Å; L2438-S2441 PolarHBondContact O-OG 3.21Å; L2438-T2442 WeakPolarHBondContact O-CB 3.37Å; L2438-T2442 PolarHBondContact O-N 3.22Å; L2438-T2442 PolarHBondContact O-OG1 3.45Å |
| 2439 | L | 93.1 | Very high | 89.5 | Confident | 0 Ų | 0 | 43.4 Ų | 43.4 | 0% | 0 | 21% | 0.208 | C | C | . | . | H | α-helix | trans | -59.8 | -48.4 | 176 | -79.1 | 164.7 | 0 | 0 | 0 | 111.6 | I2365 F2379 L2413 L2417 L2435 L2436 S2441 T2442 V2443 Y2461 | I2365-L2439 HydrophobicContact CD1-CD1 4.32Å; I2365-L2439 HydrophobicContact CD1-CD2 3.6Å; I2365-L2439 HydrophobicContact CD1-CG 4Å; I2365-L2439 HydrophobicContact CG1-CD2 4.39Å; I2365-L2439 HydrophobicContact CG2-CD2 4.48Å; F2379-L2439 HydrophobicContact CD1-CD2 4.38Å; F2379-L2439 HydrophobicContact CE1-CD2 3.61Å; F2379-L2439 HydrophobicContact CE2-CD2 4.21Å; F2379-L2439 HydrophobicContact CZ-CD2 3.48Å; F2379-L2439 VanDerWaalsContact CZ-CD2 3.48Å; L2413-L2439 HydrophobicContact CD2-CD1 3.8Å; L2413-L2439 HydrophobicContact CD2-CD2 3.8Å; L2413-L2439 HydrophobicContact CD2-CG 4.46Å; L2413-L2439 HydrophobicContact CG-CD1 4.29Å; L2417-L2439 HydrophobicContact CD1-CD1 3.52Å; L2435-L2439 HydrophobicContact CD1-CD1 4.33Å; L2435-L2439 HydrophobicContact CD1-CG 4.46Å; L2435-L2439 HydrophobicContact CG-CD1 4.21Å; L2435-L2439 WeakPolarHBondContact O-CB 3.26Å; L2435-L2439 WeakPolarHBondContact O-CG 3.14Å; L2435-L2439 PolarHBondContact O-N 2.88Å; L2436-L2439 PolarHBondContact O-N 3.3Å; L2439-S2441 VanDerWaalsContact C-N 3.34Å; L2439-S2441 PolarHBondContact O-N 3.31Å; L2439-T2442 WeakPolarHBondContact O-CA 3.5Å; L2439-T2442 WeakPolarHBondContact O-CB 3.43Å; L2439-T2442 PolarHBondContact O-N 2.91Å; L2439-T2442 VanDerWaalsContact O-N 3.12Å; L2439-V2443 WeakPolarHBondContact O-CG2 3.41Å; L2439-V2443 PolarHBondContact O-N 3.07Å; L2439-Y2461 HydrophobicContact CB-CD1 3.94Å; L2439-Y2461 HydrophobicContact CB-CE1 3.68Å; L2439-Y2461 HydrophobicContact CD1-CE1 4.01Å; L2439-Y2461 HydrophobicContact CG-CE1 4.35Å |
| 2440 | L | 92.4 | Very high | 89.1 | Confident | 0 Ų | 0 | 48.3 Ų | 48.3 | 0% | 0 | 23% | 0.225 | C | C | . | . | H | α-helix | trans | -55.1 | -48.9 | 174.8 | 176.9 | 63.6 | 0 | 0 | 0 | 111.5 | L2436 T2437 T2442 V2443 A2444 R2451 Y2452 T2458 L2462 L2465 | L2436-L2440 WeakPolarHBondContact O-CB 3.39Å; L2436-L2440 PolarHBondContact O-N 3.46Å; T2437-L2440 PolarHBondContact O-N 2.82Å; L2440-T2442 VanDerWaalsContact C-N 3.31Å; L2440-T2442 PolarHBondContact O-N 3.18Å; L2440-V2443 PolarHBondContact O-N 2.81Å; L2440-A2444 WeakPolarHBondContact O-CB 3.42Å; L2440-A2444 PolarHBondContact O-N 3.2Å; L2440-R2451 WeakPolarHBondContact CD1-O 3.16Å; L2440-R2451 WeakPolarHBondContact CG-O 3.32Å; L2440-Y2452 HydrophobicContact CD2-CD1 3.99Å; L2440-Y2452 HydrophobicContact CD2-CE1 3.99Å; L2440-T2458 HydrophobicContact CD1-CG2 3.9Å; L2440-L2462 HydrophobicContact CD1-CD2 4.12Å; L2440-L2462 HydrophobicContact CD1-CG 4.17Å; L2440-L2462 HydrophobicContact CD2-CD2 3.67Å; L2440-L2462 HydrophobicContact CD2-CG 4.48Å; L2440-L2465 HydrophobicContact CD2-CD1 4.06Å |
| 2441 | S | 89.6 | Confident | 88.8 | Confident | 34 Ų | 34 | 48.9 Ų | 48.9 | 24% | 0.238 | 22% | 0.218 | C | C | . | . | H | α-helix | trans | -64.6 | -29.9 | 177.9 | 74.7 | 0 | 0 | 0 | 0 | 113.4 | T2437 L2438 L2439 R2445 | T2437-S2441 WeakPolarHBondContact O-CB 3.5Å; T2437-S2441 PolarHBondContact O-N 2.95Å; T2437-S2441 PolarHBondContact O-OG 3.22Å; L2438-S2441 PolarHBondContact O-N 3.22Å; L2438-S2441 PolarHBondContact O-OG 3.21Å; L2439-S2441 VanDerWaalsContact C-N 3.34Å; L2439-S2441 PolarHBondContact O-N 3.31Å; S2441-R2445 VanDerWaalsContact O-CB 3.25Å; S2441-R2445 WeakPolarHBondContact O-CB 3.29Å; S2441-R2445 PolarHBondContact O-N 3.17Å |
| 2442 | T | 88 | Confident | 88.5 | Confident | 0.5 Ų | 0.5 | 46.6 Ų | 46.6 | 0% | 0.003 | 21% | 0.209 | C | C | . | . | H | α-helix | trans | -74.7 | -46.7 | 178.2 | -57.4 | 0 | 0 | 0 | 0 | 110.4 | T2369 F2374 F2379 L2438 L2439 L2440 R2445 C2446 | T2369-T2442 PolarHBondContact OG1-OG1 3.27Å; F2374-T2442 HydrophobicContact CD2-CG2 3.6Å; F2374-T2442 HydrophobicContact CE2-CG2 3.76Å; F2374-T2442 HydrophobicContact CG-CG2 4.12Å; F2374-T2442 HydrophobicContact CZ-CG2 4.42Å; F2379-T2442 HydrophobicContact CD2-CG2 4.27Å; L2438-T2442 WeakPolarHBondContact O-CB 3.37Å; L2438-T2442 PolarHBondContact O-N 3.22Å; L2438-T2442 PolarHBondContact O-OG1 3.45Å; L2439-T2442 WeakPolarHBondContact O-CA 3.5Å; L2439-T2442 WeakPolarHBondContact O-CB 3.43Å; L2439-T2442 PolarHBondContact O-N 2.91Å; L2439-T2442 VanDerWaalsContact O-N 3.12Å; L2440-T2442 VanDerWaalsContact C-N 3.31Å; L2440-T2442 PolarHBondContact O-N 3.18Å; T2442-R2445 PolarHBondContact O-N 3Å; T2442-R2445 PolarHBondContact OG1-NH2 2.98Å; T2442-C2446 PolarHBondContact O-N 3.38Å; T2442-C2446 PolarHBondContact O-SG 2.9Å |
| 2443 | V | 89.6 | Confident | 88.2 | Confident | 3.5 Ų | 3.5 | 49.6 Ų | 49.6 | 2% | 0.021 | 22% | 0.223 | C | C | . | . | H | α-helix | trans | -64.5 | -43.4 | 178 | 174.2 | 0 | 0 | 0 | 0 | 111.6 | F2379 L2439 L2440 R2445 C2446 T2447 D2457 T2458 Y2461 | F2379-V2443 HydrophobicContact CB-CG2 4.37Å; F2379-V2443 HydrophobicContact CD1-CG2 4.39Å; L2439-V2443 WeakPolarHBondContact O-CG2 3.41Å; L2439-V2443 PolarHBondContact O-N 3.07Å; L2440-V2443 PolarHBondContact O-N 2.81Å; V2443-R2445 VanDerWaalsContact C-N 3.31Å; V2443-R2445 PolarHBondContact O-N 3.41Å; V2443-C2446 WeakPolarHBondContact O-CB 2.89Å; V2443-C2446 PolarHBondContact O-N 2.81Å; V2443-T2447 PolarHBondContact O-N 3.32Å; V2443-T2447 VanDerWaalsContact O-N 3.09Å; V2443-T2447 PolarHBondContact O-OG1 2.99Å; V2443-D2457 HydrophobicContact CG1-CB 3.78Å; V2443-T2458 HydrophobicContact CG1-CG2 4.17Å; V2443-Y2461 HydrophobicContact CG2-CE2 4.05Å |
| 2444 | A | 86.3 | Confident | 87.9 | Confident | 3 Ų | 3 | 46.8 Ų | 46.8 | 3% | 0.025 | 21% | 0.21 | C | C | . | . | H | α-helix | trans | -61.5 | -39 | 174.9 | 0 | 0 | 0 | 0 | 0 | 112.2 | L2440 T2447 K2448 R2449 | L2440-A2444 WeakPolarHBondContact O-CB 3.42Å; L2440-A2444 PolarHBondContact O-N 3.2Å; A2444-T2447 WeakPolarHBondContact CA-OG1 3.45Å; A2444-T2447 PolarHBondContact O-N 3Å; A2444-T2447 PolarHBondContact O-OG1 3.36Å; A2444-T2447 VanDerWaalsContact O-OG1 3.09Å; A2444-K2448 PolarHBondContact O-N 3.32Å; A2444-R2449 PolarHBondContact O-N 3.33Å |
| 2445 | R | 83.7 | Confident | 87.7 | Confident | 105 Ų | 105 | 42 Ų | 42 | 40% | 0.396 | 19% | 0.192 | S | C | . | . | H | α-helix | trans | -68.8 | -41 | 176 | -177.2 | 170.1 | 55.1 | 128.1 | 8.5 | 112.6 | T2369 S2441 T2442 V2443 T2447 K2448 | T2369-R2445 PolarHBondContact O-NH2 3.1Å; T2369-R2445 PolarHBondContact OG1-NH2 3.35Å; S2441-R2445 VanDerWaalsContact O-CB 3.25Å; S2441-R2445 WeakPolarHBondContact O-CB 3.29Å; S2441-R2445 PolarHBondContact O-N 3.17Å; T2442-R2445 PolarHBondContact O-N 3Å; T2442-R2445 PolarHBondContact OG1-NH2 2.98Å; V2443-R2445 VanDerWaalsContact C-N 3.31Å; V2443-R2445 PolarHBondContact O-N 3.41Å; R2445-T2447 VanDerWaalsContact C-N 3.25Å; R2445-T2447 PolarHBondContact O-N 2.79Å; R2445-K2448 PolarHBondContact O-N 3.02Å |
| 2446 | C | 82.7 | Confident | 87.4 | Confident | 24 Ų | 24 | 45.5 Ų | 45.5 | 16% | 0.162 | 21% | 0.209 | C | C | . | . | H | α-helix | trans | -57.4 | -38.9 | 173.1 | -67.5 | 0 | 0 | 0 | 0 | 112.1 | T2442 V2443 | T2442-C2446 PolarHBondContact O-N 3.38Å; T2442-C2446 PolarHBondContact O-SG 2.9Å; V2443-C2446 WeakPolarHBondContact O-CB 2.89Å; V2443-C2446 PolarHBondContact O-N 2.81Å |
| 2447 | T | 81 | Confident | 87.1 | Confident | 46 Ų | 46 | 48.2 Ų | 48.2 | 28% | 0.282 | 22% | 0.224 | S | C | . | . | H | α-helix | trans | -90.6 | -2.3 | -176 | 53.6 | 0 | 0 | 0 | 0 | 113.6 | V2443 A2444 R2445 R2449 | V2443-T2447 PolarHBondContact O-N 3.32Å; V2443-T2447 VanDerWaalsContact O-N 3.09Å; V2443-T2447 PolarHBondContact O-OG1 2.99Å; A2444-T2447 WeakPolarHBondContact CA-OG1 3.45Å; A2444-T2447 PolarHBondContact O-N 3Å; A2444-T2447 PolarHBondContact O-OG1 3.36Å; A2444-T2447 VanDerWaalsContact O-OG1 3.09Å; R2445-T2447 VanDerWaalsContact C-N 3.25Å; R2445-T2447 PolarHBondContact O-N 2.79Å; T2447-R2449 VanDerWaalsContact C-N 3.28Å; T2447-R2449 PolarHBondContact O-N 2.96Å |
| 2448 | K | 81 | Confident | 87 | Confident | 184 Ų | 184 | 47.1 Ų | 47.1 | 80% | 0.8 | 22% | 0.218 | S | C | * | . | T | Hydrogen-bonded Turn | trans | 56.4 | 37.4 | -176.1 | -57.1 | -178.6 | -179.6 | 179.8 | 0 | 113.3 | A2444 R2445 | A2444-K2448 PolarHBondContact O-N 3.32Å; R2445-K2448 PolarHBondContact O-N 3.02Å |
| 2449 | R | 80.9 | Confident | 87 | Confident | 127.5 Ų | 127.5 | 46.2 Ų | 46.2 | 48% | 0.481 | 21% | 0.213 | S | C | . | . | trans | -111.9 | 168.9 | -177.6 | -74.3 | -178.4 | -171.3 | -141.5 | 13.3 | 112.1 | A2444 T2447 E2453 | A2444-R2449 PolarHBondContact O-N 3.33Å; T2447-R2449 VanDerWaalsContact C-N 3.28Å; T2447-R2449 PolarHBondContact O-N 2.96Å; R2449-E2453 VanDerWaalsContact CB-OE2 3.26Å; R2449-E2453 WeakPolarHBondContact CB-OE2 3.35Å; R2449-E2453 VanDerWaalsContact CD-OE1 3.31Å; R2449-E2453 WeakPolarHBondContact CD-OE1 3.32Å; R2449-E2453 WeakPolarHBondContact CG-OE2 3.05Å; R2449-E2453 IonicContact CZ-OE1 3.36Å; R2449-E2453 IonicContact NE-OE1 2.9Å; R2449-E2453 IonicContact NH1-OE1 3.11Å; R2449-E2453 PolarHBondContact NH1-OE1 3.05Å | ||
| 2450 | E | 83.8 | Confident | 87 | Confident | 134 Ų | 134 | 46.2 Ų | 46.2 | 63% | 0.626 | 21% | 0.213 | S | C | * | . | trans | -67.3 | 145.9 | 172.3 | -72.7 | -163.1 | -173.2 | 0 | 0 | 111.2 | Y2452 E2453 | E2450-Y2452 PolarHBondContact O-N 3.34Å; E2450-Y2452 VanDerWaalsContact O-N 3.1Å; E2450-E2453 HydrophobicContact CB-CB 4.23Å; E2450-E2453 PolarHBondContact N-OE2 3.21Å; E2450-E2453 WeakPolarHBondContact O-CB 3.3Å; E2450-E2453 PolarHBondContact O-N 3.35Å; E2450-E2453 VanDerWaalsContact O-N 3.1Å | ||
| 2451 | R | 84.2 | Confident | 87.1 | Confident | 89.5 Ų | 89.5 | 46.2 Ų | 46.2 | 34% | 0.338 | 21% | 0.213 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -55 | -33 | -174.4 | 178.9 | 176 | 171.9 | 175.6 | -7.4 | 114.7 | L2440 | L2440-R2451 WeakPolarHBondContact CD1-O 3.16Å; L2440-R2451 WeakPolarHBondContact CG-O 3.32Å |
| 2452 | Y | 87.6 | Confident | 87.3 | Confident | 13 Ų | 13 | 44.6 Ų | 44.6 | 5% | 0.051 | 20% | 0.201 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -110.9 | 8.1 | -176.6 | -59.8 | -69.4 | 0 | 0 | 0 | 112.8 | L2440 E2450 V2454 L2462 E2471 V2472 R2475 N2629 | L2440-Y2452 HydrophobicContact CD2-CD1 3.99Å; L2440-Y2452 HydrophobicContact CD2-CE1 3.99Å; E2450-Y2452 PolarHBondContact O-N 3.34Å; E2450-Y2452 VanDerWaalsContact O-N 3.1Å; Y2452-V2454 PolarHBondContact O-N 3.25Å; Y2452-L2462 HydrophobicContact CD1-CD2 4.04Å; Y2452-E2471 HydrophobicContact CE2-CG 4.08Å; Y2452-E2471 WeakPolarHBondContact CE2-OE1 3.34Å; Y2452-E2471 PolarHBondContact OH-OE1 3.35Å; Y2452-E2471 PolarHBondContact OH-OE2 3.27Å; Y2452-V2472 HydrophobicContact CD1-CG2 4.19Å; Y2452-V2472 HydrophobicContact CE1-CG2 3.96Å; Y2452-R2475 HydrophobicContact CD2-CB 4.44Å; Y2452-R2475 HydrophobicContact CD2-CG 3.88Å; Y2452-R2475 HydrophobicContact CE2-CG 4.41Å; Y2452-R2475 HydrophobicContact CG-CB 4.12Å; Y2452-R2475 HydrophobicContact CG-CG 4.07Å; Y2452-N2629 PolarHBondContact O-ND2 3.39Å |
| 2453 | E | 87.5 | Confident | 87.6 | Confident | 62.5 Ų | 62.5 | 44.6 Ų | 44.6 | 29% | 0.292 | 20% | 0.201 | S | C | . | . | trans | -61 | 127.3 | 175.3 | -167.4 | -175.3 | 138.7 | 0 | 0 | 109.5 | R2449 E2450 T2455 T2458 | R2449-E2453 VanDerWaalsContact CB-OE2 3.26Å; R2449-E2453 WeakPolarHBondContact CB-OE2 3.35Å; R2449-E2453 VanDerWaalsContact CD-OE1 3.31Å; R2449-E2453 WeakPolarHBondContact CD-OE1 3.32Å; R2449-E2453 WeakPolarHBondContact CG-OE2 3.05Å; R2449-E2453 IonicContact CZ-OE1 3.36Å; R2449-E2453 IonicContact NE-OE1 2.9Å; R2449-E2453 IonicContact NH1-OE1 3.11Å; R2449-E2453 PolarHBondContact NH1-OE1 3.05Å; E2450-E2453 HydrophobicContact CB-CB 4.23Å; E2450-E2453 PolarHBondContact N-OE2 3.21Å; E2450-E2453 WeakPolarHBondContact O-CB 3.3Å; E2450-E2453 PolarHBondContact O-N 3.35Å; E2450-E2453 VanDerWaalsContact O-N 3.1Å; E2453-T2455 HydrophobicContact CB-CG2 4.46Å; E2453-T2455 HydrophobicContact CG-CG2 4.19Å; E2453-T2455 PolarHBondContact O-N 3.03Å; E2453-T2458 PolarHBondContact O-OG1 3.18Å | ||
| 2454 | V | 87.1 | Confident | 87.8 | Confident | 6.5 Ų | 6.5 | 44.4 Ų | 44.4 | 4% | 0.039 | 20% | 0.2 | C | C | . | . | trans | -75.8 | 118.7 | 178 | -179.8 | 0 | 0 | 0 | 0 | 108.6 | Y2452 L2462 N2629 V2636 | Y2452-V2454 PolarHBondContact O-N 3.25Å; V2454-L2462 HydrophobicContact CB-CD1 4.44Å; V2454-L2462 HydrophobicContact CG2-CD1 3.87Å; V2454-N2629 PolarHBondContact N-OD1 3.26Å; V2454-V2636 HydrophobicContact CG1-CG1 4.34Å; V2454-V2636 WeakPolarHBondContact O-CG1 3.43Å | ||
| 2455 | T | 88.7 | Confident | 88.1 | Confident | 6 Ų | 6 | 44.3 Ų | 44.3 | 4% | 0.037 | 20% | 0.199 | C | C | . | . | trans | -139 | 167 | 178.6 | 78.5 | 0 | 0 | 0 | 0 | 109.4 | E2453 D2457 T2458 V2459 | E2453-T2455 HydrophobicContact CB-CG2 4.46Å; E2453-T2455 HydrophobicContact CG-CG2 4.19Å; E2453-T2455 PolarHBondContact O-N 3.03Å; T2455-D2457 PolarHBondContact O-N 3.39Å; T2455-D2457 PolarHBondContact OG1-N 3.21Å; T2455-D2457 VanDerWaalsContact OG1-N 3.15Å; T2455-T2458 WeakPolarHBondContact CB-OG1 3.48Å; T2455-T2458 HydrophobicContact CG2-CG2 4.48Å; T2455-T2458 PolarHBondContact N-OG1 3.35Å; T2455-T2458 PolarHBondContact O-N 3.15Å; T2455-T2458 PolarHBondContact O-OG1 3.12Å; T2455-T2458 WeakPolarHBondContact OG1-CB 3.3Å; T2455-T2458 WeakPolarHBondContact OG1-CG2 3.28Å; T2455-T2458 PolarHBondContact OG1-N 3.27Å; T2455-T2458 VanDerWaalsContact OG1-N 3.13Å; T2455-T2458 PolarHBondContact OG1-OG1 3.27Å; T2455-V2459 VanDerWaalsContact O-CB 3.31Å; T2455-V2459 WeakPolarHBondContact O-CB 3.35Å; T2455-V2459 WeakPolarHBondContact O-CG1 3.26Å; T2455-V2459 PolarHBondContact O-N 3.03Å | ||
| 2456 | M | 87.5 | Confident | 88.5 | Confident | 72.5 Ų | 72.5 | 39.3 Ų | 39.3 | 36% | 0.357 | 18% | 0.18 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -56.2 | -30.2 | 174.5 | -64.9 | -178.8 | 175.3 | 0 | 0 | 112.8 | V2636 C2638 E2639 I2642 | M2456-V2636 WeakPolarHBondContact CE-O 3.21Å; M2456-C2638 WeakPolarHBondContact CE-SG 3.33Å; M2456-E2639 HydrophobicContact CE-CG 4.22Å; M2456-I2642 HydrophobicContact CB-CD1 3.73Å; M2456-I2642 HydrophobicContact CE-CD1 4.3Å; M2456-I2642 HydrophobicContact CG-CD1 3.53Å; M2456-I2642 HydrophobicContact SD-CD1 3.76Å |
| 2457 | D | 88.1 | Confident | 88.9 | Confident | 57.5 Ų | 57.5 | 38.7 Ų | 38.7 | 31% | 0.307 | 18% | 0.176 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -87.4 | -34.4 | -179 | -55.2 | -24.7 | 0 | 0 | 0 | 112.5 | H2410 V2443 T2455 Y2461 | H2410-D2457 IonicContact CD2-OD1 2.76Å; H2410-D2457 IonicContact NE2-OD1 3.64Å; V2443-D2457 HydrophobicContact CG1-CB 3.78Å; T2455-D2457 PolarHBondContact O-N 3.39Å; T2455-D2457 PolarHBondContact OG1-N 3.21Å; T2455-D2457 VanDerWaalsContact OG1-N 3.15Å; D2457-Y2461 WeakPolarHBondContact O-CD2 3.37Å; D2457-Y2461 VanDerWaalsContact O-CE2 3.32Å; D2457-Y2461 WeakPolarHBondContact O-CE2 3.46Å |
| 2458 | T | 91.5 | Very high | 89.2 | Confident | 1.5 Ų | 1.5 | 38.7 Ų | 38.7 | 1% | 0.009 | 18% | 0.176 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -87.8 | -25.1 | -174.5 | 58.2 | 0 | 0 | 0 | 0 | 113.5 | L2440 V2443 E2453 T2455 A2460 Y2461 L2462 | L2440-T2458 HydrophobicContact CD1-CG2 3.9Å; V2443-T2458 HydrophobicContact CG1-CG2 4.17Å; E2453-T2458 PolarHBondContact O-OG1 3.18Å; T2455-T2458 WeakPolarHBondContact CB-OG1 3.48Å; T2455-T2458 HydrophobicContact CG2-CG2 4.48Å; T2455-T2458 PolarHBondContact N-OG1 3.35Å; T2455-T2458 PolarHBondContact O-N 3.15Å; T2455-T2458 PolarHBondContact O-OG1 3.12Å; T2455-T2458 WeakPolarHBondContact OG1-CB 3.3Å; T2455-T2458 WeakPolarHBondContact OG1-CG2 3.28Å; T2455-T2458 PolarHBondContact OG1-N 3.27Å; T2455-T2458 VanDerWaalsContact OG1-N 3.13Å; T2455-T2458 PolarHBondContact OG1-OG1 3.27Å; T2458-A2460 VanDerWaalsContact C-N 3.32Å; T2458-A2460 PolarHBondContact O-N 3.16Å; T2458-Y2461 PolarHBondContact O-N 3.32Å; T2458-Y2461 VanDerWaalsContact O-N 3.13Å; T2458-L2462 WeakPolarHBondContact O-CG 3.35Å; T2458-L2462 PolarHBondContact O-N 3.48Å; T2458-L2462 VanDerWaalsContact O-N 3.08Å |
| 2459 | V | 92.6 | Very high | 89.7 | Confident | 0 Ų | 0 | 30.8 Ų | 30.8 | 0% | 0 | 14% | 0.144 | C | C | . | . | H | α-helix | trans | -55.1 | -41.3 | -172.3 | 65.3 | 0 | 0 | 0 | 0 | 113.4 | F2411 T2455 Y2461 L2462 I2463 L2637 I2642 | F2411-V2459 HydrophobicContact CE2-CG1 4.02Å; F2411-V2459 HydrophobicContact CZ-CG1 3.85Å; T2455-V2459 VanDerWaalsContact O-CB 3.31Å; T2455-V2459 WeakPolarHBondContact O-CB 3.35Å; T2455-V2459 WeakPolarHBondContact O-CG1 3.26Å; T2455-V2459 PolarHBondContact O-N 3.03Å; V2459-Y2461 VanDerWaalsContact C-N 3.33Å; V2459-Y2461 PolarHBondContact O-N 3.26Å; V2459-L2462 PolarHBondContact O-N 2.93Å; V2459-I2463 HydrophobicContact CG2-CD1 3.72Å; V2459-I2463 HydrophobicContact CG2-CG1 4.31Å; V2459-I2463 VanDerWaalsContact O-CG1 3.31Å; V2459-I2463 WeakPolarHBondContact O-CG1 3.3Å; V2459-I2463 PolarHBondContact O-N 3.26Å; V2459-L2637 HydrophobicContact CB-CD2 4.24Å; V2459-L2637 HydrophobicContact CG1-CD2 4.2Å; V2459-L2637 HydrophobicContact CG2-CD1 4.48Å; V2459-L2637 HydrophobicContact CG2-CD2 3.97Å; V2459-I2642 HydrophobicContact CG1-CG2 4.25Å |
| 2460 | A | 93.2 | Very high | 90 | Very high | 0 Ų | 0 | 30.7 Ų | 30.7 | 0% | 0 | 15% | 0.149 | C | C | . | . | H | α-helix | trans | -61.8 | -40.7 | -179.9 | 0 | 0 | 0 | 0 | 0 | 112.2 | F2411 V2414 T2458 A2464 L2649 | F2411-A2460 HydrophobicContact CD1-CB 3.81Å; F2411-A2460 HydrophobicContact CD2-CB 4.11Å; F2411-A2460 HydrophobicContact CE1-CB 3.88Å; F2411-A2460 HydrophobicContact CE2-CB 4.17Å; F2411-A2460 HydrophobicContact CG-CB 3.93Å; F2411-A2460 HydrophobicContact CZ-CB 4.07Å; V2414-A2460 HydrophobicContact CB-CB 4.33Å; V2414-A2460 HydrophobicContact CG2-CB 3.89Å; T2458-A2460 VanDerWaalsContact C-N 3.32Å; T2458-A2460 PolarHBondContact O-N 3.16Å; A2460-A2464 WeakPolarHBondContact O-CB 3.36Å; A2460-A2464 PolarHBondContact O-N 3Å; A2460-A2464 VanDerWaalsContact O-N 3.14Å; A2460-L2649 HydrophobicContact CB-CD2 4.37Å |
| 2461 | Y | 94.7 | Very high | 90.1 | Very high | 0 Ų | 0 | 28.5 Ų | 28.5 | 0% | 0 | 14% | 0.138 | C | C | . | . | H | α-helix | trans | -72.1 | -39.7 | 178.3 | -54.8 | -75.5 | 0 | 0 | 0 | 111.8 | H2410 V2414 L2436 L2439 V2443 D2457 T2458 V2459 A2464 L2465 | H2410-Y2461 HydrophobicContact CB-CE2 3.86Å; H2410-Y2461 AromaticContact CG-CE2 3.88Å; H2410-Y2461 AromaticContact ND1-CE2 3.48Å; H2410-Y2461 WeakPolarHBondContact ND1-CE2 3.39Å; H2410-Y2461 AromaticContact ND1-CZ 3.59Å; H2410-Y2461 PolarHBondContact ND1-OH 2.99Å; V2414-Y2461 HydrophobicContact CG2-CD1 3.48Å; V2414-Y2461 VanDerWaalsContact CG2-CD1 3.44Å; V2414-Y2461 HydrophobicContact CG2-CE1 3.55Å; V2414-Y2461 HydrophobicContact CG2-CG 4.14Å; L2436-Y2461 HydrophobicContact CD2-CD1 4.04Å; L2439-Y2461 HydrophobicContact CB-CD1 3.94Å; L2439-Y2461 HydrophobicContact CB-CE1 3.68Å; L2439-Y2461 HydrophobicContact CD1-CE1 4.01Å; L2439-Y2461 HydrophobicContact CG-CE1 4.35Å; V2443-Y2461 HydrophobicContact CG2-CE2 4.05Å; D2457-Y2461 WeakPolarHBondContact O-CD2 3.37Å; D2457-Y2461 VanDerWaalsContact O-CE2 3.32Å; D2457-Y2461 WeakPolarHBondContact O-CE2 3.46Å; T2458-Y2461 PolarHBondContact O-N 3.32Å; T2458-Y2461 VanDerWaalsContact O-N 3.13Å; V2459-Y2461 VanDerWaalsContact C-N 3.33Å; V2459-Y2461 PolarHBondContact O-N 3.26Å; Y2461-A2464 PolarHBondContact O-N 3.47Å; Y2461-L2465 WeakPolarHBondContact O-CB 3.42Å; Y2461-L2465 WeakPolarHBondContact O-CG 3.46Å; Y2461-L2465 PolarHBondContact O-N 3.05Å |
| 2462 | L | 93.7 | Very high | 90.3 | Very high | 0 Ų | 0 | 24.2 Ų | 24.2 | 0% | 0 | 12% | 0.122 | C | C | . | . | H | α-helix | trans | -61.9 | -45.2 | 177 | -67.7 | 170.9 | 0 | 0 | 0 | 111 | L2440 Y2452 V2454 T2458 V2459 A2464 L2465 L2466 V2472 L2631 | L2440-L2462 HydrophobicContact CD1-CD2 4.12Å; L2440-L2462 HydrophobicContact CD1-CG 4.17Å; L2440-L2462 HydrophobicContact CD2-CD2 3.67Å; L2440-L2462 HydrophobicContact CD2-CG 4.48Å; Y2452-L2462 HydrophobicContact CD1-CD2 4.04Å; V2454-L2462 HydrophobicContact CB-CD1 4.44Å; V2454-L2462 HydrophobicContact CG2-CD1 3.87Å; T2458-L2462 WeakPolarHBondContact O-CG 3.35Å; T2458-L2462 PolarHBondContact O-N 3.48Å; T2458-L2462 VanDerWaalsContact O-N 3.08Å; V2459-L2462 PolarHBondContact O-N 2.93Å; L2462-A2464 PolarHBondContact O-N 3.23Å; L2462-L2465 PolarHBondContact O-N 3.07Å; L2462-L2466 WeakPolarHBondContact O-CB 3.29Å; L2462-L2466 PolarHBondContact O-N 3.36Å; L2462-V2472 HydrophobicContact CB-CG1 4.42Å; L2462-V2472 HydrophobicContact CD2-CG1 4.16Å; L2462-V2472 HydrophobicContact CD2-CG2 4.33Å; L2462-L2631 HydrophobicContact CB-CD1 3.79Å; L2462-L2631 HydrophobicContact CD1-CD1 4.46Å |
| 2463 | I | 93.6 | Very high | 90.4 | Very high | 0 Ų | 0 | 26.7 Ų | 26.7 | 0% | 0 | 13% | 0.132 | C | C | . | . | H | α-helix | trans | -61.6 | -44.7 | 175.3 | -68.1 | 164 | 0 | 0 | 0 | 111.5 | V2459 L2465 L2466 L2631 T2646 L2649 L2650 L2653 | V2459-I2463 HydrophobicContact CG2-CD1 3.72Å; V2459-I2463 HydrophobicContact CG2-CG1 4.31Å; V2459-I2463 VanDerWaalsContact O-CG1 3.31Å; V2459-I2463 WeakPolarHBondContact O-CG1 3.3Å; V2459-I2463 PolarHBondContact O-N 3.26Å; I2463-L2465 VanDerWaalsContact C-N 3.29Å; I2463-L2465 PolarHBondContact O-N 3Å; I2463-L2466 VanDerWaalsContact O-CB 3.23Å; I2463-L2466 WeakPolarHBondContact O-CB 3.4Å; I2463-L2466 PolarHBondContact O-N 3.33Å; I2463-L2631 HydrophobicContact CG1-CD1 4.35Å; I2463-L2631 HydrophobicContact CG1-CD2 4.21Å; I2463-L2631 HydrophobicContact CG1-CG 4.48Å; I2463-T2646 HydrophobicContact CD1-CG2 3.59Å; I2463-L2649 HydrophobicContact CB-CD2 3.82Å; I2463-L2649 HydrophobicContact CD1-CD2 4.28Å; I2463-L2649 HydrophobicContact CG2-CB 4.17Å; I2463-L2649 HydrophobicContact CG2-CD2 3.61Å; I2463-L2649 HydrophobicContact CG2-CG 3.75Å; I2463-L2650 HydrophobicContact CG2-CD2 3.79Å; I2463-L2650 HydrophobicContact CG2-CG 3.82Å; I2463-L2653 HydrophobicContact CG2-CD1 3.91Å; I2463-L2653 WeakPolarHBondContact O-CD1 3.4Å |
| 2464 | A | 93.4 | Very high | 90.4 | Very high | 0 Ų | 0 | 30.5 Ų | 30.5 | 0% | 0 | 15% | 0.153 | C | C | . | . | H | α-helix | trans | -66.1 | -27.8 | -179.7 | 0 | 0 | 0 | 0 | 0 | 113.6 | V2414 L2418 Y2421 L2436 A2460 Y2461 L2462 | V2414-A2464 HydrophobicContact CG1-CB 3.61Å; L2418-A2464 HydrophobicContact CD2-CB 3.93Å; Y2421-A2464 WeakPolarHBondContact CE2-O 3.16Å; Y2421-A2464 PolarHBondContact OH-O 3.1Å; L2436-A2464 HydrophobicContact CD1-CB 3.85Å; L2436-A2464 HydrophobicContact CD2-CB 4.14Å; A2460-A2464 WeakPolarHBondContact O-CB 3.36Å; A2460-A2464 PolarHBondContact O-N 3Å; A2460-A2464 VanDerWaalsContact O-N 3.14Å; Y2461-A2464 PolarHBondContact O-N 3.47Å; L2462-A2464 PolarHBondContact O-N 3.23Å |
| 2465 | L | 94 | Very high | 90.4 | Very high | 1.5 Ų | 1.5 | 35.5 Ų | 35.5 | 1% | 0.008 | 17% | 0.171 | C | C | . | . | H | α-helix | trans | -87.4 | -17.4 | 175.5 | -71 | 169.8 | 0 | 0 | 0 | 113.3 | M2433 L2436 L2440 Y2461 L2462 I2463 P2467 V2468 S2469 V2472 | M2433-L2465 HydrophobicContact CG-CD2 3.88Å; L2436-L2465 HydrophobicContact CB-CD1 4.36Å; L2436-L2465 HydrophobicContact CB-CD2 3.77Å; L2436-L2465 HydrophobicContact CB-CG 3.99Å; L2436-L2465 HydrophobicContact CD1-CD2 4.43Å; L2440-L2465 HydrophobicContact CD2-CD1 4.06Å; Y2461-L2465 WeakPolarHBondContact O-CB 3.42Å; Y2461-L2465 WeakPolarHBondContact O-CG 3.46Å; Y2461-L2465 PolarHBondContact O-N 3.05Å; L2462-L2465 PolarHBondContact O-N 3.07Å; I2463-L2465 VanDerWaalsContact C-N 3.29Å; I2463-L2465 PolarHBondContact O-N 3Å; L2465-P2467 VanDerWaalsContact C-CD 3.47Å; L2465-V2468 HydrophobicContact CD2-CG2 4.38Å; L2465-V2468 WeakPolarHBondContact O-CG2 3.37Å; L2465-V2468 PolarHBondContact O-N 3.26Å; L2465-V2468 VanDerWaalsContact O-N 3.13Å; L2465-S2469 VanDerWaalsContact O-CB 3.28Å; L2465-S2469 WeakPolarHBondContact O-CB 3.45Å; L2465-S2469 PolarHBondContact O-N 3.04Å; L2465-V2472 HydrophobicContact CB-CG2 3.97Å; L2465-V2472 HydrophobicContact CD1-CG2 4.45Å |
| 2466 | L | 92.3 | Very high | 90.2 | Very high | 0 Ų | 0 | 35.2 Ų | 35.2 | 0% | 0 | 17% | 0.169 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -52.2 | -45.3 | -174.8 | -169.5 | 69.7 | 0 | 0 | 0 | 115.1 | L2462 I2463 V2468 V2472 R2473 L2631 L2650 I2665 L2666 Y2669 | L2462-L2466 WeakPolarHBondContact O-CB 3.29Å; L2462-L2466 PolarHBondContact O-N 3.36Å; I2463-L2466 VanDerWaalsContact O-CB 3.23Å; I2463-L2466 WeakPolarHBondContact O-CB 3.4Å; I2463-L2466 PolarHBondContact O-N 3.33Å; L2466-V2468 VanDerWaalsContact C-N 3.29Å; L2466-V2468 PolarHBondContact O-N 2.81Å; L2466-V2472 HydrophobicContact CD1-CG1 4.14Å; L2466-R2473 HydrophobicContact CD1-CG 3.95Å; L2466-R2473 WeakPolarHBondContact O-CD 3.46Å; L2466-R2473 WeakPolarHBondContact O-CG 3.36Å; L2466-L2631 HydrophobicContact CD1-CD2 4.04Å; L2466-L2631 HydrophobicContact CD2-CD2 3.69Å; L2466-L2631 HydrophobicContact CG-CD2 4.45Å; L2466-L2650 HydrophobicContact CD2-CD2 4.06Å; L2466-I2665 HydrophobicContact CG-CG2 4.27Å; L2466-L2666 HydrophobicContact CD2-CD2 4.4Å; L2466-Y2669 HydrophobicContact CD1-CE1 4.34Å; L2466-Y2669 HydrophobicContact CD1-CE2 3.95Å; L2466-Y2669 HydrophobicContact CD2-CD1 4.22Å; L2466-Y2669 HydrophobicContact CD2-CD2 3.68Å; L2466-Y2669 HydrophobicContact CD2-CE1 4.4Å; L2466-Y2669 HydrophobicContact CD2-CE2 3.91Å; L2466-Y2669 HydrophobicContact CD2-CG 3.84Å; L2466-Y2669 HydrophobicContact CG-CD2 4.43Å; L2466-Y2669 HydrophobicContact CG-CE2 4.21Å |
| 2467 | P | 89.5 | Confident | 90.1 | Very high | 11 Ų | 11 | 34.2 Ų | 34.2 | 7% | 0.071 | 17% | 0.168 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -68.6 | -27.3 | -179.6 | 4.1 | -0.8 | 0 | 0 | 0 | 113.2 | L2465 E2662 L2666 | L2465-P2467 VanDerWaalsContact C-CD 3.47Å; P2467-E2662 HydrophobicContact CB-CB 4.12Å; P2467-E2662 HydrophobicContact CB-CG 3.92Å; P2467-L2666 HydrophobicContact CB-CD1 4.22Å; P2467-L2666 HydrophobicContact CB-CG 4.36Å |
| 2468 | V | 88.7 | Confident | 89.8 | Confident | 46.5 Ų | 46.5 | 32.3 Ų | 32.3 | 28% | 0.282 | 16% | 0.158 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -110.6 | -17.8 | -168.2 | -62.2 | 0 | 0 | 0 | 0 | 114.4 | Y2421 M2433 L2465 L2466 | Y2421-V2468 HydrophobicContact CE1-CG1 4.01Å; Y2421-V2468 HydrophobicContact CE1-CG2 4.16Å; Y2421-V2468 WeakPolarHBondContact OH-CG2 3.37Å; M2433-V2468 HydrophobicContact CB-CG2 4.4Å; M2433-V2468 HydrophobicContact CG-CG2 3.93Å; M2433-V2468 HydrophobicContact SD-CB 4.21Å; M2433-V2468 HydrophobicContact SD-CG2 3.96Å; L2465-V2468 HydrophobicContact CD2-CG2 4.38Å; L2465-V2468 WeakPolarHBondContact O-CG2 3.37Å; L2465-V2468 PolarHBondContact O-N 3.26Å; L2465-V2468 VanDerWaalsContact O-N 3.13Å; L2466-V2468 VanDerWaalsContact C-N 3.29Å; L2466-V2468 PolarHBondContact O-N 2.81Å |
| 2469 | S | 90.5 | Very high | 89.3 | Confident | 16.5 Ų | 16.5 | 35.7 Ų | 35.7 | 12% | 0.115 | 17% | 0.174 | C | C | . | . | trans | -111.1 | 110.5 | -175.1 | -175.6 | 0 | 0 | 0 | 0 | 112.2 | L2465 E2471 V2472 R2473 | L2465-S2469 VanDerWaalsContact O-CB 3.28Å; L2465-S2469 WeakPolarHBondContact O-CB 3.45Å; L2465-S2469 PolarHBondContact O-N 3.04Å; S2469-E2471 VanDerWaalsContact C-N 3.34Å; S2469-E2471 PolarHBondContact O-N 3.24Å; S2469-E2471 PolarHBondContact OG-N 3.49Å; S2469-V2472 PolarHBondContact O-N 3.37Å; S2469-V2472 PolarHBondContact OG-N 2.96Å; S2469-R2473 WeakPolarHBondContact O-CG 3.4Å; S2469-R2473 PolarHBondContact O-N 3.13Å; S2469-R2473 PolarHBondContact O-NE 3.45Å | ||
| 2470 | E | 86.8 | Confident | 88.5 | Confident | 127 Ų | 127 | 38.8 Ų | 38.8 | 59% | 0.593 | 19% | 0.194 | S | C | * | . | H | α-helix | trans | -59.3 | -37.4 | 170.8 | -69.7 | -118.2 | 154.3 | 0 | 0 | 112.3 | V2472 R2473 L2474 | E2470-V2472 VanDerWaalsContact C-N 3.34Å; E2470-V2472 PolarHBondContact O-N 3.37Å; E2470-R2473 VanDerWaalsContact CD-CZ 3.49Å; E2470-R2473 VanDerWaalsContact CD-NH2 3.29Å; E2470-R2473 PolarHBondContact O-N 3.08Å; E2470-R2473 VanDerWaalsContact O-N 3.16Å; E2470-R2473 IonicContact OE1-CZ 3.22Å; E2470-R2473 IonicContact OE1-NH1 3.77Å; E2470-R2473 PolarHBondContact OE1-NH1 3.47Å; E2470-R2473 IonicContact OE1-NH2 3.64Å; E2470-R2473 PolarHBondContact OE1-NH2 3.48Å; E2470-R2473 IonicContact OE2-CZ 3.28Å; E2470-R2473 IonicContact OE2-NH1 2.63Å; E2470-R2473 PolarHBondContact OE2-NH1 3.38Å; E2470-R2473 IonicContact OE2-NH2 3.52Å; E2470-L2474 WeakPolarHBondContact O-CG 3.46Å; E2470-L2474 PolarHBondContact O-N 3.31Å |
| 2471 | E | 87 | Confident | 87.6 | Confident | 86 Ų | 86 | 42 Ų | 42 | 40% | 0.402 | 22% | 0.216 | S | C | . | . | H | α-helix | trans | -65.1 | -39 | -177.7 | -164 | 178.7 | 172.9 | 0 | 0 | 111.6 | Y2452 S2469 R2473 L2474 R2475 | Y2452-E2471 HydrophobicContact CE2-CG 4.08Å; Y2452-E2471 WeakPolarHBondContact CE2-OE1 3.34Å; Y2452-E2471 PolarHBondContact OH-OE1 3.35Å; Y2452-E2471 PolarHBondContact OH-OE2 3.27Å; S2469-E2471 VanDerWaalsContact C-N 3.34Å; S2469-E2471 PolarHBondContact O-N 3.24Å; S2469-E2471 PolarHBondContact OG-N 3.49Å; E2471-R2473 PolarHBondContact O-N 3.23Å; E2471-L2474 PolarHBondContact O-N 3.17Å; E2471-R2475 HydrophobicContact CG-CG 4.4Å; E2471-R2475 WeakPolarHBondContact O-CB 3.19Å; E2471-R2475 VanDerWaalsContact O-CG 3.24Å; E2471-R2475 WeakPolarHBondContact O-CG 3.32Å; E2471-R2475 PolarHBondContact O-N 3.15Å |
| 2472 | V | 88.5 | Confident | 86.7 | Confident | 0.5 Ų | 0.5 | 42.4 Ų | 42.4 | 0% | 0.003 | 22% | 0.219 | C | C | . | . | H | α-helix | trans | -64.4 | -42.4 | 174.3 | 174.1 | 0 | 0 | 0 | 0 | 110.7 | Y2452 L2462 L2465 L2466 S2469 E2470 L2474 R2475 C2476 | Y2452-V2472 HydrophobicContact CD1-CG2 4.19Å; Y2452-V2472 HydrophobicContact CE1-CG2 3.96Å; L2462-V2472 HydrophobicContact CB-CG1 4.42Å; L2462-V2472 HydrophobicContact CD2-CG1 4.16Å; L2462-V2472 HydrophobicContact CD2-CG2 4.33Å; L2465-V2472 HydrophobicContact CB-CG2 3.97Å; L2465-V2472 HydrophobicContact CD1-CG2 4.45Å; L2466-V2472 HydrophobicContact CD1-CG1 4.14Å; S2469-V2472 PolarHBondContact O-N 3.37Å; S2469-V2472 PolarHBondContact OG-N 2.96Å; E2470-V2472 VanDerWaalsContact C-N 3.34Å; E2470-V2472 PolarHBondContact O-N 3.37Å; V2472-L2474 VanDerWaalsContact C-N 3.32Å; V2472-L2474 PolarHBondContact O-N 3.23Å; V2472-R2475 PolarHBondContact O-N 2.98Å; V2472-C2476 WeakPolarHBondContact O-CB 3.35Å; V2472-C2476 PolarHBondContact O-N 3.25Å |
| 2473 | R | 89 | Confident | 85.9 | Confident | 65.5 Ų | 65.5 | 46.2 Ų | 46.2 | 25% | 0.247 | 24% | 0.238 | C | C | . | . | H | α-helix | trans | -65.4 | -34 | 178.1 | -60.6 | -167.9 | -64.3 | -146.7 | -91.3 | 112.9 | L2466 S2469 E2470 E2471 | L2466-R2473 HydrophobicContact CD1-CG 3.95Å; L2466-R2473 WeakPolarHBondContact O-CD 3.46Å; L2466-R2473 WeakPolarHBondContact O-CG 3.36Å; S2469-R2473 WeakPolarHBondContact O-CG 3.4Å; S2469-R2473 PolarHBondContact O-N 3.13Å; S2469-R2473 PolarHBondContact O-NE 3.45Å; E2470-R2473 VanDerWaalsContact CD-CZ 3.49Å; E2470-R2473 VanDerWaalsContact CD-NH2 3.29Å; E2470-R2473 PolarHBondContact O-N 3.08Å; E2470-R2473 VanDerWaalsContact O-N 3.16Å; E2470-R2473 IonicContact OE1-CZ 3.22Å; E2470-R2473 IonicContact OE1-NH1 3.77Å; E2470-R2473 PolarHBondContact OE1-NH1 3.47Å; E2470-R2473 IonicContact OE1-NH2 3.64Å; E2470-R2473 PolarHBondContact OE1-NH2 3.48Å; E2470-R2473 IonicContact OE2-CZ 3.28Å; E2470-R2473 IonicContact OE2-NH1 2.63Å; E2470-R2473 PolarHBondContact OE2-NH1 3.38Å; E2470-R2473 IonicContact OE2-NH2 3.52Å; E2471-R2473 PolarHBondContact O-N 3.23Å |
| 2474 | L | 87 | Confident | 85 | Confident | 141 Ų | 141 | 53.1 Ų | 53.1 | 74% | 0.738 | 27% | 0.268 | S | S | * | . | H | α-helix | trans | -73.5 | -33.6 | 175.4 | -71.6 | 171 | 0 | 0 | 0 | 112.9 | E2470 E2471 V2472 | E2470-L2474 WeakPolarHBondContact O-CG 3.46Å; E2470-L2474 PolarHBondContact O-N 3.31Å; E2471-L2474 PolarHBondContact O-N 3.17Å; V2472-L2474 VanDerWaalsContact C-N 3.32Å; V2472-L2474 PolarHBondContact O-N 3.23Å |
| 2475 | R | 87 | Confident | 84.1 | Confident | 112 Ų | 112 | 55.4 Ų | 55.4 | 42% | 0.423 | 29% | 0.287 | S | S | . | . | H | α-helix | trans | -88.3 | -20.8 | -178.4 | -67.4 | -65.6 | -166.9 | 119.9 | 6 | 114 | Y2452 E2471 V2472 P2477 N2629 | Y2452-R2475 HydrophobicContact CD2-CB 4.44Å; Y2452-R2475 HydrophobicContact CD2-CG 3.88Å; Y2452-R2475 HydrophobicContact CE2-CG 4.41Å; Y2452-R2475 HydrophobicContact CG-CB 4.12Å; Y2452-R2475 HydrophobicContact CG-CG 4.07Å; E2471-R2475 HydrophobicContact CG-CG 4.4Å; E2471-R2475 WeakPolarHBondContact O-CB 3.19Å; E2471-R2475 VanDerWaalsContact O-CG 3.24Å; E2471-R2475 WeakPolarHBondContact O-CG 3.32Å; E2471-R2475 PolarHBondContact O-N 3.15Å; V2472-R2475 PolarHBondContact O-N 2.98Å; R2475-P2477 VanDerWaalsContact C-CD 3.5Å; R2475-N2629 PolarHBondContact O-ND2 3.43Å |
| 2476 | C | 86.3 | Confident | 83.3 | Confident | 0 Ų | 0 | 56 Ų | 56 | 0% | 0 | 29% | 0.29 | C | S | . | . | S | Bend | trans | -128.3 | 65 | 178.3 | -54.9 | 0 | 0 | 0 | 0 | 110.8 | V2472 N2629 L2631 Y2669 | V2472-C2476 WeakPolarHBondContact O-CB 3.35Å; V2472-C2476 PolarHBondContact O-N 3.25Å; C2476-N2629 WeakPolarHBondContact CA-O 3.15Å; C2476-N2629 PolarHBondContact SG-ND2 3.28Å; C2476-N2629 VanDerWaalsContact SG-ND2 3.42Å; C2476-L2631 HydrophobicContact CB-CB 4.09Å; C2476-L2631 HydrophobicContact CB-CD1 4.4Å; C2476-Y2669 PolarHBondContact O-OH 3.24Å |
| 2477 | P | 84.5 | Confident | 82.1 | Confident | 51.5 Ų | 51.5 | 59.7 Ų | 59.7 | 33% | 0.334 | 32% | 0.316 | S | S | . | . | P | Polyproline II helix | trans | -66.9 | 161 | -175.6 | 30.5 | -36.6 | 0 | 0 | 0 | 112.4 | R2475 L2630 | R2475-P2477 VanDerWaalsContact C-CD 3.5Å; P2477-L2630 WeakPolarHBondContact O-CD2 3.36Å |
| 2478 | L | 82.2 | Confident | 80.1 | Confident | 18.5 Ų | 18.5 | 65 Ų | 65 | 10% | 0.097 | 34% | 0.343 | C | S | . | . | P | Polyproline II helix | trans | -62.2 | 145.9 | 165.6 | -66.8 | 165 | 0 | 0 | 0 | 110.1 | I2483 E2668 Y2669 E2672 | L2478-I2483 HydrophobicContact CB-CD1 4.22Å; L2478-I2483 HydrophobicContact CB-CG1 3.82Å; L2478-I2483 HydrophobicContact CD1-CG1 4.41Å; L2478-I2483 WeakPolarHBondContact O-CD1 3.49Å; L2478-E2668 HydrophobicContact CD1-CB 3.87Å; L2478-Y2669 HydrophobicContact CD2-CD1 3.53Å; L2478-Y2669 HydrophobicContact CD2-CD2 3.74Å; L2478-Y2669 HydrophobicContact CD2-CE1 3.73Å; L2478-Y2669 HydrophobicContact CD2-CE2 3.92Å; L2478-Y2669 HydrophobicContact CD2-CG 3.54Å; L2478-Y2669 HydrophobicContact CG-CD1 4.47Å; L2478-Y2669 HydrophobicContact CG-CD2 4.37Å; L2478-Y2669 HydrophobicContact CG-CE1 4.21Å; L2478-Y2669 HydrophobicContact CG-CE2 4.1Å; L2478-E2672 HydrophobicContact CD2-CB 4.23Å; L2478-E2672 WeakPolarHBondContact CD2-OE2 3.29Å |
| 2479 | H | 81.6 | Confident | 77.7 | Confident | 72 Ų | 72 | 73.8 Ų | 73.8 | 33% | 0.333 | 37% | 0.371 | S | S | . | . | P | Polyproline II helix | trans | -59.2 | 138.7 | 175.7 | -174.3 | -98.8 | 0 | 0 | 0 | 110.6 | S2481 T2482 I2483 L2630 E2672 | H2479-S2481 PolarHBondContact CE1-OG 3.25Å; H2479-S2481 WeakPolarHBondContact ND1-CB 3.5Å; H2479-S2481 PolarHBondContact ND1-N 3.13Å; H2479-S2481 PolarHBondContact ND1-OG 2.79Å; H2479-S2481 PolarHBondContact O-N 2.84Å; H2479-T2482 WeakPolarHBondContact O-CA 3.28Å; H2479-T2482 WeakPolarHBondContact O-CB 3.4Å; H2479-T2482 PolarHBondContact O-N 2.91Å; H2479-T2482 PolarHBondContact O-OG1 3.38Å; H2479-I2483 PolarHBondContact O-N 3.46Å; H2479-L2630 HydrophobicContact CB-CD1 4.41Å; H2479-L2630 HydrophobicContact CB-CD2 4.1Å; H2479-E2672 WeakPolarHBondContact CA-OE1 3.26Å; H2479-E2672 WeakPolarHBondContact CB-OE1 3.34Å; H2479-E2672 PolarHBondContact N-OE1 3.16Å |
| 2480 | P | 74 | Confident | 74.8 | Confident | 66 Ų | 66 | 82 Ų | 82 | 43% | 0.429 | 41% | 0.408 | S | S | . | . | H | α-helix | trans | -55.1 | -29.1 | -175.1 | -29.6 | 35.6 | 0 | 0 | 0 | 115.1 | K2484 E2628 | P2480-K2484 WeakPolarHBondContact O-CB 3.37Å; P2480-K2484 PolarHBondContact O-N 3.06Å; P2480-K2484 VanDerWaalsContact O-N 3.09Å; P2480-E2628 WeakPolarHBondContact CD-OE2 3.2Å |
| 2481 | S | 74.2 | Confident | 72.1 | Confident | 67 Ų | 67 | 80.7 Ų | 80.7 | 47% | 0.469 | 42% | 0.419 | S | S | . | . | H | α-helix | trans | -67.1 | -38.2 | 175 | 67 | 0 | 0 | 0 | 0 | 112.7 | H2479 K2484 A2485 | H2479-S2481 PolarHBondContact CE1-OG 3.25Å; H2479-S2481 WeakPolarHBondContact ND1-CB 3.5Å; H2479-S2481 PolarHBondContact ND1-N 3.13Å; H2479-S2481 PolarHBondContact ND1-OG 2.79Å; H2479-S2481 PolarHBondContact O-N 2.84Å; S2481-K2484 PolarHBondContact O-N 3.01Å; S2481-A2485 WeakPolarHBondContact O-CB 3.47Å; S2481-A2485 PolarHBondContact O-N 3.28Å |
| 2482 | T | 77.3 | Confident | 69.4 | Low | 8 Ų | 8 | 82 Ų | 82 | 5% | 0.049 | 44% | 0.437 | C | S | . | . | H | α-helix | trans | -66.3 | -47 | 177.3 | -45.2 | 0 | 0 | 0 | 0 | 109.9 | H2479 K2484 A2485 L2486 E2672 | H2479-T2482 WeakPolarHBondContact O-CA 3.28Å; H2479-T2482 WeakPolarHBondContact O-CB 3.4Å; H2479-T2482 PolarHBondContact O-N 2.91Å; H2479-T2482 PolarHBondContact O-OG1 3.38Å; T2482-K2484 VanDerWaalsContact C-N 3.25Å; T2482-K2484 PolarHBondContact O-N 2.8Å; T2482-A2485 WeakPolarHBondContact O-CB 3.42Å; T2482-A2485 PolarHBondContact O-N 3.14Å; T2482-A2485 VanDerWaalsContact O-N 3.1Å; T2482-L2486 HydrophobicContact CG2-CD1 3.8Å; T2482-L2486 HydrophobicContact CG2-CG 4.33Å; T2482-L2486 WeakPolarHBondContact O-CG 3.42Å; T2482-L2486 PolarHBondContact O-N 3.26Å; T2482-E2672 HydrophobicContact CG2-CB 3.71Å; T2482-E2672 HydrophobicContact CG2-CG 4.47Å; T2482-E2672 PolarHBondContact OG1-OE1 2.94Å |
| 2483 | I | 76.5 | Confident | 66.6 | Low | 79.5 Ų | 79.5 | 90.7 Ų | 90.7 | 41% | 0.408 | 48% | 0.478 | S | S | . | . | H | α-helix | trans | -56.3 | -44.1 | 176.8 | -61.1 | 175.2 | 0 | 0 | 0 | 110.3 | L2478 H2479 L2486 S2487 | L2478-I2483 HydrophobicContact CB-CD1 4.22Å; L2478-I2483 HydrophobicContact CB-CG1 3.82Å; L2478-I2483 HydrophobicContact CD1-CG1 4.41Å; L2478-I2483 WeakPolarHBondContact O-CD1 3.49Å; H2479-I2483 PolarHBondContact O-N 3.46Å; I2483-L2486 PolarHBondContact O-N 3.27Å; I2483-S2487 VanDerWaalsContact O-CB 3.3Å; I2483-S2487 WeakPolarHBondContact O-CB 3.29Å; I2483-S2487 PolarHBondContact O-N 3.17Å; I2483-S2487 VanDerWaalsContact O-N 3.13Å; I2483-S2487 PolarHBondContact O-OG 3.31Å |
| 2484 | K | 74.6 | Confident | 63.8 | Low | 146 Ų | 146 | 93.2 Ų | 93.2 | 64% | 0.635 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -64.3 | -43 | 177.2 | -169 | 175.2 | -178.3 | 179.8 | 0 | 112.2 | P2480 S2481 T2482 L2486 S2487 L2488 | P2480-K2484 WeakPolarHBondContact O-CB 3.37Å; P2480-K2484 PolarHBondContact O-N 3.06Å; P2480-K2484 VanDerWaalsContact O-N 3.09Å; S2481-K2484 PolarHBondContact O-N 3.01Å; T2482-K2484 VanDerWaalsContact C-N 3.25Å; T2482-K2484 PolarHBondContact O-N 2.8Å; K2484-L2486 VanDerWaalsContact C-N 3.33Å; K2484-L2486 PolarHBondContact O-N 3.16Å; K2484-S2487 PolarHBondContact O-N 3.25Å; K2484-L2488 HydrophobicContact CG-CD1 3.96Å; K2484-L2488 WeakPolarHBondContact O-CD1 3.39Å; K2484-L2488 WeakPolarHBondContact O-CG 3.34Å |
| 2485 | A | 74 | Confident | 61 | Low | 47 Ų | 47 | 92 Ų | 92 | 39% | 0.388 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -63.3 | -40.2 | 177.7 | 0 | 0 | 0 | 0 | 0 | 112.5 | S2481 T2482 S2487 | S2481-A2485 WeakPolarHBondContact O-CB 3.47Å; S2481-A2485 PolarHBondContact O-N 3.28Å; T2482-A2485 WeakPolarHBondContact O-CB 3.42Å; T2482-A2485 PolarHBondContact O-N 3.14Å; T2482-A2485 VanDerWaalsContact O-N 3.1Å; A2485-S2487 VanDerWaalsContact C-N 3.29Å; A2485-S2487 PolarHBondContact O-N 3.23Å |
| 2486 | L | 77.8 | Confident | 58.3 | Low | 14 Ų | 14 | 90.7 Ų | 90.7 | 7% | 0.073 | 52% | 0.521 | C | S | . | . | H | α-helix | trans | -77.8 | -17.8 | -178.9 | -64.6 | 171.7 | 0 | 0 | 0 | 113.9 | T2482 I2483 K2484 E2668 A2671 R2706 A2707 H2710 | T2482-L2486 HydrophobicContact CG2-CD1 3.8Å; T2482-L2486 HydrophobicContact CG2-CG 4.33Å; T2482-L2486 WeakPolarHBondContact O-CG 3.42Å; T2482-L2486 PolarHBondContact O-N 3.26Å; I2483-L2486 PolarHBondContact O-N 3.27Å; K2484-L2486 VanDerWaalsContact C-N 3.33Å; K2484-L2486 PolarHBondContact O-N 3.16Å; L2486-E2668 HydrophobicContact CD1-CB 4.04Å; L2486-E2668 HydrophobicContact CD1-CG 4.06Å; L2486-A2671 HydrophobicContact CD2-CB 4.2Å; L2486-R2706 PolarHBondContact O-NH1 3.18Å; L2486-A2707 HydrophobicContact CD2-CB 4.18Å; L2486-H2710 HydrophobicContact CD2-CB 3.98Å |
| 2487 | S | 67.2 | Low | 55.8 | Low | 78.5 Ų | 78.5 | 97.3 Ų | 97.3 | 55% | 0.549 | 56% | 0.556 | S | S | . | * | H | α-helix | trans | -94.4 | -14.2 | -175.5 | -58.6 | 0 | 0 | 0 | 0 | 115 | I2483 K2484 A2485 R2489 | I2483-S2487 VanDerWaalsContact O-CB 3.3Å; I2483-S2487 WeakPolarHBondContact O-CB 3.29Å; I2483-S2487 PolarHBondContact O-N 3.17Å; I2483-S2487 VanDerWaalsContact O-N 3.13Å; I2483-S2487 PolarHBondContact O-OG 3.31Å; K2484-S2487 PolarHBondContact O-N 3.25Å; A2485-S2487 VanDerWaalsContact C-N 3.29Å; A2485-S2487 PolarHBondContact O-N 3.23Å; S2487-R2489 PolarHBondContact O-N 3.14Å |
| 2488 | L | 47.3 | Very low | 53.3 | Low | 123 Ų | 123 | 101.9 Ų | 101.9 | 64% | 0.644 | 58% | 0.576 | S | S | * | * | trans | -93.4 | 88.6 | -169.9 | -80.6 | 163 | 0 | 0 | 0 | 113.7 | K2484 | K2484-L2488 HydrophobicContact CG-CD1 3.96Å; K2484-L2488 WeakPolarHBondContact O-CD1 3.39Å; K2484-L2488 WeakPolarHBondContact O-CG 3.34Å | ||
| 2489 | R | 37.7 | Very low | 50.9 | Low | 229.5 Ų | 229.5 | 105.2 Ų | 105.2 | 87% | 0.866 | 60% | 0.601 | S | S | * | * | trans | -177.3 | 67.1 | 143.2 | -114.5 | 179.4 | 173.7 | -169.6 | -2.3 | 113.8 | S2487 | S2487-R2489 PolarHBondContact O-N 3.14Š| ||
| 2490 | E | 31.3 | Very low | 48.4 | Very low | 190 Ų | 190 | 109.1 Ų | 109.1 | 89% | 0.888 | 62% | 0.624 | S | S | * | * | trans | -143.2 | 77.9 | 159.3 | -91.8 | 177.9 | -163.6 | 0 | 0 | 109.9 | ||||
| 2491 | A | 29.1 | Very low | 46.3 | Very low | 99.5 Ų | 99.5 | 111.1 Ų | 111.1 | 82% | 0.822 | 64% | 0.64 | S | S | * | * | trans | -172 | 94.8 | 163.4 | 0 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 2492 | S | 30.5 | Very low | 44 | Very low | 113 Ų | 113 | 113.6 Ų | 113.6 | 79% | 0.79 | 66% | 0.656 | S | S | * | * | trans | -153.4 | 91 | 150.6 | 118.2 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 2493 | E | 29.5 | Very low | 41.8 | Very low | 183.5 Ų | 183.5 | 121.6 Ų | 121.6 | 86% | 0.857 | 69% | 0.69 | S | S | * | * | S | Bend | trans | -157.1 | 136.3 | 133.3 | -84.7 | -174.3 | 167.3 | 0 | 0 | 109.1 | ||
| 2494 | C | 30.5 | Very low | 39.5 | Very low | 118 Ų | 118 | 125.6 Ų | 125.6 | 80% | 0.797 | 71% | 0.707 | S | S | * | * | S | Bend | trans | 71.7 | 80.6 | 166.7 | -59.6 | 0 | 0 | 0 | 0 | 117.9 | ||
| 2495 | S | 28.7 | Very low | 37.2 | Very low | 115.5 Ų | 115.5 | 123.8 Ų | 123.8 | 81% | 0.808 | 71% | 0.713 | S | S | * | * | 51 | 117.3 | 104.1 | -56.3 | 0 | 0 | 0 | 0 | 117.3 | |||||
| 2496 | A | 30 | Very low | 35 | Very low | 84 Ų | 84 | 125.5 Ų | 125.5 | 69% | 0.694 | 73% | 0.727 | S | S | * | * | 98.3 | 116.4 | 110.7 | 0 | 0 | 0 | 0 | 0 | 116.5 | |||||
| 2497 | N | 32.5 | Very low | 32.7 | Very low | 139 Ų | 139 | 132.1 Ų | 132.1 | 74% | 0.743 | 76% | 0.762 | S | S | * | * | trans | 117.3 | 96.7 | 136.3 | -68.3 | -12 | 0 | 0 | 0 | 115.4 | ||||
| 2498 | I | 33.3 | Very low | 30.8 | Very low | 148.5 Ų | 148.5 | 133.6 Ų | 133.6 | 76% | 0.762 | 77% | 0.773 | S | S | * | * | 63 | 116.6 | 101.6 | -65.3 | 169.2 | 0 | 0 | 0 | 114.5 | |||||
| 2499 | S | 30.7 | Very low | 29.9 | Very low | 88.5 Ų | 88.5 | 131.7 Ų | 131.7 | 62% | 0.619 | 77% | 0.774 | S | S | * | * | 124.9 | 133.5 | 61.6 | 64.3 | 0 | 0 | 0 | 0 | 113.1 | |||||
| 2500 | N | 29.6 | Very low | 29.4 | Very low | 153.5 Ų | 153.5 | 126 Ų | 126 | 82% | 0.821 | 77% | 0.769 | S | S | * | * | trans | 54.6 | 133.3 | 138.1 | -63.7 | -5.8 | 0 | 0 | 0 | 119.5 | ||||
| 2501 | S | 30.3 | Very low | 29.2 | Very low | 107 Ų | 107 | 124.2 Ų | 124.2 | 75% | 0.748 | 77% | 0.765 | S | S | * | * | cis | 174.5 | 145.4 | 38.6 | 47.3 | 0 | 0 | 0 | 0 | 107.5 | ||||
| 2502 | C | 26.6 | Very low | 29.2 | Very low | 119.5 Ų | 119.5 | 123.8 Ų | 123.8 | 81% | 0.807 | 76% | 0.762 | S | S | * | * | trans | -139.9 | 117.8 | 163 | -74.2 | 0 | 0 | 0 | 0 | 108.7 | ||||
| 2503 | K | 29.9 | Very low | 29.1 | Very low | 176.5 Ų | 176.5 | 122.8 Ų | 122.8 | 77% | 0.767 | 76% | 0.761 | S | S | * | * | 129.8 | 133.4 | 104.6 | -93 | -176.5 | 176.7 | -168.6 | 0 | 113.4 | |||||
| 2504 | E | 29.3 | Very low | 29 | Very low | 163.5 Ų | 163.5 | 119.4 Ų | 119.4 | 76% | 0.764 | 76% | 0.756 | S | S | * | * | trans | 60.1 | 119.4 | 149.5 | -64.5 | 162.5 | 177.8 | 0 | 0 | 116.6 | ||||
| 2505 | S | 25.6 | Very low | 28.9 | Very low | 108.5 Ų | 108.5 | 122 Ų | 122 | 76% | 0.759 | 75% | 0.754 | S | S | * | * | 103.7 | 141.4 | 62.5 | 51.5 | 0 | 0 | 0 | 0 | 112.5 | |||||
| 2506 | A | 27.5 | Very low | 29 | Very low | 82.5 Ų | 82.5 | 123.4 Ų | 123.4 | 68% | 0.682 | 75% | 0.747 | S | S | * | * | 130 | 137.9 | 127 | 0 | 0 | 0 | 0 | 0 | 116.2 | |||||
| 2507 | D | 28.6 | Very low | 28.9 | Very low | 152.5 Ų | 152.5 | 126.7 Ų | 126.7 | 82% | 0.816 | 75% | 0.748 | S | S | * | * | trans | 70.7 | 123.5 | 139.2 | -58.9 | -17.6 | 0 | 0 | 0 | 123.7 | ||||
| 2508 | S | 28.9 | Very low | 28.6 | Very low | 110 Ų | 110 | 124.4 Ų | 124.4 | 77% | 0.769 | 75% | 0.749 | S | S | * | * | trans | 78.3 | 101.1 | 132.8 | 139.7 | 0 | 0 | 0 | 0 | 120.5 | ||||
| 2509 | A | 28.3 | Very low | 28.4 | Very low | 82.5 Ų | 82.5 | 122.1 Ų | 122.1 | 68% | 0.682 | 75% | 0.746 | S | S | * | * | 51.8 | 128.7 | 117.3 | 0 | 0 | 0 | 0 | 0 | 121.5 | |||||
| 2510 | C | 26.4 | Very low | 28.2 | Very low | 111.5 Ų | 111.5 | 123 Ų | 123 | 75% | 0.753 | 75% | 0.752 | S | S | * | * | trans | 68.5 | 133.8 | 139.2 | 79.6 | 0 | 0 | 0 | 0 | 120.1 | ||||
| 2511 | D | 26.8 | Very low | 28.1 | Very low | 151.5 Ų | 151.5 | 121.1 Ų | 121.1 | 81% | 0.81 | 75% | 0.746 | S | S | * | * | 143.4 | 142 | 58.7 | -100.1 | -27 | 0 | 0 | 0 | 113.6 | |||||
| 2512 | A | 29.3 | Very low | 28 | Very low | 90.5 Ų | 90.5 | 123.6 Ų | 123.6 | 75% | 0.748 | 75% | 0.751 | S | S | * | * | trans | 67.5 | 141.2 | 134.4 | 0 | 0 | 0 | 0 | 0 | 118 | ||||
| 2513 | A | 29.4 | Very low | 28 | Very low | 93 Ų | 93 | 121.4 Ų | 121.4 | 77% | 0.769 | 75% | 0.749 | S | S | * | * | 139.2 | 136.8 | 65.3 | 0 | 0 | 0 | 0 | 0 | 112.2 | |||||
| 2514 | C | 26.6 | Very low | 28 | Very low | 112 Ų | 112 | 117.8 Ų | 117.8 | 76% | 0.757 | 75% | 0.751 | S | S | * | * | cis | 119 | 146.7 | 39.3 | -170.7 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 2515 | K | 29.5 | Very low | 28 | Very low | 172 Ų | 172 | 118.8 Ų | 118.8 | 75% | 0.748 | 76% | 0.756 | S | S | * | * | trans | 128.6 | 135.9 | 158.1 | -81.2 | 175.6 | -172.5 | 174.3 | 0 | 111 | ||||
| 2516 | Q | 30 | Very low | 28.4 | Very low | 144 Ų | 144 | 119.1 Ų | 119.1 | 67% | 0.673 | 76% | 0.755 | S | S | * | * | cis | -165.8 | 157 | 11.9 | -102.5 | 166 | -38.5 | 0 | 0 | 108.6 | ||||
| 2517 | Q | 27.6 | Very low | 28.4 | Very low | 154 Ų | 154 | 119 Ų | 119 | 72% | 0.72 | 75% | 0.754 | S | S | * | * | 130.7 | 136.2 | 57.9 | -95 | 163.9 | -28.2 | 0 | 0 | 113.7 | |||||
| 2518 | A | 27.2 | Very low | 28.5 | Very low | 91 Ų | 91 | 121.5 Ų | 121.5 | 75% | 0.752 | 75% | 0.754 | S | S | * | * | 42.6 | 142 | 112.1 | 0 | 0 | 0 | 0 | 0 | 116.3 | |||||
| 2519 | S | 27.4 | Very low | 28.5 | Very low | 101 Ų | 101 | 124.6 Ų | 124.6 | 71% | 0.706 | 76% | 0.756 | S | S | * | * | cis | 177.7 | 151.3 | 20.3 | 46.8 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 2520 | S | 26.9 | Very low | 28.5 | Very low | 105.5 Ų | 105.5 | 123.6 Ų | 123.6 | 74% | 0.738 | 75% | 0.753 | S | S | * | * | trans | 79.8 | 141.5 | 139.9 | 95.4 | 0 | 0 | 0 | 0 | 120.2 | ||||
| 2521 | V | 28 | Very low | 28.7 | Very low | 115.5 Ų | 115.5 | 124.4 Ų | 124.4 | 70% | 0.7 | 76% | 0.755 | S | S | * | * | 135 | 134.9 | 80.5 | 142.8 | 0 | 0 | 0 | 0 | 115.2 | |||||
| 2522 | N | 27.3 | Very low | 28.8 | Very low | 159 Ų | 159 | 125.1 Ų | 125.1 | 85% | 0.85 | 76% | 0.758 | S | S | * | * | trans | 61.5 | 134.5 | 155.5 | -59.5 | -11.6 | 0 | 0 | 0 | 120.5 | ||||
| 2523 | G | 27 | Very low | 28.9 | Very low | 73.5 Ų | 73.5 | 124.2 Ų | 124.2 | 76% | 0.758 | 76% | 0.757 | S | S | * | * | 147.2 | 136.6 | 69.6 | 0 | 0 | 0 | 0 | 0 | 113.8 | |||||
| 2524 | A | 30.5 | Very low | 28.9 | Very low | 100 Ų | 100 | 123.5 Ų | 123.5 | 83% | 0.826 | 75% | 0.752 | S | S | * | * | trans | 75.2 | 117.3 | 157.2 | 0 | 0 | 0 | 0 | 0 | 121.7 | ||||
| 2525 | H | 28.1 | Very low | 29 | Very low | 184.5 Ų | 184.5 | 129.6 Ų | 129.6 | 85% | 0.854 | 76% | 0.759 | S | S | * | * | trans | -13.8 | 167.4 | 137 | -77.3 | -66.8 | 0 | 0 | 0 | 117.4 | ||||
| 2526 | P | 34.2 | Very low | 28.9 | Very low | 114.5 Ų | 114.5 | 130.2 Ų | 130.2 | 74% | 0.744 | 76% | 0.761 | S | S | * | * | cis | -143.4 | 177.9 | 5.2 | 37.5 | -15.8 | 0 | 0 | 0 | 118.1 | ||||
| 2527 | A | 29.1 | Very low | 28.8 | Very low | 80.5 Ų | 80.5 | 130.4 Ų | 130.4 | 67% | 0.665 | 77% | 0.766 | S | S | * | * | trans | 69.2 | 117.6 | 143.6 | 0 | 0 | 0 | 0 | 0 | 122.8 | ||||
| 2528 | Y | 29.4 | Very low | 28.7 | Very low | 206 Ų | 206 | 134.1 Ų | 134.1 | 81% | 0.808 | 77% | 0.774 | S | S | * | * | 128.2 | 137.6 | 119.2 | -95.2 | -93.1 | 0 | 0 | 0 | 119.1 | |||||
| 2529 | H | 29.7 | Very low | 28.6 | Very low | 175 Ų | 175 | 138 Ų | 138 | 81% | 0.81 | 78% | 0.776 | S | S | * | * | trans | 46.5 | 133.5 | 163.5 | -67.3 | -61 | 0 | 0 | 0 | 121.3 | ||||
| 2530 | G | 28.6 | Very low | 28.7 | Very low | 61 Ų | 61 | 141.3 Ų | 141.3 | 63% | 0.629 | 78% | 0.781 | S | S | * | * | cis | 148.3 | 126.4 | -8.9 | 0 | 0 | 0 | 0 | 0 | 115.5 | ||||
| 2531 | T | 30.7 | Very low | 28.6 | Very low | 128 Ų | 128 | 144.8 Ų | 144.8 | 79% | 0.785 | 79% | 0.785 | S | S | * | * | trans | 124.1 | 129.6 | 149.1 | 24 | 0 | 0 | 0 | 0 | 114.4 | ||||
| 2532 | L | 29.1 | Very low | 28.5 | Very low | 166 Ų | 166 | 149.8 Ų | 149.8 | 87% | 0.869 | 79% | 0.791 | S | S | * | * | 127.6 | 140.9 | 56.2 | -117.9 | 120 | 0 | 0 | 0 | 112.4 | |||||
| 2533 | G | 30.3 | Very low | 28.4 | Very low | 71.5 Ų | 71.5 | 147.3 Ų | 147.3 | 74% | 0.737 | 79% | 0.786 | S | S | * | * | 166.4 | 119.7 | 76.2 | 0 | 0 | 0 | 0 | 0 | 114.2 | |||||
| 2534 | A | 30.4 | Very low | 28.3 | Very low | 79.5 Ų | 79.5 | 148.8 Ų | 148.8 | 66% | 0.657 | 78% | 0.784 | S | S | * | * | -144.6 | 142.6 | -92.9 | 0 | 0 | 0 | 0 | 0 | 109.8 | K2536 | A2534-K2536 HydrophobicContact CB-CG 4.17Š| |||
| 2535 | W | 28.9 | Very low | 28.2 | Very low | 240 Ų | 240 | 150.5 Ų | 150.5 | 91% | 0.909 | 78% | 0.779 | S | S | * | * | 176.8 | 112 | 109.7 | -72.6 | 48.7 | 0 | 0 | 0 | 112 | L2537 | W2535-L2537 HydrophobicContact CB-CD1 4.48Å; W2535-L2537 HydrophobicContact CE3-CD1 3.83Å; W2535-L2537 HydrophobicContact CE3-CG 4.16Å | |||
| 2536 | K | 26.5 | Very low | 28.2 | Very low | 183.5 Ų | 183.5 | 148.2 Ų | 148.2 | 80% | 0.798 | 77% | 0.773 | S | S | * | * | trans | -98.9 | 140 | -171.2 | -87 | 174 | 172 | 175.9 | 0 | 110.3 | A2534 R2538 | A2534-K2536 HydrophobicContact CB-CG 4.17Å; K2536-R2538 PolarHBondContact O-N 3.06Å | ||
| 2537 | L | 28.8 | Very low | 28.1 | Very low | 149 Ų | 149 | 149.7 Ų | 149.7 | 78% | 0.78 | 77% | 0.774 | S | S | * | * | trans | -88.9 | 111.8 | 167.7 | -109.6 | 122.7 | 0 | 0 | 0 | 111.4 | W2535 H2539 | W2535-L2537 HydrophobicContact CB-CD1 4.48Å; W2535-L2537 HydrophobicContact CE3-CD1 3.83Å; W2535-L2537 HydrophobicContact CE3-CG 4.16Å; L2537-H2539 WeakPolarHBondContact CD2-O 3.44Å | ||
| 2538 | R | 24.2 | Very low | 28.2 | Very low | 232 Ų | 232 | 153 Ų | 153 | 88% | 0.875 | 78% | 0.781 | S | S | * | * | trans | -130.5 | 92 | 158 | -122.4 | -172.2 | -165.2 | -171.2 | 5.2 | 108.8 | K2536 | K2536-R2538 PolarHBondContact O-N 3.06Š| ||
| 2539 | H | 26 | Very low | 28.4 | Very low | 173.5 Ų | 173.5 | 147.7 Ų | 147.7 | 80% | 0.803 | 78% | 0.779 | S | S | * | * | trans | -118.5 | 126.3 | 154.8 | -97 | -73.9 | 0 | 0 | 0 | 105.4 | L2537 | L2537-H2539 WeakPolarHBondContact CD2-O 3.44Š| ||
| 2540 | Q | 28.2 | Very low | 28.7 | Very low | 170 Ų | 170 | 144.7 Ų | 144.7 | 79% | 0.794 | 78% | 0.775 | S | S | * | * | 140.4 | 99.5 | 98.7 | -148.7 | 177.3 | 24.8 | 0 | 0 | 111.1 | |||||
| 2541 | Q | 25.5 | Very low | 28.8 | Very low | 177.5 Ų | 177.5 | 147 Ų | 147 | 83% | 0.829 | 78% | 0.782 | S | S | * | * | trans | -107.9 | 137.6 | 163.3 | -86.5 | 178.4 | -23.4 | 0 | 0 | 107.6 | ||||
| 2542 | R | 26.4 | Very low | 29.1 | Very low | 222 Ų | 222 | 146.3 Ų | 146.3 | 84% | 0.838 | 78% | 0.78 | S | S | * | * | -138.1 | 120 | 79.1 | -80.2 | -175.5 | 171.8 | 175.8 | -5.2 | 106.5 | |||||
| 2543 | S | 25 | Very low | 29.1 | Very low | 105 Ų | 105 | 143.5 Ų | 143.5 | 73% | 0.734 | 77% | 0.774 | S | S | * | * | 62.7 | 125.9 | 92.9 | 140.2 | 0 | 0 | 0 | 0 | 111.9 | |||||
| 2544 | C | 23.9 | Very low | 29.1 | Very low | 105.5 Ų | 105.5 | 146.2 Ų | 146.2 | 71% | 0.713 | 78% | 0.776 | S | S | * | * | cis | -135.7 | 155.1 | 17.7 | -51.7 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 2545 | D | 28.7 | Very low | 29 | Very low | 137 Ų | 137 | 147.2 Ų | 147.2 | 73% | 0.733 | 78% | 0.778 | S | S | * | * | 130.5 | 119.1 | 104 | -69.2 | -25.4 | 0 | 0 | 0 | 116.7 | |||||
| 2546 | N | 28.7 | Very low | 28.9 | Very low | 136 Ų | 136 | 140.1 Ų | 140.1 | 73% | 0.727 | 77% | 0.771 | S | S | * | * | 61.8 | 107.9 | 127.3 | -67.8 | -15.3 | 0 | 0 | 0 | 121.1 | |||||
| 2547 | L | 31.9 | Very low | 29 | Very low | 144.5 Ų | 144.5 | 137.5 Ų | 137.5 | 76% | 0.757 | 77% | 0.77 | S | S | * | * | 120.3 | 111.6 | 117.8 | -73.3 | 162.2 | 0 | 0 | 0 | 116.5 | |||||
| 2548 | D | 31.1 | Very low | 29 | Very low | 150.5 Ų | 150.5 | 135.6 Ų | 135.6 | 81% | 0.805 | 76% | 0.764 | S | S | * | * | trans | 64.2 | 145.3 | 134.8 | -59.4 | -21.5 | 0 | 0 | 0 | 122.2 | ||||
| 2549 | A | 33.5 | Very low | 29.3 | Very low | 94 Ų | 94 | 131.3 Ų | 131.3 | 78% | 0.777 | 76% | 0.759 | S | S | * | * | trans | 175 | 170.1 | 170.4 | 0 | 0 | 0 | 0 | 0 | 115.5 | ||||
| 2550 | P | 35.1 | Very low | 29.4 | Very low | 113 Ų | 113 | 132.7 Ų | 132.7 | 73% | 0.734 | 76% | 0.757 | S | S | * | * | -124.7 | 173.2 | -107.7 | 33.4 | -15.8 | 0 | 0 | 0 | 114.8 | |||||
| 2551 | S | 31.9 | Very low | 29.4 | Very low | 108.5 Ų | 108.5 | 132.3 Ų | 132.3 | 76% | 0.759 | 75% | 0.753 | S | S | * | * | trans | 21.6 | 162.7 | 161.4 | 12.1 | 0 | 0 | 0 | 0 | 115.3 | ||||
| 2552 | P | 36.8 | Very low | 29.6 | Very low | 114.5 Ų | 114.5 | 131.7 Ų | 131.7 | 74% | 0.744 | 75% | 0.75 | S | S | * | * | trans | -143.7 | 161.1 | 173.9 | 34.6 | -13.5 | 0 | 0 | 0 | 116.9 | ||||
| 2553 | S | 28.1 | Very low | 29.6 | Very low | 107 Ų | 107 | 125.7 Ų | 125.7 | 75% | 0.748 | 74% | 0.742 | S | S | * | * | trans | 74.7 | 147.6 | 136.4 | 54.6 | 0 | 0 | 0 | 0 | 118.5 | ||||
| 2554 | T | 30.5 | Very low | 29.7 | Very low | 128 Ų | 128 | 127.1 Ų | 127.1 | 79% | 0.785 | 75% | 0.746 | S | S | * | * | trans | 136.7 | 110.5 | 147.5 | 19.4 | 0 | 0 | 0 | 0 | 115.8 | ||||
| 2555 | S | 29.1 | Very low | 29.9 | Very low | 100.5 Ų | 100.5 | 125.5 Ų | 125.5 | 70% | 0.703 | 75% | 0.748 | S | S | * | * | 84.2 | 106.7 | 113.7 | 0.1 | 0 | 0 | 0 | 0 | 117.6 | |||||
| 2556 | A | 27.4 | Very low | 29.9 | Very low | 91.5 Ų | 91.5 | 129.9 Ų | 129.9 | 76% | 0.756 | 76% | 0.756 | S | S | * | * | 71.6 | 127.2 | 84.2 | 0 | 0 | 0 | 0 | 0 | 117.2 | |||||
| 2557 | V | 28.2 | Very low | 29.9 | Very low | 129 Ų | 129 | 128.8 Ų | 128.8 | 78% | 0.782 | 76% | 0.759 | S | S | * | * | 137.3 | 134.8 | 65.7 | 147.7 | 0 | 0 | 0 | 0 | 113.4 | |||||
| 2558 | V | 29.7 | Very low | 29.6 | Very low | 107.5 Ų | 107.5 | 126.6 Ų | 126.6 | 65% | 0.652 | 76% | 0.755 | S | S | * | * | trans | 87.8 | 113.5 | 142 | -167.5 | 0 | 0 | 0 | 0 | 121.5 | ||||
| 2559 | N | 29.2 | Very low | 29.6 | Very low | 142 Ų | 142 | 127.7 Ų | 127.7 | 76% | 0.759 | 76% | 0.756 | S | S | * | * | 114 | 147.2 | 124.7 | -83.2 | -35.9 | 0 | 0 | 0 | 115.9 | |||||
| 2560 | R | 28.1 | Very low | 29.1 | Very low | 204 Ų | 204 | 133.1 Ų | 133.1 | 77% | 0.77 | 76% | 0.756 | S | S | * | * | cis | -174.1 | 142.1 | 4.8 | -146.9 | 177.2 | -168.5 | -176.3 | 4.1 | 108.9 | ||||
| 2561 | K | 27.7 | Very low | 28.7 | Very low | 161 Ų | 161 | 132.2 Ų | 132.2 | 70% | 0.7 | 75% | 0.752 | S | S | * | * | trans | 69.2 | 135 | 150 | -66.4 | 179.2 | 179.9 | -173.9 | 0 | 119.8 | ||||
| 2562 | Q | 30.1 | Very low | 28.4 | Very low | 164.5 Ų | 164.5 | 136.8 Ų | 136.8 | 77% | 0.769 | 75% | 0.754 | S | S | * | * | 135.8 | 140.2 | 79.6 | -95 | 161.8 | -12.8 | 0 | 0 | 114.6 | |||||
| 2563 | S | 26.5 | Very low | 27.8 | Very low | 96.5 Ų | 96.5 | 136.3 Ų | 136.3 | 68% | 0.675 | 75% | 0.754 | S | S | * | * | 120.8 | 148 | 63.7 | 61.9 | 0 | 0 | 0 | 0 | 116.9 | |||||
| 2564 | T | 28.4 | Very low | 27.7 | Very low | 134.5 Ų | 134.5 | 138.9 Ų | 138.9 | 83% | 0.825 | 76% | 0.758 | S | S | * | * | 133.2 | 135.8 | 103 | 50.2 | 0 | 0 | 0 | 0 | 116 | |||||
| 2565 | G | 28.2 | Very low | 27.5 | Very low | 72 Ų | 72 | 138.2 Ų | 138.2 | 74% | 0.742 | 76% | 0.756 | S | S | * | * | trans | 115.6 | 96.3 | 164.2 | 0 | 0 | 0 | 0 | 0 | 114.8 | ||||
| 2566 | Y | 27.5 | Very low | 27.4 | Very low | 229 Ų | 229 | 141.3 Ų | 141.3 | 90% | 0.898 | 76% | 0.764 | S | S | * | * | -113.6 | 126.5 | 104.3 | -82.2 | -99.3 | 0 | 0 | 0 | 110.6 | |||||
| 2567 | S | 29.1 | Very low | 27.4 | Very low | 113.5 Ų | 113.5 | 140.1 Ų | 140.1 | 79% | 0.794 | 76% | 0.76 | S | S | * | * | trans | 121.9 | 130.7 | 134.4 | 118.5 | 0 | 0 | 0 | 0 | 112.6 | ||||
| 2568 | S | 26.4 | Very low | 27.2 | Very low | 98.5 Ų | 98.5 | 138.8 Ų | 138.8 | 69% | 0.689 | 76% | 0.757 | S | S | * | * | -141.7 | 131.3 | 108.1 | -176.9 | 0 | 0 | 0 | 0 | 110.6 | |||||
| 2569 | Q | 29.6 | Very low | 27 | Very low | 173.5 Ų | 173.5 | 140.2 Ų | 140.2 | 81% | 0.811 | 77% | 0.766 | S | S | * | * | trans | -48.8 | 140.2 | 142.9 | -63.1 | -172.3 | -16.3 | 0 | 0 | 115 | ||||
| 2570 | R | 23.7 | Very low | 26.9 | Very low | 206.5 Ų | 206.5 | 139.3 Ų | 139.3 | 78% | 0.779 | 77% | 0.765 | S | S | * | * | -131.6 | 136.3 | 94.9 | -96.7 | 170.8 | 172.3 | 168.4 | -5 | 108.2 | |||||
| 2571 | S | 25.8 | Very low | 26.7 | Very low | 93.5 Ų | 93.5 | 134.5 Ų | 134.5 | 65% | 0.654 | 77% | 0.769 | S | S | * | * | trans | 145.1 | 127.8 | 151.9 | -5.1 | 0 | 0 | 0 | 0 | 116 | S2573 | S2571-S2573 PolarHBondContact O-N 3.16Š| ||
| 2572 | Y | 25.7 | Very low | 26.4 | Very low | 205.5 Ų | 205.5 | 130.7 Ų | 130.7 | 81% | 0.806 | 76% | 0.762 | S | S | * | * | trans | -168.3 | 103.8 | 163.9 | -63.8 | -81.8 | 0 | 0 | 0 | 113.7 | ||||
| 2573 | S | 24.9 | Very low | 26 | Very low | 104.5 Ų | 104.5 | 128.7 Ų | 128.7 | 73% | 0.731 | 76% | 0.763 | S | S | * | * | trans | -67.5 | 103.5 | 150.3 | 53.5 | 0 | 0 | 0 | 0 | 113.2 | S2571 P2575 | S2571-S2573 PolarHBondContact O-N 3.16Å; S2573-P2575 WeakPolarHBondContact O-CD 3.33Å | ||
| 2574 | L | 26.2 | Very low | 25.9 | Very low | 161.5 Ų | 161.5 | 129.6 Ų | 129.6 | 85% | 0.846 | 76% | 0.764 | S | S | * | * | trans | -115 | 117.7 | 166.3 | -85.1 | 160 | 0 | 0 | 0 | 108.8 | ||||
| 2575 | P | 26.3 | Very low | 25.7 | Very low | 114 Ų | 114 | 132.5 Ų | 132.5 | 74% | 0.74 | 77% | 0.766 | S | S | * | * | P | Polyproline II helix | trans | -84.7 | 132.1 | 165.3 | 16.3 | -1.9 | 0 | 0 | 0 | 109 | S2573 G2577 | S2573-P2575 WeakPolarHBondContact O-CD 3.33Å; P2575-G2577 PolarHBondContact O-N 2.93Å |
| 2576 | L | 27.2 | Very low | 25.6 | Very low | 165.5 Ų | 165.5 | 136 Ų | 136 | 87% | 0.866 | 76% | 0.763 | S | S | * | * | P | Polyproline II helix | trans | -113.8 | 118.8 | 166.2 | -135.9 | 66.5 | 0 | 0 | 0 | 109.8 | S2578 | L2576-S2578 PolarHBondContact O-N 3.45Š|
| 2577 | G | 26.1 | Very low | 25.7 | Very low | 66 Ų | 66 | 128.4 Ų | 128.4 | 68% | 0.68 | 74% | 0.743 | S | S | * | * | P | Polyproline II helix | trans | -66.6 | 132.2 | 169 | 0 | 0 | 0 | 0 | 0 | 110.1 | P2575 T2579 | P2575-G2577 PolarHBondContact O-N 2.93Å; G2577-T2579 PolarHBondContact O-N 3.43Å |
| 2578 | S | 24.1 | Very low | 25.8 | Very low | 100.5 Ų | 100.5 | 125.8 Ų | 125.8 | 70% | 0.703 | 73% | 0.725 | S | S | * | * | 107.8 | 110.6 | 126.7 | 60.2 | 0 | 0 | 0 | 0 | 109.3 | L2576 V2580 | L2576-S2578 PolarHBondContact O-N 3.45Å; S2578-V2580 PolarHBondContact O-N 3.08Å | |||
| 2579 | T | 26.1 | Very low | 26.1 | Very low | 137 Ų | 137 | 125.2 Ų | 125.2 | 84% | 0.84 | 71% | 0.713 | S | S | * | * | trans | 9 | 126.2 | 171.9 | 58.4 | 0 | 0 | 0 | 0 | 110.4 | G2577 | G2577-T2579 PolarHBondContact O-N 3.43Š| ||
| 2580 | V | 26.2 | Very low | 26.2 | Very low | 124 Ų | 124 | 121.6 Ų | 121.6 | 75% | 0.752 | 70% | 0.699 | S | S | * | * | -106 | 123 | 92.8 | 173 | 0 | 0 | 0 | 0 | 107.4 | S2578 C2582 | S2578-V2580 PolarHBondContact O-N 3.08Å; V2580-C2582 PolarHBondContact O-N 2.9Å; V2580-C2582 VanDerWaalsContact O-N 3.09Å | |||
| 2581 | A | 24 | Very low | 26.6 | Very low | 103 Ų | 103 | 115.2 Ų | 115.2 | 85% | 0.851 | 68% | 0.68 | S | S | * | * | trans | -73.5 | 95.8 | 170.3 | 0 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 2582 | C | 21.7 | Very low | 27 | Very low | 81 Ų | 81 | 118.3 Ų | 118.3 | 55% | 0.547 | 68% | 0.677 | S | S | . | * | trans | -77.9 | 140.3 | 158.5 | -86.3 | 0 | 0 | 0 | 0 | 108.9 | E2267 V2580 V2584 | E2267-C2582 PolarHBondContact OE1-SG 3.48Å; V2580-C2582 PolarHBondContact O-N 2.9Å; V2580-C2582 VanDerWaalsContact O-N 3.09Å; C2582-V2584 VanDerWaalsContact C-N 3.32Å; C2582-V2584 PolarHBondContact O-N 2.87Å | ||
| 2583 | P | 22.8 | Very low | 27.5 | Very low | 122 Ų | 122 | 113 Ų | 113 | 79% | 0.792 | 66% | 0.662 | S | S | * | * | trans | -73.8 | 92.5 | -165 | 31.4 | -35.3 | 0 | 0 | 0 | 110.3 | K2585 | P2583-K2585 VanDerWaalsContact C-N 3.28Å; P2583-K2585 PolarHBondContact O-N 3.21Å | ||
| 2584 | V | 24.3 | Very low | 27.9 | Very low | 116.5 Ų | 116.5 | 113.3 Ų | 113.3 | 71% | 0.706 | 65% | 0.648 | S | S | * | * | trans | -60.6 | 114.5 | 153.5 | -179.2 | 0 | 0 | 0 | 0 | 105.1 | C2582 E2586 | C2582-V2584 VanDerWaalsContact C-N 3.32Å; C2582-V2584 PolarHBondContact O-N 2.87Å; V2584-E2586 PolarHBondContact O-N 3.35Å | ||
| 2585 | K | 24.8 | Very low | 28.3 | Very low | 195.5 Ų | 195.5 | 110.8 Ų | 110.8 | 85% | 0.85 | 64% | 0.636 | S | S | * | * | trans | -53.1 | 108.1 | 164.1 | -83.4 | 178 | 174.4 | 176.7 | 0 | 106.9 | P2583 S2587 | P2583-K2585 VanDerWaalsContact C-N 3.28Å; P2583-K2585 PolarHBondContact O-N 3.21Å; K2585-S2587 PolarHBondContact O-N 3.12Å | ||
| 2586 | E | 25.9 | Very low | 28.5 | Very low | 146 Ų | 146 | 114.4 Ų | 114.4 | 68% | 0.682 | 64% | 0.636 | S | S | * | * | trans | -50.4 | 119.4 | 175.7 | -75.2 | 166.4 | 141.7 | 0 | 0 | 108 | V2584 S2588 N2591 | V2584-E2586 PolarHBondContact O-N 3.35Å; E2586-S2588 PolarHBondContact O-N 3.05Å; E2586-N2591 HydrophobicContact CB-CB 3.88Å; E2586-N2591 WeakPolarHBondContact CB-ND2 3.2Å; E2586-N2591 WeakPolarHBondContact CG-ND2 3.47Å; E2586-N2591 WeakPolarHBondContact CG-OD1 3.38Å; E2586-N2591 PolarHBondContact OE1-ND2 3.33Å; E2586-N2591 PolarHBondContact OE1-OD1 3.3Å; E2586-N2591 VanDerWaalsContact OE1-OD1 3.09Å; E2586-N2591 PolarHBondContact OE2-ND2 3.05Å | ||
| 2587 | S | 28.6 | Very low | 28.6 | Very low | 68 Ų | 68 | 113.4 Ų | 113.4 | 48% | 0.476 | 63% | 0.631 | S | S | . | * | trans | -59.2 | 119.6 | 170.5 | 46.4 | 0 | 0 | 0 | 0 | 106.9 | K2585 I2589 L2590 | K2585-S2587 PolarHBondContact O-N 3.12Å; S2587-I2589 PolarHBondContact O-N 2.95Å; S2587-L2590 PolarHBondContact O-N 3.2Å | ||
| 2588 | S | 30.7 | Very low | 28.7 | Very low | 60 Ų | 60 | 119.7 Ų | 119.7 | 42% | 0.42 | 64% | 0.64 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -72.7 | 23.6 | -163.7 | 50.9 | 0 | 0 | 0 | 0 | 114 | E2586 R2592 | E2586-S2588 PolarHBondContact O-N 3.05Å; S2588-R2592 WeakPolarHBondContact O-CB 3.43Å; S2588-R2592 WeakPolarHBondContact O-CD 3.49Å; S2588-R2592 WeakPolarHBondContact O-CG 3.45Å; S2588-R2592 PolarHBondContact O-NE 3.24Å; S2588-R2592 PolarHBondContact O-NH2 2.9Å; S2588-R2592 PolarHBondContact OG-NH2 3.42Å |
| 2589 | I | 33.5 | Very low | 28.8 | Very low | 84.5 Ų | 84.5 | 119 Ų | 119 | 43% | 0.433 | 64% | 0.635 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -99.8 | -43.1 | 174.9 | -56.5 | 176.4 | 0 | 0 | 0 | 109.7 | S2587 N2591 R2592 L2593 | S2587-I2589 PolarHBondContact O-N 2.95Å; I2589-N2591 VanDerWaalsContact C-N 3.31Å; I2589-N2591 PolarHBondContact O-N 2.77Å; I2589-R2592 CarbonylContact O-C 3.59Å; I2589-R2592 PolarHBondContact O-N 3.19Å; I2589-R2592 VanDerWaalsContact O-N 3.1Å; I2589-L2593 HydrophobicContact CG2-CD1 3.8Å; I2589-L2593 HydrophobicContact CG2-CG 4.19Å; I2589-L2593 WeakPolarHBondContact O-CB 3.44Å; I2589-L2593 VanDerWaalsContact O-CG 3.31Å; I2589-L2593 WeakPolarHBondContact O-CG 3.22Å; I2589-L2593 PolarHBondContact O-N 3.38Å |
| 2590 | L | 31.8 | Very low | 28.9 | Very low | 98.5 Ų | 98.5 | 118.5 Ų | 118.5 | 52% | 0.516 | 63% | 0.632 | S | S | . | * | H | α-helix | trans | -67.5 | -40.1 | 179.5 | -116 | 149.3 | 0 | 0 | 0 | 111.6 | S2587 R2592 L2593 Y2594 | S2587-L2590 PolarHBondContact O-N 3.2Å; L2590-R2592 VanDerWaalsContact C-N 3.31Å; L2590-R2592 PolarHBondContact O-N 3.03Å; L2590-L2593 PolarHBondContact O-N 3.13Å; L2590-Y2594 HydrophobicContact CD2-CD2 4.32Å; L2590-Y2594 HydrophobicContact CD2-CE2 4.23Å; L2590-Y2594 WeakPolarHBondContact O-CB 3.39Å; L2590-Y2594 WeakPolarHBondContact O-CD2 3.35Å; L2590-Y2594 PolarHBondContact O-N 2.94Å |
| 2591 | N | 31.6 | Very low | 28.8 | Very low | 72 Ų | 72 | 119.5 Ų | 119.5 | 39% | 0.385 | 63% | 0.633 | S | S | . | * | H | α-helix | trans | -75.6 | -20 | 174.3 | -105.7 | -3.9 | 0 | 0 | 0 | 114.8 | E2586 I2589 L2593 N2595 | E2586-N2591 HydrophobicContact CB-CB 3.88Å; E2586-N2591 WeakPolarHBondContact CB-ND2 3.2Å; E2586-N2591 WeakPolarHBondContact CG-ND2 3.47Å; E2586-N2591 WeakPolarHBondContact CG-OD1 3.38Å; E2586-N2591 PolarHBondContact OE1-ND2 3.33Å; E2586-N2591 PolarHBondContact OE1-OD1 3.3Å; E2586-N2591 VanDerWaalsContact OE1-OD1 3.09Å; E2586-N2591 PolarHBondContact OE2-ND2 3.05Å; I2589-N2591 VanDerWaalsContact C-N 3.31Å; I2589-N2591 PolarHBondContact O-N 2.77Å; N2591-L2593 VanDerWaalsContact C-N 3.29Å; N2591-N2595 VanDerWaalsContact O-CB 3.31Å; N2591-N2595 WeakPolarHBondContact O-CB 3.31Å; N2591-N2595 PolarHBondContact O-N 3.33Å; N2591-N2595 PolarHBondContact O-ND2 3.29Å |
| 2592 | R | 34.7 | Very low | 28.9 | Very low | 159 Ų | 159 | 124.8 Ų | 124.8 | 60% | 0.6 | 63% | 0.631 | S | S | * | * | H | α-helix | trans | -76.6 | -29.7 | 172.2 | -95.4 | -173.5 | -94.2 | -158.1 | -5.9 | 112.6 | S2588 I2589 L2590 Y2594 N2595 Y2596 | S2588-R2592 WeakPolarHBondContact O-CB 3.43Å; S2588-R2592 WeakPolarHBondContact O-CD 3.49Å; S2588-R2592 WeakPolarHBondContact O-CG 3.45Å; S2588-R2592 PolarHBondContact O-NE 3.24Å; S2588-R2592 PolarHBondContact O-NH2 2.9Å; S2588-R2592 PolarHBondContact OG-NH2 3.42Å; I2589-R2592 CarbonylContact O-C 3.59Å; I2589-R2592 PolarHBondContact O-N 3.19Å; I2589-R2592 VanDerWaalsContact O-N 3.1Å; L2590-R2592 VanDerWaalsContact C-N 3.31Å; L2590-R2592 PolarHBondContact O-N 3.03Å; R2592-Y2594 VanDerWaalsContact C-N 3.27Å; R2592-Y2594 PolarHBondContact O-N 3.2Å; R2592-N2595 PolarHBondContact O-N 2.93Å; R2592-Y2596 PolarHBondContact O-N 3.29Å |
| 2593 | L | 35.3 | Very low | 29.1 | Very low | 94.5 Ų | 94.5 | 126.8 Ų | 126.8 | 50% | 0.495 | 64% | 0.636 | S | S | . | * | H | α-helix | trans | -82.1 | -30.1 | 177 | -72.9 | 164.7 | 0 | 0 | 0 | 112.5 | T2369 I2589 L2590 N2591 | T2369-L2593 HydrophobicContact CG2-CD1 3.79Å; T2369-L2593 HydrophobicContact CG2-CD2 3.91Å; I2589-L2593 HydrophobicContact CG2-CD1 3.8Å; I2589-L2593 HydrophobicContact CG2-CG 4.19Å; I2589-L2593 WeakPolarHBondContact O-CB 3.44Å; I2589-L2593 VanDerWaalsContact O-CG 3.31Å; I2589-L2593 WeakPolarHBondContact O-CG 3.22Å; I2589-L2593 PolarHBondContact O-N 3.38Å; L2590-L2593 PolarHBondContact O-N 3.13Å; N2591-L2593 VanDerWaalsContact C-N 3.29Å |
| 2594 | Y | 35 | Very low | 29.3 | Very low | 111 Ų | 111 | 129 Ų | 129 | 44% | 0.435 | 64% | 0.635 | S | S | . | * | H | α-helix | trans | -84.9 | -17.1 | 176.2 | -87.4 | -85.2 | 0 | 0 | 0 | 115 | R2434 L2590 R2592 Y2596 | R2434-Y2594 WeakPolarHBondContact CG-OH 3.48Å; L2590-Y2594 HydrophobicContact CD2-CD2 4.32Å; L2590-Y2594 HydrophobicContact CD2-CE2 4.23Å; L2590-Y2594 WeakPolarHBondContact O-CB 3.39Å; L2590-Y2594 WeakPolarHBondContact O-CD2 3.35Å; L2590-Y2594 PolarHBondContact O-N 2.94Å; R2592-Y2594 VanDerWaalsContact C-N 3.27Å; R2592-Y2594 PolarHBondContact O-N 3.2Å; Y2594-Y2596 VanDerWaalsContact C-N 3.33Å |
| 2595 | N | 32.6 | Very low | 29.5 | Very low | 108.5 Ų | 108.5 | 128.5 Ų | 128.5 | 58% | 0.58 | 64% | 0.636 | S | S | * | * | trans | -101.8 | 12.9 | 179.5 | -74.4 | -51.8 | 0 | 0 | 0 | 115.3 | N2591 R2592 D2597 | N2591-N2595 VanDerWaalsContact O-CB 3.31Å; N2591-N2595 WeakPolarHBondContact O-CB 3.31Å; N2591-N2595 PolarHBondContact O-N 3.33Å; N2591-N2595 PolarHBondContact O-ND2 3.29Å; R2592-N2595 PolarHBondContact O-N 2.93Å; N2595-D2597 PolarHBondContact O-N 2.77Å | ||
| 2596 | Y | 30.9 | Very low | 29.5 | Very low | 190 Ų | 190 | 125.4 Ų | 125.4 | 75% | 0.745 | 63% | 0.634 | S | S | * | * | trans | -77.1 | -1.9 | -179.7 | -149.3 | -99.3 | 0 | 0 | 0 | 114.6 | R2592 Y2594 K2598 S2599 | R2592-Y2596 PolarHBondContact O-N 3.29Å; Y2594-Y2596 VanDerWaalsContact C-N 3.33Å; Y2596-K2598 PolarHBondContact O-N 3.09Å; Y2596-S2599 PolarHBondContact O-OG 3.37Å | ||
| 2597 | D | 29.1 | Very low | 30 | Very low | 143 Ų | 143 | 123.4 Ų | 123.4 | 77% | 0.765 | 63% | 0.634 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -108.3 | 21.3 | -172 | -146.2 | 9.7 | 0 | 0 | 0 | 114.7 | N2595 | N2595-D2597 PolarHBondContact O-N 2.77Š|
| 2598 | K | 28.2 | Very low | 30.1 | Very low | 198.5 Ų | 198.5 | 129 Ų | 129 | 86% | 0.863 | 65% | 0.652 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -126.2 | 25.2 | 171.6 | -77.2 | -169.6 | 177.5 | 174.6 | 0 | 114.8 | Y2596 | Y2596-K2598 PolarHBondContact O-N 3.09Š|
| 2599 | S | 27.1 | Very low | 29.9 | Very low | 87 Ų | 87 | 130.2 Ų | 130.2 | 61% | 0.608 | 67% | 0.667 | S | S | * | * | trans | -143.7 | 70 | 171.7 | 61 | 0 | 0 | 0 | 0 | 111.1 | Y2596 | Y2596-S2599 PolarHBondContact O-OG 3.37Š| ||
| 2600 | V | 28.1 | Very low | 29.9 | Very low | 126.5 Ų | 126.5 | 130.3 Ų | 130.3 | 77% | 0.767 | 68% | 0.68 | S | S | * | * | -118.8 | 103 | 115 | -177.3 | 0 | 0 | 0 | 0 | 110.2 | |||||
| 2601 | N | 24 | Very low | 29.8 | Very low | 145 Ų | 145 | 135.7 Ų | 135.7 | 78% | 0.775 | 70% | 0.695 | S | S | * | * | trans | -121.6 | 149.5 | 158.5 | -117.5 | -20.8 | 0 | 0 | 0 | 108.5 | ||||
| 2602 | W | 27 | Very low | 29.7 | Very low | 214 Ų | 214 | 140.7 Ų | 140.7 | 81% | 0.811 | 72% | 0.718 | S | S | * | * | trans | 96 | 101.8 | 170.1 | -53.1 | 108.8 | 0 | 0 | 0 | 121 | ||||
| 2603 | L | 25.2 | Very low | 29.7 | Very low | 123 Ų | 123 | 138.2 Ų | 138.2 | 64% | 0.644 | 73% | 0.731 | S | S | * | * | 84.2 | 104.9 | 126.8 | -55.2 | 169 | 0 | 0 | 0 | 124.1 | |||||
| 2604 | H | 26.6 | Very low | 29.3 | Very low | 167 Ų | 167 | 137.5 Ų | 137.5 | 77% | 0.773 | 75% | 0.746 | S | S | * | * | 75.6 | 144 | 121.6 | -72.1 | -40.2 | 0 | 0 | 0 | 125.1 | |||||
| 2605 | S | 28.3 | Very low | 29.2 | Very low | 106 Ų | 106 | 141.3 Ų | 141.3 | 74% | 0.741 | 77% | 0.771 | S | S | * | * | trans | 102.1 | 86.9 | 149 | -33.8 | 0 | 0 | 0 | 0 | 120.3 | ||||
| 2606 | T | 26 | Very low | 28.8 | Very low | 131 Ų | 131 | 141.2 Ų | 141.2 | 80% | 0.804 | 78% | 0.779 | S | S | * | * | -2.1 | 166.6 | 126.8 | 47.5 | 0 | 0 | 0 | 0 | 121.6 | |||||
| 2607 | P | 36.5 | Very low | 28.8 | Very low | 105 Ų | 105 | 138.1 Ų | 138.1 | 68% | 0.682 | 78% | 0.781 | S | S | * | * | cis | -142.6 | -169 | -1.9 | 32.6 | -8.1 | 0 | 0 | 0 | 117.6 | ||||
| 2608 | Q | 29.2 | Very low | 28.7 | Very low | 184 Ų | 184 | 142 Ų | 142 | 86% | 0.86 | 79% | 0.786 | S | S | * | * | trans | 78.3 | 149.1 | 158.2 | -69.5 | 173.6 | -23.3 | 0 | 0 | 119.6 | ||||
| 2609 | A | 27.6 | Very low | 28.9 | Very low | 87 Ų | 87 | 138.9 Ų | 138.9 | 72% | 0.719 | 79% | 0.785 | S | S | * | * | cis | -172.2 | 136.9 | -29.4 | 0 | 0 | 0 | 0 | 0 | 107.1 | ||||
| 2610 | A | 32.3 | Very low | 29 | Very low | 85 Ų | 85 | 140.4 Ų | 140.4 | 70% | 0.702 | 80% | 0.796 | S | S | * | * | 178.4 | 129.9 | 92.6 | 0 | 0 | 0 | 0 | 0 | 109.3 | |||||
| 2611 | Y | 29.8 | Very low | 29.1 | Very low | 213 Ų | 213 | 142.3 Ų | 142.3 | 84% | 0.835 | 80% | 0.797 | S | S | * | * | 58.3 | 130.7 | 99.5 | -68 | -67.9 | 0 | 0 | 0 | 115.8 | |||||
| 2612 | M | 29.7 | Very low | 29.3 | Very low | 177 Ų | 177 | 141.3 Ų | 141.3 | 87% | 0.872 | 80% | 0.798 | S | S | * | * | cis | -148.9 | 148 | 4.4 | -56.5 | -173.9 | 176.5 | 0 | 0 | 111.9 | ||||
| 2613 | A | 34.9 | Very low | 29.4 | Very low | 106 Ų | 106 | 141.7 Ų | 141.7 | 88% | 0.876 | 80% | 0.799 | S | S | * | * | trans | -179.3 | 123.3 | 136.1 | 0 | 0 | 0 | 0 | 0 | 108.5 | ||||
| 2614 | G | 26.3 | Very low | 29.5 | Very low | 79 Ų | 79 | 141.9 Ų | 141.9 | 81% | 0.814 | 81% | 0.811 | S | S | * | * | trans | -109.7 | 133.9 | -170.5 | 0 | 0 | 0 | 0 | 0 | 114.3 | ||||
| 2615 | M | 33.4 | Very low | 29.7 | Very low | 192 Ų | 192 | 137.9 Ų | 137.9 | 95% | 0.946 | 80% | 0.802 | S | S | * | * | trans | -159.2 | 124.5 | 143.6 | -111 | 177.4 | 164.7 | 0 | 0 | 108.7 | ||||
| 2616 | S | 25.1 | Very low | 30.2 | Very low | 107 Ų | 107 | 142.6 Ų | 142.6 | 75% | 0.748 | 81% | 0.809 | S | S | * | * | trans | -82.3 | 146.1 | 177.8 | -173.3 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 2617 | P | 30 | Very low | 31.3 | Very low | 124 Ų | 124 | 144 Ų | 144 | 81% | 0.805 | 80% | 0.8 | S | S | * | * | -124.9 | 160.2 | 106.3 | 35.7 | -31.6 | 0 | 0 | 0 | 113.8 | |||||
| 2618 | R | 28.3 | Very low | 32.5 | Very low | 226 Ų | 226 | 144 Ų | 144 | 85% | 0.853 | 79% | 0.791 | S | S | * | * | P | Polyproline II helix | trans | -47.6 | 143.4 | -173.2 | -64.3 | 168.3 | 172.1 | 170.5 | -4.7 | 114.9 | S2620 | R2618-S2620 PolarHBondContact O-N 3.11Š|
| 2619 | P | 31.3 | Very low | 35 | Very low | 132 Ų | 132 | 137.6 Ų | 137.6 | 86% | 0.857 | 76% | 0.762 | S | S | * | * | P | Polyproline II helix | trans | -67.5 | 128.7 | 160.3 | 30.9 | -31.8 | 0 | 0 | 0 | 109.1 | ||
| 2620 | S | 29.2 | Very low | 37.8 | Very low | 119 Ų | 119 | 134.7 Ų | 134.7 | 83% | 0.832 | 73% | 0.734 | S | S | * | * | P | Polyproline II helix | trans | -90.4 | 151.3 | 167.3 | 33.2 | 0 | 0 | 0 | 0 | 110 | R2618 | R2618-S2620 PolarHBondContact O-N 3.11Š|
| 2621 | E | 30 | Very low | 40.4 | Very low | 167 Ų | 167 | 130.6 Ų | 130.6 | 78% | 0.78 | 70% | 0.701 | S | S | * | * | P | Polyproline II helix | trans | -62 | 152.2 | -170.7 | -60.8 | 159.8 | 138.5 | 0 | 0 | 112.8 | R2623 | E2621-R2623 PolarHBondContact O-N 3.33Š|
| 2622 | P | 29.7 | Very low | 43.2 | Very low | 123 Ų | 123 | 120.5 Ų | 120.5 | 80% | 0.799 | 66% | 0.661 | S | S | * | * | trans | -69.4 | 94.9 | 173.4 | 30 | -33.8 | 0 | 0 | 0 | 109.6 | S2624 | P2622-S2624 VanDerWaalsContact C-N 3.29Å; P2622-S2624 PolarHBondContact O-N 2.81Å | ||
| 2623 | R | 27.6 | Very low | 46 | Very low | 223 Ų | 223 | 113.4 Ų | 113.4 | 84% | 0.842 | 63% | 0.627 | S | S | * | * | trans | -67.8 | 88.1 | 173.9 | -79.8 | -172.8 | 169.5 | -178.3 | -3.8 | 110.7 | E2621 S2625 | E2621-R2623 PolarHBondContact O-N 3.33Å; R2623-S2625 PolarHBondContact O-N 2.81Å | ||
| 2624 | S | 27.3 | Very low | 48.3 | Very low | 127 Ų | 127 | 111.7 Ų | 111.7 | 89% | 0.888 | 61% | 0.607 | S | S | * | * | trans | -69.6 | 75 | 160.5 | 40 | 0 | 0 | 0 | 0 | 109.7 | P2622 | P2622-S2624 VanDerWaalsContact C-N 3.29Å; P2622-S2624 PolarHBondContact O-N 2.81Å | ||
| 2625 | S | 30.7 | Very low | 51.1 | Low | 83 Ų | 83 | 113.9 Ų | 113.9 | 58% | 0.58 | 60% | 0.596 | S | S | * | * | trans | -126.3 | 108 | 163.6 | 58.2 | 0 | 0 | 0 | 0 | 108 | R2623 R2627 | R2623-S2625 PolarHBondContact O-N 2.81Å; S2625-R2627 PolarHBondContact O-N 3.09Å | ||
| 2626 | F | 39.1 | Very low | 53.5 | Low | 205 Ų | 205 | 106.7 Ų | 106.7 | 90% | 0.899 | 56% | 0.562 | S | S | * | * | trans | -59.2 | 91.5 | 159.1 | -86.6 | -98 | 0 | 0 | 0 | 107.4 | ||||
| 2627 | R | 49.6 | Very low | 56.5 | Low | 161 Ų | 161 | 101.6 Ų | 101.6 | 61% | 0.608 | 53% | 0.527 | S | S | * | . | trans | -60.3 | 134.2 | 146.7 | -90.7 | -175.5 | 155.9 | -150 | -4.8 | 105.5 | S2625 N2629 E2635 | S2625-R2627 PolarHBondContact O-N 3.09Å; R2627-N2629 PolarHBondContact O-N 3Å; R2627-E2635 IonicContact CZ-OE1 3.04Å; R2627-E2635 IonicContact CZ-OE2 3.33Å; R2627-E2635 IonicContact NH1-OE1 3.95Å; R2627-E2635 IonicContact NH1-OE2 3.84Å; R2627-E2635 PolarHBondContact NH1-OE2 3.32Å; R2627-E2635 IonicContact NH2-OE1 3.96Å; R2627-E2635 PolarHBondContact NH2-OE1 3.32Å; R2627-E2635 IonicContact NH2-OE2 2.61Å; R2627-E2635 PolarHBondContact NH2-OE2 3.09Å | ||
| 2628 | E | 62.1 | Low | 59.1 | Low | 105 Ų | 105 | 99.2 Ų | 99.2 | 49% | 0.491 | 51% | 0.513 | S | S | . | . | trans | -58 | 116.8 | 176.8 | -62.5 | -178.9 | 164.8 | 0 | 0 | 107.6 | P2480 L2630 | P2480-E2628 WeakPolarHBondContact CD-OE2 3.2Å; E2628-L2630 HydrophobicContact CB-CD1 4.35Å; E2628-L2630 HydrophobicContact CB-CD2 4.05Å; E2628-L2630 HydrophobicContact CB-CG 3.9Å; E2628-L2630 PolarHBondContact O-N 3.37Å | ||
| 2629 | N | 80.6 | Confident | 61.9 | Low | 48 Ų | 48 | 92.7 Ų | 92.7 | 26% | 0.257 | 49% | 0.492 | S | S | . | . | trans | -78.8 | 62.5 | -175.9 | 178.9 | 59.9 | 0 | 0 | 0 | 109.6 | Y2452 V2454 R2475 C2476 R2627 | Y2452-N2629 PolarHBondContact O-ND2 3.39Å; V2454-N2629 PolarHBondContact N-OD1 3.26Å; R2475-N2629 PolarHBondContact O-ND2 3.43Å; C2476-N2629 WeakPolarHBondContact CA-O 3.15Å; C2476-N2629 PolarHBondContact SG-ND2 3.28Å; C2476-N2629 VanDerWaalsContact SG-ND2 3.42Å; R2627-N2629 PolarHBondContact O-N 3Å | ||
| 2630 | L | 87.3 | Confident | 64.5 | Low | 26 Ų | 26 | 89.8 Ų | 89.8 | 14% | 0.136 | 47% | 0.473 | C | S | . | . | trans | -67.3 | 133.1 | -172.6 | -61 | 167.4 | 0 | 0 | 0 | 110.1 | P2477 H2479 E2628 L2632 D2633 | P2477-L2630 WeakPolarHBondContact O-CD2 3.36Å; H2479-L2630 HydrophobicContact CB-CD1 4.41Å; H2479-L2630 HydrophobicContact CB-CD2 4.1Å; E2628-L2630 HydrophobicContact CB-CD1 4.35Å; E2628-L2630 HydrophobicContact CB-CD2 4.05Å; E2628-L2630 HydrophobicContact CB-CG 3.9Å; E2628-L2630 PolarHBondContact O-N 3.37Å; L2630-L2632 PolarHBondContact O-N 3.07Å; L2630-L2632 VanDerWaalsContact O-N 3.16Å; L2630-D2633 HydrophobicContact CB-CB 4.39Å; L2630-D2633 PolarHBondContact O-N 3.26Å | ||
| 2631 | L | 87.3 | Confident | 67.3 | Low | 0 Ų | 0 | 84.8 Ų | 84.8 | 0% | 0 | 44% | 0.438 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -60 | -30.2 | -179.8 | -172.1 | 63.4 | 0 | 0 | 0 | 112.5 | L2462 I2463 L2466 C2476 Y2669 | L2462-L2631 HydrophobicContact CB-CD1 3.79Å; L2462-L2631 HydrophobicContact CD1-CD1 4.46Å; I2463-L2631 HydrophobicContact CG1-CD1 4.35Å; I2463-L2631 HydrophobicContact CG1-CD2 4.21Å; I2463-L2631 HydrophobicContact CG1-CG 4.48Å; L2466-L2631 HydrophobicContact CD1-CD2 4.04Å; L2466-L2631 HydrophobicContact CD2-CD2 3.69Å; L2466-L2631 HydrophobicContact CG-CD2 4.45Å; C2476-L2631 HydrophobicContact CB-CB 4.09Å; C2476-L2631 HydrophobicContact CB-CD1 4.4Å; L2631-Y2669 HydrophobicContact CB-CD1 4.26Å; L2631-Y2669 HydrophobicContact CB-CE1 3.94Å; L2631-Y2669 HydrophobicContact CD2-CD1 3.75Å; L2631-Y2669 HydrophobicContact CD2-CE1 3.81Å |
| 2632 | L | 89 | Confident | 70.1 | Confident | 0 Ų | 0 | 77 Ų | 77 | 0% | 0 | 40% | 0.401 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -113.4 | 34.4 | -174.1 | -60.8 | 174.3 | 0 | 0 | 0 | 111.8 | L2630 P2634 L2637 T2646 L2650 Y2669 E2672 A2673 I2676 F2677 | L2630-L2632 PolarHBondContact O-N 3.07Å; L2630-L2632 VanDerWaalsContact O-N 3.16Å; L2632-P2634 VanDerWaalsContact O-CD 3.31Å; L2632-P2634 WeakPolarHBondContact O-CD 3.5Å; L2632-L2637 HydrophobicContact CD2-CD1 4.32Å; L2632-T2646 HydrophobicContact CD2-CG2 3.75Å; L2632-L2650 HydrophobicContact CD2-CD1 4.38Å; L2632-Y2669 WeakPolarHBondContact CD1-O 3.37Å; L2632-E2672 HydrophobicContact CD1-CB 4.08Å; L2632-E2672 HydrophobicContact CD1-CG 3.82Å; L2632-A2673 HydrophobicContact CD1-CB 3.72Å; L2632-I2676 HydrophobicContact CB-CD1 3.99Å; L2632-F2677 HydrophobicContact CB-CE2 4.21Å; L2632-F2677 HydrophobicContact CD2-CE2 4.27Å |
| 2633 | D | 87.1 | Confident | 73 | Confident | 28 Ų | 28 | 72.2 Ų | 72.2 | 15% | 0.15 | 37% | 0.369 | C | S | . | . | trans | -60.8 | 115.9 | 177.3 | -174.2 | -12.3 | 0 | 0 | 0 | 111.2 | L2630 E2635 V2636 L2637 | L2630-D2633 HydrophobicContact CB-CB 4.39Å; L2630-D2633 PolarHBondContact O-N 3.26Å; D2633-E2635 VanDerWaalsContact C-N 3.27Å; D2633-E2635 PolarHBondContact O-N 3.31Å; D2633-E2635 WeakPolarHBondContact OD1-CB 3.39Å; D2633-E2635 PolarHBondContact OD1-N 3.03Å; D2633-V2636 HydrophobicContact CB-CB 4.3Å; D2633-V2636 HydrophobicContact CB-CG2 4.17Å; D2633-V2636 PolarHBondContact O-N 3.43Å; D2633-L2637 WeakPolarHBondContact O-CB 3.41Å; D2633-L2637 PolarHBondContact O-N 3.36Å | ||
| 2634 | P | 83.5 | Confident | 76 | Confident | 70 Ų | 70 | 61.8 Ų | 61.8 | 46% | 0.455 | 33% | 0.33 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -70.6 | -17.4 | 179.3 | 30.7 | -36.2 | 0 | 0 | 0 | 113.8 | L2632 I2676 F2677 | L2632-P2634 VanDerWaalsContact O-CD 3.31Å; L2632-P2634 WeakPolarHBondContact O-CD 3.5Å; P2634-I2676 HydrophobicContact CB-CG2 4.1Å; P2634-I2676 HydrophobicContact CG-CG2 4.25Å; P2634-F2677 HydrophobicContact CB-CE1 4.27Å |
| 2635 | E | 84.4 | Confident | 79.1 | Confident | 126 Ų | 126 | 55.8 Ų | 55.8 | 59% | 0.589 | 29% | 0.287 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -72.4 | -34.1 | 172.3 | -65.5 | -171.3 | -165.9 | 0 | 0 | 111.3 | R2627 D2633 | R2627-E2635 IonicContact CZ-OE1 3.04Å; R2627-E2635 IonicContact CZ-OE2 3.33Å; R2627-E2635 IonicContact NH1-OE1 3.95Å; R2627-E2635 IonicContact NH1-OE2 3.84Å; R2627-E2635 PolarHBondContact NH1-OE2 3.32Å; R2627-E2635 IonicContact NH2-OE1 3.96Å; R2627-E2635 PolarHBondContact NH2-OE1 3.32Å; R2627-E2635 IonicContact NH2-OE2 2.61Å; R2627-E2635 PolarHBondContact NH2-OE2 3.09Å; D2633-E2635 VanDerWaalsContact C-N 3.27Å; D2633-E2635 PolarHBondContact O-N 3.31Å; D2633-E2635 WeakPolarHBondContact OD1-CB 3.39Å; D2633-E2635 PolarHBondContact OD1-N 3.03Å |
| 2636 | V | 84.8 | Confident | 82 | Confident | 40 Ų | 40 | 51.8 Ų | 51.8 | 24% | 0.242 | 26% | 0.26 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -85.5 | -48.3 | 177.9 | 179.2 | 0 | 0 | 0 | 0 | 111.3 | V2454 M2456 D2633 C2638 | V2454-V2636 HydrophobicContact CG1-CG1 4.34Å; V2454-V2636 WeakPolarHBondContact O-CG1 3.43Å; M2456-V2636 WeakPolarHBondContact CE-O 3.21Å; D2633-V2636 HydrophobicContact CB-CB 4.3Å; D2633-V2636 HydrophobicContact CB-CG2 4.17Å; D2633-V2636 PolarHBondContact O-N 3.43Å; V2636-C2638 PolarHBondContact O-N 3.39Å |
| 2637 | L | 87.2 | Confident | 84.6 | Confident | 0 Ų | 0 | 42.1 Ų | 42.1 | 0% | 0 | 22% | 0.217 | C | C | . | . | S | Bend | trans | -85.3 | 55.9 | -179.9 | -54.7 | -176 | 0 | 0 | 0 | 110.2 | V2459 L2632 D2633 I2642 Q2643 T2646 F2677 | V2459-L2637 HydrophobicContact CB-CD2 4.24Å; V2459-L2637 HydrophobicContact CG1-CD2 4.2Å; V2459-L2637 HydrophobicContact CG2-CD1 4.48Å; V2459-L2637 HydrophobicContact CG2-CD2 3.97Å; L2632-L2637 HydrophobicContact CD2-CD1 4.32Å; D2633-L2637 WeakPolarHBondContact O-CB 3.41Å; D2633-L2637 PolarHBondContact O-N 3.36Å; L2637-I2642 HydrophobicContact CD2-CG2 3.88Å; L2637-Q2643 HydrophobicContact CB-CG 4.4Å; L2637-Q2643 VanDerWaalsContact O-CD 3.31Å; L2637-Q2643 VanDerWaalsContact O-CG 3.22Å; L2637-Q2643 WeakPolarHBondContact O-CG 3.48Å; L2637-Q2643 PolarHBondContact O-NE2 3.32Å; L2637-T2646 HydrophobicContact CD1-CG2 4.27Å; L2637-F2677 HydrophobicContact CB-CZ 4.15Å; L2637-F2677 HydrophobicContact CD1-CE2 4.46Å; L2637-F2677 HydrophobicContact CD1-CZ 4.24Å |
| 2638 | C | 84.6 | Confident | 86.6 | Confident | 75 Ų | 75 | 34.4 Ų | 34.4 | 51% | 0.507 | 19% | 0.188 | S | C | . | . | trans | -82.9 | -17.4 | -174.1 | 63.2 | 0 | 0 | 0 | 0 | 114.2 | M2456 V2636 | M2456-C2638 WeakPolarHBondContact CE-SG 3.33Å; V2636-C2638 PolarHBondContact O-N 3.39Å | ||
| 2639 | E | 86.7 | Confident | 88.1 | Confident | 88 Ų | 88 | 29.4 Ų | 29.4 | 41% | 0.411 | 17% | 0.165 | S | C | . | . | trans | -84 | 129.6 | 177.1 | -68.4 | -157.8 | 170 | 0 | 0 | 113 | M2456 S2641 I2642 Q2643 | M2456-E2639 HydrophobicContact CE-CG 4.22Å; E2639-S2641 PolarHBondContact O-N 3.23Å; E2639-S2641 VanDerWaalsContact O-N 3.15Å; E2639-S2641 PolarHBondContact OE2-OG 2.98Å; E2639-I2642 HydrophobicContact CB-CB 4.31Å; E2639-I2642 HydrophobicContact CB-CD1 4.11Å; E2639-I2642 HydrophobicContact CB-CG1 4.08Å; E2639-I2642 HydrophobicContact CG-CD1 4.36Å; E2639-I2642 PolarHBondContact O-N 3.04Å; E2639-I2642 VanDerWaalsContact O-N 3.17Å; E2639-Q2643 WeakPolarHBondContact O-CG 3.17Å; E2639-Q2643 PolarHBondContact O-N 3.36Å | ||
| 2640 | P | 85.9 | Confident | 88.7 | Confident | 72 Ų | 72 | 27.1 Ų | 27.1 | 47% | 0.468 | 15% | 0.153 | S | C | . | . | H | α-helix | trans | -57.5 | -29.6 | 174 | -27.4 | 35.9 | 0 | 0 | 0 | 114.3 | V2644 I2680 | P2640-V2644 WeakPolarHBondContact O-CB 3.28Å; P2640-V2644 VanDerWaalsContact O-CG2 3.27Å; P2640-V2644 WeakPolarHBondContact O-CG2 3.39Å; P2640-V2644 PolarHBondContact O-N 2.88Å; P2640-I2680 HydrophobicContact CB-CD1 4.1Å |
| 2641 | S | 88.4 | Confident | 88.9 | Confident | 13 Ų | 13 | 25.9 Ų | 25.9 | 9% | 0.091 | 15% | 0.146 | C | C | . | . | H | α-helix | trans | -63.5 | -50.9 | 177 | 73.1 | 0 | 0 | 0 | 0 | 110.8 | H2408 E2639 V2644 L2645 | H2408-S2641 PolarHBondContact NE2-OG 3.09Å; E2639-S2641 PolarHBondContact O-N 3.23Å; E2639-S2641 VanDerWaalsContact O-N 3.15Å; E2639-S2641 PolarHBondContact OE2-OG 2.98Å; S2641-V2644 PolarHBondContact O-N 2.88Å; S2641-L2645 WeakPolarHBondContact O-CG 3.42Å; S2641-L2645 PolarHBondContact O-N 3.37Å |
| 2642 | I | 90 | Very high | 89.2 | Confident | 3 Ų | 3 | 26 Ų | 26 | 2% | 0.015 | 15% | 0.146 | C | C | . | . | H | α-helix | trans | -67.8 | -39 | 179.7 | -59.9 | 177.5 | 0 | 0 | 0 | 110.7 | H2408 F2411 M2456 V2459 L2637 E2639 L2645 T2646 | H2408-I2642 VanDerWaalsContact CE1-CG1 3.44Å; H2408-I2642 WeakPolarHBondContact CE1-CG1 3.32Å; F2411-I2642 HydrophobicContact CE2-CG2 4.17Å; F2411-I2642 HydrophobicContact CZ-CG2 4.33Å; M2456-I2642 HydrophobicContact CB-CD1 3.73Å; M2456-I2642 HydrophobicContact CE-CD1 4.3Å; M2456-I2642 HydrophobicContact CG-CD1 3.53Å; M2456-I2642 HydrophobicContact SD-CD1 3.76Å; V2459-I2642 HydrophobicContact CG1-CG2 4.25Å; L2637-I2642 HydrophobicContact CD2-CG2 3.88Å; E2639-I2642 HydrophobicContact CB-CB 4.31Å; E2639-I2642 HydrophobicContact CB-CD1 4.11Å; E2639-I2642 HydrophobicContact CB-CG1 4.08Å; E2639-I2642 HydrophobicContact CG-CD1 4.36Å; E2639-I2642 PolarHBondContact O-N 3.04Å; E2639-I2642 VanDerWaalsContact O-N 3.17Å; I2642-L2645 PolarHBondContact O-N 3.45Å; I2642-T2646 WeakPolarHBondContact O-CB 3.4Å; I2642-T2646 PolarHBondContact O-N 3.45Å; I2642-T2646 PolarHBondContact O-OG1 3.26Å |
| 2643 | Q | 90.5 | Very high | 89.4 | Confident | 24 Ų | 24 | 26.3 Ų | 26.3 | 11% | 0.112 | 15% | 0.148 | C | C | . | . | H | α-helix | trans | -59.5 | -48.2 | 174.1 | -69.1 | 167.6 | -14.1 | 0 | 0 | 111.2 | L2637 E2639 T2646 L2647 F2677 I2680 | L2637-Q2643 HydrophobicContact CB-CG 4.4Å; L2637-Q2643 VanDerWaalsContact O-CD 3.31Å; L2637-Q2643 VanDerWaalsContact O-CG 3.22Å; L2637-Q2643 WeakPolarHBondContact O-CG 3.48Å; L2637-Q2643 PolarHBondContact O-NE2 3.32Å; E2639-Q2643 WeakPolarHBondContact O-CG 3.17Å; E2639-Q2643 PolarHBondContact O-N 3.36Å; Q2643-T2646 PolarHBondContact O-N 3.1Å; Q2643-L2647 WeakPolarHBondContact O-CB 3.47Å; Q2643-L2647 WeakPolarHBondContact O-CG 3.04Å; Q2643-L2647 PolarHBondContact O-N 3.34Å; Q2643-F2677 HydrophobicContact CG-CD1 3.98Å; Q2643-F2677 HydrophobicContact CG-CE1 3.8Å; Q2643-F2677 HydrophobicContact CG-CZ 4.29Å; Q2643-I2680 HydrophobicContact CB-CD1 3.98Å |
| 2644 | V | 89.7 | Confident | 89.7 | Confident | 4 Ų | 4 | 25 Ų | 25 | 2% | 0.024 | 14% | 0.141 | C | C | . | . | H | α-helix | trans | -59.9 | -46.6 | 175.5 | 166.4 | 0 | 0 | 0 | 0 | 111.7 | P2640 S2641 T2648 I2680 V2683 L2733 Y2736 | P2640-V2644 WeakPolarHBondContact O-CB 3.28Å; P2640-V2644 VanDerWaalsContact O-CG2 3.27Å; P2640-V2644 WeakPolarHBondContact O-CG2 3.39Å; P2640-V2644 PolarHBondContact O-N 2.88Å; S2641-V2644 PolarHBondContact O-N 2.88Å; V2644-T2648 VanDerWaalsContact O-CB 3.29Å; V2644-T2648 WeakPolarHBondContact O-CB 3.22Å; V2644-T2648 PolarHBondContact O-N 3.15Å; V2644-T2648 PolarHBondContact O-OG1 3.23Å; V2644-I2680 HydrophobicContact CB-CG2 4.42Å; V2644-I2680 HydrophobicContact CG2-CG2 3.41Å; V2644-I2680 VanDerWaalsContact CG2-CG2 3.41Å; V2644-V2683 HydrophobicContact CG1-CG1 4.19Å; V2644-L2733 HydrophobicContact CG1-CD2 3.65Å; V2644-L2733 HydrophobicContact CG1-CG 4.47Å; V2644-Y2736 HydrophobicContact CB-CE2 4.45Å; V2644-Y2736 HydrophobicContact CG1-CD2 4.36Å; V2644-Y2736 HydrophobicContact CG2-CE2 4.34Å |
| 2645 | L | 91.9 | Very high | 90.1 | Very high | 0 Ų | 0 | 23.1 Ų | 23.1 | 0% | 0 | 13% | 0.129 | C | C | . | . | H | α-helix | trans | -68.4 | -39.8 | -178.4 | -66.5 | 178 | 0 | 0 | 0 | 112.3 | H2408 F2411 S2641 I2642 T2648 L2649 L2733 F2738 | H2408-L2645 HydrophobicContact CB-CD1 3.84Å; H2408-L2645 VanDerWaalsContact CD2-CD1 3.42Å; H2408-L2645 WeakPolarHBondContact CD2-CD1 3.39Å; F2411-L2645 HydrophobicContact CB-CD1 4.14Å; F2411-L2645 HydrophobicContact CD1-CB 3.68Å; F2411-L2645 HydrophobicContact CD2-CB 4.26Å; F2411-L2645 HydrophobicContact CD2-CD1 4.01Å; F2411-L2645 HydrophobicContact CE1-CB 3.67Å; F2411-L2645 HydrophobicContact CE2-CB 4.25Å; F2411-L2645 HydrophobicContact CG-CB 3.98Å; F2411-L2645 HydrophobicContact CG-CD1 3.97Å; F2411-L2645 HydrophobicContact CZ-CB 3.96Å; S2641-L2645 WeakPolarHBondContact O-CG 3.42Å; S2641-L2645 PolarHBondContact O-N 3.37Å; I2642-L2645 PolarHBondContact O-N 3.45Å; L2645-T2648 PolarHBondContact O-N 3.44Å; L2645-L2649 VanDerWaalsContact O-CB 3.26Å; L2645-L2649 WeakPolarHBondContact O-CB 3.03Å; L2645-L2649 PolarHBondContact O-N 3.48Å; L2645-L2733 HydrophobicContact CD2-CD2 4.24Å; L2645-F2738 HydrophobicContact CD1-CD2 3.88Å; L2645-F2738 HydrophobicContact CD1-CE2 3.82Å; L2645-F2738 HydrophobicContact CD1-CG 4.42Å; L2645-F2738 HydrophobicContact CD1-CZ 4.3Å; L2645-F2738 HydrophobicContact CD2-CB 3.5Å; L2645-F2738 HydrophobicContact CD2-CD1 4.05Å; L2645-F2738 HydrophobicContact CD2-CD2 3.52Å; L2645-F2738 HydrophobicContact CD2-CE2 4.27Å; L2645-F2738 HydrophobicContact CD2-CG 3.4Å; L2645-F2738 VanDerWaalsContact CD2-CG 3.4Å; L2645-F2738 HydrophobicContact CG-CD2 4.34Å |
| 2646 | T | 93.1 | Very high | 90.4 | Very high | 0 Ų | 0 | 20 Ų | 20 | 0% | 0 | 11% | 0.113 | C | C | . | . | H | α-helix | trans | -56.2 | -52.8 | 173.3 | -68.6 | 0 | 0 | 0 | 0 | 111.4 | I2463 L2632 L2637 I2642 Q2643 T2648 L2649 L2650 | I2463-T2646 HydrophobicContact CD1-CG2 3.59Å; L2632-T2646 HydrophobicContact CD2-CG2 3.75Å; L2637-T2646 HydrophobicContact CD1-CG2 4.27Å; I2642-T2646 WeakPolarHBondContact O-CB 3.4Å; I2642-T2646 PolarHBondContact O-N 3.45Å; I2642-T2646 PolarHBondContact O-OG1 3.26Å; Q2643-T2646 PolarHBondContact O-N 3.1Å; T2646-T2648 VanDerWaalsContact C-N 3.34Å; T2646-T2648 PolarHBondContact O-N 3.44Å; T2646-L2649 PolarHBondContact O-N 3.03Å; T2646-L2650 HydrophobicContact CG2-CD1 4.41Å; T2646-L2650 PolarHBondContact O-N 2.82Å |
| 2647 | L | 92.1 | Very high | 90.6 | Very high | 1 Ų | 1 | 18.1 Ų | 18.1 | 1% | 0.005 | 10% | 0.101 | C | C | . | . | H | α-helix | trans | -61 | -42.1 | 176.9 | -74.8 | 170.9 | 0 | 0 | 0 | 112.1 | Q2643 S2651 A2673 F2677 I2680 F2681 I2684 | Q2643-L2647 WeakPolarHBondContact O-CB 3.47Å; Q2643-L2647 WeakPolarHBondContact O-CG 3.04Å; Q2643-L2647 PolarHBondContact O-N 3.34Å; L2647-S2651 WeakPolarHBondContact O-CB 3.33Å; L2647-S2651 PolarHBondContact O-N 2.77Å; L2647-S2651 PolarHBondContact O-OG 3.3Å; L2647-A2673 HydrophobicContact CD2-CB 3.51Å; L2647-F2677 HydrophobicContact CD1-CB 4.41Å; L2647-I2680 HydrophobicContact CD1-CB 4.38Å; L2647-I2680 HydrophobicContact CD1-CG2 3.81Å; L2647-F2681 HydrophobicContact CD2-CD2 3.82Å; L2647-F2681 HydrophobicContact CD2-CE2 4.14Å; L2647-I2684 HydrophobicContact CB-CD1 4.06Å; L2647-I2684 HydrophobicContact CB-CG1 4.44Å; L2647-I2684 HydrophobicContact CB-CG2 3.86Å; L2647-I2684 HydrophobicContact CD2-CD1 3.99Å |
| 2648 | T | 91.7 | Very high | 90.5 | Very high | 0 Ų | 0 | 24.3 Ų | 24.3 | 0% | 0 | 14% | 0.139 | C | C | . | . | H | α-helix | trans | -67.9 | -37 | -179.3 | -58 | 0 | 0 | 0 | 0 | 111.6 | V2644 L2645 T2646 S2651 T2652 L2687 L2733 L2741 | V2644-T2648 VanDerWaalsContact O-CB 3.29Å; V2644-T2648 WeakPolarHBondContact O-CB 3.22Å; V2644-T2648 PolarHBondContact O-N 3.15Å; V2644-T2648 PolarHBondContact O-OG1 3.23Å; L2645-T2648 PolarHBondContact O-N 3.44Å; T2646-T2648 VanDerWaalsContact C-N 3.34Å; T2646-T2648 PolarHBondContact O-N 3.44Å; T2648-S2651 PolarHBondContact O-N 3.39Å; T2648-T2652 VanDerWaalsContact O-CB 3.32Å; T2648-T2652 WeakPolarHBondContact O-CB 3.35Å; T2648-T2652 PolarHBondContact O-N 2.91Å; T2648-T2652 PolarHBondContact O-OG1 2.92Å; T2648-L2687 HydrophobicContact CG2-CD1 4.09Å; T2648-L2733 HydrophobicContact CG2-CD1 3.75Å; T2648-L2733 HydrophobicContact CG2-CD2 4.06Å; T2648-L2741 HydrophobicContact CG2-CD2 4.25Å |
| 2649 | L | 93.4 | Very high | 90.6 | Very high | 0 Ų | 0 | 24.3 Ų | 24.3 | 0% | 0 | 13% | 0.134 | C | C | . | . | H | α-helix | trans | -68.4 | -48.2 | 177.6 | -170.2 | 68.1 | 0 | 0 | 0 | 111.4 | F2411 V2414 L2418 A2460 I2463 L2645 T2646 S2651 T2652 L2653 L2741 | F2411-L2649 HydrophobicContact CD1-CD2 4.17Å; F2411-L2649 HydrophobicContact CE1-CD2 4.02Å; V2414-L2649 HydrophobicContact CG1-CD1 3.98Å; V2414-L2649 HydrophobicContact CG1-CD2 4.02Å; L2418-L2649 HydrophobicContact CD1-CD1 3.55Å; L2418-L2649 HydrophobicContact CG-CD1 4.28Å; A2460-L2649 HydrophobicContact CB-CD2 4.37Å; I2463-L2649 HydrophobicContact CB-CD2 3.82Å; I2463-L2649 HydrophobicContact CD1-CD2 4.28Å; I2463-L2649 HydrophobicContact CG2-CB 4.17Å; I2463-L2649 HydrophobicContact CG2-CD2 3.61Å; I2463-L2649 HydrophobicContact CG2-CG 3.75Å; L2645-L2649 VanDerWaalsContact O-CB 3.26Å; L2645-L2649 WeakPolarHBondContact O-CB 3.03Å; L2645-L2649 PolarHBondContact O-N 3.48Å; T2646-L2649 PolarHBondContact O-N 3.03Å; L2649-S2651 VanDerWaalsContact C-N 3.33Å; L2649-S2651 PolarHBondContact O-N 2.95Å; L2649-T2652 PolarHBondContact O-N 3.26Å; L2649-L2653 WeakPolarHBondContact O-CG 3.44Å; L2649-L2653 PolarHBondContact O-N 3.45Å; L2649-L2741 HydrophobicContact CD1-CD2 4.35Å |
| 2650 | L | 94 | Very high | 90.5 | Very high | 0 Ų | 0 | 24.1 Ų | 24.1 | 0% | 0 | 14% | 0.136 | C | C | . | . | H | α-helix | trans | -55.8 | -47.1 | 172 | -78.4 | 167.9 | 0 | 0 | 0 | 111.6 | I2463 L2466 L2632 T2646 T2652 L2653 V2654 L2666 L2670 | I2463-L2650 HydrophobicContact CG2-CD2 3.79Å; I2463-L2650 HydrophobicContact CG2-CG 3.82Å; L2466-L2650 HydrophobicContact CD2-CD2 4.06Å; L2632-L2650 HydrophobicContact CD2-CD1 4.38Å; T2646-L2650 HydrophobicContact CG2-CD1 4.41Å; T2646-L2650 PolarHBondContact O-N 2.82Å; L2650-T2652 PolarHBondContact O-N 2.98Å; L2650-L2653 PolarHBondContact O-N 3.42Å; L2650-V2654 WeakPolarHBondContact O-CG2 3.34Å; L2650-V2654 PolarHBondContact O-N 2.96Å; L2650-V2654 VanDerWaalsContact O-N 3.15Å; L2650-L2666 HydrophobicContact CD2-CD2 3.89Å; L2650-L2670 HydrophobicContact CB-CD2 3.86Å; L2650-L2670 HydrophobicContact CB-CG 4.26Å; L2650-L2670 HydrophobicContact CD1-CD2 4.43Å |
| 2651 | S | 92.6 | Very high | 90.6 | Very high | 0 Ų | 0 | 27.9 Ų | 27.9 | 0% | 0 | 15% | 0.145 | C | C | . | . | H | α-helix | trans | -62.7 | -41.8 | 178.8 | -57.1 | 0 | 0 | 0 | 0 | 112.2 | L2647 T2648 L2649 L2653 V2654 C2655 I2684 | L2647-S2651 WeakPolarHBondContact O-CB 3.33Å; L2647-S2651 PolarHBondContact O-N 2.77Å; L2647-S2651 PolarHBondContact O-OG 3.3Å; T2648-S2651 PolarHBondContact O-N 3.39Å; L2649-S2651 VanDerWaalsContact C-N 3.33Å; L2649-S2651 PolarHBondContact O-N 2.95Å; S2651-L2653 PolarHBondContact O-N 3.05Å; S2651-V2654 WeakPolarHBondContact O-CB 3.45Å; S2651-V2654 PolarHBondContact O-N 3.33Å; S2651-C2655 PolarHBondContact O-N 3.17Å; S2651-C2655 PolarHBondContact O-SG 2.93Å; S2651-I2684 WeakPolarHBondContact OG-CB 2.87Å; S2651-I2684 WeakPolarHBondContact OG-CD1 3.34Å |
| 2652 | T | 92.9 | Very high | 90.7 | Very high | 1 Ų | 1 | 28.9 Ų | 28.9 | 1% | 0.006 | 15% | 0.148 | C | C | . | . | H | α-helix | trans | -63.6 | -41.8 | 179.4 | -62.2 | 0 | 0 | 0 | 0 | 111.9 | L2418 T2648 L2649 L2650 V2654 C2655 Y2656 L2741 W2742 A2745 | L2418-T2652 HydrophobicContact CD1-CG2 4.37Å; T2648-T2652 VanDerWaalsContact O-CB 3.32Å; T2648-T2652 WeakPolarHBondContact O-CB 3.35Å; T2648-T2652 PolarHBondContact O-N 2.91Å; T2648-T2652 PolarHBondContact O-OG1 2.92Å; L2649-T2652 PolarHBondContact O-N 3.26Å; L2650-T2652 PolarHBondContact O-N 2.98Å; T2652-V2654 VanDerWaalsContact C-N 3.32Å; T2652-V2654 PolarHBondContact O-N 3.25Å; T2652-C2655 PolarHBondContact O-N 3.12Å; T2652-Y2656 HydrophobicContact CG2-CD2 4.14Å; T2652-Y2656 HydrophobicContact CG2-CE2 4.07Å; T2652-Y2656 WeakPolarHBondContact O-CD2 3.2Å; T2652-Y2656 PolarHBondContact O-N 2.84Å; T2652-L2741 HydrophobicContact CG2-CD2 4Å; T2652-L2741 VanDerWaalsContact OG1-CD2 3.3Å; T2652-L2741 WeakPolarHBondContact OG1-CD2 3.48Å; T2652-W2742 HydrophobicContact CG2-CB 4.34Å; T2652-W2742 WeakPolarHBondContact OG1-CB 3.5Å; T2652-A2745 HydrophobicContact CG2-CB 3.59Å |
| 2653 | L | 93.6 | Very high | 90.8 | Very high | 7 Ų | 7 | 29.3 Ų | 29.3 | 4% | 0.037 | 15% | 0.15 | C | C | . | . | H | α-helix | trans | -58.7 | -44.6 | 173.7 | -72.1 | 167.6 | 0 | 0 | 0 | 111.2 | L2418 I2463 L2649 L2650 S2651 S2657 L2666 | L2418-L2653 HydrophobicContact CD1-CD2 3.96Å; L2418-L2653 HydrophobicContact CD1-CG 4.2Å; L2418-L2653 HydrophobicContact CD2-CD2 3.72Å; L2418-L2653 HydrophobicContact CG-CD2 4.47Å; I2463-L2653 HydrophobicContact CG2-CD1 3.91Å; I2463-L2653 WeakPolarHBondContact O-CD1 3.4Å; L2649-L2653 WeakPolarHBondContact O-CG 3.44Å; L2649-L2653 PolarHBondContact O-N 3.45Å; L2650-L2653 PolarHBondContact O-N 3.42Å; S2651-L2653 PolarHBondContact O-N 3.05Å; L2653-S2657 VanDerWaalsContact O-CB 3.31Å; L2653-S2657 WeakPolarHBondContact O-CB 3.45Å; L2653-S2657 PolarHBondContact O-N 2.72Å; L2653-L2666 HydrophobicContact CB-CD1 3.7Å; L2653-L2666 HydrophobicContact CB-CD2 4.08Å; L2653-L2666 HydrophobicContact CD1-CD2 3.98Å |
| 2654 | V | 93.3 | Very high | 90.8 | Very high | 0 Ų | 0 | 32.7 Ų | 32.7 | 0% | 0 | 16% | 0.162 | C | C | . | . | H | α-helix | trans | -62.9 | -48.2 | 177.6 | 166.4 | 0 | 0 | 0 | 0 | 112.4 | L2650 S2651 T2652 Y2656 S2657 L2666 F2667 L2670 L2688 K2691 | L2650-V2654 WeakPolarHBondContact O-CG2 3.34Å; L2650-V2654 PolarHBondContact O-N 2.96Å; L2650-V2654 VanDerWaalsContact O-N 3.15Å; S2651-V2654 WeakPolarHBondContact O-CB 3.45Å; S2651-V2654 PolarHBondContact O-N 3.33Å; T2652-V2654 VanDerWaalsContact C-N 3.32Å; T2652-V2654 PolarHBondContact O-N 3.25Å; V2654-Y2656 VanDerWaalsContact C-N 3.26Å; V2654-Y2656 PolarHBondContact O-N 3.43Å; V2654-S2657 PolarHBondContact O-N 3.22Å; V2654-L2666 HydrophobicContact CG2-CB 3.25Å; V2654-L2666 HydrophobicContact CG2-CD1 3.83Å; V2654-L2666 HydrophobicContact CG2-CG 4.13Å; V2654-F2667 HydrophobicContact CG1-CD2 4.17Å; V2654-F2667 HydrophobicContact CG1-CE1 4Å; V2654-F2667 HydrophobicContact CG1-CE2 3.5Å; V2654-F2667 VanDerWaalsContact CG1-CE2 3.5Å; V2654-F2667 HydrophobicContact CG1-CZ 3.41Å; V2654-F2667 VanDerWaalsContact CG1-CZ 3.41Å; V2654-L2670 HydrophobicContact CB-CD1 4.49Å; V2654-L2670 HydrophobicContact CG2-CD1 3.82Å; V2654-L2688 HydrophobicContact CB-CD2 4.39Å; V2654-L2688 HydrophobicContact CG1-CD2 4.02Å; V2654-K2691 HydrophobicContact CG1-CB 4.48Å; V2654-K2691 HydrophobicContact CG1-CG 3.81Å; V2654-K2691 VanDerWaalsContact O-CE 3.23Å; V2654-K2691 WeakPolarHBondContact O-CE 3.41Å |
| 2655 | C | 91.7 | Very high | 90.9 | Very high | 31 Ų | 31 | 33.5 Ų | 33.5 | 21% | 0.209 | 17% | 0.166 | C | C | . | . | H | α-helix | trans | -53 | -45.9 | -177.7 | -68.2 | 0 | 0 | 0 | 0 | 112 | S2651 T2652 L2687 K2691 | S2651-C2655 PolarHBondContact O-N 3.17Å; S2651-C2655 PolarHBondContact O-SG 2.93Å; T2652-C2655 PolarHBondContact O-N 3.12Å; C2655-L2687 PolarHBondContact SG-O 2.88Å; C2655-K2691 PolarHBondContact O-NZ 3.17Å |
| 2656 | Y | 90.1 | Very high | 90.9 | Very high | 61 Ų | 61 | 33.5 Ų | 33.5 | 24% | 0.239 | 17% | 0.166 | C | C | . | . | H | α-helix | trans | -97.4 | -0.5 | -176.7 | -56.2 | -60.6 | 0 | 0 | 0 | 115.1 | R2422 T2652 V2654 W2742 G2746 | R2422-Y2656 PolarHBondContact NE-O 3.36Å; R2422-Y2656 VanDerWaalsContact NE-O 3.12Å; R2422-Y2656 PolarHBondContact NH2-O 3.26Å; T2652-Y2656 HydrophobicContact CG2-CD2 4.14Å; T2652-Y2656 HydrophobicContact CG2-CE2 4.07Å; T2652-Y2656 WeakPolarHBondContact O-CD2 3.2Å; T2652-Y2656 PolarHBondContact O-N 2.84Å; V2654-Y2656 VanDerWaalsContact C-N 3.26Å; V2654-Y2656 PolarHBondContact O-N 3.43Å; Y2656-W2742 WeakPolarHBondContact CE2-O 3.31Å; Y2656-W2742 VanDerWaalsContact CZ-O 3.31Å; Y2656-W2742 PolarHBondContact OH-O 2.89Å; Y2656-G2746 VanDerWaalsContact CZ-CA 3.46Å |
| 2657 | S | 89.4 | Confident | 91 | Very high | 0 Ų | 0 | 33.5 Ų | 33.5 | 0% | 0 | 17% | 0.166 | C | C | . | . | trans | -72.7 | 146.6 | 173.3 | -176.5 | 0 | 0 | 0 | 0 | 111 | L2653 V2654 E2662 K2691 | L2653-S2657 VanDerWaalsContact O-CB 3.31Å; L2653-S2657 WeakPolarHBondContact O-CB 3.45Å; L2653-S2657 PolarHBondContact O-N 2.72Å; V2654-S2657 PolarHBondContact O-N 3.22Å; S2657-E2662 WeakPolarHBondContact CB-OE2 3.27Å; S2657-E2662 VanDerWaalsContact OG-CB 3.24Å; S2657-E2662 WeakPolarHBondContact OG-CB 3.42Å; S2657-E2662 PolarHBondContact OG-OE2 3.37Å; S2657-K2691 PolarHBondContact O-NZ 2.82Å | ||
| 2658 | T | 84.9 | Confident | 91 | Very high | 131 Ų | 131 | 35.1 Ų | 35.1 | 80% | 0.804 | 17% | 0.174 | S | C | * | . | trans | -126.7 | -3.8 | -179.9 | 52.2 | 0 | 0 | 0 | 0 | 113 | ||||
| 2659 | D | 87.2 | Confident | 91.1 | Very high | 75 Ų | 75 | 35.6 Ų | 35.6 | 40% | 0.401 | 18% | 0.176 | S | C | . | . | trans | -94.7 | 124 | 171.4 | -176.9 | -8 | 0 | 0 | 0 | 109 | K2661 E2662 M2663 | D2659-K2661 PolarHBondContact O-N 3.43Å; D2659-K2661 VanDerWaalsContact O-N 3.17Å; D2659-K2661 WeakPolarHBondContact OD1-CB 3.41Å; D2659-K2661 PolarHBondContact OD1-N 2.96Å; D2659-E2662 HydrophobicContact CB-CB 4.21Å; D2659-E2662 HydrophobicContact CB-CG 4.02Å; D2659-E2662 PolarHBondContact O-N 3.5Å; D2659-M2663 WeakPolarHBondContact O-CG 3.47Å; D2659-M2663 PolarHBondContact O-N 2.9Å | ||
| 2660 | D | 84.9 | Confident | 91.1 | Very high | 84 Ų | 84 | 35.6 Ų | 35.6 | 45% | 0.449 | 18% | 0.176 | S | C | . | . | H | α-helix | trans | -55.6 | -30 | 175.6 | -74.4 | -37.5 | 0 | 0 | 0 | 112.4 | M2663 R2664 | D2660-M2663 HydrophobicContact CB-CE 4.46Å; D2660-M2663 WeakPolarHBondContact OD1-CE 3.15Å; D2660-R2664 WeakPolarHBondContact O-CB 3.34Å; D2660-R2664 PolarHBondContact O-N 3.11Å |
| 2661 | K | 87.8 | Confident | 91 | Very high | 150 Ų | 150 | 35.6 Ų | 35.6 | 65% | 0.652 | 18% | 0.176 | S | C | * | . | H | α-helix | trans | -71.3 | -46.6 | 177.3 | -63.7 | 177.5 | -177.2 | 173.4 | 0 | 112.5 | D2659 R2664 I2665 | D2659-K2661 PolarHBondContact O-N 3.43Å; D2659-K2661 VanDerWaalsContact O-N 3.17Å; D2659-K2661 WeakPolarHBondContact OD1-CB 3.41Å; D2659-K2661 PolarHBondContact OD1-N 2.96Å; K2661-R2664 PolarHBondContact O-N 2.94Å; K2661-I2665 WeakPolarHBondContact O-CD1 3.48Å; K2661-I2665 VanDerWaalsContact O-CG1 3.31Å; K2661-I2665 WeakPolarHBondContact O-CG1 3.45Å; K2661-I2665 PolarHBondContact O-N 3.1Å |
| 2662 | E | 90.1 | Very high | 90.9 | Very high | 34 Ų | 34 | 35.6 Ų | 35.6 | 16% | 0.159 | 18% | 0.176 | C | C | . | . | H | α-helix | trans | -60.5 | -47.9 | 174.2 | -72.3 | -171.7 | 168.8 | 0 | 0 | 110.2 | P2467 S2657 D2659 R2664 I2665 L2666 | P2467-E2662 HydrophobicContact CB-CB 4.12Å; P2467-E2662 HydrophobicContact CB-CG 3.92Å; S2657-E2662 WeakPolarHBondContact CB-OE2 3.27Å; S2657-E2662 VanDerWaalsContact OG-CB 3.24Å; S2657-E2662 WeakPolarHBondContact OG-CB 3.42Å; S2657-E2662 PolarHBondContact OG-OE2 3.37Å; D2659-E2662 HydrophobicContact CB-CB 4.21Å; D2659-E2662 HydrophobicContact CB-CG 4.02Å; D2659-E2662 PolarHBondContact O-N 3.5Å; E2662-R2664 PolarHBondContact O-N 3.28Å; E2662-I2665 PolarHBondContact O-N 3.26Å; E2662-L2666 WeakPolarHBondContact O-CB 3.38Å; E2662-L2666 WeakPolarHBondContact O-CD1 3.34Å; E2662-L2666 VanDerWaalsContact O-CG 3.29Å; E2662-L2666 WeakPolarHBondContact O-CG 3.49Å; E2662-L2666 PolarHBondContact O-N 2.72Å |
| 2663 | M | 91 | Very high | 90.8 | Very high | 12 Ų | 12 | 35.6 Ų | 35.6 | 6% | 0.059 | 18% | 0.175 | C | C | . | . | H | α-helix | trans | -58.3 | -47.4 | 177.5 | -71.9 | -169.6 | -64.4 | 0 | 0 | 111 | D2659 D2660 L2666 F2667 K2691 L2704 | D2659-M2663 WeakPolarHBondContact O-CG 3.47Å; D2659-M2663 PolarHBondContact O-N 2.9Å; D2660-M2663 HydrophobicContact CB-CE 4.46Å; D2660-M2663 WeakPolarHBondContact OD1-CE 3.15Å; M2663-L2666 PolarHBondContact O-N 3.25Å; M2663-F2667 HydrophobicContact CB-CD2 4.32Å; M2663-F2667 WeakPolarHBondContact O-CB 3.3Å; M2663-F2667 WeakPolarHBondContact O-CD2 3.32Å; M2663-F2667 PolarHBondContact O-N 3.42Å; M2663-K2691 WeakPolarHBondContact SD-CE 3.42Å; M2663-L2704 HydrophobicContact CB-CD1 4.42Å; M2663-L2704 HydrophobicContact CB-CD2 4.4Å |
| 2664 | R | 91.3 | Very high | 90.7 | Very high | 95 Ų | 95 | 35.5 Ų | 35.5 | 36% | 0.358 | 18% | 0.175 | S | C | . | . | H | α-helix | trans | -54.9 | -55 | 176.1 | 175.9 | 178.5 | 164.6 | 172 | -3 | 111.6 | D2660 K2661 E2662 L2666 F2667 E2668 D2701 L2704 | D2660-R2664 WeakPolarHBondContact O-CB 3.34Å; D2660-R2664 PolarHBondContact O-N 3.11Å; K2661-R2664 PolarHBondContact O-N 2.94Å; E2662-R2664 PolarHBondContact O-N 3.28Å; R2664-L2666 VanDerWaalsContact C-N 3.33Å; R2664-L2666 PolarHBondContact O-N 3.38Å; R2664-F2667 PolarHBondContact O-N 3.18Å; R2664-E2668 HydrophobicContact CG-CG 4.35Å; R2664-E2668 WeakPolarHBondContact CG-OE1 3.48Å; R2664-E2668 IonicContact CZ-OE1 3.66Å; R2664-E2668 IonicContact NE-OE1 2.68Å; R2664-E2668 PolarHBondContact NE-OE1 3.45Å; R2664-E2668 IonicContact NH2-OE1 4Å; R2664-E2668 PolarHBondContact NH2-OE1 3.15Å; R2664-E2668 WeakPolarHBondContact O-CG 3.46Å; R2664-E2668 PolarHBondContact O-N 3.35Å; R2664-D2701 WeakPolarHBondContact CD-OD2 3.38Å; R2664-D2701 IonicContact NH1-OD2 2.99Å; R2664-L2704 HydrophobicContact CB-CB 4.18Å; R2664-L2704 HydrophobicContact CG-CB 4.46Å |
| 2665 | I | 91.4 | Very high | 90.5 | Very high | 21 Ų | 21 | 39.2 Ų | 39.2 | 11% | 0.108 | 20% | 0.198 | C | C | . | . | H | α-helix | trans | -52.7 | -54.4 | 179.5 | -70 | 159 | 0 | 0 | 0 | 109.6 | L2466 K2661 E2662 F2667 E2668 Y2669 | L2466-I2665 HydrophobicContact CG-CG2 4.27Å; K2661-I2665 WeakPolarHBondContact O-CD1 3.48Å; K2661-I2665 VanDerWaalsContact O-CG1 3.31Å; K2661-I2665 WeakPolarHBondContact O-CG1 3.45Å; K2661-I2665 PolarHBondContact O-N 3.1Å; E2662-I2665 PolarHBondContact O-N 3.26Å; I2665-F2667 VanDerWaalsContact C-N 3.34Å; I2665-F2667 PolarHBondContact O-N 2.92Å; I2665-E2668 PolarHBondContact O-N 2.84Å; I2665-E2668 VanDerWaalsContact O-N 3.14Å; I2665-Y2669 HydrophobicContact CG2-CD2 4.3Å; I2665-Y2669 HydrophobicContact CG2-CE2 4.22Å; I2665-Y2669 WeakPolarHBondContact O-CD2 3.42Å; I2665-Y2669 PolarHBondContact O-N 3Å |
| 2666 | L | 93.4 | Very high | 90.3 | Very high | 1 Ų | 1 | 40.3 Ų | 40.3 | 1% | 0.005 | 20% | 0.201 | C | C | . | . | H | α-helix | trans | -64.8 | -36 | -176 | -66.2 | 163.1 | 0 | 0 | 0 | 112.9 | L2466 P2467 L2650 L2653 V2654 E2662 M2663 R2664 Y2669 L2670 | L2466-L2666 HydrophobicContact CD2-CD2 4.4Å; P2467-L2666 HydrophobicContact CB-CD1 4.22Å; P2467-L2666 HydrophobicContact CB-CG 4.36Å; L2650-L2666 HydrophobicContact CD2-CD2 3.89Å; L2653-L2666 HydrophobicContact CB-CD1 3.7Å; L2653-L2666 HydrophobicContact CB-CD2 4.08Å; L2653-L2666 HydrophobicContact CD1-CD2 3.98Å; V2654-L2666 HydrophobicContact CG2-CB 3.25Å; V2654-L2666 HydrophobicContact CG2-CD1 3.83Å; V2654-L2666 HydrophobicContact CG2-CG 4.13Å; E2662-L2666 WeakPolarHBondContact O-CB 3.38Å; E2662-L2666 WeakPolarHBondContact O-CD1 3.34Å; E2662-L2666 VanDerWaalsContact O-CG 3.29Å; E2662-L2666 WeakPolarHBondContact O-CG 3.49Å; E2662-L2666 PolarHBondContact O-N 2.72Å; M2663-L2666 PolarHBondContact O-N 3.25Å; R2664-L2666 VanDerWaalsContact C-N 3.33Å; R2664-L2666 PolarHBondContact O-N 3.38Å; L2666-Y2669 PolarHBondContact O-N 2.93Å; L2666-L2670 WeakPolarHBondContact O-CG 3.47Å; L2666-L2670 PolarHBondContact O-N 2.89Å |
| 2667 | F | 94 | Very high | 90.2 | Very high | 0 Ų | 0 | 37.8 Ų | 37.8 | 0% | 0 | 19% | 0.192 | C | C | . | . | H | α-helix | trans | -69.6 | -32.8 | 173.9 | -84.9 | -65.1 | 0 | 0 | 0 | 112.7 | V2654 M2663 R2664 I2665 L2670 A2671 K2691 I2692 V2695 L2704 A2707 V2708 I2711 | V2654-F2667 HydrophobicContact CG1-CD2 4.17Å; V2654-F2667 HydrophobicContact CG1-CE1 4Å; V2654-F2667 HydrophobicContact CG1-CE2 3.5Å; V2654-F2667 VanDerWaalsContact CG1-CE2 3.5Å; V2654-F2667 HydrophobicContact CG1-CZ 3.41Å; V2654-F2667 VanDerWaalsContact CG1-CZ 3.41Å; M2663-F2667 HydrophobicContact CB-CD2 4.32Å; M2663-F2667 WeakPolarHBondContact O-CB 3.3Å; M2663-F2667 WeakPolarHBondContact O-CD2 3.32Å; M2663-F2667 PolarHBondContact O-N 3.42Å; R2664-F2667 PolarHBondContact O-N 3.18Å; I2665-F2667 VanDerWaalsContact C-N 3.34Å; I2665-F2667 PolarHBondContact O-N 2.92Å; F2667-L2670 HydrophobicContact CD1-CD1 4.17Å; F2667-L2670 HydrophobicContact CE1-CD1 4.49Å; F2667-L2670 PolarHBondContact O-N 3.06Å; F2667-A2671 VanDerWaalsContact O-CB 3.27Å; F2667-A2671 WeakPolarHBondContact O-CB 3.45Å; F2667-A2671 PolarHBondContact O-N 3.35Å; F2667-K2691 HydrophobicContact CZ-CG 4.27Å; F2667-I2692 HydrophobicContact CE1-CG1 3.95Å; F2667-I2692 HydrophobicContact CZ-CG1 4.24Å; F2667-V2695 HydrophobicContact CE2-CG2 4.04Å; F2667-L2704 HydrophobicContact CB-CD1 4.06Å; F2667-L2704 HydrophobicContact CD2-CD1 3.31Å; F2667-L2704 HydrophobicContact CE2-CD1 4.01Å; F2667-L2704 HydrophobicContact CG-CD1 3.98Å; F2667-A2707 HydrophobicContact CB-CB 3.95Å; F2667-V2708 HydrophobicContact CD1-CG2 3.77Å; F2667-V2708 HydrophobicContact CD2-CG2 4.14Å; F2667-V2708 HydrophobicContact CE1-CG2 3.82Å; F2667-V2708 HydrophobicContact CE2-CG2 4.19Å; F2667-V2708 HydrophobicContact CG-CG2 3.92Å; F2667-V2708 HydrophobicContact CZ-CG2 4.02Å; F2667-I2711 HydrophobicContact CD1-CD1 3.7Å; F2667-I2711 HydrophobicContact CE1-CD1 4.37Å |
| 2668 | E | 92.5 | Very high | 89.9 | Confident | 35 Ų | 35 | 41.6 Ų | 41.6 | 16% | 0.164 | 22% | 0.216 | C | C | . | . | H | α-helix | trans | -62.8 | -40.5 | 173.1 | -68.1 | 175.1 | 176 | 0 | 0 | 111.1 | L2478 L2486 R2664 I2665 A2671 E2672 A2707 | L2478-E2668 HydrophobicContact CD1-CB 3.87Å; L2486-E2668 HydrophobicContact CD1-CB 4.04Å; L2486-E2668 HydrophobicContact CD1-CG 4.06Å; R2664-E2668 HydrophobicContact CG-CG 4.35Å; R2664-E2668 WeakPolarHBondContact CG-OE1 3.48Å; R2664-E2668 IonicContact CZ-OE1 3.66Å; R2664-E2668 IonicContact NE-OE1 2.68Å; R2664-E2668 PolarHBondContact NE-OE1 3.45Å; R2664-E2668 IonicContact NH2-OE1 4Å; R2664-E2668 PolarHBondContact NH2-OE1 3.15Å; R2664-E2668 WeakPolarHBondContact O-CG 3.46Å; R2664-E2668 PolarHBondContact O-N 3.35Å; I2665-E2668 PolarHBondContact O-N 2.84Å; I2665-E2668 VanDerWaalsContact O-N 3.14Å; E2668-A2671 WeakPolarHBondContact O-CB 3.37Å; E2668-A2671 PolarHBondContact O-N 2.82Å; E2668-E2672 PolarHBondContact O-N 3.04Å; E2668-A2707 HydrophobicContact CG-CB 4.18Å |
| 2669 | Y | 93.5 | Very high | 89.7 | Confident | 9 Ų | 9 | 39.1 Ų | 39.1 | 4% | 0.035 | 20% | 0.204 | C | C | . | . | H | α-helix | trans | -73.9 | -33.1 | 173.4 | -75.7 | -95.1 | 0 | 0 | 0 | 113.4 | L2466 C2476 L2478 L2631 L2632 I2665 L2666 A2671 E2672 A2673 | L2466-Y2669 HydrophobicContact CD1-CE1 4.34Å; L2466-Y2669 HydrophobicContact CD1-CE2 3.95Å; L2466-Y2669 HydrophobicContact CD2-CD1 4.22Å; L2466-Y2669 HydrophobicContact CD2-CD2 3.68Å; L2466-Y2669 HydrophobicContact CD2-CE1 4.4Å; L2466-Y2669 HydrophobicContact CD2-CE2 3.91Å; L2466-Y2669 HydrophobicContact CD2-CG 3.84Å; L2466-Y2669 HydrophobicContact CG-CD2 4.43Å; L2466-Y2669 HydrophobicContact CG-CE2 4.21Å; C2476-Y2669 PolarHBondContact O-OH 3.24Å; L2478-Y2669 HydrophobicContact CD2-CD1 3.53Å; L2478-Y2669 HydrophobicContact CD2-CD2 3.74Å; L2478-Y2669 HydrophobicContact CD2-CE1 3.73Å; L2478-Y2669 HydrophobicContact CD2-CE2 3.92Å; L2478-Y2669 HydrophobicContact CD2-CG 3.54Å; L2478-Y2669 HydrophobicContact CG-CD1 4.47Å; L2478-Y2669 HydrophobicContact CG-CD2 4.37Å; L2478-Y2669 HydrophobicContact CG-CE1 4.21Å; L2478-Y2669 HydrophobicContact CG-CE2 4.1Å; L2631-Y2669 HydrophobicContact CB-CD1 4.26Å; L2631-Y2669 HydrophobicContact CB-CE1 3.94Å; L2631-Y2669 HydrophobicContact CD2-CD1 3.75Å; L2631-Y2669 HydrophobicContact CD2-CE1 3.81Å; L2632-Y2669 WeakPolarHBondContact CD1-O 3.37Å; I2665-Y2669 HydrophobicContact CG2-CD2 4.3Å; I2665-Y2669 HydrophobicContact CG2-CE2 4.22Å; I2665-Y2669 WeakPolarHBondContact O-CD2 3.42Å; I2665-Y2669 PolarHBondContact O-N 3Å; L2666-Y2669 PolarHBondContact O-N 2.93Å; Y2669-A2671 VanDerWaalsContact C-N 3.31Å; Y2669-E2672 WeakPolarHBondContact O-CB 3.41Å; Y2669-E2672 PolarHBondContact O-N 3.44Å; Y2669-A2673 WeakPolarHBondContact O-CB 3.22Å; Y2669-A2673 PolarHBondContact O-N 3.16Å |
| 2670 | L | 93.6 | Very high | 89.6 | Confident | 0 Ų | 0 | 36.3 Ų | 36.3 | 0% | 0 | 19% | 0.189 | C | C | . | . | H | α-helix | trans | -67.3 | -33.2 | 171 | -75.4 | 168.2 | 0 | 0 | 0 | 111.9 | L2650 V2654 L2666 F2667 A2673 S2674 F2681 I2684 L2688 I2711 | L2650-L2670 HydrophobicContact CB-CD2 3.86Å; L2650-L2670 HydrophobicContact CB-CG 4.26Å; L2650-L2670 HydrophobicContact CD1-CD2 4.43Å; V2654-L2670 HydrophobicContact CB-CD1 4.49Å; V2654-L2670 HydrophobicContact CG2-CD1 3.82Å; L2666-L2670 WeakPolarHBondContact O-CG 3.47Å; L2666-L2670 PolarHBondContact O-N 2.89Å; F2667-L2670 HydrophobicContact CD1-CD1 4.17Å; F2667-L2670 HydrophobicContact CE1-CD1 4.49Å; F2667-L2670 PolarHBondContact O-N 3.06Å; L2670-A2673 PolarHBondContact O-N 2.95Å; L2670-S2674 PolarHBondContact O-N 3.27Å; L2670-F2681 HydrophobicContact CD2-CE2 4.35Å; L2670-F2681 VanDerWaalsContact O-CE2 3.28Å; L2670-F2681 WeakPolarHBondContact O-CE2 3.4Å; L2670-I2684 HydrophobicContact CD2-CD1 3.78Å; L2670-L2688 HydrophobicContact CD1-CD1 4.05Å; L2670-L2688 HydrophobicContact CD1-CD2 3.89Å; L2670-I2711 HydrophobicContact CB-CD1 3.75Å |
| 2671 | A | 91.5 | Very high | 89.7 | Confident | 0 Ų | 0 | 32.6 Ų | 32.6 | 0% | 0 | 17% | 0.169 | C | C | . | . | H | α-helix | trans | -64.1 | -43.3 | 174.3 | 0 | 0 | 0 | 0 | 0 | 111.1 | L2486 F2667 E2668 Y2669 S2674 A2707 H2710 I2711 | L2486-A2671 HydrophobicContact CD2-CB 4.2Å; F2667-A2671 VanDerWaalsContact O-CB 3.27Å; F2667-A2671 WeakPolarHBondContact O-CB 3.45Å; F2667-A2671 PolarHBondContact O-N 3.35Å; E2668-A2671 WeakPolarHBondContact O-CB 3.37Å; E2668-A2671 PolarHBondContact O-N 2.82Å; Y2669-A2671 VanDerWaalsContact C-N 3.31Å; A2671-S2674 PolarHBondContact O-N 2.89Å; A2671-S2674 PolarHBondContact O-OG 2.99Å; A2671-A2707 HydrophobicContact CB-CB 4.4Å; A2671-H2710 HydrophobicContact CB-CB 4.37Å; A2671-I2711 HydrophobicContact CB-CD1 4.32Å; A2671-I2711 HydrophobicContact CB-CG1 3.9Å |
| 2672 | E | 91.2 | Very high | 89.5 | Confident | 1 Ų | 1 | 26 Ų | 26 | 1% | 0.005 | 14% | 0.141 | C | C | . | . | H | α-helix | trans | -58.1 | -50.8 | 168.1 | 177.8 | 157.1 | -101.4 | 0 | 0 | 112.6 | L2478 H2479 T2482 L2632 E2668 Y2669 S2674 V2675 I2676 | L2478-E2672 HydrophobicContact CD2-CB 4.23Å; L2478-E2672 WeakPolarHBondContact CD2-OE2 3.29Å; H2479-E2672 WeakPolarHBondContact CA-OE1 3.26Å; H2479-E2672 WeakPolarHBondContact CB-OE1 3.34Å; H2479-E2672 PolarHBondContact N-OE1 3.16Å; T2482-E2672 HydrophobicContact CG2-CB 3.71Å; T2482-E2672 HydrophobicContact CG2-CG 4.47Å; T2482-E2672 PolarHBondContact OG1-OE1 2.94Å; L2632-E2672 HydrophobicContact CD1-CB 4.08Å; L2632-E2672 HydrophobicContact CD1-CG 3.82Å; E2668-E2672 PolarHBondContact O-N 3.04Å; Y2669-E2672 WeakPolarHBondContact O-CB 3.41Å; Y2669-E2672 PolarHBondContact O-N 3.44Å; E2672-S2674 PolarHBondContact O-N 3Å; E2672-V2675 PolarHBondContact O-N 3.34Å; E2672-I2676 HydrophobicContact CG-CD1 3.52Å; E2672-I2676 HydrophobicContact CG-CG1 4.19Å; E2672-I2676 PolarHBondContact O-N 2.71Å; E2672-I2676 VanDerWaalsContact O-N 3.08Å |
| 2673 | A | 91.4 | Very high | 89.2 | Confident | 0 Ų | 0 | 24.5 Ų | 24.5 | 0% | 0 | 13% | 0.134 | C | C | . | . | H | α-helix | trans | -61.9 | -27.9 | -177.2 | 0 | 0 | 0 | 0 | 0 | 113.1 | L2632 L2647 Y2669 L2670 V2675 F2677 F2681 | L2632-A2673 HydrophobicContact CD1-CB 3.72Å; L2647-A2673 HydrophobicContact CD2-CB 3.51Å; Y2669-A2673 WeakPolarHBondContact O-CB 3.22Å; Y2669-A2673 PolarHBondContact O-N 3.16Å; L2670-A2673 PolarHBondContact O-N 2.95Å; A2673-V2675 VanDerWaalsContact C-N 3.26Å; A2673-V2675 PolarHBondContact O-N 2.99Å; A2673-F2677 HydrophobicContact CB-CD2 4.46Å; A2673-F2677 PolarHBondContact O-N 2.65Å; A2673-F2681 HydrophobicContact CB-CD2 4.43Å; A2673-F2681 HydrophobicContact CB-CE2 4.3Å |
| 2674 | S | 90.2 | Very high | 88.9 | Confident | 5 Ų | 5 | 23.9 Ų | 23.9 | 4% | 0.035 | 13% | 0.132 | C | C | . | . | H | α-helix | trans | -66.2 | -25.3 | 173.9 | 77 | 0 | 0 | 0 | 0 | 113.7 | L2670 A2671 E2672 F2681 N2714 | L2670-S2674 PolarHBondContact O-N 3.27Å; A2671-S2674 PolarHBondContact O-N 2.89Å; A2671-S2674 PolarHBondContact O-OG 2.99Å; E2672-S2674 PolarHBondContact O-N 3Å; S2674-F2681 VanDerWaalsContact CA-CD2 3.46Å; S2674-N2714 PolarHBondContact OG-ND2 2.94Å |
| 2675 | V | 88.8 | Confident | 88.6 | Confident | 78 Ų | 78 | 21 Ų | 21 | 47% | 0.473 | 12% | 0.122 | S | C | . | . | H | α-helix | trans | -89.8 | -38.9 | 176.1 | -177.2 | 0 | 0 | 0 | 0 | 111.3 | E2672 A2673 P2678 N2714 | E2672-V2675 PolarHBondContact O-N 3.34Å; A2673-V2675 VanDerWaalsContact C-N 3.26Å; A2673-V2675 PolarHBondContact O-N 2.99Å; V2675-P2678 WeakPolarHBondContact O-CD 3.32Å; V2675-N2714 VanDerWaalsContact CG2-ND2 3.28Å; V2675-N2714 WeakPolarHBondContact CG2-ND2 3.28Å |
| 2676 | I | 88 | Confident | 88.2 | Confident | 55 Ų | 55 | 23.3 Ų | 23.3 | 28% | 0.282 | 14% | 0.14 | S | C | . | . | H | α-helix | trans | -78.1 | -39.1 | -176.3 | -59 | -179.5 | 0 | 0 | 0 | 112.1 | L2632 P2634 E2672 P2678 | L2632-I2676 HydrophobicContact CB-CD1 3.99Å; P2634-I2676 HydrophobicContact CB-CG2 4.1Å; P2634-I2676 HydrophobicContact CG-CG2 4.25Å; E2672-I2676 HydrophobicContact CG-CD1 3.52Å; E2672-I2676 HydrophobicContact CG-CG1 4.19Å; E2672-I2676 PolarHBondContact O-N 2.71Å; E2672-I2676 VanDerWaalsContact O-N 3.08Å; I2676-P2678 VanDerWaalsContact O-CD 3.3Å; I2676-P2678 WeakPolarHBondContact O-CD 3.45Å |
| 2677 | F | 87.9 | Confident | 87.8 | Confident | 8 Ų | 8 | 24 Ų | 24 | 4% | 0.035 | 14% | 0.144 | C | C | . | . | trans | -120.2 | 49.7 | -174.9 | -54.1 | -63.3 | 0 | 0 | 0 | 113.9 | L2632 P2634 L2637 Q2643 L2647 A2673 S2679 I2680 F2681 | L2632-F2677 HydrophobicContact CB-CE2 4.21Å; L2632-F2677 HydrophobicContact CD2-CE2 4.27Å; P2634-F2677 HydrophobicContact CB-CE1 4.27Å; L2637-F2677 HydrophobicContact CB-CZ 4.15Å; L2637-F2677 HydrophobicContact CD1-CE2 4.46Å; L2637-F2677 HydrophobicContact CD1-CZ 4.24Å; Q2643-F2677 HydrophobicContact CG-CD1 3.98Å; Q2643-F2677 HydrophobicContact CG-CE1 3.8Å; Q2643-F2677 HydrophobicContact CG-CZ 4.29Å; L2647-F2677 HydrophobicContact CD1-CB 4.41Å; A2673-F2677 HydrophobicContact CB-CD2 4.46Å; A2673-F2677 PolarHBondContact O-N 2.65Å; F2677-S2679 PolarHBondContact O-N 3.47Å; F2677-S2679 VanDerWaalsContact O-N 3.13Å; F2677-I2680 PolarHBondContact O-N 2.81Å; F2677-F2681 WeakPolarHBondContact O-CB 3.33Å; F2677-F2681 PolarHBondContact O-N 2.88Å | ||
| 2678 | P | 83 | Confident | 87.5 | Confident | 80 Ų | 80 | 24 Ų | 24 | 52% | 0.519 | 14% | 0.144 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -64.3 | -24.6 | -168.6 | 27.6 | -36.5 | 0 | 0 | 0 | 114.2 | V2675 I2676 P2682 | V2675-P2678 WeakPolarHBondContact O-CD 3.32Å; I2676-P2678 VanDerWaalsContact O-CD 3.3Å; I2676-P2678 WeakPolarHBondContact O-CD 3.45Å; P2678-P2682 VanDerWaalsContact O-CD 3.32Å; P2678-P2682 WeakPolarHBondContact O-CD 3.42Å |
| 2679 | S | 81.5 | Confident | 87.3 | Confident | 78 Ų | 78 | 27.5 Ų | 27.5 | 55% | 0.545 | 16% | 0.164 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -72.8 | -28.5 | 176.2 | 51 | 0 | 0 | 0 | 0 | 113.5 | F2677 | F2677-S2679 PolarHBondContact O-N 3.47Å; F2677-S2679 VanDerWaalsContact O-N 3.13Å |
| 2680 | I | 83.8 | Confident | 87 | Confident | 17 Ų | 17 | 34.8 Ų | 34.8 | 9% | 0.087 | 20% | 0.198 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -107.1 | -27.1 | -173.7 | -65 | 172.5 | 0 | 0 | 0 | 111.7 | P2640 Q2643 V2644 L2647 F2677 V2683 | P2640-I2680 HydrophobicContact CB-CD1 4.1Å; Q2643-I2680 HydrophobicContact CB-CD1 3.98Å; V2644-I2680 HydrophobicContact CB-CG2 4.42Å; V2644-I2680 HydrophobicContact CG2-CG2 3.41Å; V2644-I2680 VanDerWaalsContact CG2-CG2 3.41Å; L2647-I2680 HydrophobicContact CD1-CB 4.38Å; L2647-I2680 HydrophobicContact CD1-CG2 3.81Å; F2677-I2680 PolarHBondContact O-N 2.81Å; I2680-V2683 HydrophobicContact CG2-CG2 4.37Å; I2680-V2683 VanDerWaalsContact O-CB 3.25Å; I2680-V2683 WeakPolarHBondContact O-CB 3.45Å; I2680-V2683 VanDerWaalsContact O-CG2 3.3Å; I2680-V2683 WeakPolarHBondContact O-CG2 3.42Å; I2680-V2683 PolarHBondContact O-N 2.99Å |
| 2681 | F | 87.4 | Confident | 86.8 | Confident | 6 Ų | 6 | 35.6 Ų | 35.6 | 3% | 0.026 | 20% | 0.201 | C | C | . | . | G | 310 helix | trans | -46.6 | -36.2 | 175.8 | -159.2 | -91.5 | 0 | 0 | 0 | 114.6 | L2647 L2670 A2673 S2674 F2677 V2683 I2684 H2685 L2688 I2711 M2715 | L2647-F2681 HydrophobicContact CD2-CD2 3.82Å; L2647-F2681 HydrophobicContact CD2-CE2 4.14Å; L2670-F2681 HydrophobicContact CD2-CE2 4.35Å; L2670-F2681 VanDerWaalsContact O-CE2 3.28Å; L2670-F2681 WeakPolarHBondContact O-CE2 3.4Å; A2673-F2681 HydrophobicContact CB-CD2 4.43Å; A2673-F2681 HydrophobicContact CB-CE2 4.3Å; S2674-F2681 VanDerWaalsContact CA-CD2 3.46Å; F2677-F2681 WeakPolarHBondContact O-CB 3.33Å; F2677-F2681 PolarHBondContact O-N 2.88Å; F2681-V2683 PolarHBondContact O-N 3.32Å; F2681-I2684 HydrophobicContact CD2-CD1 4.08Å; F2681-I2684 HydrophobicContact CE1-CD1 4.49Å; F2681-I2684 HydrophobicContact CE2-CD1 3.79Å; F2681-I2684 HydrophobicContact CZ-CD1 4.01Å; F2681-I2684 WeakPolarHBondContact O-CG1 3.26Å; F2681-I2684 PolarHBondContact O-N 3.32Å; F2681-I2684 VanDerWaalsContact O-N 3.12Å; F2681-H2685 AromaticContact CD1-CD2 3.93Å; F2681-H2685 AromaticContact CD1-NE2 3.54Å; F2681-H2685 PolarHBondContact O-CD2 3.29Å; F2681-L2688 HydrophobicContact CZ-CD1 4.35Å; F2681-I2711 HydrophobicContact CE1-CG2 3.74Å; F2681-I2711 HydrophobicContact CZ-CG1 4.44Å; F2681-I2711 HydrophobicContact CZ-CG2 3.82Å; F2681-M2715 HydrophobicContact CD1-CG 4.47Å; F2681-M2715 HydrophobicContact CE1-CG 4.25Å; F2681-M2715 HydrophobicContact CE1-SD 4.44Å |
| 2682 | P | 84.7 | Confident | 86.8 | Confident | 11 Ų | 11 | 36.2 Ų | 36.2 | 7% | 0.071 | 21% | 0.205 | C | C | . | . | G | 310 helix | trans | -56.1 | -20.7 | 173.3 | -28.8 | 37.8 | 0 | 0 | 0 | 116.4 | P2678 I2684 T2722 | P2678-P2682 VanDerWaalsContact O-CD 3.32Å; P2678-P2682 WeakPolarHBondContact O-CD 3.42Å; P2682-I2684 VanDerWaalsContact C-N 3.31Å; P2682-I2684 PolarHBondContact O-N 2.83Å; P2682-T2722 HydrophobicContact CG-CG2 4.41Å |
| 2683 | V | 82.1 | Confident | 86.7 | Confident | 2 Ų | 2 | 38.9 Ų | 38.9 | 1% | 0.012 | 22% | 0.221 | C | C | . | . | G | 310 helix | trans | -62.9 | -35.8 | 176.5 | 175.1 | 0 | 0 | 0 | 0 | 111.4 | V2644 I2680 F2681 Y2725 H2729 F2732 | V2644-V2683 HydrophobicContact CG1-CG1 4.19Å; I2680-V2683 HydrophobicContact CG2-CG2 4.37Å; I2680-V2683 VanDerWaalsContact O-CB 3.25Å; I2680-V2683 WeakPolarHBondContact O-CB 3.45Å; I2680-V2683 VanDerWaalsContact O-CG2 3.3Å; I2680-V2683 WeakPolarHBondContact O-CG2 3.42Å; I2680-V2683 PolarHBondContact O-N 2.99Å; F2681-V2683 PolarHBondContact O-N 3.32Å; V2683-Y2725 HydrophobicContact CG2-CD1 4.37Å; V2683-H2729 WeakPolarHBondContact O-CB 3.32Å; V2683-H2729 PolarHBondContact O-ND1 2.78Å; V2683-F2732 HydrophobicContact CG1-CB 4.5Å; V2683-F2732 HydrophobicContact CG2-CD2 4.27Å |
| 2684 | I | 86.6 | Confident | 86.6 | Confident | 0 Ų | 0 | 43.5 Ų | 43.5 | 0% | 0 | 24% | 0.242 | C | C | . | . | G | 310 helix | trans | -92.3 | -2.8 | -174.9 | 52.9 | 161 | 0 | 0 | 0 | 114.8 | L2647 S2651 L2670 F2681 P2682 S2686 L2687 L2688 | L2647-I2684 HydrophobicContact CB-CD1 4.06Å; L2647-I2684 HydrophobicContact CB-CG1 4.44Å; L2647-I2684 HydrophobicContact CB-CG2 3.86Å; L2647-I2684 HydrophobicContact CD2-CD1 3.99Å; S2651-I2684 WeakPolarHBondContact OG-CB 2.87Å; S2651-I2684 WeakPolarHBondContact OG-CD1 3.34Å; L2670-I2684 HydrophobicContact CD2-CD1 3.78Å; F2681-I2684 HydrophobicContact CD2-CD1 4.08Å; F2681-I2684 HydrophobicContact CE1-CD1 4.49Å; F2681-I2684 HydrophobicContact CE2-CD1 3.79Å; F2681-I2684 HydrophobicContact CZ-CD1 4.01Å; F2681-I2684 WeakPolarHBondContact O-CG1 3.26Å; F2681-I2684 PolarHBondContact O-N 3.32Å; F2681-I2684 VanDerWaalsContact O-N 3.12Å; P2682-I2684 VanDerWaalsContact C-N 3.31Å; P2682-I2684 PolarHBondContact O-N 2.83Å; I2684-S2686 VanDerWaalsContact C-N 3.28Å; I2684-S2686 PolarHBondContact O-N 3.07Å; I2684-L2687 PolarHBondContact O-N 3.07Å; I2684-L2688 HydrophobicContact CD1-CD1 3.9Å; I2684-L2688 PolarHBondContact O-N 2.69Å |
| 2685 | H | 84.9 | Confident | 86.6 | Confident | 33 Ų | 33 | 43.5 Ų | 43.5 | 15% | 0.153 | 24% | 0.242 | C | C | . | . | H | α-helix | trans | -53.3 | -41.7 | -176 | -72.3 | -176.7 | 0 | 0 | 0 | 113.3 | F2681 L2687 L2688 D2689 | F2681-H2685 AromaticContact CD1-CD2 3.93Å; F2681-H2685 AromaticContact CD1-NE2 3.54Å; F2681-H2685 PolarHBondContact O-CD2 3.29Å; H2685-L2687 VanDerWaalsContact C-N 3.26Å; H2685-L2687 PolarHBondContact O-N 3.35Å; H2685-L2688 PolarHBondContact O-N 3.23Å; H2685-D2689 WeakPolarHBondContact O-CB 3.45Å; H2685-D2689 PolarHBondContact O-N 3.49Å |
| 2686 | S | 82.7 | Confident | 86.6 | Confident | 70 Ų | 70 | 43.7 Ų | 43.7 | 49% | 0.49 | 24% | 0.24 | S | C | . | . | H | α-helix | trans | -68.7 | -19.4 | -179.5 | 52.7 | 0 | 0 | 0 | 0 | 114.6 | I2684 H2729 | I2684-S2686 VanDerWaalsContact C-N 3.28Å; I2684-S2686 PolarHBondContact O-N 3.07Å; S2686-H2729 PolarHBondContact OG-CD2 3.43Å; S2686-H2729 VanDerWaalsContact OG-CD2 3.27Å |
| 2687 | L | 83.9 | Confident | 86.7 | Confident | 16 Ų | 16 | 48.2 Ų | 48.2 | 8% | 0.084 | 26% | 0.26 | C | S | . | . | H | α-helix | trans | -81.7 | -43.5 | 172 | -62.2 | 179.7 | 0 | 0 | 0 | 110.3 | T2648 C2655 I2684 H2685 W2742 | T2648-L2687 HydrophobicContact CG2-CD1 4.09Å; C2655-L2687 PolarHBondContact SG-O 2.88Å; I2684-L2687 PolarHBondContact O-N 3.07Å; H2685-L2687 VanDerWaalsContact C-N 3.26Å; H2685-L2687 PolarHBondContact O-N 3.35Å; L2687-W2742 HydrophobicContact CD1-CB 4.17Å; L2687-W2742 HydrophobicContact CD1-CG 4.43Å; L2687-W2742 HydrophobicContact CD2-CB 3.95Å; L2687-W2742 HydrophobicContact CD2-CD2 3.7Å; L2687-W2742 HydrophobicContact CD2-CE3 4.15Å; L2687-W2742 HydrophobicContact CD2-CG 3.6Å |
| 2688 | L | 89 | Confident | 86.6 | Confident | 1 Ų | 1 | 52.5 Ų | 52.5 | 1% | 0.005 | 29% | 0.287 | C | S | . | . | H | α-helix | trans | -77.2 | -27 | -176.2 | -64.7 | -176.5 | 0 | 0 | 0 | 114.2 | V2654 L2670 F2681 I2684 H2685 Q2690 K2691 I2692 | V2654-L2688 HydrophobicContact CB-CD2 4.39Å; V2654-L2688 HydrophobicContact CG1-CD2 4.02Å; L2670-L2688 HydrophobicContact CD1-CD1 4.05Å; L2670-L2688 HydrophobicContact CD1-CD2 3.89Å; F2681-L2688 HydrophobicContact CZ-CD1 4.35Å; I2684-L2688 HydrophobicContact CD1-CD1 3.9Å; I2684-L2688 PolarHBondContact O-N 2.69Å; H2685-L2688 PolarHBondContact O-N 3.23Å; L2688-Q2690 PolarHBondContact O-N 3.26Å; L2688-K2691 CarbonylContact O-C 3.08Å; L2688-K2691 WeakPolarHBondContact O-CA 3.05Å; L2688-K2691 PolarHBondContact O-N 3.15Å; L2688-I2692 HydrophobicContact CB-CD1 3.77Å; L2688-I2692 HydrophobicContact CB-CG1 4.2Å; L2688-I2692 HydrophobicContact CD1-CD1 4.44Å; L2688-I2692 WeakPolarHBondContact O-CB 3.31Å; L2688-I2692 WeakPolarHBondContact O-CG1 3.5Å; L2688-I2692 PolarHBondContact O-N 3.14Å |
| 2689 | D | 87.1 | Confident | 86.7 | Confident | 108 Ų | 108 | 49.4 Ų | 49.4 | 58% | 0.578 | 27% | 0.267 | S | S | * | . | H | α-helix | trans | -49.2 | -53.3 | -171.6 | -176 | 59.2 | 0 | 0 | 0 | 114.1 | H2685 K2691 T2693 | H2685-D2689 WeakPolarHBondContact O-CB 3.45Å; H2685-D2689 PolarHBondContact O-N 3.49Å; D2689-K2691 VanDerWaalsContact C-N 3.31Å; D2689-K2691 PolarHBondContact O-N 3.13Å; D2689-T2693 WeakPolarHBondContact O-CB 3.48Å; D2689-T2693 PolarHBondContact O-N 3.3Å; D2689-T2693 PolarHBondContact O-OG1 2.89Å |
| 2690 | Q | 87.5 | Confident | 86.9 | Confident | 162 Ų | 162 | 54.3 Ų | 54.3 | 76% | 0.757 | 28% | 0.281 | S | S | * | . | H | α-helix | trans | -63.9 | -37.2 | 178.2 | -172.9 | 179.3 | 4.8 | 0 | 0 | 111.9 | L2688 Q2694 | L2688-Q2690 PolarHBondContact O-N 3.26Å; Q2690-Q2694 WeakPolarHBondContact O-CB 3.23Å; Q2690-Q2694 PolarHBondContact O-N 3.33Å |
| 2691 | K | 89.9 | Confident | 87.1 | Confident | 16 Ų | 16 | 55.9 Ų | 55.9 | 7% | 0.07 | 29% | 0.29 | C | S | . | . | H | α-helix | trans | -77.5 | -39.8 | -176.4 | -162.8 | 68.7 | 174.7 | -164.1 | 0 | 112.4 | V2654 C2655 S2657 M2663 F2667 L2688 D2689 T2693 Q2694 V2695 | V2654-K2691 HydrophobicContact CG1-CB 4.48Å; V2654-K2691 HydrophobicContact CG1-CG 3.81Å; V2654-K2691 VanDerWaalsContact O-CE 3.23Å; V2654-K2691 WeakPolarHBondContact O-CE 3.41Å; C2655-K2691 PolarHBondContact O-NZ 3.17Å; S2657-K2691 PolarHBondContact O-NZ 2.82Å; M2663-K2691 WeakPolarHBondContact SD-CE 3.42Å; F2667-K2691 HydrophobicContact CZ-CG 4.27Å; L2688-K2691 CarbonylContact O-C 3.08Å; L2688-K2691 WeakPolarHBondContact O-CA 3.05Å; L2688-K2691 PolarHBondContact O-N 3.15Å; D2689-K2691 VanDerWaalsContact C-N 3.31Å; D2689-K2691 PolarHBondContact O-N 3.13Å; K2691-T2693 VanDerWaalsContact C-N 3.33Å; K2691-Q2694 PolarHBondContact O-N 3.27Å; K2691-V2695 WeakPolarHBondContact O-CG2 3.35Å; K2691-V2695 PolarHBondContact O-N 2.68Å |
| 2692 | I | 90.7 | Very high | 87.1 | Confident | 14 Ų | 14 | 58.2 Ų | 58.2 | 7% | 0.072 | 31% | 0.31 | C | S | . | . | H | α-helix | trans | -58.6 | -47.5 | 169.8 | -74.8 | 174.2 | 0 | 0 | 0 | 109.4 | F2667 L2688 Q2694 V2695 L2696 V2708 I2711 I2712 | F2667-I2692 HydrophobicContact CE1-CG1 3.95Å; F2667-I2692 HydrophobicContact CZ-CG1 4.24Å; L2688-I2692 HydrophobicContact CB-CD1 3.77Å; L2688-I2692 HydrophobicContact CB-CG1 4.2Å; L2688-I2692 HydrophobicContact CD1-CD1 4.44Å; L2688-I2692 WeakPolarHBondContact O-CB 3.31Å; L2688-I2692 WeakPolarHBondContact O-CG1 3.5Å; L2688-I2692 PolarHBondContact O-N 3.14Å; I2692-Q2694 PolarHBondContact O-N 2.81Å; I2692-V2695 PolarHBondContact O-N 3.46Å; I2692-L2696 HydrophobicContact CG2-CD1 3.92Å; I2692-L2696 HydrophobicContact CG2-CG 4.39Å; I2692-L2696 WeakPolarHBondContact O-CB 3.33Å; I2692-L2696 VanDerWaalsContact O-CG 3.31Å; I2692-L2696 WeakPolarHBondContact O-CG 3.41Å; I2692-L2696 PolarHBondContact O-N 3.38Å; I2692-V2708 HydrophobicContact CB-CG1 4.42Å; I2692-V2708 HydrophobicContact CG1-CG1 4.27Å; I2692-V2708 HydrophobicContact CG2-CG1 3.81Å; I2692-I2711 HydrophobicContact CD1-CG2 4.36Å; I2692-I2712 HydrophobicContact CG2-CD1 3.98Å; I2692-I2712 HydrophobicContact CG2-CG1 4.4Å |
| 2693 | T | 90.4 | Very high | 87.2 | Confident | 56 Ų | 56 | 58 Ų | 58 | 34% | 0.344 | 31% | 0.309 | S | S | . | . | H | α-helix | trans | -59.5 | -44.9 | 176.3 | -59.3 | 0 | 0 | 0 | 0 | 111.7 | D2689 K2691 L2696 Q2697 | D2689-T2693 WeakPolarHBondContact O-CB 3.48Å; D2689-T2693 PolarHBondContact O-N 3.3Å; D2689-T2693 PolarHBondContact O-OG1 2.89Å; K2691-T2693 VanDerWaalsContact C-N 3.33Å; T2693-L2696 PolarHBondContact O-N 3.3Å; T2693-Q2697 WeakPolarHBondContact O-CB 3.31Å; T2693-Q2697 VanDerWaalsContact O-CG 3.26Å; T2693-Q2697 WeakPolarHBondContact O-CG 3.34Å; T2693-Q2697 PolarHBondContact O-N 3.21Å |
| 2694 | Q | 89.3 | Confident | 87.6 | Confident | 97 Ų | 97 | 57.9 Ų | 57.9 | 45% | 0.453 | 31% | 0.308 | S | S | . | . | H | α-helix | trans | -59.5 | -47.8 | 175.3 | -174.5 | -176.3 | 15.1 | 0 | 0 | 112.1 | Q2690 K2691 I2692 Q2697 V2698 | Q2690-Q2694 WeakPolarHBondContact O-CB 3.23Å; Q2690-Q2694 PolarHBondContact O-N 3.33Å; K2691-Q2694 PolarHBondContact O-N 3.27Å; I2692-Q2694 PolarHBondContact O-N 2.81Å; Q2694-Q2697 PolarHBondContact O-N 3.19Å; Q2694-V2698 WeakPolarHBondContact O-CB 3.23Å; Q2694-V2698 WeakPolarHBondContact O-CG2 3.29Å; Q2694-V2698 PolarHBondContact O-N 2.8Å |
| 2695 | V | 89.3 | Confident | 87.7 | Confident | 6 Ų | 6 | 59.9 Ų | 59.9 | 4% | 0.036 | 32% | 0.319 | C | S | . | . | H | α-helix | trans | -64.9 | -42.6 | -178.9 | 169.9 | 0 | 0 | 0 | 0 | 111.3 | F2667 K2691 I2692 Q2697 S2699 L2704 L2705 V2708 | F2667-V2695 HydrophobicContact CE2-CG2 4.04Å; K2691-V2695 WeakPolarHBondContact O-CG2 3.35Å; K2691-V2695 PolarHBondContact O-N 2.68Å; I2692-V2695 PolarHBondContact O-N 3.46Å; V2695-Q2697 VanDerWaalsContact C-N 3.31Å; V2695-Q2697 PolarHBondContact O-N 3.45Å; V2695-S2699 WeakPolarHBondContact O-CB 3.09Å; V2695-S2699 PolarHBondContact O-N 2.91Å; V2695-L2704 HydrophobicContact CG1-CD1 4.06Å; V2695-L2704 HydrophobicContact CG1-CD2 4.06Å; V2695-L2704 HydrophobicContact CG1-CG 3.74Å; V2695-L2705 HydrophobicContact CG1-CD2 4.25Å; V2695-V2708 HydrophobicContact CG1-CG2 3.94Å |
| 2696 | L | 89 | Confident | 87.9 | Confident | 81 Ų | 81 | 62.6 Ų | 62.6 | 42% | 0.424 | 33% | 0.328 | S | S | . | . | H | α-helix | trans | -64.7 | -32.3 | 176.3 | -71.5 | 174.5 | 0 | 0 | 0 | 113.4 | I2692 T2693 L2705 V2708 I2712 | I2692-L2696 HydrophobicContact CG2-CD1 3.92Å; I2692-L2696 HydrophobicContact CG2-CG 4.39Å; I2692-L2696 WeakPolarHBondContact O-CB 3.33Å; I2692-L2696 VanDerWaalsContact O-CG 3.31Å; I2692-L2696 WeakPolarHBondContact O-CG 3.41Å; I2692-L2696 PolarHBondContact O-N 3.38Å; T2693-L2696 PolarHBondContact O-N 3.3Å; L2696-L2705 HydrophobicContact CD2-CD2 4.38Å; L2696-V2708 HydrophobicContact CD2-CG1 4.06Å; L2696-V2708 HydrophobicContact CG-CG1 4.15Å; L2696-I2712 HydrophobicContact CD1-CD1 3.81Å; L2696-I2712 HydrophobicContact CD2-CD1 4.35Å; L2696-I2712 HydrophobicContact CG-CD1 4.5Å |
| 2697 | Q | 89.5 | Confident | 88.3 | Confident | 151 Ų | 151 | 59.2 Ų | 59.2 | 71% | 0.706 | 30% | 0.304 | S | S | * | . | H | α-helix | trans | -82.9 | -31 | -179.3 | -74.5 | 176.7 | -3.1 | 0 | 0 | 113.6 | T2693 Q2694 V2695 | T2693-Q2697 WeakPolarHBondContact O-CB 3.31Å; T2693-Q2697 VanDerWaalsContact O-CG 3.26Å; T2693-Q2697 WeakPolarHBondContact O-CG 3.34Å; T2693-Q2697 PolarHBondContact O-N 3.21Å; Q2694-Q2697 PolarHBondContact O-N 3.19Å; V2695-Q2697 VanDerWaalsContact C-N 3.31Å; V2695-Q2697 PolarHBondContact O-N 3.45Å |
| 2698 | V | 86.4 | Confident | 88.6 | Confident | 97 Ų | 97 | 58.5 Ų | 58.5 | 59% | 0.588 | 30% | 0.3 | S | S | * | . | H | α-helix | trans | -123.2 | -27.3 | -164.5 | -173.1 | 0 | 0 | 0 | 0 | 113.8 | Q2694 | Q2694-V2698 WeakPolarHBondContact O-CB 3.23Å; Q2694-V2698 WeakPolarHBondContact O-CG2 3.29Å; Q2694-V2698 PolarHBondContact O-N 2.8Å |
| 2699 | S | 85.8 | Confident | 88.6 | Confident | 16 Ų | 16 | 62.4 Ų | 62.4 | 11% | 0.112 | 32% | 0.321 | C | S | . | . | trans | -79 | 146.8 | -173 | -165.2 | 0 | 0 | 0 | 0 | 113 | V2695 D2701 | V2695-S2699 WeakPolarHBondContact O-CB 3.09Å; V2695-S2699 PolarHBondContact O-N 2.91Å; S2699-D2701 PolarHBondContact OG-N 2.76Å | ||
| 2700 | H | 86 | Confident | 88.7 | Confident | 181 Ų | 181 | 58.7 Ų | 58.7 | 84% | 0.838 | 30% | 0.3 | S | S | * | . | trans | -116.4 | -1.2 | 174 | -60.5 | -34.1 | 0 | 0 | 0 | 113 | A2702 | H2700-A2702 PolarHBondContact O-N 2.84Š| ||
| 2701 | D | 87.1 | Confident | 88.8 | Confident | 49 Ų | 49 | 51 Ų | 51 | 26% | 0.262 | 26% | 0.264 | S | S | . | . | trans | -74.8 | 108.5 | 174.9 | 179.9 | -1.4 | 0 | 0 | 0 | 110 | R2664 S2699 A2703 L2704 L2705 | R2664-D2701 WeakPolarHBondContact CD-OD2 3.38Å; R2664-D2701 IonicContact NH1-OD2 2.99Å; S2699-D2701 PolarHBondContact OG-N 2.76Å; D2701-A2703 PolarHBondContact O-N 3.29Å; D2701-A2703 VanDerWaalsContact O-N 3.17Å; D2701-A2703 WeakPolarHBondContact OD1-CB 3.49Å; D2701-A2703 PolarHBondContact OD1-N 2.92Å; D2701-L2704 HydrophobicContact CB-CB 3.93Å; D2701-L2704 PolarHBondContact O-N 3.4Å; D2701-L2705 WeakPolarHBondContact O-CB 3.35Å; D2701-L2705 WeakPolarHBondContact O-CG 3.47Å; D2701-L2705 PolarHBondContact O-N 2.88Å | ||
| 2702 | A | 87.1 | Confident | 88.6 | Confident | 55 Ų | 55 | 52.7 Ų | 52.7 | 46% | 0.455 | 27% | 0.273 | S | S | . | . | H | α-helix | trans | -59.1 | -25.1 | 180 | 0 | 0 | 0 | 0 | 0 | 113.9 | H2700 R2706 | H2700-A2702 PolarHBondContact O-N 2.84Å; A2702-R2706 WeakPolarHBondContact O-CB 3.33Å; A2702-R2706 VanDerWaalsContact O-CG 3.29Å; A2702-R2706 WeakPolarHBondContact O-CG 3.31Å; A2702-R2706 PolarHBondContact O-N 3.35Å; A2702-R2706 VanDerWaalsContact O-N 3.13Å; A2702-R2706 PolarHBondContact O-NE 2.88Å |
| 2703 | A | 86.9 | Confident | 88.4 | Confident | 6 Ų | 6 | 57.9 Ų | 57.9 | 5% | 0.05 | 30% | 0.297 | C | S | . | . | H | α-helix | trans | -81.5 | -43.4 | 177.6 | 0 | 0 | 0 | 0 | 0 | 112 | D2701 R2706 A2707 | D2701-A2703 PolarHBondContact O-N 3.29Å; D2701-A2703 VanDerWaalsContact O-N 3.17Å; D2701-A2703 WeakPolarHBondContact OD1-CB 3.49Å; D2701-A2703 PolarHBondContact OD1-N 2.92Å; A2703-R2706 WeakPolarHBondContact O-CB 3.42Å; A2703-R2706 PolarHBondContact O-N 3.44Å; A2703-R2706 VanDerWaalsContact O-N 3.17Å; A2703-A2707 PolarHBondContact O-N 3.3Å |
| 2704 | L | 90.2 | Very high | 88 | Confident | 0 Ų | 0 | 58.3 Ų | 58.3 | 0% | 0 | 30% | 0.297 | C | S | . | . | H | α-helix | trans | -58.3 | -47.1 | 170.6 | 170.8 | 53.6 | 0 | 0 | 0 | 111.1 | M2663 R2664 F2667 V2695 D2701 R2706 A2707 V2708 | M2663-L2704 HydrophobicContact CB-CD1 4.42Å; M2663-L2704 HydrophobicContact CB-CD2 4.4Å; R2664-L2704 HydrophobicContact CB-CB 4.18Å; R2664-L2704 HydrophobicContact CG-CB 4.46Å; F2667-L2704 HydrophobicContact CB-CD1 4.06Å; F2667-L2704 HydrophobicContact CD2-CD1 3.31Å; F2667-L2704 HydrophobicContact CE2-CD1 4.01Å; F2667-L2704 HydrophobicContact CG-CD1 3.98Å; V2695-L2704 HydrophobicContact CG1-CD1 4.06Å; V2695-L2704 HydrophobicContact CG1-CD2 4.06Å; V2695-L2704 HydrophobicContact CG1-CG 3.74Å; D2701-L2704 HydrophobicContact CB-CB 3.93Å; D2701-L2704 PolarHBondContact O-N 3.4Å; L2704-R2706 VanDerWaalsContact C-N 3.32Å; L2704-R2706 PolarHBondContact O-N 3.25Å; L2704-A2707 PolarHBondContact O-N 2.99Å; L2704-V2708 HydrophobicContact CD1-CG2 4.27Å; L2704-V2708 WeakPolarHBondContact O-CG2 3.16Å; L2704-V2708 PolarHBondContact O-N 3.04Å |
| 2705 | L | 89.6 | Confident | 87.4 | Confident | 42 Ų | 42 | 56.6 Ų | 56.6 | 22% | 0.22 | 29% | 0.29 | C | S | . | . | H | α-helix | trans | -60.5 | -38.4 | 174.2 | -71.4 | 171.8 | 0 | 0 | 0 | 112.3 | V2695 L2696 D2701 V2708 L2709 | V2695-L2705 HydrophobicContact CG1-CD2 4.25Å; L2696-L2705 HydrophobicContact CD2-CD2 4.38Å; D2701-L2705 WeakPolarHBondContact O-CB 3.35Å; D2701-L2705 WeakPolarHBondContact O-CG 3.47Å; D2701-L2705 PolarHBondContact O-N 2.88Å; L2705-V2708 PolarHBondContact O-N 3.22Å; L2705-L2709 VanDerWaalsContact O-CB 3.31Å; L2705-L2709 WeakPolarHBondContact O-CB 3.49Å; L2705-L2709 WeakPolarHBondContact O-CG 3.3Å; L2705-L2709 PolarHBondContact O-N 3.45Å |
| 2706 | R | 89.4 | Confident | 86.4 | Confident | 90 Ų | 90 | 61.7 Ų | 61.7 | 34% | 0.34 | 32% | 0.316 | S | S | . | . | H | α-helix | trans | -64.1 | -42.4 | 175.1 | -88.9 | 176 | -81.6 | 140.7 | -14.8 | 112.6 | L2486 A2702 A2703 L2704 L2709 H2710 | L2486-R2706 PolarHBondContact O-NH1 3.18Å; A2702-R2706 WeakPolarHBondContact O-CB 3.33Å; A2702-R2706 VanDerWaalsContact O-CG 3.29Å; A2702-R2706 WeakPolarHBondContact O-CG 3.31Å; A2702-R2706 PolarHBondContact O-N 3.35Å; A2702-R2706 VanDerWaalsContact O-N 3.13Å; A2702-R2706 PolarHBondContact O-NE 2.88Å; A2703-R2706 WeakPolarHBondContact O-CB 3.42Å; A2703-R2706 PolarHBondContact O-N 3.44Å; A2703-R2706 VanDerWaalsContact O-N 3.17Å; L2704-R2706 VanDerWaalsContact C-N 3.32Å; L2704-R2706 PolarHBondContact O-N 3.25Å; R2706-L2709 PolarHBondContact O-N 3.44Å; R2706-H2710 WeakPolarHBondContact O-CB 3.26Å; R2706-H2710 PolarHBondContact O-N 2.66Å |
| 2707 | A | 89.7 | Confident | 84.9 | Confident | 0 Ų | 0 | 61 Ų | 61 | 0% | 0 | 32% | 0.316 | C | S | . | . | H | α-helix | trans | -62.9 | -45.5 | 175.7 | 0 | 0 | 0 | 0 | 0 | 111.8 | L2486 F2667 E2668 A2671 A2703 L2704 H2710 I2711 | L2486-A2707 HydrophobicContact CD2-CB 4.18Å; F2667-A2707 HydrophobicContact CB-CB 3.95Å; E2668-A2707 HydrophobicContact CG-CB 4.18Å; A2671-A2707 HydrophobicContact CB-CB 4.4Å; A2703-A2707 PolarHBondContact O-N 3.3Å; L2704-A2707 PolarHBondContact O-N 2.99Å; A2707-H2710 PolarHBondContact O-N 3.45Å; A2707-I2711 WeakPolarHBondContact O-CG1 3.28Å; A2707-I2711 PolarHBondContact O-N 3.18Å |
| 2708 | V | 90.9 | Very high | 83 | Confident | 0 Ų | 0 | 61.2 Ų | 61.2 | 0% | 0 | 32% | 0.323 | C | S | . | . | H | α-helix | trans | -63.1 | -43 | 175.4 | 171.9 | 0 | 0 | 0 | 0 | 112 | F2667 I2692 V2695 L2696 L2704 L2705 H2710 I2711 I2712 | F2667-V2708 HydrophobicContact CD1-CG2 3.77Å; F2667-V2708 HydrophobicContact CD2-CG2 4.14Å; F2667-V2708 HydrophobicContact CE1-CG2 3.82Å; F2667-V2708 HydrophobicContact CE2-CG2 4.19Å; F2667-V2708 HydrophobicContact CG-CG2 3.92Å; F2667-V2708 HydrophobicContact CZ-CG2 4.02Å; I2692-V2708 HydrophobicContact CB-CG1 4.42Å; I2692-V2708 HydrophobicContact CG1-CG1 4.27Å; I2692-V2708 HydrophobicContact CG2-CG1 3.81Å; V2695-V2708 HydrophobicContact CG1-CG2 3.94Å; L2696-V2708 HydrophobicContact CD2-CG1 4.06Å; L2696-V2708 HydrophobicContact CG-CG1 4.15Å; L2704-V2708 HydrophobicContact CD1-CG2 4.27Å; L2704-V2708 WeakPolarHBondContact O-CG2 3.16Å; L2704-V2708 PolarHBondContact O-N 3.04Å; L2705-V2708 PolarHBondContact O-N 3.22Å; V2708-H2710 VanDerWaalsContact C-N 3.32Å; V2708-H2710 PolarHBondContact O-N 2.94Å; V2708-I2711 PolarHBondContact O-N 3.27Å; V2708-I2712 HydrophobicContact CG1-CD1 3.81Å; V2708-I2712 VanDerWaalsContact O-CG1 3.3Å; V2708-I2712 WeakPolarHBondContact O-CG1 3.22Å; V2708-I2712 PolarHBondContact O-N 3.25Å |
| 2709 | L | 88.9 | Confident | 81.1 | Confident | 83 Ų | 83 | 63.5 Ų | 63.5 | 44% | 0.435 | 33% | 0.331 | S | S | . | . | H | α-helix | trans | -64 | -35.9 | 175.7 | -74.7 | 168.8 | 0 | 0 | 0 | 112.4 | L2705 R2706 I2712 Q2713 | L2705-L2709 VanDerWaalsContact O-CB 3.31Å; L2705-L2709 WeakPolarHBondContact O-CB 3.49Å; L2705-L2709 WeakPolarHBondContact O-CG 3.3Å; L2705-L2709 PolarHBondContact O-N 3.45Å; R2706-L2709 PolarHBondContact O-N 3.44Å; L2709-I2712 PolarHBondContact O-N 2.91Å; L2709-Q2713 VanDerWaalsContact O-CG 3.27Å; L2709-Q2713 WeakPolarHBondContact O-CG 3.45Å; L2709-Q2713 PolarHBondContact O-N 2.94Å |
| 2710 | H | 88.9 | Confident | 79.5 | Confident | 30 Ų | 30 | 66.1 Ų | 66.1 | 14% | 0.139 | 36% | 0.361 | C | S | . | . | H | α-helix | trans | -65.8 | -43.8 | 175.6 | -164.6 | 55.1 | 0 | 0 | 0 | 111.5 | L2486 A2671 R2706 A2707 V2708 I2712 Q2713 N2714 | L2486-H2710 HydrophobicContact CD2-CB 3.98Å; A2671-H2710 HydrophobicContact CB-CB 4.37Å; R2706-H2710 WeakPolarHBondContact O-CB 3.26Å; R2706-H2710 PolarHBondContact O-N 2.66Å; A2707-H2710 PolarHBondContact O-N 3.45Å; V2708-H2710 VanDerWaalsContact C-N 3.32Å; V2708-H2710 PolarHBondContact O-N 2.94Å; H2710-I2712 VanDerWaalsContact C-N 3.35Å; H2710-I2712 PolarHBondContact O-N 3.3Å; H2710-Q2713 PolarHBondContact O-N 3.17Å; H2710-N2714 PolarHBondContact CD2-ND2 3.06Å; H2710-N2714 PolarHBondContact NE2-ND2 2.69Å; H2710-N2714 VanDerWaalsContact O-CG 3.25Å; H2710-N2714 PolarHBondContact O-N 3.12Å; H2710-N2714 PolarHBondContact O-ND2 2.68Å |
| 2711 | I | 89.7 | Confident | 77.8 | Confident | 0 Ų | 0 | 61.9 Ų | 61.9 | 0% | 0 | 35% | 0.351 | C | S | . | . | H | α-helix | trans | -56.5 | -48.9 | 171.9 | -67.8 | 164.7 | 0 | 0 | 0 | 110.4 | F2667 L2670 A2671 F2681 I2692 A2707 V2708 Q2713 N2714 M2715 | F2667-I2711 HydrophobicContact CD1-CD1 3.7Å; F2667-I2711 HydrophobicContact CE1-CD1 4.37Å; L2670-I2711 HydrophobicContact CB-CD1 3.75Å; A2671-I2711 HydrophobicContact CB-CD1 4.32Å; A2671-I2711 HydrophobicContact CB-CG1 3.9Å; F2681-I2711 HydrophobicContact CE1-CG2 3.74Å; F2681-I2711 HydrophobicContact CZ-CG1 4.44Å; F2681-I2711 HydrophobicContact CZ-CG2 3.82Å; I2692-I2711 HydrophobicContact CD1-CG2 4.36Å; A2707-I2711 WeakPolarHBondContact O-CG1 3.28Å; A2707-I2711 PolarHBondContact O-N 3.18Å; V2708-I2711 PolarHBondContact O-N 3.27Å; I2711-Q2713 VanDerWaalsContact C-N 3.34Å; I2711-Q2713 PolarHBondContact O-N 2.93Å; I2711-N2714 CarbonylContact O-C 3.58Å; I2711-N2714 PolarHBondContact O-N 3.27Å; I2711-M2715 HydrophobicContact CG2-CG 4.16Å; I2711-M2715 HydrophobicContact CG2-SD 3.58Å; I2711-M2715 VanDerWaalsContact CG2-SD 3.58Å; I2711-M2715 WeakPolarHBondContact O-CB 3.39Å; I2711-M2715 WeakPolarHBondContact O-CG 3.27Å; I2711-M2715 PolarHBondContact O-N 3.05Å |
| 2712 | I | 86.3 | Confident | 76.1 | Confident | 52 Ų | 52 | 61.2 Ų | 61.2 | 27% | 0.267 | 35% | 0.349 | S | S | . | . | H | α-helix | trans | -61.8 | -40.5 | -179.8 | -67.9 | 163.9 | 0 | 0 | 0 | 111.8 | I2692 L2696 V2708 L2709 H2710 N2714 M2715 I2716 | I2692-I2712 HydrophobicContact CG2-CD1 3.98Å; I2692-I2712 HydrophobicContact CG2-CG1 4.4Å; L2696-I2712 HydrophobicContact CD1-CD1 3.81Å; L2696-I2712 HydrophobicContact CD2-CD1 4.35Å; L2696-I2712 HydrophobicContact CG-CD1 4.5Å; V2708-I2712 HydrophobicContact CG1-CD1 3.81Å; V2708-I2712 VanDerWaalsContact O-CG1 3.3Å; V2708-I2712 WeakPolarHBondContact O-CG1 3.22Å; V2708-I2712 PolarHBondContact O-N 3.25Å; L2709-I2712 PolarHBondContact O-N 2.91Å; H2710-I2712 VanDerWaalsContact C-N 3.35Å; H2710-I2712 PolarHBondContact O-N 3.3Å; I2712-N2714 VanDerWaalsContact C-N 3.35Å; I2712-M2715 PolarHBondContact O-N 2.89Å; I2712-I2716 PolarHBondContact O-N 3.42Å |
| 2713 | Q | 85.8 | Confident | 74.3 | Confident | 123 Ų | 123 | 64.1 Ų | 64.1 | 58% | 0.575 | 36% | 0.361 | S | S | * | . | H | α-helix | trans | -60.7 | -44 | 175.4 | -75.4 | 168.9 | -4.6 | 0 | 0 | 111.6 | L2709 H2710 I2711 M2715 I2716 | L2709-Q2713 VanDerWaalsContact O-CG 3.27Å; L2709-Q2713 WeakPolarHBondContact O-CG 3.45Å; L2709-Q2713 PolarHBondContact O-N 2.94Å; H2710-Q2713 PolarHBondContact O-N 3.17Å; I2711-Q2713 VanDerWaalsContact C-N 3.34Å; I2711-Q2713 PolarHBondContact O-N 2.93Å; Q2713-M2715 VanDerWaalsContact C-N 3.31Å; Q2713-M2715 PolarHBondContact O-N 3.08Å; Q2713-I2716 PolarHBondContact O-N 3.28Å |
| 2714 | N | 82.5 | Confident | 72.5 | Confident | 65 Ų | 65 | 66.8 Ų | 66.8 | 35% | 0.348 | 38% | 0.383 | S | S | . | . | H | α-helix | trans | -74.9 | -19.1 | 178.8 | -60.1 | -24.5 | 0 | 0 | 0 | 112.8 | S2674 V2675 H2710 I2711 I2712 | S2674-N2714 PolarHBondContact OG-ND2 2.94Å; V2675-N2714 VanDerWaalsContact CG2-ND2 3.28Å; V2675-N2714 WeakPolarHBondContact CG2-ND2 3.28Å; H2710-N2714 PolarHBondContact CD2-ND2 3.06Å; H2710-N2714 PolarHBondContact NE2-ND2 2.69Å; H2710-N2714 VanDerWaalsContact O-CG 3.25Å; H2710-N2714 PolarHBondContact O-N 3.12Å; H2710-N2714 PolarHBondContact O-ND2 2.68Å; I2711-N2714 CarbonylContact O-C 3.58Å; I2711-N2714 PolarHBondContact O-N 3.27Å; I2712-N2714 VanDerWaalsContact C-N 3.35Å |
| 2715 | M | 75.7 | Confident | 70.7 | Confident | 62 Ų | 62 | 70.9 Ų | 70.9 | 31% | 0.305 | 40% | 0.399 | S | S | . | . | H | α-helix | trans | -78.5 | -14.4 | 174.6 | -77 | 173.6 | 62.6 | 0 | 0 | 114.4 | F2681 I2711 I2712 Q2713 P2717 | F2681-M2715 HydrophobicContact CD1-CG 4.47Å; F2681-M2715 HydrophobicContact CE1-CG 4.25Å; F2681-M2715 HydrophobicContact CE1-SD 4.44Å; I2711-M2715 HydrophobicContact CG2-CG 4.16Å; I2711-M2715 HydrophobicContact CG2-SD 3.58Å; I2711-M2715 VanDerWaalsContact CG2-SD 3.58Å; I2711-M2715 WeakPolarHBondContact O-CB 3.39Å; I2711-M2715 WeakPolarHBondContact O-CG 3.27Å; I2711-M2715 PolarHBondContact O-N 3.05Å; I2712-M2715 PolarHBondContact O-N 2.89Å; Q2713-M2715 VanDerWaalsContact C-N 3.31Å; Q2713-M2715 PolarHBondContact O-N 3.08Å; M2715-P2717 WeakPolarHBondContact O-CD 3.28Å |
| 2716 | I | 68.3 | Low | 68.8 | Low | 113 Ų | 113 | 75.6 Ų | 75.6 | 58% | 0.579 | 42% | 0.418 | S | S | * | . | S | Bend | trans | -76.9 | 114.8 | 176.2 | -63.4 | 165.3 | 0 | 0 | 0 | 107.7 | I2712 Q2713 N2718 | I2712-I2716 PolarHBondContact O-N 3.42Å; Q2713-I2716 PolarHBondContact O-N 3.28Å; I2716-N2718 PolarHBondContact O-N 3.2Å |
| 2717 | P | 58 | Low | 67 | Low | 66 Ų | 66 | 80.3 Ų | 80.3 | 43% | 0.429 | 44% | 0.441 | S | S | . | . | trans | -73.1 | 116.2 | -169.1 | 28.3 | -34.2 | 0 | 0 | 0 | 111.9 | M2715 D2719 T2722 | M2715-P2717 WeakPolarHBondContact O-CD 3.28Å; P2717-D2719 PolarHBondContact O-N 3.48Å; P2717-T2722 HydrophobicContact CB-CG2 4.2Å; P2717-T2722 WeakPolarHBondContact CB-OG1 3.11Å | ||
| 2718 | N | 50.2 | Low | 65.5 | Low | 156 Ų | 156 | 84.1 Ų | 84.1 | 83% | 0.834 | 46% | 0.458 | S | S | * | . | S | Bend | trans | -75.5 | 110.2 | 154.2 | -67.8 | -29 | 0 | 0 | 0 | 107.4 | I2716 | I2716-N2718 PolarHBondContact O-N 3.2Š|
| 2719 | D | 46.6 | Very low | 64 | Low | 145 Ų | 145 | 84.7 Ų | 84.7 | 78% | 0.775 | 46% | 0.461 | S | S | * | . | S | Bend | trans | 67.6 | 150 | -177.2 | -64.3 | -35.6 | 0 | 0 | 0 | 118.7 | P2717 S2721 | P2717-D2719 PolarHBondContact O-N 3.48Å; D2719-S2721 VanDerWaalsContact C-N 3.28Å; D2719-S2721 PolarHBondContact O-N 3.15Å |
| 2720 | G | 50.8 | Low | 62.7 | Low | 70 Ų | 70 | 85.5 Ų | 85.5 | 72% | 0.722 | 46% | 0.461 | S | S | * | . | G | 310 helix | trans | -76.4 | 23.4 | -157.1 | 0 | 0 | 0 | 0 | 0 | 118.3 | ||
| 2721 | S | 50.7 | Low | 61.8 | Low | 92 Ų | 92 | 86.5 Ų | 86.5 | 64% | 0.643 | 47% | 0.469 | S | S | * | . | G | 310 helix | trans | -79 | -13.8 | -175.9 | 59.1 | 0 | 0 | 0 | 0 | 114.7 | D2719 V2723 | D2719-S2721 VanDerWaalsContact C-N 3.28Å; D2719-S2721 PolarHBondContact O-N 3.15Å; S2721-V2723 PolarHBondContact O-N 2.86Å |
| 2722 | T | 51 | Low | 61 | Low | 36 Ų | 36 | 88.9 Ų | 88.9 | 22% | 0.221 | 48% | 0.48 | C | S | . | . | G | 310 helix | trans | -79.5 | -6.8 | -171.7 | 45 | 0 | 0 | 0 | 0 | 115.9 | P2682 P2717 A2724 Y2725 | P2682-T2722 HydrophobicContact CG-CG2 4.41Å; P2717-T2722 HydrophobicContact CB-CG2 4.2Å; P2717-T2722 WeakPolarHBondContact CB-OG1 3.11Å; T2722-A2724 VanDerWaalsContact C-N 3.31Å; T2722-A2724 PolarHBondContact O-N 2.77Å; T2722-Y2725 PolarHBondContact O-N 3.31Å |
| 2723 | V | 49.8 | Very low | 60.6 | Low | 116 Ų | 116 | 86.5 Ų | 86.5 | 70% | 0.703 | 47% | 0.467 | S | S | * | . | G | 310 helix | trans | -68.3 | -29 | -178 | -177.9 | 0 | 0 | 0 | 0 | 112.4 | S2721 | S2721-V2723 PolarHBondContact O-N 2.86Š|
| 2724 | A | 49.9 | Very low | 60.4 | Low | 61 Ų | 61 | 86.8 Ų | 86.8 | 50% | 0.504 | 47% | 0.469 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -65.6 | -43.5 | 177.8 | 0 | 0 | 0 | 0 | 0 | 112.6 | T2722 H2728 | T2722-A2724 VanDerWaalsContact C-N 3.31Å; T2722-A2724 PolarHBondContact O-N 2.77Å; A2724-H2728 PolarHBondContact O-CD2 3.05Å |
| 2725 | Y | 51.5 | Low | 60.4 | Low | 87 Ų | 87 | 88.8 Ų | 88.8 | 34% | 0.341 | 48% | 0.479 | S | S | . | . | G | 310 helix | trans | -83.6 | -27.4 | -169.7 | -70.2 | -87.4 | 0 | 0 | 0 | 114.2 | V2683 T2722 K2727 H2728 F2732 | V2683-Y2725 HydrophobicContact CG2-CD1 4.37Å; T2722-Y2725 PolarHBondContact O-N 3.31Å; Y2725-K2727 PolarHBondContact O-N 3.41Å; Y2725-H2728 PolarHBondContact O-N 2.87Å; Y2725-F2732 HydrophobicContact CD1-CD2 4.32Å; Y2725-F2732 AromaticContact CD1-CE2 3.52Å; Y2725-F2732 HydrophobicContact CD1-CE2 3.52Å; Y2725-F2732 AromaticContact CD1-CZ 3.94Å; Y2725-F2732 HydrophobicContact CD1-CZ 3.94Å; Y2725-F2732 HydrophobicContact CE1-CE1 4.39Å; Y2725-F2732 AromaticContact CE1-CE2 3.59Å; Y2725-F2732 HydrophobicContact CE1-CE2 3.59Å; Y2725-F2732 AromaticContact CE1-CZ 3.47Å; Y2725-F2732 HydrophobicContact CE1-CZ 3.47Å; Y2725-F2732 VanDerWaalsContact CE1-CZ 3.47Å |
| 2726 | K | 50.9 | Low | 60.8 | Low | 141 Ų | 141 | 88.6 Ų | 88.6 | 61% | 0.613 | 48% | 0.476 | S | S | * | . | G | 310 helix | trans | -60 | -18.6 | -178.2 | -80.4 | -173.5 | 176 | -178.7 | 0 | 115.3 | ||
| 2727 | K | 51.7 | Low | 61.7 | Low | 189 Ų | 189 | 84 Ų | 84 | 82% | 0.822 | 46% | 0.457 | S | S | * | . | G | 310 helix | trans | -98.7 | -5.3 | 176.2 | -88.2 | -173.3 | 173.9 | -178.9 | 0 | 114.8 | Y2725 | Y2725-K2727 PolarHBondContact O-N 3.41Š|
| 2728 | H | 57.6 | Low | 63.3 | Low | 80 Ų | 80 | 80.9 Ų | 80.9 | 37% | 0.37 | 44% | 0.436 | S | S | . | . | trans | -116.8 | 14.5 | -163.9 | -72.2 | -48.6 | 0 | 0 | 0 | 116 | A2724 Y2725 F2730 T2731 F2732 | A2724-H2728 PolarHBondContact O-CD2 3.05Å; Y2725-H2728 PolarHBondContact O-N 2.87Å; H2728-F2730 VanDerWaalsContact C-N 3.34Å; H2728-F2730 PolarHBondContact O-N 2.78Å; H2728-T2731 PolarHBondContact ND1-OG1 2.85Å; H2728-T2731 PolarHBondContact O-N 3.37Å; H2728-F2732 HydrophobicContact CB-CD2 3.6Å; H2728-F2732 HydrophobicContact CB-CE2 3.67Å; H2728-F2732 WeakPolarHBondContact O-CD2 3.44Å; H2728-F2732 PolarHBondContact O-N 3.26Å | ||
| 2729 | H | 60.1 | Low | 65.1 | Low | 11 Ų | 11 | 74.8 Ų | 74.8 | 5% | 0.051 | 41% | 0.406 | C | S | . | . | H | α-helix | trans | -47 | -56.5 | 172 | 171.1 | 69.8 | 0 | 0 | 0 | 112.2 | V2683 S2686 T2731 L2733 | V2683-H2729 WeakPolarHBondContact O-CB 3.32Å; V2683-H2729 PolarHBondContact O-ND1 2.78Å; S2686-H2729 PolarHBondContact OG-CD2 3.43Å; S2686-H2729 VanDerWaalsContact OG-CD2 3.27Å; H2729-T2731 PolarHBondContact O-N 3.06Å; H2729-L2733 WeakPolarHBondContact CE1-CD1 3.29Å; H2729-L2733 PolarHBondContact O-N 3.3Å |
| 2730 | F | 61.3 | Low | 67.1 | Low | 100 Ų | 100 | 68 Ų | 68 | 44% | 0.439 | 37% | 0.37 | S | S | . | . | H | α-helix | trans | -62.9 | -41.5 | 177.3 | -72 | -70.4 | 0 | 0 | 0 | 111.9 | H2728 Q2734 W2742 | H2728-F2730 VanDerWaalsContact C-N 3.34Å; H2728-F2730 PolarHBondContact O-N 2.78Å; F2730-Q2734 WeakPolarHBondContact O-CB 3.15Å; F2730-Q2734 PolarHBondContact O-N 2.84Å; F2730-W2742 AromaticContact CE1-CZ2 4Å; F2730-W2742 HydrophobicContact CE1-CZ2 4Å; F2730-W2742 HydrophobicContact CZ-CZ2 4.21Å |
| 2731 | T | 69 | Low | 69 | Low | 51 Ų | 51 | 64.7 Ų | 64.7 | 31% | 0.313 | 34% | 0.336 | S | S | . | . | H | α-helix | trans | -65.1 | -44.8 | -178.3 | -39 | 0 | 0 | 0 | 0 | 112.3 | H2728 H2729 Q2734 N2735 | H2728-T2731 PolarHBondContact ND1-OG1 2.85Å; H2728-T2731 PolarHBondContact O-N 3.37Å; H2729-T2731 PolarHBondContact O-N 3.06Å; T2731-Q2734 PolarHBondContact O-N 3.01Å; T2731-N2735 VanDerWaalsContact O-CB 3.27Å; T2731-N2735 WeakPolarHBondContact O-CB 3.33Å; T2731-N2735 PolarHBondContact O-N 3.27Å; T2731-N2735 PolarHBondContact O-ND2 3.03Å; T2731-N2735 PolarHBondContact O-OD1 3.23Å |
| 2732 | F | 72.4 | Confident | 70.8 | Confident | 51 Ų | 51 | 63.1 Ų | 63.1 | 22% | 0.224 | 32% | 0.316 | C | S | . | . | H | α-helix | trans | -66.4 | -48.4 | 178.5 | -82.7 | -73.5 | 0 | 0 | 0 | 111.9 | V2683 Y2725 H2728 Q2734 N2735 Y2736 | V2683-F2732 HydrophobicContact CG1-CB 4.5Å; V2683-F2732 HydrophobicContact CG2-CD2 4.27Å; Y2725-F2732 HydrophobicContact CD1-CD2 4.32Å; Y2725-F2732 AromaticContact CD1-CE2 3.52Å; Y2725-F2732 HydrophobicContact CD1-CE2 3.52Å; Y2725-F2732 AromaticContact CD1-CZ 3.94Å; Y2725-F2732 HydrophobicContact CD1-CZ 3.94Å; Y2725-F2732 HydrophobicContact CE1-CE1 4.39Å; Y2725-F2732 AromaticContact CE1-CE2 3.59Å; Y2725-F2732 HydrophobicContact CE1-CE2 3.59Å; Y2725-F2732 AromaticContact CE1-CZ 3.47Å; Y2725-F2732 HydrophobicContact CE1-CZ 3.47Å; Y2725-F2732 VanDerWaalsContact CE1-CZ 3.47Å; H2728-F2732 HydrophobicContact CB-CD2 3.6Å; H2728-F2732 HydrophobicContact CB-CE2 3.67Å; H2728-F2732 WeakPolarHBondContact O-CD2 3.44Å; H2728-F2732 PolarHBondContact O-N 3.26Å; F2732-Q2734 VanDerWaalsContact C-N 3.32Å; F2732-Q2734 PolarHBondContact O-N 3.38Å; F2732-N2735 PolarHBondContact O-N 2.79Å; F2732-Y2736 HydrophobicContact CD1-CE2 4.24Å; F2732-Y2736 WeakPolarHBondContact O-CD2 3.27Å; F2732-Y2736 PolarHBondContact O-N 3.08Å; F2732-Y2736 VanDerWaalsContact O-N 3.12Å |
| 2733 | L | 79.2 | Confident | 72.6 | Confident | 1 Ų | 1 | 68.2 Ų | 68.2 | 1% | 0.005 | 33% | 0.331 | C | S | . | . | H | α-helix | trans | -66.9 | -33.2 | 177.3 | -71.3 | 178.3 | 0 | 0 | 0 | 112.7 | V2644 L2645 T2648 H2729 G2737 F2738 S2739 | V2644-L2733 HydrophobicContact CG1-CD2 3.65Å; V2644-L2733 HydrophobicContact CG1-CG 4.47Å; L2645-L2733 HydrophobicContact CD2-CD2 4.24Å; T2648-L2733 HydrophobicContact CG2-CD1 3.75Å; T2648-L2733 HydrophobicContact CG2-CD2 4.06Å; H2729-L2733 WeakPolarHBondContact CE1-CD1 3.29Å; H2729-L2733 PolarHBondContact O-N 3.3Å; L2733-G2737 PolarHBondContact O-N 3.48Å; L2733-G2737 VanDerWaalsContact O-N 3.08Å; L2733-F2738 HydrophobicContact CD2-CB 4.3Å; L2733-F2738 CarbonylContact O-C 3.27Å; L2733-F2738 PolarHBondContact O-N 3.32Å; L2733-S2739 PolarHBondContact O-N 3.02Å |
| 2734 | Q | 82.1 | Confident | 74.5 | Confident | 130 Ų | 130 | 63.1 Ų | 63.1 | 61% | 0.607 | 30% | 0.299 | S | S | * | . | H | α-helix | trans | -68.8 | -40.4 | 173.9 | -173.7 | 174.5 | 11.7 | 0 | 0 | 111.7 | F2730 T2731 F2732 Y2736 G2737 | F2730-Q2734 WeakPolarHBondContact O-CB 3.15Å; F2730-Q2734 PolarHBondContact O-N 2.84Å; T2731-Q2734 PolarHBondContact O-N 3.01Å; F2732-Q2734 VanDerWaalsContact C-N 3.32Å; F2732-Q2734 PolarHBondContact O-N 3.38Å; Q2734-Y2736 VanDerWaalsContact C-N 3.29Å; Q2734-Y2736 PolarHBondContact O-N 2.88Å; Q2734-G2737 PolarHBondContact O-N 3Å |
| 2735 | N | 82.6 | Confident | 76.5 | Confident | 106 Ų | 106 | 60.3 Ų | 60.3 | 57% | 0.567 | 28% | 0.277 | S | S | * | . | H | α-helix | trans | -62.1 | -35.4 | 176.2 | -72.7 | -9 | 0 | 0 | 0 | 112.5 | T2731 F2732 | T2731-N2735 VanDerWaalsContact O-CB 3.27Å; T2731-N2735 WeakPolarHBondContact O-CB 3.33Å; T2731-N2735 PolarHBondContact O-N 3.27Å; T2731-N2735 PolarHBondContact O-ND2 3.03Å; T2731-N2735 PolarHBondContact O-OD1 3.23Å; F2732-N2735 PolarHBondContact O-N 2.79Å |
| 2736 | Y | 84 | Confident | 78.3 | Confident | 59 Ų | 59 | 56.3 Ų | 56.3 | 23% | 0.231 | 26% | 0.261 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -87.2 | -2.2 | 173.8 | -59.4 | -53.8 | 0 | 0 | 0 | 113.9 | H2407 V2644 F2732 Q2734 F2738 | H2407-Y2736 VanDerWaalsContact CB-O 3.29Å; H2407-Y2736 WeakPolarHBondContact CB-O 3.17Å; V2644-Y2736 HydrophobicContact CB-CE2 4.45Å; V2644-Y2736 HydrophobicContact CG1-CD2 4.36Å; V2644-Y2736 HydrophobicContact CG2-CE2 4.34Å; F2732-Y2736 HydrophobicContact CD1-CE2 4.24Å; F2732-Y2736 WeakPolarHBondContact O-CD2 3.27Å; F2732-Y2736 PolarHBondContact O-N 3.08Å; F2732-Y2736 VanDerWaalsContact O-N 3.12Å; Q2734-Y2736 VanDerWaalsContact C-N 3.29Å; Q2734-Y2736 PolarHBondContact O-N 2.88Å; Y2736-F2738 WeakPolarHBondContact O-CD2 3.17Å |
| 2737 | G | 86.3 | Confident | 80.1 | Confident | 17 Ų | 17 | 53.8 Ų | 53.8 | 18% | 0.175 | 26% | 0.26 | C | S | . | . | T | Hydrogen-bonded Turn | trans | 73.7 | 25.1 | -179.8 | 0 | 0 | 0 | 0 | 0 | 115.5 | G2402 I2403 S2404 L2733 Q2734 | G2402-G2737 CarbonylContact C-O 3.5Å; G2402-G2737 VanDerWaalsContact C-O 3.27Å; G2402-G2737 VanDerWaalsContact O-O 3.12Å; I2403-G2737 CarbonylContact C-O 3.52Å; I2403-G2737 WeakPolarHBondContact CA-O 3.38Å; I2403-G2737 PolarHBondContact N-O 3.08Å; S2404-G2737 PolarHBondContact N-O 3.03Å; L2733-G2737 PolarHBondContact O-N 3.48Å; L2733-G2737 VanDerWaalsContact O-N 3.08Å; Q2734-G2737 PolarHBondContact O-N 3Å |
| 2738 | F | 92.1 | Very high | 81.9 | Confident | 0 Ų | 0 | 45.9 Ų | 45.9 | 0% | 0 | 23% | 0.225 | C | C | . | . | trans | -120 | 18.1 | -179.7 | -74.8 | -84.5 | 0 | 0 | 0 | 114.4 | G2402 I2403 S2404 H2407 H2408 F2411 A2412 L2645 L2733 Y2736 G2740 L2741 | G2402-F2738 CarbonylContact O-C 3.32Å; G2402-F2738 WeakPolarHBondContact O-CA 3.31Å; I2403-F2738 HydrophobicContact CG2-CD1 4.23Å; I2403-F2738 HydrophobicContact CG2-CE1 3.96Å; S2404-F2738 VanDerWaalsContact O-CZ 3.31Å; S2404-F2738 WeakPolarHBondContact O-CZ 3.42Å; H2407-F2738 HydrophobicContact CB-CE2 3.89Å; H2408-F2738 HydrophobicContact CB-CE2 3.9Å; H2408-F2738 HydrophobicContact CB-CZ 3.81Å; H2408-F2738 WeakPolarHBondContact O-CZ 3.34Å; F2411-F2738 HydrophobicContact CB-CE1 4.05Å; F2411-F2738 HydrophobicContact CB-CZ 4.18Å; A2412-F2738 HydrophobicContact CB-CE1 3.99Å; A2412-F2738 HydrophobicContact CB-CZ 4.16Å; L2645-F2738 HydrophobicContact CD1-CD2 3.88Å; L2645-F2738 HydrophobicContact CD1-CE2 3.82Å; L2645-F2738 HydrophobicContact CD1-CG 4.42Å; L2645-F2738 HydrophobicContact CD1-CZ 4.3Å; L2645-F2738 HydrophobicContact CD2-CB 3.5Å; L2645-F2738 HydrophobicContact CD2-CD1 4.05Å; L2645-F2738 HydrophobicContact CD2-CD2 3.52Å; L2645-F2738 HydrophobicContact CD2-CE2 4.27Å; L2645-F2738 HydrophobicContact CD2-CG 3.4Å; L2645-F2738 VanDerWaalsContact CD2-CG 3.4Å; L2645-F2738 HydrophobicContact CG-CD2 4.34Å; L2733-F2738 HydrophobicContact CD2-CB 4.3Å; L2733-F2738 CarbonylContact O-C 3.27Å; L2733-F2738 PolarHBondContact O-N 3.32Å; Y2736-F2738 WeakPolarHBondContact O-CD2 3.17Å; F2738-G2740 PolarHBondContact O-N 3.22Å; F2738-L2741 HydrophobicContact CD1-CD1 4.17Å; F2738-L2741 WeakPolarHBondContact O-CB 3.31Å; F2738-L2741 PolarHBondContact O-N 2.84Å; F2738-L2741 VanDerWaalsContact O-N 3.15Å | ||
| 2739 | S | 88.6 | Confident | 83 | Confident | 28 Ų | 28 | 45.3 Ų | 45.3 | 20% | 0.196 | 23% | 0.229 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -57.6 | -19.7 | -179.8 | 66.4 | 0 | 0 | 0 | 0 | 115.4 | G2402 L2733 W2742 | G2402-S2739 PolarHBondContact O-N 3.46Å; G2402-S2739 VanDerWaalsContact O-N 3.15Å; L2733-S2739 PolarHBondContact O-N 3.02Å; S2739-W2742 PolarHBondContact O-NE1 3.26Å |
| 2740 | G | 88 | Confident | 83.4 | Confident | 3 Ų | 3 | 53.5 Ų | 53.5 | 3% | 0.031 | 27% | 0.272 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -100 | -6.1 | 179.5 | 0 | 0 | 0 | 0 | 0 | 115.9 | I2401 G2402 F2738 W2742 R2743 F2744 | I2401-G2740 WeakPolarHBondContact O-CA 3.48Å; G2402-G2740 PolarHBondContact O-N 3Å; F2738-G2740 PolarHBondContact O-N 3.22Å; G2740-W2742 VanDerWaalsContact C-N 3.32Å; G2740-W2742 PolarHBondContact O-N 2.88Å; G2740-R2743 WeakPolarHBondContact O-CA 3.4Å; G2740-R2743 WeakPolarHBondContact O-CB 3.38Å; G2740-R2743 PolarHBondContact O-N 3.37Å; G2740-F2744 PolarHBondContact O-N 3.38Å |
| 2741 | L | 91.2 | Very high | 83.1 | Confident | 0 Ų | 0 | 56.7 Ų | 56.7 | 0% | 0 | 29% | 0.285 | C | S | . | . | H | α-helix | trans | -49.7 | -51.4 | -177.4 | -177.7 | 163.2 | 0 | 0 | 0 | 111.9 | S2415 T2648 L2649 T2652 F2738 R2743 A2745 | S2415-L2741 WeakPolarHBondContact OG-CD1 3.47Å; S2415-L2741 WeakPolarHBondContact OG-CG 3.13Å; T2648-L2741 HydrophobicContact CG2-CD2 4.25Å; L2649-L2741 HydrophobicContact CD1-CD2 4.35Å; T2652-L2741 HydrophobicContact CG2-CD2 4Å; T2652-L2741 VanDerWaalsContact OG1-CD2 3.3Å; T2652-L2741 WeakPolarHBondContact OG1-CD2 3.48Å; F2738-L2741 HydrophobicContact CD1-CD1 4.17Å; F2738-L2741 WeakPolarHBondContact O-CB 3.31Å; F2738-L2741 PolarHBondContact O-N 2.84Å; F2738-L2741 VanDerWaalsContact O-N 3.15Å; L2741-R2743 VanDerWaalsContact C-N 3.28Å; L2741-R2743 PolarHBondContact O-N 3.21Å; L2741-A2745 PolarHBondContact O-N 2.79Å |
| 2742 | W | 87.7 | Confident | 82.3 | Confident | 58 Ų | 58 | 59.9 Ų | 59.9 | 22% | 0.22 | 31% | 0.307 | C | S | . | . | H | α-helix | trans | -71.4 | -19.3 | -179.6 | 71.4 | -92.5 | 0 | 0 | 0 | 113.6 | T2652 Y2656 L2687 F2730 S2739 G2740 | T2652-W2742 HydrophobicContact CG2-CB 4.34Å; T2652-W2742 WeakPolarHBondContact OG1-CB 3.5Å; Y2656-W2742 WeakPolarHBondContact CE2-O 3.31Å; Y2656-W2742 VanDerWaalsContact CZ-O 3.31Å; Y2656-W2742 PolarHBondContact OH-O 2.89Å; L2687-W2742 HydrophobicContact CD1-CB 4.17Å; L2687-W2742 HydrophobicContact CD1-CG 4.43Å; L2687-W2742 HydrophobicContact CD2-CB 3.95Å; L2687-W2742 HydrophobicContact CD2-CD2 3.7Å; L2687-W2742 HydrophobicContact CD2-CE3 4.15Å; L2687-W2742 HydrophobicContact CD2-CG 3.6Å; F2730-W2742 AromaticContact CE1-CZ2 4Å; F2730-W2742 HydrophobicContact CE1-CZ2 4Å; F2730-W2742 HydrophobicContact CZ-CZ2 4.21Å; S2739-W2742 PolarHBondContact O-NE1 3.26Å; G2740-W2742 VanDerWaalsContact C-N 3.32Å; G2740-W2742 PolarHBondContact O-N 2.88Å |
| 2743 | R | 88.5 | Confident | 80.6 | Confident | 144 Ų | 144 | 61.7 Ų | 61.7 | 54% | 0.543 | 33% | 0.326 | S | S | . | . | H | α-helix | trans | -82.7 | -48.7 | 176.6 | -64.3 | -178.8 | 176 | 166.2 | -1.6 | 110.6 | G2740 L2741 A2745 G2746 | G2740-R2743 WeakPolarHBondContact O-CA 3.4Å; G2740-R2743 WeakPolarHBondContact O-CB 3.38Å; G2740-R2743 PolarHBondContact O-N 3.37Å; L2741-R2743 VanDerWaalsContact C-N 3.28Å; L2741-R2743 PolarHBondContact O-N 3.21Å; R2743-A2745 PolarHBondContact O-N 3.19Å; R2743-G2746 PolarHBondContact O-N 3.46Å; R2743-G2746 VanDerWaalsContact O-N 3.13Å |
| 2744 | F | 90.8 | Very high | 78.7 | Confident | 8 Ų | 8 | 65.6 Ų | 65.6 | 4% | 0.035 | 35% | 0.354 | C | S | . | . | H | α-helix | trans | -61.2 | -43.4 | -177.5 | -171.3 | -88.4 | 0 | 0 | 0 | 111.9 | L2346 E2349 I2401 I2403 Y2416 K2419 G2740 G2746 | L2346-F2744 WeakPolarHBondContact O-CZ 3.37Å; E2349-F2744 HydrophobicContact CG-CE2 4.06Å; E2349-F2744 WeakPolarHBondContact OE1-CD2 3.41Å; E2349-F2744 VanDerWaalsContact OE1-CE2 3.29Å; E2349-F2744 WeakPolarHBondContact OE1-CE2 3.07Å; I2401-F2744 HydrophobicContact CG2-CD2 4.13Å; I2403-F2744 HydrophobicContact CD1-CB 3.89Å; I2403-F2744 HydrophobicContact CD1-CG 4.2Å; Y2416-F2744 HydrophobicContact CD1-CD1 4.08Å; Y2416-F2744 AromaticContact CD1-CE1 3.6Å; Y2416-F2744 HydrophobicContact CD1-CE1 3.6Å; Y2416-F2744 HydrophobicContact CD1-CE2 4.06Å; Y2416-F2744 AromaticContact CD1-CZ 3.59Å; Y2416-F2744 HydrophobicContact CD1-CZ 3.59Å; Y2416-F2744 HydrophobicContact CE1-CD2 4.33Å; Y2416-F2744 HydrophobicContact CE1-CE1 4.33Å; Y2416-F2744 HydrophobicContact CE1-CE2 4.06Å; Y2416-F2744 HydrophobicContact CE1-CZ 4.07Å; Y2416-F2744 HydrophobicContact CG-CE1 4.4Å; K2419-F2744 HydrophobicContact CB-CE1 4.13Å; K2419-F2744 HydrophobicContact CD-CE1 4.04Å; K2419-F2744 HydrophobicContact CD-CZ 4.2Å; K2419-F2744 WeakPolarHBondContact CD-O 3.41Å; K2419-F2744 WeakPolarHBondContact CG-O 3.43Å; K2419-F2744 PolarHBondContact NZ-O 3.44Å; G2740-F2744 PolarHBondContact O-N 3.38Å; F2744-G2746 PolarHBondContact O-N 3.12Å |
| 2745 | A | 91.4 | Very high | 77 | Confident | 3 Ų | 3 | 65 Ų | 65 | 3% | 0.025 | 36% | 0.361 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -70.1 | 1 | 178.8 | 0 | 0 | 0 | 0 | 0 | 115.1 | L2418 T2652 L2741 R2743 | L2418-A2745 HydrophobicContact CB-CB 3.82Å; L2418-A2745 HydrophobicContact CD1-CB 4.19Å; T2652-A2745 HydrophobicContact CG2-CB 3.59Å; L2741-A2745 PolarHBondContact O-N 2.79Å; R2743-A2745 PolarHBondContact O-N 3.19Å |
| 2746 | G | 89.4 | Confident | 75.6 | Confident | 2 Ų | 2 | 64.4 Ų | 64.4 | 2% | 0.021 | 36% | 0.357 | C | S | . | . | S | Bend | trans | -70.7 | 178.9 | 175.2 | 0 | 0 | 0 | 0 | 0 | 114.2 | K2419 Y2656 R2743 F2744 | K2419-G2746 WeakPolarHBondContact CG-O 3.34Å; Y2656-G2746 VanDerWaalsContact CZ-CA 3.46Å; R2743-G2746 PolarHBondContact O-N 3.46Å; R2743-G2746 VanDerWaalsContact O-N 3.13Å; F2744-G2746 PolarHBondContact O-N 3.12Å |
| 2747 | P | 88.8 | Confident | 74.2 | Confident | 89 Ų | 89 | 65.5 Ų | 65.5 | 58% | 0.578 | 38% | 0.379 | S | S | * | . | P | Polyproline II helix | trans | -63 | 154.7 | 179.3 | 28.3 | -35.7 | 0 | 0 | 0 | 112.4 | ||
| 2748 | F | 88.4 | Confident | 73 | Confident | 23 Ų | 23 | 67.8 Ų | 67.8 | 10% | 0.101 | 39% | 0.386 | C | S | . | . | P | Polyproline II helix | trans | -62.6 | 142.4 | 173.9 | -72.7 | -94.1 | 0 | 0 | 0 | 111.5 | E2349 P2351 Y2354 K2419 R2422 H2423 L2750 | E2349-F2748 VanDerWaalsContact O-CD1 3.3Å; E2349-F2748 WeakPolarHBondContact O-CD1 3.43Å; P2351-F2748 HydrophobicContact CB-CD1 4.4Å; P2351-F2748 HydrophobicContact CG-CB 4.23Å; P2351-F2748 HydrophobicContact CG-CD1 3.79Å; P2351-F2748 HydrophobicContact CG-CE1 4.45Å; P2351-F2748 HydrophobicContact CG-CG 4.09Å; Y2354-F2748 HydrophobicContact CD1-CE1 4.41Å; Y2354-F2748 AromaticContact CD1-CZ 3.78Å; Y2354-F2748 HydrophobicContact CD1-CZ 3.78Å; Y2354-F2748 HydrophobicContact CD2-CE1 4.21Å; Y2354-F2748 HydrophobicContact CD2-CZ 4.11Å; Y2354-F2748 HydrophobicContact CE1-CZ 4.2Å; Y2354-F2748 AromaticContact CG-CE1 3.94Å; Y2354-F2748 HydrophobicContact CG-CE1 3.94Å; Y2354-F2748 AromaticContact CG-CZ 3.74Å; Y2354-F2748 HydrophobicContact CG-CZ 3.74Å; K2419-F2748 HydrophobicContact CD-CE1 4.1Å; K2419-F2748 HydrophobicContact CD-CE2 4.36Å; K2419-F2748 HydrophobicContact CD-CZ 3.97Å; K2419-F2748 HydrophobicContact CG-CE2 3.98Å; K2419-F2748 HydrophobicContact CG-CZ 3.99Å; K2419-F2748 WeakPolarHBondContact O-CE2 2.97Å; R2422-F2748 WeakPolarHBondContact O-CD2 3.46Å; H2423-F2748 HydrophobicContact CB-CE2 3.96Å; H2423-F2748 HydrophobicContact CB-CZ 4.49Å; H2423-F2748 AromaticContact CD2-CE2 3.95Å; H2423-F2748 AromaticContact CD2-CZ 3.76Å; F2748-L2750 PolarHBondContact O-N 2.66Å |
| 2749 | P | 82.2 | Confident | 72 | Confident | 68 Ų | 68 | 68.5 Ų | 68.5 | 44% | 0.442 | 39% | 0.391 | S | S | . | . | P | Polyproline II helix | trans | -63.2 | 130.8 | -178.9 | 24.2 | -32.9 | 0 | 0 | 0 | 112.1 | K2751 | P2749-K2751 PolarHBondContact O-N 2.67Š|
| 2750 | L | 66.8 | Low | 71.1 | Confident | 182 Ų | 182 | 71.3 Ų | 71.3 | 95% | 0.953 | 41% | 0.408 | S | S | * | . | S | Bend | trans | -67.4 | -3.2 | -173.7 | -77.4 | 164.6 | 0 | 0 | 0 | 115.5 | F2748 | F2748-L2750 PolarHBondContact O-N 2.66Š|
| 2751 | K | 56.4 | Low | 70.3 | Confident | 167 Ų | 167 | 75.1 Ų | 75.1 | 73% | 0.726 | 43% | 0.425 | S | S | * | . | S | Bend | trans | -141.4 | 134.8 | 169.8 | -69.2 | -177.2 | 178.6 | 178.8 | 0 | 108.4 | P2749 S2753 | P2749-K2751 PolarHBondContact O-N 2.67Å; K2751-S2753 VanDerWaalsContact C-N 3.29Å; K2751-S2753 PolarHBondContact O-N 3.31Å |
| 2752 | P | 51 | Low | 69.6 | Low | 118 Ų | 118 | 75.6 Ų | 75.6 | 77% | 0.766 | 43% | 0.428 | S | S | * | . | trans | -66.3 | 96.7 | 157.4 | 29.1 | -30.9 | 0 | 0 | 0 | 107 | S2754 | P2752-S2754 PolarHBondContact O-N 3.06Š| ||
| 2753 | S | 37.3 | Very low | 68.8 | Low | 90 Ų | 90 | 76.4 Ų | 76.4 | 63% | 0.629 | 44% | 0.437 | S | S | * | . | trans | -77.4 | 111.9 | -177.7 | 50 | 0 | 0 | 0 | 0 | 109.7 | K2751 | K2751-S2753 VanDerWaalsContact C-N 3.29Å; K2751-S2753 PolarHBondContact O-N 3.31Å | ||
| 2754 | S | 39.5 | Very low | 68.2 | Low | 83 Ų | 83 | 71.9 Ų | 71.9 | 58% | 0.58 | 43% | 0.425 | S | S | * | . | S | Bend | trans | 65.3 | 172.1 | -177.5 | 93.7 | 0 | 0 | 0 | 0 | 112.8 | P2752 L2756 | P2752-S2754 PolarHBondContact O-N 3.06Å; S2754-L2756 PolarHBondContact O-N 3Å |
| 2755 | P | 46.7 | Very low | 67.5 | Low | 117 Ų | 117 | 71.5 Ų | 71.5 | 76% | 0.76 | 42% | 0.423 | S | S | * | . | S | Bend | trans | -55.4 | 137.4 | 165.9 | 26.6 | -34.7 | 0 | 0 | 0 | 107.7 | A2757 | P2755-A2757 PolarHBondContact O-N 3.44Š|
| 2756 | L | 53.4 | Low | 66.7 | Low | 94 Ų | 94 | 72.6 Ų | 72.6 | 49% | 0.492 | 43% | 0.429 | S | S | . | . | trans | -24.9 | 104.8 | -177.4 | -90.5 | 134.9 | 0 | 0 | 0 | 110.7 | F2348 D2350 L2353 S2754 I2758 | F2348-L2756 HydrophobicContact CB-CD2 3.79Å; F2348-L2756 HydrophobicContact CD1-CD2 4.25Å; F2348-L2756 HydrophobicContact CG-CD2 4.02Å; D2350-L2756 HydrophobicContact CB-CD2 4.49Å; L2353-L2756 HydrophobicContact CD1-CD1 4.06Å; L2353-L2756 HydrophobicContact CD1-CD2 3.81Å; S2754-L2756 PolarHBondContact O-N 3Å; L2756-I2758 HydrophobicContact CB-CG1 4.22Å; L2756-I2758 PolarHBondContact O-N 3.43Å | ||
| 2757 | A | 52.9 | Low | 65.7 | Low | 82 Ų | 82 | 77.7 Ų | 77.7 | 68% | 0.678 | 45% | 0.452 | S | S | * | . | trans | -77.2 | 63.5 | -175.3 | 0 | 0 | 0 | 0 | 0 | 109.1 | P2755 S2759 | P2755-A2757 PolarHBondContact O-N 3.44Å; A2757-S2759 PolarHBondContact O-N 3.48Å; A2757-S2759 VanDerWaalsContact O-N 3.09Å | ||
| 2758 | I | 62.9 | Low | 64.9 | Low | 64 Ų | 64 | 79.7 Ų | 79.7 | 33% | 0.328 | 45% | 0.448 | S | S | . | . | trans | -54.8 | 115.4 | 172.7 | -56.3 | 176.4 | 0 | 0 | 0 | 105.4 | F2348 L2756 T2762 L2763 | F2348-I2758 HydrophobicContact CD1-CG1 4.33Å; F2348-I2758 HydrophobicContact CE1-CB 4.28Å; F2348-I2758 HydrophobicContact CE1-CD1 4.39Å; F2348-I2758 HydrophobicContact CE1-CG1 3.74Å; F2348-I2758 HydrophobicContact CE1-CG2 4.03Å; F2348-I2758 HydrophobicContact CZ-CG1 4.34Å; L2756-I2758 HydrophobicContact CB-CG1 4.22Å; L2756-I2758 PolarHBondContact O-N 3.43Å; I2758-T2762 HydrophobicContact CG2-CG2 4.08Å; I2758-L2763 HydrophobicContact CD1-CD1 4.36Å; I2758-L2763 HydrophobicContact CG2-CB 3.77Å; I2758-L2763 HydrophobicContact CG2-CD1 4.06Å; I2758-L2763 HydrophobicContact CG2-CG 4.49Å | ||
| 2759 | S | 69.8 | Low | 63.9 | Low | 15 Ų | 15 | 78.9 Ų | 78.9 | 11% | 0.105 | 45% | 0.445 | C | S | . | . | trans | -61.8 | 144.3 | 177.2 | 69.6 | 0 | 0 | 0 | 0 | 108.8 | Q2400 A2757 E2761 T2762 L2763 | Q2400-S2759 PolarHBondContact OE1-OG 3.02Å; A2757-S2759 PolarHBondContact O-N 3.48Å; A2757-S2759 VanDerWaalsContact O-N 3.09Å; S2759-E2761 VanDerWaalsContact CB-OE2 3.22Å; S2759-E2761 WeakPolarHBondContact CB-OE2 3.39Å; S2759-E2761 PolarHBondContact O-N 3.39Å; S2759-E2761 VanDerWaalsContact O-N 3.11Å; S2759-E2761 PolarHBondContact OG-OE2 2.9Å; S2759-T2762 WeakPolarHBondContact O-CA 3.44Å; S2759-T2762 WeakPolarHBondContact O-CB 3.21Å; S2759-T2762 PolarHBondContact O-N 3.45Å; S2759-T2762 PolarHBondContact OG-N 2.87Å; S2759-T2762 PolarHBondContact OG-OG1 3.06Å; S2759-L2763 PolarHBondContact O-N 2.83Å | ||
| 2760 | P | 70.5 | Confident | 62.9 | Low | 87 Ų | 87 | 76.9 Ų | 76.9 | 57% | 0.565 | 43% | 0.43 | S | S | * | . | H | α-helix | trans | -56.8 | -30.2 | -179.4 | 22.5 | -32.2 | 0 | 0 | 0 | 111.5 | L2763 T2764 | P2760-L2763 PolarHBondContact O-N 3.04Å; P2760-T2764 VanDerWaalsContact O-CB 3.26Å; P2760-T2764 WeakPolarHBondContact O-CB 3.46Å; P2760-T2764 PolarHBondContact O-N 3.34Å; P2760-T2764 PolarHBondContact O-OG1 3.19Å |
| 2761 | E | 71.7 | Confident | 62.4 | Low | 83 Ų | 83 | 70.7 Ų | 70.7 | 39% | 0.388 | 41% | 0.41 | S | S | . | . | H | α-helix | trans | -63.3 | -43.3 | 171.7 | -56.9 | 76 | -167.2 | 0 | 0 | 112.2 | A2396 S2759 C2765 | A2396-E2761 HydrophobicContact CB-CG 4.3Å; S2759-E2761 VanDerWaalsContact CB-OE2 3.22Å; S2759-E2761 WeakPolarHBondContact CB-OE2 3.39Å; S2759-E2761 PolarHBondContact O-N 3.39Å; S2759-E2761 VanDerWaalsContact O-N 3.11Å; S2759-E2761 PolarHBondContact OG-OE2 2.9Å; E2761-C2765 VanDerWaalsContact O-CB 3.23Å; E2761-C2765 WeakPolarHBondContact O-CB 3.39Å; E2761-C2765 PolarHBondContact O-N 3.08Å |
| 2762 | T | 75.2 | Confident | 62.5 | Low | 10 Ų | 10 | 67.1 Ų | 67.1 | 6% | 0.061 | 40% | 0.399 | C | S | . | . | H | α-helix | trans | -68.2 | -39 | 176.7 | -54.6 | 0 | 0 | 0 | 0 | 111.4 | I2344 F2348 I2758 S2759 C2765 L2766 | I2344-T2762 HydrophobicContact CG2-CG2 3.51Å; F2348-T2762 HydrophobicContact CE1-CG2 3.79Å; F2348-T2762 HydrophobicContact CZ-CG2 4.05Å; I2758-T2762 HydrophobicContact CG2-CG2 4.08Å; S2759-T2762 WeakPolarHBondContact O-CA 3.44Å; S2759-T2762 WeakPolarHBondContact O-CB 3.21Å; S2759-T2762 PolarHBondContact O-N 3.45Å; S2759-T2762 PolarHBondContact OG-N 2.87Å; S2759-T2762 PolarHBondContact OG-OG1 3.06Å; T2762-C2765 PolarHBondContact O-N 3.47Å; T2762-L2766 PolarHBondContact O-N 3.12Å |
| 2763 | L | 71.7 | Confident | 62.6 | Low | 76 Ų | 76 | 63.8 Ų | 63.8 | 40% | 0.398 | 37% | 0.374 | S | S | . | . | H | α-helix | trans | -69.9 | -41.3 | 177.2 | -163 | 121.3 | 0 | 0 | 0 | 111.4 | I2758 S2759 P2760 L2766 E2767 | I2758-L2763 HydrophobicContact CD1-CD1 4.36Å; I2758-L2763 HydrophobicContact CG2-CB 3.77Å; I2758-L2763 HydrophobicContact CG2-CD1 4.06Å; I2758-L2763 HydrophobicContact CG2-CG 4.49Å; S2759-L2763 PolarHBondContact O-N 2.83Å; P2760-L2763 PolarHBondContact O-N 3.04Å; L2763-L2766 CarbonylContact O-C 3.45Å; L2763-L2766 WeakPolarHBondContact O-CA 3.32Å; L2763-L2766 PolarHBondContact O-N 3.4Å; L2763-E2767 WeakPolarHBondContact CD2-OE1 3.26Å; L2763-E2767 WeakPolarHBondContact O-CG 3.35Å; L2763-E2767 PolarHBondContact O-N 3.3Å |
| 2764 | T | 75.1 | Confident | 63 | Low | 48 Ų | 48 | 61.2 Ų | 61.2 | 29% | 0.294 | 36% | 0.362 | S | S | . | . | H | α-helix | trans | -67.7 | -36.3 | 173.8 | -61.5 | 0 | 0 | 0 | 0 | 111.7 | P2760 L2766 E2767 R2768 | P2760-T2764 VanDerWaalsContact O-CB 3.26Å; P2760-T2764 WeakPolarHBondContact O-CB 3.46Å; P2760-T2764 PolarHBondContact O-N 3.34Å; P2760-T2764 PolarHBondContact O-OG1 3.19Å; T2764-L2766 VanDerWaalsContact C-N 3.34Å; T2764-E2767 PolarHBondContact O-N 3.43Å; T2764-R2768 HydrophobicContact CG2-CG 4.26Å; T2764-R2768 WeakPolarHBondContact O-CB 3.34Å; T2764-R2768 WeakPolarHBondContact O-CG 3.38Å; T2764-R2768 PolarHBondContact O-N 3.13Å |
| 2765 | C | 76.8 | Confident | 63 | Low | 0 Ų | 0 | 66.5 Ų | 66.5 | 0% | 0 | 38% | 0.377 | C | S | . | . | H | α-helix | trans | -63.4 | -44.6 | 170.9 | -166.5 | 0 | 0 | 0 | 0 | 110 | E2393 M2397 E2761 T2762 R2768 I2769 | E2393-C2765 HydrophobicContact CB-CB 3.89Å; M2397-C2765 HydrophobicContact SD-CB 3.51Å; M2397-C2765 VanDerWaalsContact SD-CB 3.51Å; M2397-C2765 PolarHBondContact SD-SG 3.04Å; E2761-C2765 VanDerWaalsContact O-CB 3.23Å; E2761-C2765 WeakPolarHBondContact O-CB 3.39Å; E2761-C2765 PolarHBondContact O-N 3.08Å; T2762-C2765 PolarHBondContact O-N 3.47Å; C2765-R2768 PolarHBondContact O-N 2.99Å; C2765-I2769 VanDerWaalsContact O-CB 3.28Å; C2765-I2769 WeakPolarHBondContact O-CB 2.99Å; C2765-I2769 WeakPolarHBondContact O-CG1 3.5Å; C2765-I2769 PolarHBondContact O-N 3Å |
| 2766 | L | 73.8 | Confident | 62.7 | Low | 26 Ų | 26 | 62.4 Ų | 62.4 | 14% | 0.136 | 35% | 0.35 | C | S | . | . | H | α-helix | trans | -35.4 | -75.6 | 159.4 | 59.8 | 67.3 | 0 | 0 | 0 | 111.1 | L2328 I2341 I2344 T2762 L2763 T2764 R2768 I2769 I2770 | L2328-L2766 HydrophobicContact CD2-CB 3.68Å; L2328-L2766 HydrophobicContact CD2-CD2 3.85Å; L2328-L2766 HydrophobicContact CD2-CG 4.24Å; I2341-L2766 HydrophobicContact CG1-CD2 4.26Å; I2344-L2766 HydrophobicContact CB-CD2 4.01Å; I2344-L2766 HydrophobicContact CD1-CD2 3.62Å; I2344-L2766 HydrophobicContact CD1-CG 4.02Å; I2344-L2766 HydrophobicContact CG1-CD2 4.39Å; I2344-L2766 HydrophobicContact CG2-CD1 4.27Å; I2344-L2766 HydrophobicContact CG2-CD2 3.67Å; I2344-L2766 HydrophobicContact CG2-CG 4.05Å; T2762-L2766 PolarHBondContact O-N 3.12Å; L2763-L2766 CarbonylContact O-C 3.45Å; L2763-L2766 WeakPolarHBondContact O-CA 3.32Å; L2763-L2766 PolarHBondContact O-N 3.4Å; T2764-L2766 VanDerWaalsContact C-N 3.34Å; L2766-R2768 PolarHBondContact O-N 3.36Å; L2766-R2768 VanDerWaalsContact O-N 3.11Å; L2766-I2769 HydrophobicContact CB-CB 4.43Å; L2766-I2769 HydrophobicContact CB-CD1 4.36Å; L2766-I2769 PolarHBondContact O-N 3.17Å; L2766-I2770 VanDerWaalsContact O-CB 3.22Å; L2766-I2770 WeakPolarHBondContact O-CB 3.48Å; L2766-I2770 VanDerWaalsContact O-CD1 3.23Å; L2766-I2770 WeakPolarHBondContact O-CD1 3.44Å; L2766-I2770 WeakPolarHBondContact O-CG1 3.27Å; L2766-I2770 PolarHBondContact O-N 3.15Å |
| 2767 | E | 69.2 | Low | 62.1 | Low | 110 Ų | 110 | 62.9 Ų | 62.9 | 51% | 0.514 | 36% | 0.359 | S | S | . | . | H | α-helix | trans | -58.5 | -21.9 | -175.3 | -70 | 172.8 | 167.5 | 0 | 0 | 115.2 | L2763 T2764 I2770 G2771 | L2763-E2767 WeakPolarHBondContact CD2-OE1 3.26Å; L2763-E2767 WeakPolarHBondContact O-CG 3.35Å; L2763-E2767 PolarHBondContact O-N 3.3Å; T2764-E2767 PolarHBondContact O-N 3.43Å; E2767-I2770 WeakPolarHBondContact O-CB 3.3Å; E2767-G2771 WeakPolarHBondContact O-CA 3.3Å; E2767-G2771 PolarHBondContact O-N 2.69Å |
| 2768 | R | 70.9 | Confident | 61.6 | Low | 130 Ų | 130 | 64.8 Ų | 64.8 | 49% | 0.491 | 36% | 0.364 | S | S | . | . | H | α-helix | trans | -100.1 | -32.1 | 177.7 | -65.8 | -178.2 | 178.1 | -166.6 | -1.5 | 114 | L2390 E2393 T2764 C2765 L2766 I2770 G2771 N2772 | L2390-R2768 HydrophobicContact CD2-CB 3.36Å; E2393-R2768 WeakPolarHBondContact OE1-CD 3.25Å; E2393-R2768 IonicContact OE1-CZ 2.67Å; E2393-R2768 IonicContact OE1-NE 3.48Å; E2393-R2768 IonicContact OE1-NH1 3.19Å; E2393-R2768 PolarHBondContact OE1-NH1 2.96Å; T2764-R2768 HydrophobicContact CG2-CG 4.26Å; T2764-R2768 WeakPolarHBondContact O-CB 3.34Å; T2764-R2768 WeakPolarHBondContact O-CG 3.38Å; T2764-R2768 PolarHBondContact O-N 3.13Å; C2765-R2768 PolarHBondContact O-N 2.99Å; L2766-R2768 PolarHBondContact O-N 3.36Å; L2766-R2768 VanDerWaalsContact O-N 3.11Å; R2768-I2770 PolarHBondContact O-N 3.03Å; R2768-G2771 PolarHBondContact O-N 2.97Å; R2768-N2772 WeakPolarHBondContact O-CB 3.1Å; R2768-N2772 PolarHBondContact O-N 3Å |
| 2769 | I | 69.1 | Low | 60.8 | Low | 7 Ų | 7 | 64.8 Ų | 64.8 | 4% | 0.036 | 36% | 0.364 | C | S | . | . | H | α-helix | trans | -53.9 | -41 | 160.2 | -70.4 | 169 | 0 | 0 | 0 | 108.4 | I2341 I2344 L2390 F2394 C2765 L2766 L2773 | I2341-I2769 HydrophobicContact CD1-CG2 4.12Å; I2341-I2769 HydrophobicContact CG1-CG2 4.12Å; I2344-I2769 HydrophobicContact CD1-CD1 3.34Å; L2390-I2769 HydrophobicContact CD1-CB 4.12Å; L2390-I2769 HydrophobicContact CD1-CG1 3.51Å; F2394-I2769 HydrophobicContact CE1-CD1 4.28Å; F2394-I2769 HydrophobicContact CE2-CG1 4.5Å; F2394-I2769 HydrophobicContact CZ-CD1 3.72Å; F2394-I2769 HydrophobicContact CZ-CG1 4.13Å; C2765-I2769 VanDerWaalsContact O-CB 3.28Å; C2765-I2769 WeakPolarHBondContact O-CB 2.99Å; C2765-I2769 WeakPolarHBondContact O-CG1 3.5Å; C2765-I2769 PolarHBondContact O-N 3Å; L2766-I2769 HydrophobicContact CB-CB 4.43Å; L2766-I2769 HydrophobicContact CB-CD1 4.36Å; L2766-I2769 PolarHBondContact O-N 3.17Å; I2769-L2773 WeakPolarHBondContact O-CD1 3.46Å; I2769-L2773 WeakPolarHBondContact O-CG 3.38Å |
| 2770 | I | 60.3 | Low | 59.4 | Low | 26 Ų | 26 | 70.1 Ų | 70.1 | 13% | 0.133 | 40% | 0.397 | C | S | . | . | H | α-helix | trans | -64.6 | -59.4 | 171.6 | -74.5 | 168.4 | 0 | 0 | 0 | 112.4 | L2328 Q2329 L2766 E2767 R2768 N2772 L2773 | L2328-I2770 VanDerWaalsContact CA-CD1 3.43Å; L2328-I2770 HydrophobicContact CB-CD1 3.71Å; L2328-I2770 HydrophobicContact CB-CG1 3.58Å; L2328-I2770 HydrophobicContact CD2-CD1 3.76Å; L2328-I2770 HydrophobicContact CD2-CG1 3.8Å; L2328-I2770 HydrophobicContact CG-CD1 3.71Å; L2328-I2770 HydrophobicContact CG-CG1 3.99Å; Q2329-I2770 HydrophobicContact CB-CG2 3.43Å; Q2329-I2770 VanDerWaalsContact CB-CG2 3.43Å; Q2329-I2770 HydrophobicContact CG-CG2 3.79Å; Q2329-I2770 VanDerWaalsContact N-CG2 3.27Å; L2766-I2770 VanDerWaalsContact O-CB 3.22Å; L2766-I2770 WeakPolarHBondContact O-CB 3.48Å; L2766-I2770 VanDerWaalsContact O-CD1 3.23Å; L2766-I2770 WeakPolarHBondContact O-CD1 3.44Å; L2766-I2770 WeakPolarHBondContact O-CG1 3.27Å; L2766-I2770 PolarHBondContact O-N 3.15Å; E2767-I2770 WeakPolarHBondContact O-CB 3.3Å; R2768-I2770 PolarHBondContact O-N 3.03Å; I2770-N2772 PolarHBondContact O-N 2.67Å; I2770-L2773 WeakPolarHBondContact O-CB 3.29Å; I2770-L2773 WeakPolarHBondContact O-CG 3.48Å; I2770-L2773 PolarHBondContact O-N 3.04Å |
| 2771 | G | 56.1 | Low | 58.2 | Low | 51 Ų | 51 | 67.3 Ų | 67.3 | 53% | 0.526 | 38% | 0.378 | S | S | . | . | H | α-helix | trans | -75.2 | -24.3 | -164.2 | 0 | 0 | 0 | 0 | 0 | 114.9 | E2767 R2768 L2773 | E2767-G2771 WeakPolarHBondContact O-CA 3.3Å; E2767-G2771 PolarHBondContact O-N 2.69Å; R2768-G2771 PolarHBondContact O-N 2.97Å; G2771-L2773 PolarHBondContact O-N 3.19Å; G2771-L2773 VanDerWaalsContact O-N 3.07Å |
| 2772 | N | 58.3 | Low | 56.9 | Low | 93 Ų | 93 | 68.2 Ų | 68.2 | 50% | 0.497 | 39% | 0.391 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -68 | -2.1 | 174.5 | -85.6 | -15.2 | 0 | 0 | 0 | 113.8 | P2389 L2390 R2768 I2770 | P2389-N2772 WeakPolarHBondContact CB-ND2 3.23Å; P2389-N2772 PolarHBondContact O-ND2 3.19Å; L2390-N2772 VanDerWaalsContact CD2-ND2 3.29Å; L2390-N2772 WeakPolarHBondContact CD2-ND2 3.17Å; L2390-N2772 WeakPolarHBondContact CG-ND2 3.22Å; R2768-N2772 WeakPolarHBondContact O-CB 3.1Å; R2768-N2772 PolarHBondContact O-N 3Å; I2770-N2772 PolarHBondContact O-N 2.67Å |
| 2773 | L | 52.8 | Low | 55.5 | Low | 48 Ų | 48 | 72.2 Ų | 72.2 | 25% | 0.251 | 42% | 0.418 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -100.6 | -35.6 | -170.1 | -47.4 | 179.3 | 0 | 0 | 0 | 112 | Q2329 E2330 H2331 I2769 I2770 G2771 | Q2329-L2773 WeakPolarHBondContact O-CD1 3.45Å; E2330-L2773 CarbonylContact O-C 3.56Å; E2330-L2773 WeakPolarHBondContact O-CA 3.46Å; E2330-L2773 WeakPolarHBondContact O-CB 3.33Å; H2331-L2773 HydrophobicContact CB-CB 3.85Å; H2331-L2773 VanDerWaalsContact CB-O 3.26Å; H2331-L2773 WeakPolarHBondContact CB-O 3.27Å; H2331-L2773 VanDerWaalsContact N-CB 3.3Å; H2331-L2773 WeakPolarHBondContact O-CD2 3.35Å; I2769-L2773 WeakPolarHBondContact O-CD1 3.46Å; I2769-L2773 WeakPolarHBondContact O-CG 3.38Å; I2770-L2773 WeakPolarHBondContact O-CB 3.29Å; I2770-L2773 WeakPolarHBondContact O-CG 3.48Å; I2770-L2773 PolarHBondContact O-N 3.04Å; G2771-L2773 PolarHBondContact O-N 3.19Å; G2771-L2773 VanDerWaalsContact O-N 3.07Å |
| 2774 | G | 46.8 | Very low | 54.5 | Low | 35 Ų | 35 | 71.3 Ų | 71.3 | 36% | 0.361 | 41% | 0.413 | S | S | . | . | trans | 135.3 | 179.6 | 162.8 | 0 | 0 | 0 | 0 | 0 | 117 | E2330 | E2330-G2774 PolarHBondContact O-N 3.37Š| ||
| 2775 | E | 38.8 | Very low | 52.7 | Low | 195 Ų | 195 | 75.5 Ų | 75.5 | 91% | 0.911 | 44% | 0.438 | S | S | * | . | trans | -84.5 | 141.4 | -178 | -70.7 | -170.9 | 165.9 | 0 | 0 | 113.5 | ||||
| 2776 | V | 41.7 | Very low | 50.9 | Low | 31 Ų | 31 | 77.3 Ų | 77.3 | 19% | 0.188 | 45% | 0.45 | C | S | . | . | trans | -126.2 | 134 | -177.4 | -169.7 | 0 | 0 | 0 | 0 | 108.6 | E2330 | E2330-V2776 HydrophobicContact CB-CG2 3.9Å; E2330-V2776 HydrophobicContact CG-CG2 3.91Å; E2330-V2776 WeakPolarHBondContact OE2-CG2 3.16Å | ||
| 2777 | P | 40.2 | Very low | 49 | Very low | 103 Ų | 103 | 79.5 Ų | 79.5 | 67% | 0.669 | 47% | 0.467 | S | S | * | . | trans | -63.8 | 149.7 | 179.4 | 25.9 | -34.5 | 0 | 0 | 0 | 112.2 | L2779 | P2777-L2779 PolarHBondContact O-N 3.41Š| ||
| 2778 | P | 42.9 | Very low | 47 | Very low | 122 Ų | 122 | 84.8 Ų | 84.8 | 79% | 0.792 | 49% | 0.488 | S | S | * | . | trans | -63.2 | 130.4 | -170.4 | 23.1 | -33.6 | 0 | 0 | 0 | 113.7 | T2780 | P2778-T2780 PolarHBondContact O-N 3.4Å; P2778-T2780 VanDerWaalsContact O-N 3.09Å | ||
| 2779 | L | 44.9 | Very low | 45.1 | Very low | 64 Ų | 64 | 83 Ų | 83 | 34% | 0.335 | 49% | 0.492 | S | S | . | . | trans | -66.5 | 100.8 | -178.3 | -75.6 | 159.7 | 0 | 0 | 0 | 112.5 | L2294 Q2322 L2326 P2777 | L2294-L2779 HydrophobicContact CD1-CD2 4.08Å; L2294-L2779 HydrophobicContact CD2-CD2 4.39Å; Q2322-L2779 HydrophobicContact CG-CD2 4.25Å; L2326-L2779 HydrophobicContact CD1-CD1 4.28Å; L2326-L2779 HydrophobicContact CD2-CD1 4.23Å; L2326-L2779 HydrophobicContact CG-CD1 4.18Å; P2777-L2779 PolarHBondContact O-N 3.41Å | ||
| 2780 | T | 41.8 | Very low | 43.1 | Very low | 128 Ų | 128 | 89.8 Ų | 89.8 | 79% | 0.785 | 53% | 0.528 | S | S | * | . | trans | -131.1 | 90.5 | 158.4 | 32.3 | 0 | 0 | 0 | 0 | 110.2 | P2778 | P2778-T2780 PolarHBondContact O-N 3.4Å; P2778-T2780 VanDerWaalsContact O-N 3.09Å | ||
| 2781 | P | 44.6 | Very low | 41.4 | Very low | 27 Ų | 27 | 96.2 Ų | 96.2 | 18% | 0.175 | 56% | 0.563 | C | S | . | * | P | Polyproline II helix | trans | -66.1 | 134.3 | 170.6 | 27.7 | -32.8 | 0 | 0 | 0 | 109.1 | R2295 | R2295-P2781 HydrophobicContact CG-CG 4.38Å; R2295-P2781 PolarHBondContact NH2-O 3.47Å; R2295-P2781 VanDerWaalsContact NH2-O 3.12Å |
| 2782 | P | 43.7 | Very low | 40 | Very low | 102 Ų | 102 | 99.2 Ų | 99.2 | 66% | 0.662 | 58% | 0.576 | S | S | * | * | P | Polyproline II helix | trans | -60.1 | 151 | 179.6 | 25.7 | -34.4 | 0 | 0 | 0 | 111 | H2291 | H2291-P2782 PolarHBondContact CE1-O 3.37Š|
| 2783 | P | 45.9 | Very low | 38.6 | Very low | 95 Ų | 95 | 99.7 Ų | 99.7 | 62% | 0.617 | 59% | 0.586 | S | S | * | * | P | Polyproline II helix | trans | -60.8 | 138.2 | 177.7 | 26.1 | -34.1 | 0 | 0 | 0 | 110.9 | T2785 | P2783-T2785 PolarHBondContact O-N 3.03Š|
| 2784 | L | 50.8 | Low | 37.3 | Very low | 57 Ų | 57 | 101.1 Ų | 101.1 | 30% | 0.298 | 61% | 0.605 | S | S | . | * | trans | -79.6 | 110.1 | -179 | -74.9 | 160.8 | 0 | 0 | 0 | 109.7 | L2288 H2291 P2786 | L2288-L2784 HydrophobicContact CD2-CD1 3.73Å; L2288-L2784 HydrophobicContact CD2-CD2 4.44Å; H2291-L2784 HydrophobicContact CB-CD1 3.64Å; L2784-P2786 WeakPolarHBondContact O-CD 3.27Å | ||
| 2785 | T | 37.8 | Very low | 36.3 | Very low | 135 Ų | 135 | 107.2 Ų | 107.2 | 83% | 0.828 | 63% | 0.629 | S | S | * | * | trans | -83.5 | 114.7 | 164.1 | 33.4 | 0 | 0 | 0 | 0 | 109 | P2783 C2787 | P2783-T2785 PolarHBondContact O-N 3.03Å; T2785-C2787 PolarHBondContact O-N 3.04Å | ||
| 2786 | P | 38.5 | Very low | 35.8 | Very low | 38 Ų | 38 | 107.2 Ų | 107.2 | 25% | 0.247 | 62% | 0.62 | C | S | . | * | trans | -70.3 | 125.4 | 173.7 | 28.1 | -30.7 | 0 | 0 | 0 | 109.2 | R2097 L2784 | R2097-P2786 HydrophobicContact CB-CG 4.32Å; R2097-P2786 HydrophobicContact CG-CG 4.02Å; L2784-P2786 WeakPolarHBondContact O-CD 3.27Å | ||
| 2787 | C | 33.7 | Very low | 35.4 | Very low | 73 Ų | 73 | 111.4 Ų | 111.4 | 49% | 0.493 | 64% | 0.636 | S | S | . | * | S | Bend | trans | 49.2 | 132 | 170.1 | -66.8 | 0 | 0 | 0 | 0 | 118.9 | T2785 V2789 | T2785-C2787 PolarHBondContact O-N 3.04Å; C2787-V2789 PolarHBondContact O-N 2.82Å |
| 2788 | K | 27.7 | Very low | 34.9 | Very low | 221 Ų | 221 | 113.2 Ų | 113.2 | 96% | 0.961 | 64% | 0.64 | S | S | * | * | trans | -66.5 | 100.5 | 177.2 | -71.1 | -179.6 | 177.9 | 177.8 | 0 | 111.8 | ||||
| 2789 | V | 30.1 | Very low | 34.2 | Very low | 92 Ų | 92 | 110.4 Ų | 110.4 | 56% | 0.558 | 63% | 0.627 | S | S | * | * | trans | -116.9 | 142.8 | 157.6 | -175.3 | 0 | 0 | 0 | 0 | 108.2 | C2787 N2791 | C2787-V2789 PolarHBondContact O-N 2.82Å; V2789-N2791 PolarHBondContact O-N 2.95Å | ||
| 2790 | N | 27 | Very low | 33.5 | Very low | 149 Ų | 149 | 112.4 Ų | 112.4 | 80% | 0.797 | 64% | 0.638 | S | S | * | * | trans | -53.3 | 133 | -167.8 | -75 | -39.2 | 0 | 0 | 0 | 113.6 | S2792 | N2790-S2792 PolarHBondContact O-N 3.24Š| ||
| 2791 | N | 25.4 | Very low | 33 | Very low | 162 Ų | 162 | 113.8 Ų | 113.8 | 87% | 0.866 | 64% | 0.635 | S | S | * | * | S | Bend | trans | -58.9 | 100 | 177.6 | -79.5 | -20.8 | 0 | 0 | 0 | 112.3 | V2789 | V2789-N2791 PolarHBondContact O-N 2.95Š|
| 2792 | S | 27.2 | Very low | 32.3 | Very low | 114 Ų | 114 | 116.7 Ų | 116.7 | 80% | 0.797 | 66% | 0.656 | S | S | * | * | S | Bend | trans | -148.4 | -3.9 | 165.6 | 59.1 | 0 | 0 | 0 | 0 | 115.7 | N2790 | N2790-S2792 PolarHBondContact O-N 3.24Š|
| 2793 | S | 27.9 | Very low | 31.5 | Very low | 102 Ų | 102 | 119.7 Ų | 119.7 | 71% | 0.713 | 66% | 0.661 | S | S | * | * | S | Bend | trans | -132.8 | -4.3 | -175.5 | 56.7 | 0 | 0 | 0 | 0 | 116.5 | L2795 | S2793-L2795 VanDerWaalsContact C-N 3.28Å; S2793-L2795 PolarHBondContact O-N 3.34Å; S2793-L2795 VanDerWaalsContact O-N 3.08Å |
| 2794 | A | 26.4 | Very low | 30.8 | Very low | 79 Ų | 79 | 122 Ų | 122 | 65% | 0.653 | 67% | 0.669 | S | S | * | * | trans | -83.9 | 29.8 | -170.5 | 0 | 0 | 0 | 0 | 0 | 115.9 | ||||
| 2795 | L | 25.7 | Very low | 29.6 | Very low | 163 Ų | 163 | 124.4 Ų | 124.4 | 85% | 0.853 | 69% | 0.69 | S | S | * | * | trans | -137.9 | 87.6 | -179.8 | -73.5 | 173.7 | 0 | 0 | 0 | 111.5 | S2793 | S2793-L2795 VanDerWaalsContact C-N 3.28Å; S2793-L2795 PolarHBondContact O-N 3.34Å; S2793-L2795 VanDerWaalsContact O-N 3.08Å | ||
| 2796 | R | 28.8 | Very low | 29.1 | Very low | 194 Ų | 194 | 124 Ų | 124 | 73% | 0.732 | 69% | 0.688 | S | S | * | * | trans | 164.4 | 75.4 | 153.4 | -91.9 | 161.1 | -173.6 | -157.2 | 2.9 | 111 | ||||
| 2797 | F | 32.2 | Very low | 28.6 | Very low | 120 Ų | 120 | 127.8 Ų | 127.8 | 53% | 0.526 | 72% | 0.715 | S | S | . | * | S | Bend | trans | -114.8 | -30.2 | 160.1 | -99.4 | -85.3 | 0 | 0 | 0 | 112.5 | A2799 | F2797-A2799 VanDerWaalsContact C-N 3.3Å; F2797-A2799 PolarHBondContact O-N 2.87Å |
| 2798 | D | 30.2 | Very low | 28.2 | Very low | 140 Ų | 140 | 128.1 Ų | 128.1 | 75% | 0.749 | 73% | 0.731 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -82.7 | 4.6 | -177.6 | -52.5 | -50.9 | 0 | 0 | 0 | 115.3 | ||
| 2799 | A | 28.5 | Very low | 28.3 | Very low | 64 Ų | 64 | 127 Ų | 127 | 53% | 0.529 | 73% | 0.729 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -107.2 | 5 | -171.6 | 0 | 0 | 0 | 0 | 0 | 115.1 | F2797 | F2797-A2799 VanDerWaalsContact C-N 3.3Å; F2797-A2799 PolarHBondContact O-N 2.87Å |
| 2800 | L | 29.1 | Very low | 28.1 | Very low | 106 Ų | 106 | 131.9 Ų | 131.9 | 56% | 0.555 | 74% | 0.742 | S | S | * | * | S | Bend | trans | -120.8 | -3.6 | -174.9 | -87.7 | 161.7 | 0 | 0 | 0 | 115.1 | ||
| 2801 | E | 31.3 | Very low | 28.1 | Very low | 156 Ų | 156 | 136.9 Ų | 136.9 | 73% | 0.729 | 75% | 0.75 | S | S | * | * | S | Bend | trans | -92.3 | -10 | 174.3 | -69.4 | -177.5 | 148.7 | 0 | 0 | 113 | ||
| 2802 | S | 30.7 | Very low | 28.2 | Very low | 88 Ų | 88 | 135.7 Ų | 135.7 | 62% | 0.615 | 74% | 0.742 | S | S | * | * | S | Bend | trans | -94.7 | 5.5 | -175.3 | 56.7 | 0 | 0 | 0 | 0 | 116 | ||
| 2803 | Q | 27.7 | Very low | 28.2 | Very low | 165 Ų | 165 | 135 Ų | 135 | 77% | 0.771 | 74% | 0.738 | S | S | * | * | S | Bend | trans | -128.1 | 2 | -179.3 | -72.6 | -163 | -15.3 | 0 | 0 | 116.4 | ||
| 2804 | N | 29.8 | Very low | 28.1 | Very low | 144 Ų | 144 | 136.5 Ų | 136.5 | 77% | 0.77 | 74% | 0.742 | S | S | * | * | trans | -98.3 | 14.7 | 176.2 | -84.5 | -19 | 0 | 0 | 0 | 114.6 | V2806 | N2804-V2806 VanDerWaalsContact C-N 3.32Å; N2804-V2806 PolarHBondContact O-N 3.48Å | ||
| 2805 | S | 26.6 | Very low | 28.1 | Very low | 107 Ų | 107 | 139.3 Ų | 139.3 | 75% | 0.748 | 75% | 0.751 | S | S | * | * | trans | -92.2 | 29.9 | 175 | 67.6 | 0 | 0 | 0 | 0 | 113.9 | ||||
| 2806 | V | 26.5 | Very low | 28.2 | Very low | 128 Ų | 128 | 141.1 Ų | 141.1 | 78% | 0.776 | 76% | 0.755 | S | S | * | * | trans | -141.1 | 73.8 | 174.5 | -167.9 | 0 | 0 | 0 | 0 | 111.8 | N2804 | N2804-V2806 VanDerWaalsContact C-N 3.32Å; N2804-V2806 PolarHBondContact O-N 3.48Å | ||
| 2807 | S | 29.3 | Very low | 28.1 | Very low | 117 Ų | 117 | 141.4 Ų | 141.4 | 82% | 0.818 | 76% | 0.761 | S | S | * | * | trans | -170.1 | 113.4 | 146.4 | 31.5 | 0 | 0 | 0 | 0 | 108.6 | ||||
| 2808 | G | 25.3 | Very low | 27.9 | Very low | 80 Ų | 80 | 143.5 Ų | 143.5 | 83% | 0.825 | 78% | 0.777 | S | S | * | * | trans | -90.2 | 127.9 | -177 | 0 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 2809 | E | 27.8 | Very low | 27.8 | Very low | 198 Ų | 198 | 145.8 Ų | 145.8 | 93% | 0.925 | 78% | 0.783 | S | S | * | * | trans | -105.9 | 137.8 | 151.9 | -78.8 | -153.1 | 131.3 | 0 | 0 | 111.2 | R2811 | E2809-R2811 PolarHBondContact O-N 2.95Å; E2809-R2811 VanDerWaalsContact O-N 3.13Å | ||
| 2810 | K | 26.4 | Very low | 27.7 | Very low | 193 Ų | 193 | 152 Ų | 152 | 84% | 0.839 | 80% | 0.801 | S | S | * | * | trans | -73.8 | 100.3 | -167 | -66.4 | 164.2 | 178.9 | 167.4 | 0 | 111.5 | I2812 | K2810-I2812 HydrophobicContact CB-CD1 4.46Å; K2810-I2812 HydrophobicContact CB-CG1 4.23Å | ||
| 2811 | R | 27.5 | Very low | 27.5 | Very low | 254 Ų | 254 | 152.2 Ų | 152.2 | 96% | 0.958 | 81% | 0.812 | S | S | * | * | trans | -95.4 | 98.1 | 149.7 | -85.3 | -170.2 | 174.1 | 179.3 | 0.7 | 110.1 | E2809 | E2809-R2811 PolarHBondContact O-N 2.95Å; E2809-R2811 VanDerWaalsContact O-N 3.13Å | ||
| 2812 | I | 28.3 | Very low | 27.4 | Very low | 137 Ų | 137 | 149.6 Ų | 149.6 | 70% | 0.703 | 81% | 0.81 | S | S | * | * | trans | -74.7 | 124.4 | -177.3 | -68.6 | 162.4 | 0 | 0 | 0 | 110.2 | K2810 | K2810-I2812 HydrophobicContact CB-CD1 4.46Å; K2810-I2812 HydrophobicContact CB-CG1 4.23Å | ||
| 2813 | S | 25.6 | Very low | 27.4 | Very low | 100 Ų | 100 | 152.9 Ų | 152.9 | 70% | 0.699 | 82% | 0.816 | S | S | * | * | trans | 59.1 | 133.5 | 159.4 | 72 | 0 | 0 | 0 | 0 | 119.6 | ||||
| 2814 | V | 26.7 | Very low | 27.4 | Very low | 134 Ų | 134 | 150.4 Ų | 150.4 | 81% | 0.812 | 82% | 0.824 | S | S | * | * | S | Bend | 165.8 | 57.6 | 112.1 | -175.3 | 0 | 0 | 0 | 0 | 108.1 | |||
| 2815 | V | 27.3 | Very low | 27.4 | Very low | 137 Ų | 137 | 151.2 Ų | 151.2 | 83% | 0.83 | 84% | 0.84 | S | S | * | * | S | Bend | trans | -139.9 | -36.3 | 172 | -173 | 0 | 0 | 0 | 0 | 113 | K2817 | V2815-K2817 VanDerWaalsContact C-N 3.3Å; V2815-K2817 PolarHBondContact O-N 3.37Å |
| 2816 | E | 26.4 | Very low | 27.4 | Very low | 201 Ų | 201 | 153.4 Ų | 153.4 | 94% | 0.939 | 85% | 0.845 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -80.8 | 62.7 | -180 | -66.9 | -172.4 | 130.2 | 0 | 0 | 114.2 | ||
| 2817 | K | 27.4 | Very low | 27.4 | Very low | 200 Ų | 200 | 154.7 Ų | 154.7 | 87% | 0.87 | 85% | 0.849 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -146.1 | 18.2 | 173.2 | -119.5 | 178.3 | -172.6 | -176.7 | 0 | 116.8 | V2815 | V2815-K2817 VanDerWaalsContact C-N 3.3Å; V2815-K2817 PolarHBondContact O-N 3.37Å |
| 2818 | L | 27.2 | Very low | 27.3 | Very low | 164 Ų | 164 | 156.8 Ų | 156.8 | 86% | 0.859 | 85% | 0.85 | S | S | * | * | S | Bend | trans | -132.3 | 21.5 | -175.3 | -75.3 | 174.3 | 0 | 0 | 0 | 116 | ||
| 2819 | Q | 28 | Very low | 27.5 | Very low | 188 Ų | 188 | 161.4 Ų | 161.4 | 88% | 0.879 | 85% | 0.852 | S | S | * | * | S | Bend | trans | -126 | 19.9 | 177.2 | -77.1 | -168.1 | -27 | 0 | 0 | 115.9 | ||
| 2820 | H | 26.9 | Very low | 27.4 | Very low | 194 Ų | 194 | 159.1 Ų | 159.1 | 90% | 0.898 | 85% | 0.847 | S | S | * | * | S | Bend | trans | -128.9 | 64.3 | 171.9 | -81 | -12 | 0 | 0 | 0 | 112.5 | ||
| 2821 | S | 25.8 | Very low | 27.5 | Very low | 112 Ų | 112 | 156.8 Ų | 156.8 | 78% | 0.783 | 85% | 0.848 | S | S | * | * | trans | -168.6 | 71.7 | 163.2 | 60.4 | 0 | 0 | 0 | 0 | 114.3 | ||||
| 2822 | S | 27.8 | Very low | 27.5 | Very low | 100 Ų | 100 | 149.9 Ų | 149.9 | 70% | 0.699 | 84% | 0.84 | S | S | * | * | trans | -166.7 | 140.7 | 160.4 | 50.5 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 2823 | H | 30.4 | Very low | 27.5 | Very low | 157 Ų | 157 | 150.8 Ų | 150.8 | 73% | 0.727 | 85% | 0.85 | S | S | * | * | trans | 66.4 | 83.2 | -174.5 | -48.6 | -63.7 | 0 | 0 | 0 | 113.1 | S2825 | H2823-S2825 PolarHBondContact ND1-OG 3.16Š| ||
| 2824 | A | 28.1 | Very low | 27.6 | Very low | 114 Ų | 114 | 155.1 Ų | 155.1 | 94% | 0.942 | 86% | 0.863 | S | S | * | * | -62.3 | 101.7 | 73.1 | 0 | 0 | 0 | 0 | 0 | 117.7 | |||||
| 2825 | S | 29.5 | Very low | 27.7 | Very low | 160 Ų | 160 | 157 Ų | 157 | 100% | 1.119 | 87% | 0.868 | S | S | * | * | trans | -175.5 | 0 | 152.7 | 63.3 | 0 | 0 | 0 | 0 | 108.5 | H2823 | H2823-S2825 PolarHBondContact ND1-OG 3.16Š|
Retrieved 2,825 of 2,825 residues in 8331.5 ms
(Link to these results)