| 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 | 30.5 | Very low | 38.6 | Very low | 240 Ų | 240 | 98.6 Ų | 98.6 | 100% | 1.182 | 62% | 0.618 | S | S | * | * | 0 | 98.8 | 0 | -78.5 | 157.3 | 78 | 0 | 0 | 107.7 | |||||
| 2 | S | 27.7 | Very low | 39.9 | Very low | 116 Ų | 116 | 94.5 Ų | 94.5 | 81% | 0.811 | 61% | 0.608 | S | S | * | * | trans | -72.8 | 120.7 | -175 | 30.6 | 0 | 0 | 0 | 0 | 111 | ||||
| 3 | V | 38.3 | Very low | 41.9 | Very low | 127 Ų | 127 | 100 Ų | 100 | 77% | 0.77 | 62% | 0.621 | S | S | * | * | trans | -110.1 | 51 | 175 | -174.4 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 4 | E | 37.3 | Very low | 43.9 | Very low | 79 Ų | 79 | 99.1 Ų | 99.1 | 37% | 0.369 | 62% | 0.617 | S | S | . | * | trans | -128.1 | 65.5 | 170.6 | -86.9 | -174 | 88.8 | 0 | 0 | 109.2 | H136 Q142 | E4-H136 IonicContact OE2-CE1 3.67Å; E4-H136 IonicContact OE2-CG 3.97Å; E4-H136 IonicContact OE2-ND1 2.88Å; E4-H136 PolarHBondContact OE2-ND1 2.85Å; E4-Q142 PolarHBondContact OE1-NE2 2.87Å; E4-Q142 VanDerWaalsContact OE1-NE2 3.13Å | ||
| 5 | D | 35.4 | Very low | 46.1 | Very low | 85 Ų | 85 | 103.8 Ų | 103.8 | 46% | 0.455 | 62% | 0.618 | S | S | . | * | trans | -91.2 | 92.8 | 160.1 | -85 | -40.8 | 0 | 0 | 0 | 108.6 | G7 P9 | D5-G7 PolarHBondContact O-N 3.35Å; D5-P9 HydrophobicContact CB-CG 4.12Å; D5-P9 WeakPolarHBondContact OD2-CD 3.31Å; D5-P9 WeakPolarHBondContact OD2-CG 3.33Å | ||
| 6 | G | 42.4 | Very low | 48.3 | Very low | 31 Ų | 31 | 103.9 Ų | 103.9 | 32% | 0.32 | 61% | 0.61 | S | S | . | * | S | Bend | trans | -66.6 | 12.6 | 169.7 | 0 | 0 | 0 | 0 | 0 | 114.3 | Y321 | G6-Y321 VanDerWaalsContact O-CD1 3.29Å; G6-Y321 WeakPolarHBondContact O-CD1 3.47Å |
| 7 | G | 44.5 | Very low | 50.5 | Low | 54 Ų | 54 | 101.4 Ų | 101.4 | 56% | 0.557 | 61% | 0.605 | S | S | * | * | S | Bend | trans | -157.9 | 88 | 163.9 | 0 | 0 | 0 | 0 | 0 | 106.6 | D5 P9 | D5-G7 PolarHBondContact O-N 3.35Å; G7-P9 WeakPolarHBondContact O-CD 3.16Å |
| 8 | M | 39.7 | Very low | 52.6 | Low | 122 Ų | 122 | 106.1 Ų | 106.1 | 60% | 0.601 | 61% | 0.61 | S | S | * | * | trans | -46.9 | 101.6 | -165.2 | -68.4 | -78.5 | -74.1 | 0 | 0 | 113.4 | G10 L11 | M8-G10 PolarHBondContact O-N 2.86Å; M8-L11 HydrophobicContact CB-CD1 4.07Å; M8-L11 HydrophobicContact CE-CD1 3.33Å; M8-L11 HydrophobicContact CG-CD1 4.46Å | ||
| 9 | P | 37.2 | Very low | 54.5 | Low | 87 Ų | 87 | 104.5 Ų | 104.5 | 57% | 0.565 | 59% | 0.593 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -75.5 | 122.4 | 167.2 | 29.7 | -23.6 | 0 | 0 | 0 | 107.5 | D5 G7 | D5-P9 HydrophobicContact CB-CG 4.12Å; D5-P9 WeakPolarHBondContact OD2-CD 3.31Å; D5-P9 WeakPolarHBondContact OD2-CG 3.33Å; G7-P9 WeakPolarHBondContact O-CD 3.16Å |
| 10 | G | 46.4 | Very low | 56.3 | Low | 81 Ų | 81 | 102.7 Ų | 102.7 | 84% | 0.835 | 58% | 0.584 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 113.5 | 15.4 | 168.5 | 0 | 0 | 0 | 0 | 0 | 117.5 | M8 | M8-G10 PolarHBondContact O-N 2.86Š|
| 11 | L | 45.1 | Very low | 58 | Low | 63 Ų | 63 | 103.3 Ų | 103.3 | 33% | 0.33 | 59% | 0.585 | S | S | . | * | trans | -98.9 | 127.5 | 160.8 | -83.3 | 100.8 | 0 | 0 | 0 | 109.9 | M8 H13 R15 | M8-L11 HydrophobicContact CB-CD1 4.07Å; M8-L11 HydrophobicContact CE-CD1 3.33Å; M8-L11 HydrophobicContact CG-CD1 4.46Å; L11-H13 PolarHBondContact O-N 3.15Å; L11-R15 HydrophobicContact CB-CB 4.18Å; L11-R15 HydrophobicContact CD2-CB 3.5Å; L11-R15 HydrophobicContact CD2-CG 4.26Å; L11-R15 HydrophobicContact CG-CB 4.4Å | ||
| 12 | G | 54.8 | Low | 61 | Low | 49 Ų | 49 | 93.5 Ų | 93.5 | 51% | 0.505 | 54% | 0.537 | S | S | . | . | trans | -52.7 | 142.6 | 173.2 | 0 | 0 | 0 | 0 | 0 | 111.4 | P14 R15 | G12-P14 VanDerWaalsContact C-N 3.27Å; G12-P14 WeakPolarHBondContact O-CD 3.14Å; G12-R15 PolarHBondContact O-N 3.19Å | ||
| 13 | H | 65.8 | Low | 64.1 | Low | 166 Ų | 166 | 89.7 Ų | 89.7 | 77% | 0.769 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -30.9 | -48.2 | 179.1 | -99.8 | -128.7 | 0 | 0 | 0 | 115.8 | L11 R15 Q16 A17 | L11-H13 PolarHBondContact O-N 3.15Å; H13-R15 VanDerWaalsContact C-N 3.34Å; H13-R15 PolarHBondContact O-N 3.43Å; H13-Q16 PolarHBondContact O-N 3.43Å; H13-A17 PolarHBondContact O-N 3.49Å; H13-A17 VanDerWaalsContact O-N 3.15Å |
| 14 | P | 69.3 | Low | 66.8 | Low | 87 Ų | 87 | 89 Ų | 89 | 57% | 0.565 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -66.1 | -29.6 | -178.6 | 23.7 | -35.4 | 0 | 0 | 0 | 114.6 | G12 R18 | G12-P14 VanDerWaalsContact C-N 3.27Å; G12-P14 WeakPolarHBondContact O-CD 3.14Å; P14-R18 VanDerWaalsContact O-CG 3.31Å; P14-R18 WeakPolarHBondContact O-CG 3.04Å; P14-R18 PolarHBondContact O-N 3.22Å |
| 15 | R | 77.5 | Confident | 69.5 | Low | 170 Ų | 170 | 89.3 Ų | 89.3 | 64% | 0.642 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -77.7 | -36 | 179.7 | -67.6 | -173.5 | 176.9 | -177.4 | -2.9 | 111.9 | L11 G12 H13 R18 W19 | L11-R15 HydrophobicContact CB-CB 4.18Å; L11-R15 HydrophobicContact CD2-CB 3.5Å; L11-R15 HydrophobicContact CD2-CG 4.26Å; L11-R15 HydrophobicContact CG-CB 4.4Å; G12-R15 PolarHBondContact O-N 3.19Å; H13-R15 VanDerWaalsContact C-N 3.34Å; H13-R15 PolarHBondContact O-N 3.43Å; R15-R18 PolarHBondContact O-N 3.19Å; R15-W19 PolarHBondContact O-N 3.07Å; R15-W19 VanDerWaalsContact O-N 3.07Å |
| 16 | Q | 81.4 | Confident | 72.3 | Confident | 105 Ų | 105 | 85.2 Ų | 85.2 | 49% | 0.491 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -66 | -42.9 | 174.9 | -170.6 | 175.5 | 3 | 0 | 0 | 111.2 | H13 R18 W19 T20 | H13-Q16 PolarHBondContact O-N 3.43Å; Q16-R18 VanDerWaalsContact C-N 3.35Å; Q16-R18 PolarHBondContact O-N 2.94Å; Q16-W19 PolarHBondContact O-N 3.44Å; Q16-T20 PolarHBondContact O-N 3.27Å; Q16-T20 PolarHBondContact O-OG1 3.42Å |
| 17 | A | 85.8 | Confident | 74.7 | Confident | 62 Ų | 62 | 84.6 Ų | 84.6 | 51% | 0.512 | 47% | 0.471 | S | S | . | . | H | α-helix | trans | -58.9 | -44 | 175.1 | 0 | 0 | 0 | 0 | 0 | 112.4 | H13 W19 T20 L21 | H13-A17 PolarHBondContact O-N 3.49Å; H13-A17 VanDerWaalsContact O-N 3.15Å; A17-W19 PolarHBondContact O-N 2.91Å; A17-T20 PolarHBondContact O-N 3.44Å; A17-L21 WeakPolarHBondContact O-CB 3.33Å; A17-L21 PolarHBondContact O-N 3.49Å |
| 18 | R | 87.7 | Confident | 77.1 | Confident | 185 Ų | 185 | 84.1 Ų | 84.1 | 70% | 0.698 | 46% | 0.461 | S | S | * | . | H | α-helix | trans | -62.2 | -41.6 | 176 | -73.1 | 174.2 | -177.3 | -173.1 | 1.1 | 112.5 | P14 R15 Q16 M22 | P14-R18 VanDerWaalsContact O-CG 3.31Å; P14-R18 WeakPolarHBondContact O-CG 3.04Å; P14-R18 PolarHBondContact O-N 3.22Å; R15-R18 PolarHBondContact O-N 3.19Å; Q16-R18 VanDerWaalsContact C-N 3.35Å; Q16-R18 PolarHBondContact O-N 2.94Å; R18-M22 WeakPolarHBondContact O-CB 3.44Å; R18-M22 PolarHBondContact O-N 2.98Å |
| 19 | W | 89.1 | Confident | 79.6 | Confident | 77 Ų | 77 | 79.4 Ų | 79.4 | 29% | 0.292 | 44% | 0.438 | S | S | . | . | H | α-helix | trans | -64.1 | -48 | 177.2 | 179.5 | -105.1 | 0 | 0 | 0 | 111.9 | R15 Q16 A17 L21 M22 L23 H273 | R15-W19 PolarHBondContact O-N 3.07Å; R15-W19 VanDerWaalsContact O-N 3.07Å; Q16-W19 PolarHBondContact O-N 3.44Å; A17-W19 PolarHBondContact O-N 2.91Å; W19-L21 VanDerWaalsContact C-N 3.34Å; W19-L21 PolarHBondContact O-N 3.2Å; W19-M22 HydrophobicContact CD2-CE 4.3Å; W19-M22 HydrophobicContact CE3-CE 3.52Å; W19-M22 HydrophobicContact CE3-SD 4.46Å; W19-M22 HydrophobicContact CH2-CE 3.71Å; W19-M22 HydrophobicContact CZ2-CE 4.46Å; W19-M22 HydrophobicContact CZ3-CE 3.17Å; W19-M22 HydrophobicContact CZ3-SD 4.33Å; W19-M22 WeakPolarHBondContact O-CB 3.48Å; W19-M22 PolarHBondContact O-N 3.26Å; W19-M22 VanDerWaalsContact O-N 3.17Å; W19-L23 HydrophobicContact CZ2-CD2 4.21Å; W19-L23 PolarHBondContact O-N 3.38Å; W19-H273 HydrophobicContact CH2-CB 3.93Å; W19-H273 HydrophobicContact CZ3-CB 3.59Å |
| 20 | T | 89.9 | Confident | 82 | Confident | 67 Ų | 67 | 79.4 Ų | 79.4 | 41% | 0.411 | 43% | 0.427 | S | S | . | . | H | α-helix | trans | -61.9 | -43.1 | 177.4 | -59.1 | 0 | 0 | 0 | 0 | 111.2 | Q16 A17 M22 L23 L24 | Q16-T20 PolarHBondContact O-N 3.27Å; Q16-T20 PolarHBondContact O-OG1 3.42Å; A17-T20 PolarHBondContact O-N 3.44Å; T20-M22 VanDerWaalsContact C-N 3.3Å; T20-M22 PolarHBondContact O-N 3.26Å; T20-L23 PolarHBondContact O-N 3.11Å; T20-L24 HydrophobicContact CG2-CD1 4.08Å; T20-L24 HydrophobicContact CG2-CG 4.37Å; T20-L24 WeakPolarHBondContact O-CB 3.33Å; T20-L24 WeakPolarHBondContact O-CG 3.5Å; T20-L24 PolarHBondContact O-N 2.98Å |
| 21 | L | 92.6 | Very high | 83.9 | Confident | 117 Ų | 117 | 75.6 Ų | 75.6 | 61% | 0.613 | 39% | 0.388 | S | S | * | . | H | α-helix | trans | -58 | -43.1 | 174.4 | 179.9 | 64.3 | 0 | 0 | 0 | 111.7 | A17 W19 L24 L25 | A17-L21 WeakPolarHBondContact O-CB 3.33Å; A17-L21 PolarHBondContact O-N 3.49Å; W19-L21 VanDerWaalsContact C-N 3.34Å; W19-L21 PolarHBondContact O-N 3.2Å; L21-L24 PolarHBondContact O-N 3.45Å; L21-L25 VanDerWaalsContact O-CB 3.31Å; L21-L25 WeakPolarHBondContact O-CB 3.39Å; L21-L25 PolarHBondContact O-N 2.92Å |
| 22 | M | 93.6 | Very high | 86 | Confident | 34 Ų | 34 | 73.3 Ų | 73.3 | 17% | 0.167 | 38% | 0.378 | C | S | . | . | H | α-helix | trans | -62.5 | -43 | 177.8 | -167.8 | -167.8 | 73.3 | 0 | 0 | 112 | R18 W19 T20 S26 L266 A269 V270 | R18-M22 WeakPolarHBondContact O-CB 3.44Å; R18-M22 PolarHBondContact O-N 2.98Å; W19-M22 HydrophobicContact CD2-CE 4.3Å; W19-M22 HydrophobicContact CE3-CE 3.52Å; W19-M22 HydrophobicContact CE3-SD 4.46Å; W19-M22 HydrophobicContact CH2-CE 3.71Å; W19-M22 HydrophobicContact CZ2-CE 4.46Å; W19-M22 HydrophobicContact CZ3-CE 3.17Å; W19-M22 HydrophobicContact CZ3-SD 4.33Å; W19-M22 WeakPolarHBondContact O-CB 3.48Å; W19-M22 PolarHBondContact O-N 3.26Å; W19-M22 VanDerWaalsContact O-N 3.17Å; T20-M22 VanDerWaalsContact C-N 3.3Å; T20-M22 PolarHBondContact O-N 3.26Å; M22-S26 WeakPolarHBondContact O-CB 3.31Å; M22-S26 PolarHBondContact O-N 3.24Å; M22-S26 PolarHBondContact O-OG 3.39Å; M22-L266 HydrophobicContact CG-CD2 3.64Å; M22-A269 HydrophobicContact CE-CB 4.35Å; M22-A269 HydrophobicContact SD-CB 3.78Å; M22-V270 HydrophobicContact CE-CG2 3.65Å |
| 23 | L | 93.4 | Very high | 87.6 | Confident | 36 Ų | 36 | 73.8 Ų | 73.8 | 19% | 0.188 | 37% | 0.367 | C | S | . | . | H | α-helix | trans | -65 | -46 | 176.7 | -67.8 | 178.5 | 0 | 0 | 0 | 111.5 | W19 T20 L25 S26 T27 V270 T278 V282 | W19-L23 HydrophobicContact CZ2-CD2 4.21Å; W19-L23 PolarHBondContact O-N 3.38Å; T20-L23 PolarHBondContact O-N 3.11Å; L23-L25 PolarHBondContact O-N 3.44Å; L23-S26 WeakPolarHBondContact O-CB 3.37Å; L23-S26 PolarHBondContact O-N 3.37Å; L23-T27 WeakPolarHBondContact O-CB 3.45Å; L23-T27 PolarHBondContact O-N 3.01Å; L23-T27 PolarHBondContact O-OG1 2.88Å; L23-T27 VanDerWaalsContact O-OG1 3.05Å; L23-V270 HydrophobicContact CD2-CG1 4.45Å; L23-V270 HydrophobicContact CD2-CG2 3.84Å; L23-T278 HydrophobicContact CD2-CG2 3.96Å; L23-V282 HydrophobicContact CD2-CG2 3.7Å |
| 24 | L | 94.1 | Very high | 88.4 | Confident | 111 Ų | 111 | 68.2 Ų | 68.2 | 58% | 0.581 | 35% | 0.35 | S | S | * | . | H | α-helix | trans | -60.6 | -44.5 | 177.3 | -71.4 | 174.1 | 0 | 0 | 0 | 111.6 | T20 L21 T27 A28 | T20-L24 HydrophobicContact CG2-CD1 4.08Å; T20-L24 HydrophobicContact CG2-CG 4.37Å; T20-L24 WeakPolarHBondContact O-CB 3.33Å; T20-L24 WeakPolarHBondContact O-CG 3.5Å; T20-L24 PolarHBondContact O-N 2.98Å; L21-L24 PolarHBondContact O-N 3.45Å; L24-T27 PolarHBondContact O-N 2.92Å; L24-A28 VanDerWaalsContact O-CB 3.31Å; L24-A28 WeakPolarHBondContact O-CB 3.28Å; L24-A28 PolarHBondContact O-N 3Å |
| 25 | L | 94.4 | Very high | 89.1 | Confident | 86 Ų | 86 | 64.1 Ų | 64.1 | 45% | 0.45 | 32% | 0.323 | S | S | . | . | H | α-helix | trans | -63.2 | -43.8 | 176.4 | -175.6 | 64.8 | 0 | 0 | 0 | 111.3 | L21 L23 T27 A28 M29 L266 | L21-L25 VanDerWaalsContact O-CB 3.31Å; L21-L25 WeakPolarHBondContact O-CB 3.39Å; L21-L25 PolarHBondContact O-N 2.92Å; L23-L25 PolarHBondContact O-N 3.44Å; L25-T27 PolarHBondContact O-N 3Å; L25-A28 PolarHBondContact O-N 3.44Å; L25-M29 HydrophobicContact CD1-CG 4.1Å; L25-M29 HydrophobicContact CD1-SD 3.92Å; L25-M29 HydrophobicContact CD2-SD 4.36Å; L25-M29 HydrophobicContact CG-CG 4.31Å; L25-M29 HydrophobicContact CG-SD 3.8Å; L25-M29 WeakPolarHBondContact O-CB 3.33Å; L25-M29 WeakPolarHBondContact O-CG 3.46Å; L25-M29 PolarHBondContact O-N 3.35Å; L25-L266 HydrophobicContact CB-CD1 4.39Å; L25-L266 HydrophobicContact CD2-CD1 3.88Å; L25-L266 HydrophobicContact CG-CD1 3.88Å |
| 26 | S | 93.1 | Very high | 89.5 | Confident | 0 Ų | 0 | 57.3 Ų | 57.3 | 0% | 0 | 30% | 0.3 | C | S | . | . | H | α-helix | trans | -59.8 | -46.1 | 175.6 | -53.7 | 0 | 0 | 0 | 0 | 111.6 | M22 L23 A28 M29 Y30 L266 | M22-S26 WeakPolarHBondContact O-CB 3.31Å; M22-S26 PolarHBondContact O-N 3.24Å; M22-S26 PolarHBondContact O-OG 3.39Å; L23-S26 WeakPolarHBondContact O-CB 3.37Å; L23-S26 PolarHBondContact O-N 3.37Å; S26-A28 VanDerWaalsContact C-N 3.34Å; S26-A28 PolarHBondContact O-N 3.35Å; S26-M29 PolarHBondContact O-N 3.14Å; S26-Y30 VanDerWaalsContact O-CB 3.26Å; S26-Y30 WeakPolarHBondContact O-CB 3.02Å; S26-Y30 PolarHBondContact O-N 2.83Å; S26-L266 WeakPolarHBondContact OG-CB 3.49Å |
| 27 | T | 93.9 | Very high | 89.6 | Confident | 18 Ų | 18 | 54.7 Ų | 54.7 | 11% | 0.11 | 29% | 0.289 | C | S | . | . | H | α-helix | trans | -61.7 | -43.2 | 176.7 | -62.6 | 0 | 0 | 0 | 0 | 111.2 | L23 L24 L25 G31 V282 C285 S286 V289 | L23-T27 WeakPolarHBondContact O-CB 3.45Å; L23-T27 PolarHBondContact O-N 3.01Å; L23-T27 PolarHBondContact O-OG1 2.88Å; L23-T27 VanDerWaalsContact O-OG1 3.05Å; L24-T27 PolarHBondContact O-N 2.92Å; L25-T27 PolarHBondContact O-N 3Å; T27-G31 PolarHBondContact O-N 3.17Å; T27-V282 WeakPolarHBondContact OG1-CG1 3.28Å; T27-C285 HydrophobicContact CG2-CB 3.64Å; T27-S286 WeakPolarHBondContact O-CB 3.33Å; T27-V289 HydrophobicContact CG2-CG2 3.91Å |
| 28 | A | 93.6 | Very high | 89.5 | Confident | 43 Ų | 43 | 53.4 Ų | 53.4 | 36% | 0.355 | 28% | 0.278 | S | S | . | . | H | α-helix | trans | -63.9 | -48.9 | 179 | 0 | 0 | 0 | 0 | 0 | 111.9 | L24 L25 S26 G31 A32 | L24-A28 VanDerWaalsContact O-CB 3.31Å; L24-A28 WeakPolarHBondContact O-CB 3.28Å; L24-A28 PolarHBondContact O-N 3Å; L25-A28 PolarHBondContact O-N 3.44Å; S26-A28 VanDerWaalsContact C-N 3.34Å; S26-A28 PolarHBondContact O-N 3.35Å; A28-G31 PolarHBondContact O-N 3.23Å; A28-A32 VanDerWaalsContact O-CB 3.23Å; A28-A32 WeakPolarHBondContact O-CB 3.48Å; A28-A32 PolarHBondContact O-N 3.16Å |
| 29 | M | 92.3 | Very high | 89.3 | Confident | 24 Ų | 24 | 47.7 Ų | 47.7 | 12% | 0.118 | 26% | 0.261 | C | S | . | . | H | α-helix | trans | -68.3 | -40.8 | -178.1 | -65 | -178.7 | 76.3 | 0 | 0 | 112.2 | L25 S26 H33 S259 L262 N263 L266 | L25-M29 HydrophobicContact CD1-CG 4.1Å; L25-M29 HydrophobicContact CD1-SD 3.92Å; L25-M29 HydrophobicContact CD2-SD 4.36Å; L25-M29 HydrophobicContact CG-CG 4.31Å; L25-M29 HydrophobicContact CG-SD 3.8Å; L25-M29 WeakPolarHBondContact O-CB 3.33Å; L25-M29 WeakPolarHBondContact O-CG 3.46Å; L25-M29 PolarHBondContact O-N 3.35Å; S26-M29 PolarHBondContact O-N 3.14Å; M29-H33 PolarHBondContact O-N 3.13Å; M29-S259 VanDerWaalsContact CE-O 3.26Å; M29-S259 WeakPolarHBondContact CE-O 3.45Å; M29-L262 HydrophobicContact CE-CB 3.33Å; M29-L262 HydrophobicContact CE-CD1 3.86Å; M29-L262 HydrophobicContact CE-CG 4.24Å; M29-L262 HydrophobicContact SD-CB 4.25Å; M29-N263 HydrophobicContact CB-CB 4.06Å; M29-L266 HydrophobicContact SD-CD1 3.8Å |
| 30 | Y | 88.9 | Confident | 88.9 | Confident | 87 Ų | 87 | 44.1 Ų | 44.1 | 34% | 0.341 | 25% | 0.248 | S | C | . | . | H | α-helix | trans | -64.7 | -42.1 | 174.9 | -159.6 | -75 | 0 | 0 | 0 | 111.2 | S26 H33 N263 M267 V283 S286 | S26-Y30 VanDerWaalsContact O-CB 3.26Å; S26-Y30 WeakPolarHBondContact O-CB 3.02Å; S26-Y30 PolarHBondContact O-N 2.83Å; Y30-H33 WeakPolarHBondContact O-CB 3.21Å; Y30-H33 PolarHBondContact O-N 2.71Å; Y30-N263 VanDerWaalsContact CD2-ND2 3.3Å; Y30-N263 WeakPolarHBondContact CD2-ND2 3.29Å; Y30-M267 HydrophobicContact CD2-CE 3.7Å; Y30-M267 HydrophobicContact CE2-CE 4.43Å; Y30-M267 HydrophobicContact CG-CE 4.33Å; Y30-V283 HydrophobicContact CD2-CG2 4.36Å; Y30-V283 HydrophobicContact CE1-CG1 3.88Å; Y30-V283 HydrophobicContact CE1-CG2 4.25Å; Y30-V283 HydrophobicContact CE2-CG2 3.99Å; Y30-S286 WeakPolarHBondContact CD1-OG 3.34Å |
| 31 | G | 86.3 | Confident | 88.3 | Confident | 1 Ų | 1 | 45 Ų | 45 | 1% | 0.01 | 25% | 0.247 | C | C | . | . | H | α-helix | trans | -71.2 | -33.2 | -179.6 | 0 | 0 | 0 | 0 | 0 | 113 | T27 A28 H33 P35 S286 N290 | T27-G31 PolarHBondContact O-N 3.17Å; A28-G31 PolarHBondContact O-N 3.23Å; G31-H33 PolarHBondContact O-N 3.1Å; G31-P35 WeakPolarHBondContact O-CD 3.48Å; G31-S286 VanDerWaalsContact CA-O 3.28Å; G31-S286 WeakPolarHBondContact CA-O 3.31Å; G31-N290 VanDerWaalsContact O-CA 3.26Å; G31-N290 WeakPolarHBondContact O-CA 3.07Å; G31-N290 VanDerWaalsContact O-CB 3.31Å; G31-N290 WeakPolarHBondContact O-CB 3.47Å; G31-N290 PolarHBondContact O-OD1 3.41Å |
| 32 | A | 88.8 | Confident | 87.4 | Confident | 15 Ų | 15 | 43.7 Ų | 43.7 | 12% | 0.124 | 24% | 0.244 | C | C | . | . | H | α-helix | trans | -73.1 | -11.1 | 176.1 | 0 | 0 | 0 | 0 | 0 | 113.5 | A28 P35 L36 L293 | A28-A32 VanDerWaalsContact O-CB 3.23Å; A28-A32 WeakPolarHBondContact O-CB 3.48Å; A28-A32 PolarHBondContact O-N 3.16Å; A32-P35 WeakPolarHBondContact O-CD 3.48Å; A32-L36 HydrophobicContact CB-CD1 4.01Å; A32-L36 HydrophobicContact CB-CG 4.46Å; A32-L36 VanDerWaalsContact O-CB 3.23Å; A32-L36 WeakPolarHBondContact O-CB 3.05Å; A32-L36 WeakPolarHBondContact O-CD1 3.26Å; A32-L36 WeakPolarHBondContact O-CG 3.33Å; A32-L36 PolarHBondContact O-N 3.13Å; A32-L293 HydrophobicContact CB-CD2 3.91Å |
| 33 | H | 87.6 | Confident | 86 | Confident | 58 Ų | 58 | 49.8 Ų | 49.8 | 27% | 0.269 | 28% | 0.277 | S | S | . | . | H | α-helix | trans | -60.9 | -53.5 | -175.8 | 175.3 | 51.3 | 0 | 0 | 0 | 113.7 | M29 Y30 G31 L36 L37 Q260 | M29-H33 PolarHBondContact O-N 3.13Å; Y30-H33 WeakPolarHBondContact O-CB 3.21Å; Y30-H33 PolarHBondContact O-N 2.71Å; G31-H33 PolarHBondContact O-N 3.1Å; H33-L36 PolarHBondContact O-N 2.85Å; H33-L37 WeakPolarHBondContact O-CB 3.44Å; H33-L37 PolarHBondContact O-N 3.14Å; H33-Q260 PolarHBondContact CD2-NE2 3.4Å; H33-Q260 PolarHBondContact CE1-NE2 3.01Å; H33-Q260 PolarHBondContact ND1-NE2 3.04Å; H33-Q260 PolarHBondContact NE2-NE2 3.35Å |
| 34 | A | 84.2 | Confident | 84.7 | Confident | 50 Ų | 50 | 51 Ų | 51 | 41% | 0.413 | 30% | 0.298 | S | S | . | . | H | α-helix | trans | -67.2 | -40.2 | -175.3 | 0 | 0 | 0 | 0 | 0 | 113.1 | L37 A38 | A34-L37 PolarHBondContact O-N 3Å; A34-A38 WeakPolarHBondContact O-CB 3.32Å; A34-A38 PolarHBondContact O-N 3.49Å |
| 35 | P | 83.5 | Confident | 83.5 | Confident | 1 Ų | 1 | 55.4 Ų | 55.4 | 1% | 0.006 | 31% | 0.307 | C | S | . | . | H | α-helix | trans | -66 | -41.2 | 174.4 | -22.2 | 35.5 | 0 | 0 | 0 | 112 | G31 A32 L37 A38 L39 N290 L293 S294 L297 | G31-P35 WeakPolarHBondContact O-CD 3.48Å; A32-P35 WeakPolarHBondContact O-CD 3.48Å; P35-L37 VanDerWaalsContact C-N 3.31Å; P35-L37 PolarHBondContact O-N 2.82Å; P35-A38 WeakPolarHBondContact O-CB 3.42Å; P35-A38 PolarHBondContact O-N 2.9Å; P35-L39 WeakPolarHBondContact O-CG 3.47Å; P35-L39 PolarHBondContact O-N 3.35Å; P35-N290 WeakPolarHBondContact CD-OD1 3.19Å; P35-N290 WeakPolarHBondContact CG-OD1 3.41Å; P35-L293 HydrophobicContact CB-CB 4.35Å; P35-L293 HydrophobicContact CG-CB 3.97Å; P35-S294 WeakPolarHBondContact CG-OG 3.49Å; P35-L297 HydrophobicContact CB-CD1 4.18Å |
| 36 | L | 85.6 | Confident | 82.6 | Confident | 27 Ų | 27 | 53.5 Ų | 53.5 | 14% | 0.141 | 30% | 0.299 | C | S | . | . | H | α-helix | trans | -63.5 | -39.1 | 175.3 | -72.3 | 171.5 | 0 | 0 | 0 | 111.7 | A32 H33 A38 L39 C40 W252 L255 V256 | A32-L36 HydrophobicContact CB-CD1 4.01Å; A32-L36 HydrophobicContact CB-CG 4.46Å; A32-L36 VanDerWaalsContact O-CB 3.23Å; A32-L36 WeakPolarHBondContact O-CB 3.05Å; A32-L36 WeakPolarHBondContact O-CD1 3.26Å; A32-L36 WeakPolarHBondContact O-CG 3.33Å; A32-L36 PolarHBondContact O-N 3.13Å; H33-L36 PolarHBondContact O-N 2.85Å; L36-A38 VanDerWaalsContact C-N 3.34Å; L36-L39 PolarHBondContact O-N 3.41Å; L36-C40 PolarHBondContact O-N 3.25Å; L36-C40 PolarHBondContact O-SG 2.92Å; L36-W252 HydrophobicContact CD2-CE3 4.44Å; L36-W252 HydrophobicContact CD2-CZ3 4.28Å; L36-L255 HydrophobicContact CD2-CD2 4.14Å; L36-V256 HydrophobicContact CB-CG2 3.74Å |
| 37 | L | 84.6 | Confident | 81.8 | Confident | 50 Ų | 50 | 56 Ų | 56 | 26% | 0.262 | 32% | 0.315 | S | S | . | . | H | α-helix | trans | -66 | -38.3 | 174.1 | -173.5 | 65.2 | 0 | 0 | 0 | 111.4 | H33 A34 P35 L39 C40 H41 F48 | H33-L37 WeakPolarHBondContact O-CB 3.44Å; H33-L37 PolarHBondContact O-N 3.14Å; A34-L37 PolarHBondContact O-N 3Å; P35-L37 VanDerWaalsContact C-N 3.31Å; P35-L37 PolarHBondContact O-N 2.82Å; L37-L39 VanDerWaalsContact C-N 3.27Å; L37-L39 PolarHBondContact O-N 2.87Å; L37-C40 VanDerWaalsContact O-CB 3.26Å; L37-C40 WeakPolarHBondContact O-CB 3.35Å; L37-C40 PolarHBondContact O-N 3.47Å; L37-H41 PolarHBondContact O-CD2 3.11Å; L37-F48 HydrophobicContact CD1-CZ 3.82Å |
| 38 | A | 81.9 | Confident | 81.2 | Confident | 35 Ų | 35 | 55.9 Ų | 55.9 | 29% | 0.289 | 31% | 0.313 | S | S | . | . | H | α-helix | trans | -59.7 | -38.2 | 174.6 | 0 | 0 | 0 | 0 | 0 | 111.8 | A34 P35 L36 C40 H41 L298 | A34-A38 WeakPolarHBondContact O-CB 3.32Å; A34-A38 PolarHBondContact O-N 3.49Å; P35-A38 WeakPolarHBondContact O-CB 3.42Å; P35-A38 PolarHBondContact O-N 2.9Å; L36-A38 VanDerWaalsContact C-N 3.34Å; A38-C40 PolarHBondContact O-N 3.25Å; A38-H41 WeakPolarHBondContact O-CB 3.37Å; A38-H41 PolarHBondContact O-N 3.05Å; A38-H41 VanDerWaalsContact O-N 3.16Å; A38-L298 HydrophobicContact CB-CD1 3.9Å; A38-L298 HydrophobicContact CB-CD2 4.37Å |
| 39 | L | 83.4 | Confident | 80.7 | Confident | 65 Ų | 65 | 56.3 Ų | 56.3 | 34% | 0.34 | 31% | 0.306 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -68.4 | -15.9 | 174.5 | -64.9 | 174.1 | 0 | 0 | 0 | 113.8 | P35 L36 L37 H41 W252 L298 | P35-L39 WeakPolarHBondContact O-CG 3.47Å; P35-L39 PolarHBondContact O-N 3.35Å; L36-L39 PolarHBondContact O-N 3.41Å; L37-L39 VanDerWaalsContact C-N 3.27Å; L37-L39 PolarHBondContact O-N 2.87Å; L39-H41 VanDerWaalsContact C-N 3.33Å; L39-W252 HydrophobicContact CD1-CE3 4.49Å; L39-W252 HydrophobicContact CD1-CH2 4.43Å; L39-W252 HydrophobicContact CD1-CZ3 4.19Å; L39-L298 HydrophobicContact CD2-CD2 4.38Å |
| 40 | C | 81.7 | Confident | 80.1 | Confident | 2 Ų | 2 | 59.6 Ų | 59.6 | 1% | 0.014 | 33% | 0.329 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -79.8 | -12.3 | 172.7 | -64.7 | 0 | 0 | 0 | 0 | 113.4 | L36 L37 A38 V42 P47 F48 W252 | L36-C40 PolarHBondContact O-N 3.25Å; L36-C40 PolarHBondContact O-SG 2.92Å; L37-C40 VanDerWaalsContact O-CB 3.26Å; L37-C40 WeakPolarHBondContact O-CB 3.35Å; L37-C40 PolarHBondContact O-N 3.47Å; A38-C40 PolarHBondContact O-N 3.25Å; C40-V42 PolarHBondContact O-N 3.5Å; C40-P47 VanDerWaalsContact O-CD 3.24Å; C40-P47 WeakPolarHBondContact O-CD 3.44Å; C40-F48 HydrophobicContact CB-CE1 4.14Å; C40-W252 VanDerWaalsContact SG-C 3.54Å |
| 41 | H | 78.1 | Confident | 79.9 | Confident | 86 Ų | 86 | 57.6 Ų | 57.6 | 40% | 0.398 | 33% | 0.327 | S | S | . | . | trans | -68.7 | 129.5 | -177.9 | -80.3 | -106.6 | 0 | 0 | 0 | 111 | L37 A38 L39 G44 R45 V46 | L37-H41 PolarHBondContact O-CD2 3.11Å; A38-H41 WeakPolarHBondContact O-CB 3.37Å; A38-H41 PolarHBondContact O-N 3.05Å; A38-H41 VanDerWaalsContact O-N 3.16Å; L39-H41 VanDerWaalsContact C-N 3.33Å; H41-G44 VanDerWaalsContact ND1-C 3.35Å; H41-G44 PolarHBondContact ND1-O 3.26Å; H41-G44 VanDerWaalsContact ND1-O 3.11Å; H41-R45 WeakPolarHBondContact CA-O 3.44Å; H41-V46 WeakPolarHBondContact NE2-CG2 3.4Å | ||
| 42 | V | 71.9 | Confident | 79.9 | Confident | 89 Ų | 89 | 57.6 Ų | 57.6 | 54% | 0.539 | 33% | 0.327 | S | S | . | . | B | Isolated β-bridge | trans | -118.4 | 125.6 | 169.1 | -176.1 | 0 | 0 | 0 | 0 | 106 | C40 G44 R45 P47 | C40-V42 PolarHBondContact O-N 3.5Å; V42-G44 PolarHBondContact O-N 2.69Å; V42-R45 PolarHBondContact N-O 2.87Å; V42-R45 PolarHBondContact O-N 3.47Å; V42-P47 HydrophobicContact CG2-CG 4.42Å |
| 43 | D | 65.7 | Low | 79.9 | Confident | 162 Ų | 162 | 57.6 Ų | 57.6 | 87% | 0.866 | 33% | 0.327 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 53.6 | 37.4 | -176.5 | -54 | -41.8 | 0 | 0 | 0 | 114.3 | R45 | D43-R45 PolarHBondContact O-N 2.93Š|
| 44 | G | 65.1 | Low | 79.9 | Confident | 61 Ų | 61 | 57.2 Ų | 57.2 | 63% | 0.629 | 33% | 0.329 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 74.4 | 2.5 | 179.6 | 0 | 0 | 0 | 0 | 0 | 114.7 | H41 V42 | H41-G44 VanDerWaalsContact ND1-C 3.35Å; H41-G44 PolarHBondContact ND1-O 3.26Å; H41-G44 VanDerWaalsContact ND1-O 3.11Å; V42-G44 PolarHBondContact O-N 2.69Å |
| 45 | R | 69.5 | Low | 80.2 | Confident | 203 Ų | 203 | 55.3 Ų | 55.3 | 77% | 0.766 | 31% | 0.312 | S | S | * | . | B | Isolated β-bridge | trans | -120.2 | 150.4 | 177.2 | -64.6 | -175.6 | 178.9 | -179.1 | 0.8 | 111.6 | H41 V42 D43 P47 | H41-R45 WeakPolarHBondContact CA-O 3.44Å; V42-R45 PolarHBondContact N-O 2.87Å; V42-R45 PolarHBondContact O-N 3.47Å; D43-R45 PolarHBondContact O-N 2.93Å; R45-P47 WeakPolarHBondContact O-CD 3.33Å |
| 46 | V | 74.2 | Confident | 80.6 | Confident | 47 Ų | 47 | 56.6 Ų | 56.6 | 29% | 0.285 | 32% | 0.318 | S | S | . | . | trans | -78.6 | 120.5 | 169.7 | -176.7 | 0 | 0 | 0 | 0 | 107.3 | H41 F48 | H41-V46 WeakPolarHBondContact NE2-CG2 3.4Å; V46-F48 HydrophobicContact CG1-CD1 3.52Å; V46-F48 HydrophobicContact CG1-CD2 3.85Å; V46-F48 HydrophobicContact CG1-CE1 3.27Å; V46-F48 HydrophobicContact CG1-CE2 3.61Å; V46-F48 HydrophobicContact CG1-CG 3.82Å; V46-F48 HydrophobicContact CG1-CZ 3.32Å; V46-F48 PolarHBondContact O-N 2.8Å | ||
| 47 | P | 77.9 | Confident | 80.9 | Confident | 52 Ų | 52 | 56.1 Ų | 56.1 | 34% | 0.338 | 32% | 0.317 | S | S | . | . | S | Bend | trans | -71.8 | -14.5 | -172.7 | 27 | -34.6 | 0 | 0 | 0 | 113.7 | C40 V42 R45 G248 | C40-P47 VanDerWaalsContact O-CD 3.24Å; C40-P47 WeakPolarHBondContact O-CD 3.44Å; V42-P47 HydrophobicContact CG2-CG 4.42Å; R45-P47 WeakPolarHBondContact O-CD 3.33Å; P47-G248 WeakPolarHBondContact CG-O 3.35Å |
| 48 | F | 81.6 | Confident | 81.4 | Confident | 16 Ų | 16 | 55 Ų | 55 | 7% | 0.07 | 31% | 0.31 | C | S | . | . | S | Bend | trans | -106.9 | 155.9 | 179.5 | 61.8 | -98.3 | 0 | 0 | 0 | 112.5 | L37 C40 V46 A53 F249 A253 | L37-F48 HydrophobicContact CD1-CZ 3.82Å; C40-F48 HydrophobicContact CB-CE1 4.14Å; V46-F48 HydrophobicContact CG1-CD1 3.52Å; V46-F48 HydrophobicContact CG1-CD2 3.85Å; V46-F48 HydrophobicContact CG1-CE1 3.27Å; V46-F48 HydrophobicContact CG1-CE2 3.61Å; V46-F48 HydrophobicContact CG1-CG 3.82Å; V46-F48 HydrophobicContact CG1-CZ 3.32Å; V46-F48 PolarHBondContact O-N 2.8Å; F48-A53 HydrophobicContact CD2-CB 3.79Å; F48-A53 HydrophobicContact CE2-CB 3.49Å; F48-A53 VanDerWaalsContact CE2-CB 3.49Å; F48-A53 HydrophobicContact CZ-CB 4.48Å; F48-F249 HydrophobicContact CB-CD2 3.75Å; F48-F249 HydrophobicContact CB-CE2 3.6Å; F48-F249 HydrophobicContact CB-CZ 4.36Å; F48-F249 HydrophobicContact CD2-CE2 4.18Å; F48-F249 HydrophobicContact CD2-CZ 4.19Å; F48-F249 HydrophobicContact CG-CD2 4.33Å; F48-F249 AromaticContact CG-CE2 3.93Å; F48-F249 HydrophobicContact CG-CE2 3.93Å; F48-F249 HydrophobicContact CG-CZ 4.19Å; F48-A253 HydrophobicContact CD1-CB 3.68Å; F48-A253 HydrophobicContact CE1-CB 3.52Å; F48-A253 HydrophobicContact CZ-CB 4.4Å |
| 49 | R | 81.8 | Confident | 82 | Confident | 52 Ų | 52 | 56.5 Ų | 56.5 | 20% | 0.196 | 31% | 0.313 | C | S | . | . | trans | -71.9 | 131 | 175.4 | -76.5 | 169.5 | 154.2 | -168.4 | -24.6 | 111.4 | S51 S52 A53 G240 P241 G242 P243 | R49-S51 VanDerWaalsContact C-N 3.27Å; R49-S51 PolarHBondContact O-N 2.71Å; R49-S52 WeakPolarHBondContact O-CB 3.35Å; R49-S52 PolarHBondContact O-N 2.69Å; R49-S52 VanDerWaalsContact O-N 3.12Å; R49-A53 PolarHBondContact O-N 3.49Å; R49-G240 PolarHBondContact NH2-O 3.27Å; R49-G240 VanDerWaalsContact NH2-O 3.13Å; R49-P241 PolarHBondContact NH2-O 3.04Å; R49-G242 PolarHBondContact NH1-O 3.27Å; R49-G242 VanDerWaalsContact NH1-O 3.08Å; R49-P243 WeakPolarHBondContact CD-O 3.37Å; R49-P243 HydrophobicContact CG-CG 3.98Å; R49-P243 VanDerWaalsContact NE-CD 3.31Å; R49-P243 PolarHBondContact NH1-O 3.46Å | ||
| 50 | P | 81 | Confident | 82.6 | Confident | 93 Ų | 93 | 55.1 Ų | 55.1 | 60% | 0.604 | 31% | 0.307 | S | S | * | . | H | α-helix | trans | -56.7 | -37.9 | 176.8 | -27.4 | 35 | 0 | 0 | 0 | 113.7 | S52 A53 V54 | P50-S52 PolarHBondContact O-N 2.89Å; P50-A53 PolarHBondContact O-N 3.38Å; P50-V54 WeakPolarHBondContact O-CG2 3.38Å; P50-V54 PolarHBondContact O-N 3.17Å |
| 51 | S | 83.1 | Confident | 83.2 | Confident | 44 Ų | 44 | 56.1 Ų | 56.1 | 31% | 0.308 | 31% | 0.311 | S | S | . | . | H | α-helix | trans | -63.9 | -38.4 | 178 | 57.3 | 0 | 0 | 0 | 0 | 112.6 | R49 V54 L55 H236 | R49-S51 VanDerWaalsContact C-N 3.27Å; R49-S51 PolarHBondContact O-N 2.71Å; S51-V54 PolarHBondContact O-N 3.42Å; S51-L55 WeakPolarHBondContact O-CB 3.43Å; S51-L55 PolarHBondContact O-N 2.84Å; S51-H236 PolarHBondContact OG-ND1 2.97Å |
| 52 | S | 87.5 | Confident | 84 | Confident | 1 Ų | 1 | 53.6 Ų | 53.6 | 1% | 0.007 | 30% | 0.3 | C | S | . | . | H | α-helix | trans | -63.9 | -43.1 | 174.4 | -56.1 | 0 | 0 | 0 | 0 | 111.6 | R49 P50 L55 L56 H236 L245 | R49-S52 WeakPolarHBondContact O-CB 3.35Å; R49-S52 PolarHBondContact O-N 2.69Å; R49-S52 VanDerWaalsContact O-N 3.12Å; P50-S52 PolarHBondContact O-N 2.89Å; S52-L55 PolarHBondContact O-N 3.42Å; S52-L56 WeakPolarHBondContact O-CB 3.48Å; S52-L56 WeakPolarHBondContact O-CG 3.42Å; S52-L56 PolarHBondContact O-N 3.03Å; S52-H236 PolarHBondContact OG-CE1 2.85Å; S52-L245 VanDerWaalsContact CB-O 3.31Å; S52-L245 WeakPolarHBondContact CB-O 3.12Å |
| 53 | A | 87.8 | Confident | 85.1 | Confident | 15 Ų | 15 | 54.3 Ų | 54.3 | 12% | 0.124 | 30% | 0.301 | C | S | . | . | H | α-helix | trans | -64.4 | -40.5 | 178.1 | 0 | 0 | 0 | 0 | 0 | 112.8 | F48 R49 P50 T57 F249 | F48-A53 HydrophobicContact CD2-CB 3.79Å; F48-A53 HydrophobicContact CE2-CB 3.49Å; F48-A53 VanDerWaalsContact CE2-CB 3.49Å; F48-A53 HydrophobicContact CZ-CB 4.48Å; R49-A53 PolarHBondContact O-N 3.49Å; P50-A53 PolarHBondContact O-N 3.38Å; A53-T57 VanDerWaalsContact O-CB 3.28Å; A53-T57 WeakPolarHBondContact O-CB 3.25Å; A53-T57 PolarHBondContact O-N 3.33Å; A53-T57 PolarHBondContact O-OG1 3.32Å; A53-F249 HydrophobicContact CB-CZ 4.06Å |
| 54 | V | 88.2 | Confident | 86.4 | Confident | 51 Ų | 51 | 49.4 Ų | 49.4 | 31% | 0.309 | 27% | 0.274 | S | S | . | . | H | α-helix | trans | -64.9 | -45.6 | 174.7 | 178.3 | 0 | 0 | 0 | 0 | 110.6 | P50 S51 T57 E58 N232 | P50-V54 WeakPolarHBondContact O-CG2 3.38Å; P50-V54 PolarHBondContact O-N 3.17Å; S51-V54 PolarHBondContact O-N 3.42Å; V54-T57 WeakPolarHBondContact O-CB 3.44Å; V54-T57 PolarHBondContact O-N 3.08Å; V54-E58 PolarHBondContact O-N 2.94Å; V54-N232 VanDerWaalsContact CG1-OD1 3.24Å; V54-N232 WeakPolarHBondContact CG1-OD1 3.3Å |
| 55 | L | 90.6 | Very high | 87.7 | Confident | 10 Ų | 10 | 46.7 Ų | 46.7 | 5% | 0.052 | 25% | 0.246 | C | C | . | . | H | α-helix | trans | -60.6 | -47.6 | 177.9 | 178.3 | 60.4 | 0 | 0 | 0 | 112.1 | S51 S52 T57 E58 L59 V229 N232 L233 H236 L245 | S51-L55 WeakPolarHBondContact O-CB 3.43Å; S51-L55 PolarHBondContact O-N 2.84Å; S52-L55 PolarHBondContact O-N 3.42Å; L55-T57 VanDerWaalsContact C-N 3.28Å; L55-T57 PolarHBondContact O-N 3.44Å; L55-E58 PolarHBondContact O-N 3.3Å; L55-L59 WeakPolarHBondContact O-CB 3.12Å; L55-L59 PolarHBondContact O-N 2.93Å; L55-V229 HydrophobicContact CD1-CG1 4.15Å; L55-N232 HydrophobicContact CB-CB 4.31Å; L55-N232 HydrophobicContact CD1-CB 3.95Å; L55-L233 HydrophobicContact CD1-CB 4.3Å; L55-L233 HydrophobicContact CD2-CD1 4.09Å; L55-H236 HydrophobicContact CD2-CB 4.34Å; L55-L245 HydrophobicContact CD2-CD1 3.83Å |
| 56 | L | 92.1 | Very high | 88.7 | Confident | 27 Ų | 27 | 38.5 Ų | 38.5 | 14% | 0.141 | 22% | 0.221 | C | C | . | . | H | α-helix | trans | -63.3 | -35.2 | 176.7 | -75 | 169.3 | 0 | 0 | 0 | 112.2 | S52 T60 L245 L246 F249 V257 | S52-L56 WeakPolarHBondContact O-CB 3.48Å; S52-L56 WeakPolarHBondContact O-CG 3.42Å; S52-L56 PolarHBondContact O-N 3.03Å; L56-T60 VanDerWaalsContact O-CB 3.29Å; L56-T60 WeakPolarHBondContact O-CB 3.31Å; L56-T60 PolarHBondContact O-N 3.31Å; L56-T60 PolarHBondContact O-OG1 3.25Å; L56-L245 HydrophobicContact CD1-CD2 4.06Å; L56-L245 HydrophobicContact CD2-CD2 3.69Å; L56-L245 HydrophobicContact CG-CD2 3.88Å; L56-L246 HydrophobicContact CD1-CD2 3.91Å; L56-L246 HydrophobicContact CD2-CD2 4.2Å; L56-F249 HydrophobicContact CD1-CD1 4.34Å; L56-F249 HydrophobicContact CD1-CD2 4.36Å; L56-F249 HydrophobicContact CD1-CE1 3.73Å; L56-F249 HydrophobicContact CD1-CE2 3.74Å; L56-F249 HydrophobicContact CD1-CZ 3.41Å; L56-F249 VanDerWaalsContact CD1-CZ 3.41Å; L56-V257 HydrophobicContact CB-CG1 4.08Å; L56-V257 HydrophobicContact CB-CG2 4.4Å |
| 57 | T | 92.2 | Very high | 89.5 | Confident | 18 Ų | 18 | 41.7 Ų | 41.7 | 11% | 0.11 | 23% | 0.232 | C | C | . | . | H | α-helix | trans | -64.7 | -48 | 175.2 | -62 | 0 | 0 | 0 | 0 | 111.1 | A53 V54 L55 T60 K61 Q260 | A53-T57 VanDerWaalsContact O-CB 3.28Å; A53-T57 WeakPolarHBondContact O-CB 3.25Å; A53-T57 PolarHBondContact O-N 3.33Å; A53-T57 PolarHBondContact O-OG1 3.32Å; V54-T57 WeakPolarHBondContact O-CB 3.44Å; V54-T57 PolarHBondContact O-N 3.08Å; L55-T57 VanDerWaalsContact C-N 3.28Å; L55-T57 PolarHBondContact O-N 3.44Å; T57-T60 PolarHBondContact O-N 3.32Å; T57-K61 WeakPolarHBondContact O-CG 3.36Å; T57-K61 PolarHBondContact O-N 3Å; T57-Q260 HydrophobicContact CG2-CB 3.82Å |
| 58 | E | 93.8 | Very high | 90 | Very high | 27 Ų | 27 | 40 Ų | 40 | 13% | 0.126 | 22% | 0.221 | C | C | . | . | H | α-helix | trans | -64.8 | -39.7 | 176.6 | -68.2 | -58.3 | 129.2 | 0 | 0 | 112 | V54 L55 K61 L62 Y225 V229 | V54-E58 PolarHBondContact O-N 2.94Å; L55-E58 PolarHBondContact O-N 3.3Å; E58-K61 PolarHBondContact O-N 3.09Å; E58-K61 IonicContact OE1-NZ 2.72Å; E58-K61 PolarHBondContact OE1-NZ 3.14Å; E58-L62 WeakPolarHBondContact O-CB 3.46Å; E58-L62 PolarHBondContact O-N 2.67Å; E58-Y225 WeakPolarHBondContact OE2-CD1 3.28Å; E58-V229 HydrophobicContact CB-CG2 3.78Å |
| 59 | L | 94.9 | Very high | 90.2 | Very high | 66 Ų | 66 | 40.2 Ų | 40.2 | 35% | 0.346 | 22% | 0.223 | S | C | . | . | H | α-helix | trans | -63 | -44.1 | 175 | -175.9 | 63.4 | 0 | 0 | 0 | 111.4 | L55 K61 L62 L63 V229 | L55-L59 WeakPolarHBondContact O-CB 3.12Å; L55-L59 PolarHBondContact O-N 2.93Å; L59-K61 PolarHBondContact O-N 2.9Å; L59-L62 WeakPolarHBondContact O-CB 3.49Å; L59-L62 PolarHBondContact O-N 3.32Å; L59-L63 HydrophobicContact CG-CD1 4.25Å; L59-L63 VanDerWaalsContact O-CG 3.3Å; L59-L63 WeakPolarHBondContact O-CG 3.49Å; L59-L63 PolarHBondContact O-N 3.15Å; L59-V229 HydrophobicContact CB-CG2 4.41Å |
| 60 | T | 95.3 | Very high | 90.4 | Very high | 36 Ų | 36 | 45 Ų | 45 | 22% | 0.221 | 25% | 0.251 | C | S | . | . | H | α-helix | trans | -62.5 | -42.8 | 177.4 | -57.7 | 0 | 0 | 0 | 0 | 111 | L56 T57 L62 L63 L64 L258 A261 | L56-T60 VanDerWaalsContact O-CB 3.29Å; L56-T60 WeakPolarHBondContact O-CB 3.31Å; L56-T60 PolarHBondContact O-N 3.31Å; L56-T60 PolarHBondContact O-OG1 3.25Å; T57-T60 PolarHBondContact O-N 3.32Å; T60-L62 VanDerWaalsContact C-N 3.34Å; T60-L62 PolarHBondContact O-N 3.49Å; T60-L63 PolarHBondContact O-N 2.91Å; T60-L64 HydrophobicContact CG2-CD1 4.02Å; T60-L64 HydrophobicContact CG2-CG 4.41Å; T60-L64 WeakPolarHBondContact O-CB 3.29Å; T60-L64 VanDerWaalsContact O-CG 3.25Å; T60-L64 WeakPolarHBondContact O-CG 3.41Å; T60-L64 PolarHBondContact O-N 3.31Å; T60-L258 HydrophobicContact CG2-CD1 4.4Å; T60-A261 HydrophobicContact CG2-CB 3.6Å |
| 61 | K | 95.2 | Very high | 90.6 | Very high | 23 Ų | 23 | 43.9 Ų | 43.9 | 10% | 0.1 | 24% | 0.243 | C | C | . | . | H | α-helix | trans | -59.9 | -44.6 | 174 | -69.4 | 173.4 | -166.5 | 165.2 | 0 | 111.8 | T57 E58 L59 L64 C65 Y225 A261 | T57-K61 WeakPolarHBondContact O-CG 3.36Å; T57-K61 PolarHBondContact O-N 3Å; E58-K61 PolarHBondContact O-N 3.09Å; E58-K61 IonicContact OE1-NZ 2.72Å; E58-K61 PolarHBondContact OE1-NZ 3.14Å; L59-K61 PolarHBondContact O-N 2.9Å; K61-L64 PolarHBondContact O-N 3.07Å; K61-C65 WeakPolarHBondContact O-CB 3.26Å; K61-C65 PolarHBondContact O-N 3.36Å; K61-C65 PolarHBondContact O-SG 3.49Å; K61-Y225 HydrophobicContact CB-CD1 4.24Å; K61-Y225 HydrophobicContact CB-CD2 3.53Å; K61-Y225 HydrophobicContact CB-CE1 4.38Å; K61-Y225 HydrophobicContact CB-CE2 3.65Å; K61-Y225 HydrophobicContact CB-CG 3.85Å; K61-Y225 HydrophobicContact CD-CD1 3.98Å; K61-Y225 HydrophobicContact CD-CE1 3.68Å; K61-Y225 HydrophobicContact CD-CE2 4.26Å; K61-Y225 HydrophobicContact CD-CG 4.44Å; K61-Y225 HydrophobicContact CG-CE2 4.35Å; K61-A261 HydrophobicContact CG-CB 3.78Å |
| 62 | L | 94.9 | Very high | 90.1 | Very high | 32 Ų | 32 | 44.3 Ų | 44.3 | 17% | 0.168 | 25% | 0.254 | C | S | . | . | H | α-helix | trans | -60.2 | -47.3 | 178.2 | -178.4 | 67 | 0 | 0 | 0 | 111.2 | E58 L59 T60 C65 A66 L222 T226 V229 | E58-L62 WeakPolarHBondContact O-CB 3.46Å; E58-L62 PolarHBondContact O-N 2.67Å; L59-L62 WeakPolarHBondContact O-CB 3.49Å; L59-L62 PolarHBondContact O-N 3.32Å; T60-L62 VanDerWaalsContact C-N 3.34Å; T60-L62 PolarHBondContact O-N 3.49Å; L62-C65 PolarHBondContact O-N 2.94Å; L62-A66 WeakPolarHBondContact O-CB 3.43Å; L62-A66 PolarHBondContact O-N 2.94Å; L62-L222 HydrophobicContact CD1-CD1 3.63Å; L62-L222 HydrophobicContact CD1-CG 4.12Å; L62-T226 WeakPolarHBondContact CD1-OG1 3.49Å; L62-V229 HydrophobicContact CD2-CG2 4.26Å |
| 63 | L | 94.9 | Very high | 89.5 | Confident | 105 Ų | 105 | 53.1 Ų | 53.1 | 55% | 0.55 | 29% | 0.287 | S | S | . | . | H | α-helix | trans | -62.7 | -43.9 | 178.2 | -69.2 | 174.4 | 0 | 0 | 0 | 112 | L59 T60 C65 A66 F67 | L59-L63 HydrophobicContact CG-CD1 4.25Å; L59-L63 VanDerWaalsContact O-CG 3.3Å; L59-L63 WeakPolarHBondContact O-CG 3.49Å; L59-L63 PolarHBondContact O-N 3.15Å; T60-L63 PolarHBondContact O-N 2.91Å; L63-C65 VanDerWaalsContact C-N 3.34Å; L63-C65 PolarHBondContact O-N 3.44Å; L63-A66 PolarHBondContact O-N 3Å; L63-F67 VanDerWaalsContact O-CB 3.28Å; L63-F67 WeakPolarHBondContact O-CB 3.28Å; L63-F67 PolarHBondContact O-N 3.4Å |
| 64 | L | 94.1 | Very high | 88.8 | Confident | 58 Ų | 58 | 55.3 Ų | 55.3 | 30% | 0.304 | 30% | 0.295 | S | S | . | . | H | α-helix | trans | -63.1 | -39.5 | 176.5 | -71.1 | 171.5 | 0 | 0 | 0 | 112 | T60 K61 S68 A261 L262 L265 | T60-L64 HydrophobicContact CG2-CD1 4.02Å; T60-L64 HydrophobicContact CG2-CG 4.41Å; T60-L64 WeakPolarHBondContact O-CB 3.29Å; T60-L64 VanDerWaalsContact O-CG 3.25Å; T60-L64 WeakPolarHBondContact O-CG 3.41Å; T60-L64 PolarHBondContact O-N 3.31Å; K61-L64 PolarHBondContact O-N 3.07Å; L64-S68 WeakPolarHBondContact O-CB 3.3Å; L64-S68 PolarHBondContact O-N 3.18Å; L64-A261 HydrophobicContact CD1-CB 4.35Å; L64-L262 HydrophobicContact CD1-CD2 4.11Å; L64-L265 HydrophobicContact CB-CD1 3.89Å; L64-L265 HydrophobicContact CD1-CD1 3.9Å |
| 65 | C | 91.7 | Very high | 87.9 | Confident | 5 Ų | 5 | 56.7 Ų | 56.7 | 3% | 0.034 | 31% | 0.311 | C | S | . | . | H | α-helix | trans | -66.8 | -44.5 | 174.2 | -77.5 | 0 | 0 | 0 | 0 | 112.7 | K61 L62 L63 S68 L69 N221 L222 L265 | K61-C65 WeakPolarHBondContact O-CB 3.26Å; K61-C65 PolarHBondContact O-N 3.36Å; K61-C65 PolarHBondContact O-SG 3.49Å; L62-C65 PolarHBondContact O-N 2.94Å; L63-C65 VanDerWaalsContact C-N 3.34Å; L63-C65 PolarHBondContact O-N 3.44Å; C65-S68 PolarHBondContact O-N 3.47Å; C65-L69 WeakPolarHBondContact O-CG 3.44Å; C65-L69 PolarHBondContact O-N 3.48Å; C65-L69 VanDerWaalsContact O-N 3.16Å; C65-N221 WeakPolarHBondContact SG-CB 3.47Å; C65-L222 HydrophobicContact CB-CD1 4.28Å; C65-L265 WeakPolarHBondContact SG-CD2 3.27Å |
| 66 | A | 90.8 | Very high | 86.9 | Confident | 31 Ų | 31 | 61.9 Ų | 61.9 | 26% | 0.256 | 33% | 0.33 | S | S | . | . | H | α-helix | trans | -61.2 | -46.2 | 176.7 | 0 | 0 | 0 | 0 | 0 | 110.8 | L62 L63 S68 L69 L70 L222 | L62-A66 WeakPolarHBondContact O-CB 3.43Å; L62-A66 PolarHBondContact O-N 2.94Å; L63-A66 PolarHBondContact O-N 3Å; A66-S68 PolarHBondContact O-N 3.36Å; A66-L69 PolarHBondContact O-N 2.96Å; A66-L69 VanDerWaalsContact O-N 3.1Å; A66-L70 WeakPolarHBondContact O-CG 3.32Å; A66-L70 PolarHBondContact O-N 3.47Å; A66-L222 HydrophobicContact CB-CD1 3.98Å |
| 67 | F | 90.5 | Very high | 85.8 | Confident | 114 Ų | 114 | 62.7 Ų | 62.7 | 50% | 0.5 | 34% | 0.337 | S | S | . | . | H | α-helix | trans | -58.2 | -46.3 | 175.9 | -179.5 | -102.3 | 0 | 0 | 0 | 112 | L63 L69 L70 V71 | L63-F67 VanDerWaalsContact O-CB 3.28Å; L63-F67 WeakPolarHBondContact O-CB 3.28Å; L63-F67 PolarHBondContact O-N 3.4Å; F67-L69 PolarHBondContact O-N 3.31Å; F67-L70 PolarHBondContact O-N 3.25Å; F67-V71 HydrophobicContact CD1-CG2 4.25Å; F67-V71 HydrophobicContact CD2-CG2 4.05Å; F67-V71 HydrophobicContact CE1-CG2 3.87Å; F67-V71 HydrophobicContact CE2-CG2 3.64Å; F67-V71 HydrophobicContact CG-CG2 4.34Å; F67-V71 HydrophobicContact CZ-CG2 3.55Å; F67-V71 WeakPolarHBondContact O-CG2 3.29Å; F67-V71 PolarHBondContact O-N 2.82Å |
| 68 | S | 87.9 | Confident | 84.4 | Confident | 17 Ų | 17 | 71.7 Ų | 71.7 | 12% | 0.119 | 38% | 0.378 | C | S | . | . | H | α-helix | trans | -60.2 | -29.8 | 176.7 | 179.9 | 0 | 0 | 0 | 0 | 113.4 | L64 C65 A66 W73 | L64-S68 WeakPolarHBondContact O-CB 3.3Å; L64-S68 PolarHBondContact O-N 3.18Å; C65-S68 PolarHBondContact O-N 3.47Å; A66-S68 PolarHBondContact O-N 3.36Å; S68-W73 WeakPolarHBondContact O-CB 3.38Å; S68-W73 PolarHBondContact O-N 3.35Å |
| 69 | L | 86 | Confident | 83.1 | Confident | 20 Ų | 20 | 73.1 Ų | 73.1 | 11% | 0.105 | 40% | 0.4 | C | S | . | . | H | α-helix | trans | -80 | -41.1 | 176.1 | -70.5 | 167.3 | 0 | 0 | 0 | 111.5 | C65 A66 F67 G72 Q74 W76 A218 L219 L222 | C65-L69 WeakPolarHBondContact O-CG 3.44Å; C65-L69 PolarHBondContact O-N 3.48Å; C65-L69 VanDerWaalsContact O-N 3.16Å; A66-L69 PolarHBondContact O-N 2.96Å; A66-L69 VanDerWaalsContact O-N 3.1Å; F67-L69 PolarHBondContact O-N 3.31Å; L69-G72 PolarHBondContact O-N 3.5Å; L69-G72 VanDerWaalsContact O-N 3.11Å; L69-Q74 HydrophobicContact CD2-CB 4.16Å; L69-W76 HydrophobicContact CD1-CE3 4.28Å; L69-W76 HydrophobicContact CD1-CZ3 4.07Å; L69-A218 HydrophobicContact CD1-CB 4.35Å; L69-A218 HydrophobicContact CD2-CB 3.92Å; L69-A218 HydrophobicContact CG-CB 3.88Å; L69-L219 HydrophobicContact CD1-CD1 4.37Å; L69-L222 HydrophobicContact CD1-CB 4.46Å; L69-L222 HydrophobicContact CD1-CD2 4.12Å |
| 70 | L | 85.4 | Confident | 81.4 | Confident | 151 Ų | 151 | 74.1 Ų | 74.1 | 79% | 0.791 | 42% | 0.418 | S | S | * | . | H | α-helix | trans | -64.6 | -39.7 | 179.2 | -70.5 | 172.5 | 0 | 0 | 0 | 112.7 | A66 F67 G72 | A66-L70 WeakPolarHBondContact O-CG 3.32Å; A66-L70 PolarHBondContact O-N 3.47Å; F67-L70 PolarHBondContact O-N 3.25Å; L70-G72 PolarHBondContact O-N 2.89Å |
| 71 | V | 85.3 | Confident | 79.8 | Confident | 71 Ų | 71 | 76 Ų | 76 | 43% | 0.43 | 43% | 0.431 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -73 | -7.2 | 176.6 | 178.2 | 0 | 0 | 0 | 0 | 111.9 | F67 W73 | F67-V71 HydrophobicContact CD1-CG2 4.25Å; F67-V71 HydrophobicContact CD2-CG2 4.05Å; F67-V71 HydrophobicContact CE1-CG2 3.87Å; F67-V71 HydrophobicContact CE2-CG2 3.64Å; F67-V71 HydrophobicContact CG-CG2 4.34Å; F67-V71 HydrophobicContact CZ-CG2 3.55Å; F67-V71 WeakPolarHBondContact O-CG2 3.29Å; F67-V71 PolarHBondContact O-N 2.82Å; V71-W73 VanDerWaalsContact C-N 3.26Å; V71-W73 HydrophobicContact CG1-CD2 4.43Å; V71-W73 HydrophobicContact CG1-CG 4.32Å; V71-W73 PolarHBondContact O-N 3.27Å |
| 72 | G | 74.2 | Confident | 79 | Confident | 52 Ų | 52 | 76.8 Ų | 76.8 | 54% | 0.536 | 44% | 0.438 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 73.8 | 14.7 | 178.9 | 0 | 0 | 0 | 0 | 0 | 114 | L69 L70 Q74 | L69-G72 PolarHBondContact O-N 3.5Å; L69-G72 VanDerWaalsContact O-N 3.11Å; L70-G72 PolarHBondContact O-N 2.89Å; G72-Q74 PolarHBondContact O-N 3.08Å |
| 73 | W | 74.8 | Confident | 78.2 | Confident | 187 Ų | 187 | 84 Ų | 84 | 71% | 0.708 | 46% | 0.463 | S | S | * | . | S | Bend | trans | -59.9 | -24.8 | 171.1 | -73.7 | -10.9 | 0 | 0 | 0 | 112.1 | S68 V71 | S68-W73 WeakPolarHBondContact O-CB 3.38Å; S68-W73 PolarHBondContact O-N 3.35Å; V71-W73 VanDerWaalsContact C-N 3.26Å; V71-W73 HydrophobicContact CG1-CD2 4.43Å; V71-W73 HydrophobicContact CG1-CG 4.32Å; V71-W73 PolarHBondContact O-N 3.27Å |
| 74 | Q | 73.5 | Confident | 77.7 | Confident | 60 Ų | 60 | 88.1 Ų | 88.1 | 28% | 0.28 | 47% | 0.471 | S | S | . | . | S | Bend | trans | -133.1 | 130.1 | 168.9 | -63.2 | -174.1 | 15.8 | 0 | 0 | 109.4 | L69 G72 W76 P216 A218 | L69-Q74 HydrophobicContact CD2-CB 4.16Å; G72-Q74 PolarHBondContact O-N 3.08Å; Q74-W76 PolarHBondContact O-N 3.33Å; Q74-P216 HydrophobicContact CB-CB 4.18Å; Q74-A218 HydrophobicContact CG-CB 4.47Å |
| 75 | A | 68.4 | Low | 77.3 | Confident | 80 Ų | 80 | 88.7 Ų | 88.7 | 66% | 0.661 | 47% | 0.473 | S | S | * | . | P | Polyproline II helix | trans | -66.1 | 130.1 | -178.7 | 0 | 0 | 0 | 0 | 0 | 111.3 | P216 | A75-P216 VanDerWaalsContact O-CG 3.28Å; A75-P216 WeakPolarHBondContact O-CG 3.26Å |
| 76 | W | 70.4 | Confident | 77.1 | Confident | 120 Ų | 120 | 89 Ų | 89 | 46% | 0.455 | 48% | 0.475 | S | S | . | . | P | Polyproline II helix | trans | -67 | 131.6 | 168.2 | -171.6 | -90.6 | 0 | 0 | 0 | 109.2 | L69 Q74 Q78 P81 L219 L222 | L69-W76 HydrophobicContact CD1-CE3 4.28Å; L69-W76 HydrophobicContact CD1-CZ3 4.07Å; Q74-W76 PolarHBondContact O-N 3.33Å; W76-Q78 PolarHBondContact O-N 2.9Å; W76-P81 HydrophobicContact CZ2-CB 4.32Å; W76-L219 HydrophobicContact CE3-CD1 4.23Å; W76-L219 HydrophobicContact CH2-CD1 3.7Å; W76-L219 HydrophobicContact CZ2-CD1 4.45Å; W76-L219 HydrophobicContact CZ3-CD1 3.57Å; W76-L222 HydrophobicContact CZ3-CD2 4.37Å |
| 77 | P | 68.8 | Low | 77.1 | Confident | 44 Ų | 44 | 89.6 Ų | 89.6 | 29% | 0.286 | 48% | 0.48 | S | S | . | . | P | Polyproline II helix | trans | -60.6 | 132.8 | 176.3 | -13.1 | 24.3 | 0 | 0 | 0 | 110 | G79 L215 L219 | P77-G79 PolarHBondContact O-N 2.87Å; P77-G79 VanDerWaalsContact O-N 3.13Å; P77-L215 HydrophobicContact CG-CD2 3.97Å; P77-L219 HydrophobicContact CG-CD2 3.59Å |
| 78 | Q | 62.8 | Low | 77.3 | Confident | 206 Ų | 206 | 85.7 Ų | 85.7 | 96% | 0.963 | 47% | 0.467 | S | S | * | . | S | Bend | trans | -61.4 | 118.1 | 174.2 | -68.6 | -178 | -13.3 | 0 | 0 | 109.7 | W76 | W76-Q78 PolarHBondContact O-N 2.9Š|
| 79 | G | 66.3 | Low | 77.5 | Confident | 57 Ų | 57 | 84.9 Ų | 84.9 | 59% | 0.588 | 46% | 0.461 | S | S | * | . | S | Bend | trans | 130 | 173 | 179.8 | 0 | 0 | 0 | 0 | 0 | 114.4 | P77 | P77-G79 PolarHBondContact O-N 2.87Å; P77-G79 VanDerWaalsContact O-N 3.13Å |
| 80 | A | 58.4 | Low | 77.9 | Confident | 88 Ų | 88 | 85.4 Ų | 85.4 | 73% | 0.727 | 47% | 0.468 | S | S | * | . | S | Bend | trans | -63.9 | 146.1 | 174.3 | 0 | 0 | 0 | 0 | 0 | 110.8 | P82 | A80-P82 VanDerWaalsContact O-CD 3.26Å; A80-P82 WeakPolarHBondContact O-CD 3.37Å; A80-P82 VanDerWaalsContact O-N 3.1Å |
| 81 | P | 62.7 | Low | 78.3 | Confident | 75 Ų | 75 | 81.6 Ų | 81.6 | 49% | 0.487 | 45% | 0.451 | S | S | . | . | trans | -58.8 | 119.5 | 175.3 | 23.9 | -32 | 0 | 0 | 0 | 108.7 | W76 W83 F223 | W76-P81 HydrophobicContact CZ2-CB 4.32Å; P81-W83 PolarHBondContact O-N 2.88Å; P81-F223 HydrophobicContact CB-CZ 4.47Å | ||
| 82 | P | 77.2 | Confident | 78.7 | Confident | 39 Ų | 39 | 78.2 Ų | 78.2 | 25% | 0.253 | 43% | 0.43 | S | S | . | . | trans | -74.1 | 95.9 | -176.6 | 25.4 | -28.4 | 0 | 0 | 0 | 108.4 | A80 R84 Q85 A86 | A80-P82 VanDerWaalsContact O-CD 3.26Å; A80-P82 WeakPolarHBondContact O-CD 3.37Å; A80-P82 VanDerWaalsContact O-N 3.1Å; P82-R84 PolarHBondContact O-N 2.87Å; P82-Q85 HydrophobicContact CB-CB 4.16Å; P82-Q85 HydrophobicContact CB-CG 3.81Å; P82-Q85 HydrophobicContact CG-CB 3.89Å; P82-Q85 HydrophobicContact CG-CG 3.77Å; P82-Q85 VanDerWaalsContact CG-NE2 3.32Å; P82-Q85 WeakPolarHBondContact O-CA 3.4Å; P82-Q85 WeakPolarHBondContact O-CB 3.41Å; P82-Q85 PolarHBondContact O-N 3.42Å; P82-A86 PolarHBondContact O-N 3.08Å; P82-A86 VanDerWaalsContact O-N 3.14Å | ||
| 83 | W | 78.8 | Confident | 79.6 | Confident | 185 Ų | 185 | 76 Ų | 76 | 70% | 0.701 | 41% | 0.407 | S | S | * | . | H | α-helix | trans | -52.4 | -31 | 178.4 | 72.8 | -96.5 | 0 | 0 | 0 | 112.2 | P81 Q85 A86 A87 | P81-W83 PolarHBondContact O-N 2.88Å; W83-Q85 VanDerWaalsContact C-N 3.26Å; W83-Q85 PolarHBondContact O-N 2.99Å; W83-A86 PolarHBondContact O-N 2.9Å; W83-A86 VanDerWaalsContact O-N 3.14Å; W83-A87 PolarHBondContact O-N 3.38Å |
| 84 | R | 84.1 | Confident | 80.5 | Confident | 190 Ų | 190 | 71.9 Ų | 71.9 | 72% | 0.717 | 40% | 0.398 | S | S | * | . | H | α-helix | trans | -61.1 | -31.2 | 173.3 | -66.9 | -173.7 | 174.6 | -139.2 | 1 | 113.4 | P82 P88 | P82-R84 PolarHBondContact O-N 2.87Å; R84-P88 VanDerWaalsContact O-CD 3.26Å; R84-P88 WeakPolarHBondContact O-CD 3.4Å |
| 85 | Q | 85.6 | Confident | 81.5 | Confident | 71 Ų | 71 | 70.4 Ų | 70.4 | 33% | 0.332 | 39% | 0.392 | S | S | . | . | H | α-helix | trans | -86.6 | -26 | 175.6 | -59.4 | 177.2 | 31.2 | 0 | 0 | 111.5 | P82 W83 P88 F89 Q213 L215 | P82-Q85 HydrophobicContact CB-CB 4.16Å; P82-Q85 HydrophobicContact CB-CG 3.81Å; P82-Q85 HydrophobicContact CG-CB 3.89Å; P82-Q85 HydrophobicContact CG-CG 3.77Å; P82-Q85 VanDerWaalsContact CG-NE2 3.32Å; P82-Q85 WeakPolarHBondContact O-CA 3.4Å; P82-Q85 WeakPolarHBondContact O-CB 3.41Å; P82-Q85 PolarHBondContact O-N 3.42Å; W83-Q85 VanDerWaalsContact C-N 3.26Å; W83-Q85 PolarHBondContact O-N 2.99Å; Q85-P88 WeakPolarHBondContact O-CD 3.35Å; Q85-F89 VanDerWaalsContact O-CD2 3.28Å; Q85-F89 WeakPolarHBondContact O-CD2 3.28Å; Q85-F89 WeakPolarHBondContact O-CE2 3.33Å; Q85-Q213 PolarHBondContact O-NE2 2.93Å; Q85-L215 HydrophobicContact CB-CD1 4.33Å; Q85-L215 VanDerWaalsContact OE1-CD1 3.28Å |
| 86 | A | 88.5 | Confident | 82.5 | Confident | 11 Ų | 11 | 68.6 Ų | 68.6 | 9% | 0.091 | 37% | 0.369 | C | S | . | . | H | α-helix | trans | -74.4 | -41.3 | 174.3 | 0 | 0 | 0 | 0 | 0 | 112.7 | P82 W83 P88 F89 F223 F227 | P82-A86 PolarHBondContact O-N 3.08Å; P82-A86 VanDerWaalsContact O-N 3.14Å; W83-A86 PolarHBondContact O-N 2.9Å; W83-A86 VanDerWaalsContact O-N 3.14Å; A86-P88 VanDerWaalsContact C-CD 3.49Å; A86-F89 VanDerWaalsContact O-CB 3.3Å; A86-F89 WeakPolarHBondContact O-CB 3.19Å; A86-F89 PolarHBondContact O-N 3.3Å; A86-F223 HydrophobicContact CB-CB 4.29Å; A86-F223 HydrophobicContact CB-CD1 3.83Å; A86-F223 HydrophobicContact CB-CD2 3.87Å; A86-F223 HydrophobicContact CB-CE1 4.06Å; A86-F223 HydrophobicContact CB-CE2 4.09Å; A86-F223 HydrophobicContact CB-CG 3.74Å; A86-F223 HydrophobicContact CB-CZ 4.19Å; A86-F227 HydrophobicContact CB-CE2 4.47Å; A86-F227 WeakPolarHBondContact O-CE2 3.48Å |
| 87 | A | 90.4 | Very high | 83.3 | Confident | 43 Ų | 43 | 63.3 Ų | 63.3 | 36% | 0.355 | 35% | 0.352 | S | S | . | . | H | α-helix | trans | -54.4 | -39.9 | -174 | 0 | 0 | 0 | 0 | 0 | 115 | W83 F89 A90 | W83-A87 PolarHBondContact O-N 3.38Å; A87-F89 PolarHBondContact O-N 2.84Å; A87-A90 WeakPolarHBondContact O-CB 3.24Å; A87-A90 PolarHBondContact O-N 3.49Å |
| 88 | P | 93.4 | Very high | 84.3 | Confident | 33 Ų | 33 | 63 Ų | 63 | 21% | 0.214 | 35% | 0.353 | C | S | . | . | H | α-helix | trans | -58.9 | -28.9 | 173.2 | -27.1 | 36.2 | 0 | 0 | 0 | 114.3 | R84 Q85 A86 A90 V91 S92 Y205 L209 | R84-P88 VanDerWaalsContact O-CD 3.26Å; R84-P88 WeakPolarHBondContact O-CD 3.4Å; Q85-P88 WeakPolarHBondContact O-CD 3.35Å; A86-P88 VanDerWaalsContact C-CD 3.49Å; P88-A90 PolarHBondContact O-N 2.91Å; P88-V91 PolarHBondContact O-N 3.32Å; P88-S92 PolarHBondContact O-N 3.45Å; P88-Y205 WeakPolarHBondContact O-CE1 3.4Å; P88-L209 HydrophobicContact CB-CD1 3.57Å; P88-L209 HydrophobicContact CB-CD2 3.76Å; P88-L209 HydrophobicContact CB-CG 4.33Å; P88-L209 HydrophobicContact CG-CD1 4.27Å |
| 89 | F | 93.4 | Very high | 85.6 | Confident | 0 Ų | 0 | 53.8 Ų | 53.8 | 0% | 0 | 31% | 0.31 | C | S | . | . | H | α-helix | trans | -68.8 | -23.2 | 176 | -69.1 | -82.6 | 0 | 0 | 0 | 112.5 | Q85 A86 A87 V91 S92 A93 L209 M210 Q213 Q220 F223 L224 F227 | Q85-F89 VanDerWaalsContact O-CD2 3.28Å; Q85-F89 WeakPolarHBondContact O-CD2 3.28Å; Q85-F89 WeakPolarHBondContact O-CE2 3.33Å; A86-F89 VanDerWaalsContact O-CB 3.3Å; A86-F89 WeakPolarHBondContact O-CB 3.19Å; A86-F89 PolarHBondContact O-N 3.3Å; A87-F89 PolarHBondContact O-N 2.84Å; F89-V91 VanDerWaalsContact C-N 3.31Å; F89-V91 PolarHBondContact O-N 3.31Å; F89-S92 PolarHBondContact O-N 3.42Å; F89-A93 WeakPolarHBondContact O-CB 3.39Å; F89-A93 PolarHBondContact O-N 3.21Å; F89-L209 HydrophobicContact CB-CD2 4.38Å; F89-L209 HydrophobicContact CD1-CD2 3.49Å; F89-L209 VanDerWaalsContact CD1-CD2 3.49Å; F89-L209 HydrophobicContact CD1-CG 4.36Å; F89-L209 HydrophobicContact CD2-CD2 3.88Å; F89-L209 HydrophobicContact CE1-CD2 3.57Å; F89-L209 HydrophobicContact CE1-CG 3.93Å; F89-L209 HydrophobicContact CE2-CD2 3.97Å; F89-L209 HydrophobicContact CE2-CG 4.17Å; F89-L209 HydrophobicContact CG-CD2 3.65Å; F89-L209 HydrophobicContact CZ-CD2 3.8Å; F89-L209 HydrophobicContact CZ-CG 3.82Å; F89-M210 HydrophobicContact CE1-CG 4.45Å; F89-Q213 VanDerWaalsContact CE2-OE1 3.29Å; F89-Q220 HydrophobicContact CE1-CB 3.9Å; F89-Q220 HydrophobicContact CE2-CB 4.45Å; F89-Q220 HydrophobicContact CZ-CB 3.57Å; F89-Q220 HydrophobicContact CZ-CG 3.77Å; F89-F223 HydrophobicContact CB-CB 4.03Å; F89-F223 HydrophobicContact CD2-CB 3.79Å; F89-F223 AromaticContact CD2-CD2 3.97Å; F89-F223 HydrophobicContact CD2-CD2 3.97Å; F89-F223 HydrophobicContact CD2-CG 4.37Å; F89-F223 HydrophobicContact CE2-CB 4.46Å; F89-F223 HydrophobicContact CE2-CD2 4Å; F89-F223 HydrophobicContact CG-CB 3.96Å; F89-L224 HydrophobicContact CB-CB 4.49Å; F89-L224 HydrophobicContact CD1-CB 3.95Å; F89-L224 HydrophobicContact CD1-CD1 4.46Å; F89-F227 HydrophobicContact CB-CD2 4.26Å |
| 90 | A | 93.9 | Very high | 86.5 | Confident | 31 Ų | 31 | 54.7 Ų | 54.7 | 26% | 0.256 | 30% | 0.302 | S | S | . | . | H | α-helix | trans | -63.6 | -38.8 | 172.3 | 0 | 0 | 0 | 0 | 0 | 111.5 | A87 P88 A93 L94 F227 | A87-A90 WeakPolarHBondContact O-CB 3.24Å; A87-A90 PolarHBondContact O-N 3.49Å; P88-A90 PolarHBondContact O-N 2.91Å; A90-A93 PolarHBondContact O-N 3.17Å; A90-L94 WeakPolarHBondContact O-CB 3.36Å; A90-L94 PolarHBondContact O-N 3.34Å; A90-F227 HydrophobicContact CB-CB 4.4Å; A90-F227 HydrophobicContact CB-CD1 3.66Å; A90-F227 HydrophobicContact CB-CD2 3.81Å; A90-F227 HydrophobicContact CB-CE1 3.78Å; A90-F227 HydrophobicContact CB-CE2 3.94Å; A90-F227 HydrophobicContact CB-CG 3.69Å; A90-F227 HydrophobicContact CB-CZ 3.92Å |
| 91 | V | 94.3 | Very high | 87.7 | Confident | 70 Ų | 70 | 53.5 Ų | 53.5 | 42% | 0.424 | 28% | 0.283 | S | S | . | . | H | α-helix | trans | -65.7 | -43.6 | 175.9 | -179.5 | 0 | 0 | 0 | 0 | 110.6 | P88 F89 L94 L95 Y205 | P88-V91 PolarHBondContact O-N 3.32Å; F89-V91 VanDerWaalsContact C-N 3.31Å; F89-V91 PolarHBondContact O-N 3.31Å; V91-L94 PolarHBondContact O-N 2.99Å; V91-L95 HydrophobicContact CG1-CD1 4.3Å; V91-L95 WeakPolarHBondContact O-CG 3.34Å; V91-L95 PolarHBondContact O-N 3.47Å; V91-Y205 HydrophobicContact CB-CE1 4.03Å; V91-Y205 HydrophobicContact CG1-CE1 4.11Å |
| 92 | S | 93.3 | Very high | 88.8 | Confident | 0 Ų | 0 | 51 Ų | 51 | 0% | 0 | 27% | 0.265 | C | S | . | . | H | α-helix | trans | -59.6 | -47.8 | 174.2 | 169.8 | 0 | 0 | 0 | 0 | 111.6 | P88 F89 L94 L95 Y96 T206 L224 | P88-S92 PolarHBondContact O-N 3.45Å; F89-S92 PolarHBondContact O-N 3.42Å; S92-L94 VanDerWaalsContact C-N 3.33Å; S92-L94 PolarHBondContact O-N 2.83Å; S92-L95 PolarHBondContact O-N 2.88Å; S92-Y96 VanDerWaalsContact O-CD2 3.27Å; S92-Y96 WeakPolarHBondContact O-CD2 3.49Å; S92-Y96 PolarHBondContact O-N 3.44Å; S92-T206 PolarHBondContact OG-OG1 3.39Å; S92-L224 VanDerWaalsContact OG-CD1 3.23Å; S92-L224 WeakPolarHBondContact OG-CD1 3.39Å |
| 93 | A | 93.4 | Very high | 89.1 | Confident | 6 Ų | 6 | 50.4 Ų | 50.4 | 5% | 0.05 | 26% | 0.261 | C | S | . | . | H | α-helix | trans | -60.6 | -41.4 | 177 | 0 | 0 | 0 | 0 | 0 | 112.1 | F89 A90 Y96 G97 L224 F227 L231 | F89-A93 WeakPolarHBondContact O-CB 3.39Å; F89-A93 PolarHBondContact O-N 3.21Å; A90-A93 PolarHBondContact O-N 3.17Å; A93-Y96 PolarHBondContact O-N 3.33Å; A93-G97 PolarHBondContact O-N 3.44Å; A93-L224 HydrophobicContact CB-CD1 4.14Å; A93-F227 HydrophobicContact CB-CB 3.6Å; A93-L231 HydrophobicContact CB-CD1 3.96Å |
| 94 | L | 94 | Very high | 89.2 | Confident | 101 Ų | 101 | 46.3 Ų | 46.3 | 53% | 0.529 | 25% | 0.252 | S | S | . | . | H | α-helix | trans | -63 | -43.5 | 176.1 | -177.4 | 65.6 | 0 | 0 | 0 | 111.6 | A90 V91 S92 G97 A98 L231 | A90-L94 WeakPolarHBondContact O-CB 3.36Å; A90-L94 PolarHBondContact O-N 3.34Å; V91-L94 PolarHBondContact O-N 2.99Å; S92-L94 VanDerWaalsContact C-N 3.33Å; S92-L94 PolarHBondContact O-N 2.83Å; L94-G97 PolarHBondContact O-N 3Å; L94-A98 VanDerWaalsContact O-CB 3.23Å; L94-A98 WeakPolarHBondContact O-CB 3.46Å; L94-A98 PolarHBondContact O-N 3.28Å; L94-L231 HydrophobicContact CB-CD1 4.32Å; L94-L231 HydrophobicContact CD1-CD1 4.49Å; L94-L231 HydrophobicContact CD1-CD2 4.22Å |
| 95 | L | 93.8 | Very high | 89.2 | Confident | 29 Ų | 29 | 41.8 Ų | 41.8 | 15% | 0.152 | 24% | 0.236 | C | C | . | . | H | α-helix | trans | -63.8 | -41.7 | 177 | -70.3 | 170.9 | 0 | 0 | 0 | 111.6 | V91 S92 N99 I198 L201 | V91-L95 HydrophobicContact CG1-CD1 4.3Å; V91-L95 WeakPolarHBondContact O-CG 3.34Å; V91-L95 PolarHBondContact O-N 3.47Å; S92-L95 PolarHBondContact O-N 2.88Å; L95-N99 WeakPolarHBondContact O-CB 3.42Å; L95-N99 PolarHBondContact O-N 3.25Å; L95-I198 HydrophobicContact CD2-CG2 4.23Å; L95-I198 WeakPolarHBondContact O-CG2 3.44Å; L95-L201 HydrophobicContact CD1-CD2 4.21Å; L95-L201 HydrophobicContact CD1-CG 4.04Å; L95-L201 HydrophobicContact CD2-CD2 4.15Å |
| 96 | Y | 90.1 | Very high | 89.1 | Confident | 41 Ų | 41 | 38.4 Ų | 38.4 | 16% | 0.161 | 22% | 0.22 | C | C | . | . | H | α-helix | trans | -64.5 | -44.8 | 174 | -80.2 | -58.1 | 0 | 0 | 0 | 112.3 | S92 A93 N99 N100 S202 T206 R279 | S92-Y96 VanDerWaalsContact O-CD2 3.27Å; S92-Y96 WeakPolarHBondContact O-CD2 3.49Å; S92-Y96 PolarHBondContact O-N 3.44Å; A93-Y96 PolarHBondContact O-N 3.33Å; Y96-N99 PolarHBondContact O-N 3.39Å; Y96-N100 VanDerWaalsContact O-CG 3.29Å; Y96-N100 PolarHBondContact O-N 3.26Å; Y96-S202 WeakPolarHBondContact CE1-OG 3.44Å; Y96-T206 HydrophobicContact CE2-CG2 4.28Å; Y96-T206 VanDerWaalsContact CE2-OG1 3.27Å; Y96-T206 WeakPolarHBondContact CE2-OG1 3.33Å; Y96-R279 PolarHBondContact OH-NH1 3.15Å |
| 97 | G | 86.6 | Confident | 88.7 | Confident | 10 Ų | 10 | 42.9 Ų | 42.9 | 10% | 0.103 | 24% | 0.239 | C | C | . | . | H | α-helix | trans | -60.9 | -47.1 | 176.1 | 0 | 0 | 0 | 0 | 0 | 112 | A93 L94 N99 N100 N101 | A93-G97 PolarHBondContact O-N 3.44Å; L94-G97 PolarHBondContact O-N 3Å; G97-N99 VanDerWaalsContact C-N 3.34Å; G97-N99 PolarHBondContact O-N 3.07Å; G97-N100 PolarHBondContact O-N 2.8Å; G97-N101 PolarHBondContact O-N 3Å; G97-N101 VanDerWaalsContact O-N 3.08Å; G97-N101 PolarHBondContact O-ND2 3.28Å |
| 98 | A | 88.6 | Confident | 88.3 | Confident | 38 Ų | 38 | 49.9 Ų | 49.9 | 31% | 0.314 | 26% | 0.256 | S | S | . | . | H | α-helix | trans | -60.3 | -43.6 | 175.6 | 0 | 0 | 0 | 0 | 0 | 111.4 | L94 N100 N101 L102 I198 | L94-A98 VanDerWaalsContact O-CB 3.23Å; L94-A98 WeakPolarHBondContact O-CB 3.46Å; L94-A98 PolarHBondContact O-N 3.28Å; A98-N100 PolarHBondContact O-N 3.21Å; A98-N101 PolarHBondContact O-N 2.96Å; A98-L102 WeakPolarHBondContact O-CB 3.36Å; A98-L102 PolarHBondContact O-N 2.85Å; A98-I198 HydrophobicContact CB-CG2 4.41Å |
| 99 | N | 90.6 | Very high | 87.7 | Confident | 12 Ų | 12 | 51.4 Ų | 51.4 | 6% | 0.064 | 26% | 0.258 | C | S | . | . | H | α-helix | trans | -58.5 | -47.9 | 177.5 | -165.6 | -108.7 | 0 | 0 | 0 | 111.8 | L95 Y96 G97 L102 V103 Y195 I198 S199 | L95-N99 WeakPolarHBondContact O-CB 3.42Å; L95-N99 PolarHBondContact O-N 3.25Å; Y96-N99 PolarHBondContact O-N 3.39Å; G97-N99 VanDerWaalsContact C-N 3.34Å; G97-N99 PolarHBondContact O-N 3.07Å; N99-L102 PolarHBondContact O-N 3.13Å; N99-V103 WeakPolarHBondContact O-CG2 3.23Å; N99-V103 PolarHBondContact O-N 2.82Å; N99-Y195 VanDerWaalsContact CG-CE2 3.46Å; N99-Y195 VanDerWaalsContact ND2-CD2 3.26Å; N99-Y195 WeakPolarHBondContact ND2-CD2 3.37Å; N99-Y195 WeakPolarHBondContact ND2-CE2 3.46Å; N99-Y195 PolarHBondContact ND2-O 3.02Å; N99-Y195 VanDerWaalsContact ND2-O 3.15Å; N99-Y195 VanDerWaalsContact OD1-CE2 3.3Å; N99-Y195 WeakPolarHBondContact OD1-CE2 3.44Å; N99-I198 HydrophobicContact CB-CG2 4.02Å; N99-S199 VanDerWaalsContact ND2-CA 3.31Å; N99-S199 WeakPolarHBondContact ND2-CA 3.27Å; N99-S199 VanDerWaalsContact ND2-CB 3.27Å; N99-S199 WeakPolarHBondContact ND2-CB 3.49Å; N99-S199 PolarHBondContact ND2-N 3.41Å |
| 100 | N | 84.9 | Confident | 87.1 | Confident | 76 Ų | 76 | 51.7 Ų | 51.7 | 41% | 0.406 | 26% | 0.259 | S | S | . | . | H | α-helix | trans | -63.3 | -43.9 | -178.9 | -69.4 | -13.5 | 0 | 0 | 0 | 112.4 | Y96 G97 A98 | Y96-N100 VanDerWaalsContact O-CG 3.29Å; Y96-N100 PolarHBondContact O-N 3.26Å; G97-N100 PolarHBondContact O-N 2.8Å; A98-N100 PolarHBondContact O-N 3.21Å |
| 101 | N | 83.6 | Confident | 86.4 | Confident | 63 Ų | 63 | 52.3 Ų | 52.3 | 34% | 0.337 | 26% | 0.259 | S | S | . | . | H | α-helix | trans | -70.2 | -36.2 | 179.1 | -75.1 | -81.3 | 0 | 0 | 0 | 112.3 | G97 A98 V103 I104 Y105 L235 | G97-N101 PolarHBondContact O-N 3Å; G97-N101 VanDerWaalsContact O-N 3.08Å; G97-N101 PolarHBondContact O-ND2 3.28Å; A98-N101 PolarHBondContact O-N 2.96Å; N101-V103 VanDerWaalsContact C-N 3.27Å; N101-V103 PolarHBondContact O-N 3.43Å; N101-I104 PolarHBondContact O-N 2.98Å; N101-I104 VanDerWaalsContact O-N 3.16Å; N101-Y105 PolarHBondContact O-N 3.27Å; N101-L235 WeakPolarHBondContact ND2-CD1 3.37Å |
| 102 | L | 86.1 | Confident | 85.5 | Confident | 21 Ų | 21 | 53 Ų | 53 | 11% | 0.11 | 26% | 0.264 | C | S | . | . | H | α-helix | trans | -64 | -33.9 | 179.9 | -171.1 | 57 | 0 | 0 | 0 | 111.5 | A98 N99 Y105 L106 L191 L194 Y195 I198 | A98-L102 WeakPolarHBondContact O-CB 3.36Å; A98-L102 PolarHBondContact O-N 2.85Å; N99-L102 PolarHBondContact O-N 3.13Å; L102-Y105 PolarHBondContact O-N 3.31Å; L102-L106 WeakPolarHBondContact O-CB 3.35Å; L102-L106 PolarHBondContact O-N 2.94Å; L102-L191 HydrophobicContact CD1-CD2 4.08Å; L102-L194 HydrophobicContact CD2-CB 4.49Å; L102-L194 HydrophobicContact CD2-CD2 4.37Å; L102-L194 HydrophobicContact CD2-CG 4.17Å; L102-Y195 HydrophobicContact CB-CD2 4.45Å; L102-Y195 VanDerWaalsContact CD2-CA 3.5Å; L102-I198 HydrophobicContact CD2-CD1 4.09Å |
| 103 | V | 84.2 | Confident | 84.7 | Confident | 28 Ų | 28 | 54.8 Ų | 54.8 | 17% | 0.17 | 28% | 0.277 | C | S | . | . | H | α-helix | trans | -57.7 | -49.3 | 171.8 | 177.1 | 0 | 0 | 0 | 0 | 111.7 | N99 N101 Y105 L106 Q107 Y115 Y195 | N99-V103 WeakPolarHBondContact O-CG2 3.23Å; N99-V103 PolarHBondContact O-N 2.82Å; N101-V103 VanDerWaalsContact C-N 3.27Å; N101-V103 PolarHBondContact O-N 3.43Å; V103-Y105 VanDerWaalsContact C-N 3.3Å; V103-Y105 PolarHBondContact O-N 3.49Å; V103-L106 WeakPolarHBondContact O-CB 3.1Å; V103-L106 PolarHBondContact O-N 3.27Å; V103-Q107 PolarHBondContact O-N 3.42Å; V103-Y115 HydrophobicContact CG1-CE1 3.99Å; V103-Y115 WeakPolarHBondContact CG2-OH 3.48Å; V103-Y195 HydrophobicContact CG2-CD2 3.8Å; V103-Y195 HydrophobicContact CG2-CE2 3.13Å |
| 104 | I | 81 | Confident | 84.1 | Confident | 99 Ų | 99 | 55.1 Ų | 55.1 | 51% | 0.508 | 28% | 0.278 | S | S | . | . | H | α-helix | trans | -63 | -42.5 | -178.8 | -59.7 | 171.9 | 0 | 0 | 0 | 110 | N101 L106 Q107 | N101-I104 PolarHBondContact O-N 2.98Å; N101-I104 VanDerWaalsContact O-N 3.16Å; I104-L106 VanDerWaalsContact C-N 3.34Å; I104-Q107 PolarHBondContact O-N 3.08Å |
| 105 | Y | 83.2 | Confident | 83.7 | Confident | 95 Ų | 95 | 51.7 Ų | 51.7 | 37% | 0.373 | 26% | 0.258 | S | S | . | . | H | α-helix | trans | -64.6 | -39.6 | 177.2 | -168.5 | -104.9 | 0 | 0 | 0 | 112.1 | N101 L102 V103 Q107 R108 Y109 L191 | N101-Y105 PolarHBondContact O-N 3.27Å; L102-Y105 PolarHBondContact O-N 3.31Å; V103-Y105 VanDerWaalsContact C-N 3.3Å; V103-Y105 PolarHBondContact O-N 3.49Å; Y105-Q107 VanDerWaalsContact C-N 3.29Å; Y105-Q107 PolarHBondContact O-N 3.02Å; Y105-R108 WeakPolarHBondContact O-CB 3.23Å; Y105-R108 PolarHBondContact O-N 2.98Å; Y105-R108 VanDerWaalsContact O-N 3.1Å; Y105-Y109 HydrophobicContact CD1-CD2 4.33Å; Y105-Y109 AromaticContact CD1-CE2 3.94Å; Y105-Y109 HydrophobicContact CD1-CE2 3.94Å; Y105-Y109 HydrophobicContact CE1-CD2 4.13Å; Y105-Y109 AromaticContact CE1-CE2 3.37Å; Y105-Y109 HydrophobicContact CE1-CE2 3.37Å; Y105-Y109 HydrophobicContact CE2-CE2 4.26Å; Y105-Y109 AromaticContact CZ-CE2 3.56Å; Y105-Y109 WeakPolarHBondContact O-CD2 3.26Å; Y105-Y109 PolarHBondContact OH-OH 3.49Å; Y105-L191 HydrophobicContact CD1-CD1 3.92Å; Y105-L191 HydrophobicContact CE1-CD1 3.73Å |
| 106 | L | 84.6 | Confident | 83 | Confident | 0 Ų | 0 | 54.8 Ų | 54.8 | 0% | 0 | 27% | 0.272 | C | S | . | . | H | α-helix | trans | -65.2 | -31.6 | -178.1 | -160.6 | 68.7 | 0 | 0 | 0 | 112.8 | L102 V103 I104 R108 Y109 M110 Y115 G188 L191 L192 | L102-L106 WeakPolarHBondContact O-CB 3.35Å; L102-L106 PolarHBondContact O-N 2.94Å; V103-L106 WeakPolarHBondContact O-CB 3.1Å; V103-L106 PolarHBondContact O-N 3.27Å; I104-L106 VanDerWaalsContact C-N 3.34Å; L106-R108 PolarHBondContact O-N 3.2Å; L106-R108 VanDerWaalsContact O-N 3.09Å; L106-Y109 PolarHBondContact O-N 3.05Å; L106-M110 PolarHBondContact O-N 3.27Å; L106-M110 VanDerWaalsContact O-N 3.16Å; L106-Y115 HydrophobicContact CD2-CD2 3.41Å; L106-Y115 VanDerWaalsContact CD2-CD2 3.41Å; L106-Y115 HydrophobicContact CD2-CE2 3.58Å; L106-Y115 HydrophobicContact CG-CD2 4.35Å; L106-G188 WeakPolarHBondContact CD1-O 3.48Å; L106-L191 HydrophobicContact CD1-CB 3.35Å; L106-L191 HydrophobicContact CD1-CD1 4.4Å; L106-L192 HydrophobicContact CD1-CB 4.36Å; L106-L192 HydrophobicContact CD2-CB 4Å; L106-L192 HydrophobicContact CD2-CD1 3.59Å; L106-L192 HydrophobicContact CD2-CG 4.4Å |
| 107 | Q | 79 | Confident | 82.8 | Confident | 105 Ų | 105 | 55 Ų | 55 | 49% | 0.491 | 28% | 0.278 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -62.6 | -13 | 174.5 | -69.8 | -176.4 | 2.8 | 0 | 0 | 113.7 | V103 I104 Y105 | V103-Q107 PolarHBondContact O-N 3.42Å; I104-Q107 PolarHBondContact O-N 3.08Å; Y105-Q107 VanDerWaalsContact C-N 3.29Å; Y105-Q107 PolarHBondContact O-N 3.02Å |
| 108 | R | 81.9 | Confident | 82.7 | Confident | 189 Ų | 189 | 56.7 Ų | 56.7 | 71% | 0.713 | 28% | 0.284 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -79.8 | -18.6 | 172 | -58.5 | -178.7 | 179.5 | -179.2 | -0.8 | 113.4 | Y105 L106 | Y105-R108 WeakPolarHBondContact O-CB 3.23Å; Y105-R108 PolarHBondContact O-N 2.98Å; Y105-R108 VanDerWaalsContact O-N 3.1Å; L106-R108 PolarHBondContact O-N 3.2Å; L106-R108 VanDerWaalsContact O-N 3.09Å |
| 109 | Y | 81.4 | Confident | 82.6 | Confident | 65 Ų | 65 | 55.2 Ų | 55.2 | 26% | 0.255 | 27% | 0.272 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -118.1 | -7.8 | -170.5 | -68.2 | -78.3 | 0 | 0 | 0 | 113.8 | Y105 L106 T185 L187 L191 | Y105-Y109 HydrophobicContact CD1-CD2 4.33Å; Y105-Y109 AromaticContact CD1-CE2 3.94Å; Y105-Y109 HydrophobicContact CD1-CE2 3.94Å; Y105-Y109 HydrophobicContact CE1-CD2 4.13Å; Y105-Y109 AromaticContact CE1-CE2 3.37Å; Y105-Y109 HydrophobicContact CE1-CE2 3.37Å; Y105-Y109 HydrophobicContact CE2-CE2 4.26Å; Y105-Y109 AromaticContact CZ-CE2 3.56Å; Y105-Y109 WeakPolarHBondContact O-CD2 3.26Å; Y105-Y109 PolarHBondContact OH-OH 3.49Å; L106-Y109 PolarHBondContact O-N 3.05Å; Y109-T185 PolarHBondContact O-OG1 3.34Å; Y109-T185 VanDerWaalsContact O-OG1 3.08Å; Y109-L187 HydrophobicContact CD1-CD2 4.14Å; Y109-L187 HydrophobicContact CE1-CD2 3.61Å; Y109-L191 HydrophobicContact CD2-CD1 3.99Å; Y109-L191 HydrophobicContact CE2-CD1 4.22Å; Y109-L191 HydrophobicContact CG-CD1 4.49Å |
| 110 | M | 80.3 | Confident | 82.5 | Confident | 6 Ų | 6 | 55.5 Ų | 55.5 | 3% | 0.03 | 27% | 0.273 | C | S | . | . | S | Bend | trans | -153.6 | 140.4 | -175.4 | -175.4 | 177 | -73.1 | 0 | 0 | 109 | L106 T114 Y115 L118 I184 | L106-M110 PolarHBondContact O-N 3.27Å; L106-M110 VanDerWaalsContact O-N 3.16Å; M110-T114 HydrophobicContact CE-CG2 4.2Å; M110-T114 HydrophobicContact CG-CG2 3.78Å; M110-T114 HydrophobicContact SD-CG2 3.72Å; M110-Y115 VanDerWaalsContact SD-CA 3.55Å; M110-Y115 PolarHBondContact SD-N 2.74Å; M110-L118 HydrophobicContact CE-CD1 3.75Å; M110-L118 HydrophobicContact SD-CD1 4.04Å; M110-I184 HydrophobicContact CE-CG1 4.41Å; M110-I184 HydrophobicContact CE-CG2 4.36Å |
| 111 | D | 79.1 | Confident | 82.7 | Confident | 45 Ų | 45 | 55.9 Ų | 55.9 | 24% | 0.241 | 28% | 0.275 | C | S | . | . | trans | -67.4 | 151.1 | 175.8 | 61.9 | -78.4 | 0 | 0 | 0 | 111.7 | S113 T114 Y115 | D111-S113 VanDerWaalsContact C-N 3.25Å; D111-S113 PolarHBondContact O-N 3.05Å; D111-S113 WeakPolarHBondContact OD2-CB 3.35Å; D111-S113 PolarHBondContact OD2-N 2.85Å; D111-S113 PolarHBondContact OD2-OG 3.36Å; D111-T114 PolarHBondContact O-N 3.38Å; D111-T114 WeakPolarHBondContact OD1-CB 3.07Å; D111-T114 PolarHBondContact OD1-OG1 3.02Å; D111-T114 WeakPolarHBondContact OD2-CB 3.45Å; D111-T114 PolarHBondContact OD2-N 2.95Å; D111-T114 PolarHBondContact OD2-OG1 2.88Å; D111-Y115 WeakPolarHBondContact O-CB 3.39Å; D111-Y115 PolarHBondContact O-N 2.59Å | ||
| 112 | P | 75.9 | Confident | 83 | Confident | 83 Ų | 83 | 54.9 Ų | 54.9 | 54% | 0.539 | 27% | 0.267 | S | S | . | . | H | α-helix | trans | -56.9 | -35.3 | -177 | -27.6 | 35.6 | 0 | 0 | 0 | 114.2 | Q116 | P112-Q116 WeakPolarHBondContact O-CB 3.23Å; P112-Q116 PolarHBondContact O-N 3.47Å |
| 113 | S | 76.6 | Confident | 83.3 | Confident | 38 Ų | 38 | 54.1 Ų | 54.1 | 27% | 0.266 | 26% | 0.263 | S | S | . | . | H | α-helix | trans | -65.5 | -51.4 | 178.3 | 24.3 | 0 | 0 | 0 | 0 | 112.4 | D111 Y115 Q116 V117 | D111-S113 VanDerWaalsContact C-N 3.25Å; D111-S113 PolarHBondContact O-N 3.05Å; D111-S113 WeakPolarHBondContact OD2-CB 3.35Å; D111-S113 PolarHBondContact OD2-N 2.85Å; D111-S113 PolarHBondContact OD2-OG 3.36Å; S113-Y115 VanDerWaalsContact C-N 3.31Å; S113-Y115 PolarHBondContact O-N 2.87Å; S113-Q116 PolarHBondContact O-N 3.33Å; S113-V117 PolarHBondContact O-N 3.47Å; S113-V117 VanDerWaalsContact O-N 3.12Å |
| 114 | T | 81.6 | Confident | 83.6 | Confident | 14 Ų | 14 | 54.1 Ų | 54.1 | 9% | 0.086 | 27% | 0.269 | C | S | . | . | H | α-helix | trans | -62 | -42.3 | 176.5 | -59.8 | 0 | 0 | 0 | 0 | 110.5 | M110 D111 Q116 V117 L118 I184 | M110-T114 HydrophobicContact CE-CG2 4.2Å; M110-T114 HydrophobicContact CG-CG2 3.78Å; M110-T114 HydrophobicContact SD-CG2 3.72Å; D111-T114 PolarHBondContact O-N 3.38Å; D111-T114 WeakPolarHBondContact OD1-CB 3.07Å; D111-T114 PolarHBondContact OD1-OG1 3.02Å; D111-T114 WeakPolarHBondContact OD2-CB 3.45Å; D111-T114 PolarHBondContact OD2-N 2.95Å; D111-T114 PolarHBondContact OD2-OG1 2.88Å; T114-Q116 VanDerWaalsContact C-N 3.33Å; T114-Q116 PolarHBondContact O-N 2.88Å; T114-V117 PolarHBondContact O-N 3.45Å; T114-L118 HydrophobicContact CG2-CD1 3.7Å; T114-L118 HydrophobicContact CG2-CG 4.22Å; T114-L118 WeakPolarHBondContact O-CB 3.43Å; T114-L118 WeakPolarHBondContact O-CG 3.2Å; T114-L118 PolarHBondContact O-N 3.4Å; T114-I184 HydrophobicContact CG2-CD1 3.82Å; T114-I184 HydrophobicContact CG2-CG1 3.85Å |
| 115 | Y | 83.8 | Confident | 84.2 | Confident | 28 Ų | 28 | 50.2 Ų | 50.2 | 11% | 0.11 | 25% | 0.251 | C | S | . | . | H | α-helix | trans | -57 | -46.9 | 173.6 | 167 | -104.6 | 0 | 0 | 0 | 111.5 | V103 L106 M110 D111 S113 V117 L118 S119 L192 Y195 | V103-Y115 HydrophobicContact CG1-CE1 3.99Å; V103-Y115 WeakPolarHBondContact CG2-OH 3.48Å; L106-Y115 HydrophobicContact CD2-CD2 3.41Å; L106-Y115 VanDerWaalsContact CD2-CD2 3.41Å; L106-Y115 HydrophobicContact CD2-CE2 3.58Å; L106-Y115 HydrophobicContact CG-CD2 4.35Å; M110-Y115 VanDerWaalsContact SD-CA 3.55Å; M110-Y115 PolarHBondContact SD-N 2.74Å; D111-Y115 WeakPolarHBondContact O-CB 3.39Å; D111-Y115 PolarHBondContact O-N 2.59Å; S113-Y115 VanDerWaalsContact C-N 3.31Å; S113-Y115 PolarHBondContact O-N 2.87Å; Y115-V117 PolarHBondContact O-N 3.17Å; Y115-L118 PolarHBondContact O-N 3.42Å; Y115-S119 WeakPolarHBondContact O-CA 3.24Å; Y115-S119 WeakPolarHBondContact O-CB 3.44Å; Y115-S119 PolarHBondContact O-N 3.38Å; Y115-S119 PolarHBondContact O-OG 2.92Å; Y115-L192 HydrophobicContact CD2-CD1 3.88Å; Y115-L192 HydrophobicContact CE2-CD1 4.11Å; Y115-Y195 HydrophobicContact CE2-CD1 4.29Å; Y115-Y195 HydrophobicContact CE2-CE1 4.11Å; Y115-Y195 VanDerWaalsContact OH-CZ 3.25Å; Y115-Y195 PolarHBondContact OH-OH 3.47Å |
| 116 | Q | 80.9 | Confident | 84.6 | Confident | 95 Ų | 95 | 45.9 Ų | 45.9 | 44% | 0.444 | 23% | 0.234 | S | C | . | . | H | α-helix | trans | -64.2 | -41.5 | -176 | -163.8 | 176.9 | -10.3 | 0 | 0 | 111.8 | P112 S113 T114 S119 N120 A157 | P112-Q116 WeakPolarHBondContact O-CB 3.23Å; P112-Q116 PolarHBondContact O-N 3.47Å; S113-Q116 PolarHBondContact O-N 3.33Å; T114-Q116 VanDerWaalsContact C-N 3.33Å; T114-Q116 PolarHBondContact O-N 2.88Å; Q116-S119 PolarHBondContact O-OG 3.44Å; Q116-N120 PolarHBondContact O-ND2 2.93Å; Q116-A157 HydrophobicContact CB-CB 3.94Å; Q116-A157 HydrophobicContact CG-CB 3.63Å |
| 117 | V | 84.1 | Confident | 85 | Confident | 46 Ų | 46 | 46.4 Ų | 46.4 | 28% | 0.279 | 24% | 0.238 | S | C | . | . | H | α-helix | trans | -63.3 | -53.8 | 175.3 | 175.2 | 0 | 0 | 0 | 0 | 110.6 | S113 T114 Y115 S119 N120 A154 A157 | S113-V117 PolarHBondContact O-N 3.47Å; S113-V117 VanDerWaalsContact O-N 3.12Å; T114-V117 PolarHBondContact O-N 3.45Å; Y115-V117 PolarHBondContact O-N 3.17Å; V117-S119 PolarHBondContact O-N 2.95Å; V117-N120 WeakPolarHBondContact O-CB 3.42Å; V117-N120 PolarHBondContact O-N 3.16Å; V117-N120 PolarHBondContact O-ND2 3.32Å; V117-A154 HydrophobicContact CG1-CB 4.24Å; V117-A157 HydrophobicContact CB-CB 4.39Å; V117-A157 HydrophobicContact CG2-CB 3.65Å |
| 118 | L | 86.4 | Confident | 85.7 | Confident | 44 Ų | 44 | 45.6 Ų | 45.6 | 23% | 0.23 | 24% | 0.24 | C | C | . | . | H | α-helix | trans | -74.9 | -24.7 | -172.9 | -58.8 | 178 | 0 | 0 | 0 | 113.2 | M110 T114 Y115 N120 L121 I184 L192 | M110-L118 HydrophobicContact CE-CD1 3.75Å; M110-L118 HydrophobicContact SD-CD1 4.04Å; T114-L118 HydrophobicContact CG2-CD1 3.7Å; T114-L118 HydrophobicContact CG2-CG 4.22Å; T114-L118 WeakPolarHBondContact O-CB 3.43Å; T114-L118 WeakPolarHBondContact O-CG 3.2Å; T114-L118 PolarHBondContact O-N 3.4Å; Y115-L118 PolarHBondContact O-N 3.42Å; L118-N120 PolarHBondContact O-N 3.49Å; L118-N120 VanDerWaalsContact O-N 3.15Å; L118-L121 WeakPolarHBondContact O-CB 3.32Å; L118-L121 VanDerWaalsContact O-CD1 3.26Å; L118-L121 WeakPolarHBondContact O-CD1 3.38Å; L118-L121 PolarHBondContact O-N 3.49Å; L118-L121 VanDerWaalsContact O-N 3.09Å; L118-I184 HydrophobicContact CD1-CD1 4.21Å; L118-L192 HydrophobicContact CB-CD1 4.36Å; L118-L192 HydrophobicContact CB-CD2 3.27Å; L118-L192 HydrophobicContact CB-CG 4.43Å; L118-L192 HydrophobicContact CD1-CD2 3.88Å; L118-L192 HydrophobicContact CG-CD2 4.2Å |
| 119 | S | 86 | Confident | 86.2 | Confident | 8 Ų | 8 | 37.9 Ų | 37.9 | 6% | 0.056 | 21% | 0.213 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -64.4 | -17.6 | 176.6 | 71.3 | 0 | 0 | 0 | 0 | 113.2 | Y115 Q116 V117 L121 K122 | Y115-S119 WeakPolarHBondContact O-CA 3.24Å; Y115-S119 WeakPolarHBondContact O-CB 3.44Å; Y115-S119 PolarHBondContact O-N 3.38Å; Y115-S119 PolarHBondContact O-OG 2.92Å; Q116-S119 PolarHBondContact O-OG 3.44Å; V117-S119 PolarHBondContact O-N 2.95Å; S119-L121 PolarHBondContact O-N 3.01Å; S119-K122 VanDerWaalsContact O-CB 3.28Å; S119-K122 WeakPolarHBondContact O-CB 3.41Å; S119-K122 WeakPolarHBondContact O-CD 3.49Å; S119-K122 WeakPolarHBondContact O-CG 3.25Å; S119-K122 PolarHBondContact O-N 3.46Å |
| 120 | N | 88.8 | Confident | 86.7 | Confident | 17 Ų | 17 | 35.3 Ų | 35.3 | 9% | 0.091 | 20% | 0.203 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -63.8 | -18.5 | 173.6 | -66.9 | -60.1 | 0 | 0 | 0 | 112.8 | Q116 V117 L118 K122 I123 M150 G153 A154 | Q116-N120 PolarHBondContact O-ND2 2.93Å; V117-N120 WeakPolarHBondContact O-CB 3.42Å; V117-N120 PolarHBondContact O-N 3.16Å; V117-N120 PolarHBondContact O-ND2 3.32Å; L118-N120 PolarHBondContact O-N 3.49Å; L118-N120 VanDerWaalsContact O-N 3.15Å; N120-K122 PolarHBondContact O-N 2.91Å; N120-I123 WeakPolarHBondContact O-CB 3.3Å; N120-I123 PolarHBondContact O-N 3.19Å; N120-M150 HydrophobicContact CB-CG 4.01Å; N120-G153 PolarHBondContact ND2-O 3.26Å; N120-A154 WeakPolarHBondContact ND2-CA 3.49Å; N120-A154 PolarHBondContact ND2-N 2.91Å; N120-A154 VanDerWaalsContact ND2-N 3.17Å |
| 121 | L | 88 | Confident | 87.2 | Confident | 84 Ų | 84 | 36.9 Ų | 36.9 | 44% | 0.44 | 21% | 0.214 | S | C | . | . | H | α-helix | trans | -56.4 | -20.6 | 170.1 | -87.7 | 69 | 0 | 0 | 0 | 112.5 | L118 S119 I123 G124 S125 | L118-L121 WeakPolarHBondContact O-CB 3.32Å; L118-L121 VanDerWaalsContact O-CD1 3.26Å; L118-L121 WeakPolarHBondContact O-CD1 3.38Å; L118-L121 PolarHBondContact O-N 3.49Å; L118-L121 VanDerWaalsContact O-N 3.09Å; S119-L121 PolarHBondContact O-N 3.01Å; L121-I123 PolarHBondContact O-N 3.46Å; L121-G124 PolarHBondContact O-N 3.02Å; L121-G124 VanDerWaalsContact O-N 3.11Å; L121-S125 PolarHBondContact O-N 3.42Å |
| 122 | K | 91.1 | Very high | 87.8 | Confident | 43 Ų | 43 | 40.4 Ų | 40.4 | 19% | 0.187 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -56.2 | -29.7 | 171.6 | 78.7 | -170.6 | 178.3 | -174.3 | 0 | 112.9 | S119 N120 T126 C196 | S119-K122 VanDerWaalsContact O-CB 3.28Å; S119-K122 WeakPolarHBondContact O-CB 3.41Å; S119-K122 WeakPolarHBondContact O-CD 3.49Å; S119-K122 WeakPolarHBondContact O-CG 3.25Å; S119-K122 PolarHBondContact O-N 3.46Å; N120-K122 PolarHBondContact O-N 2.91Å; K122-T126 VanDerWaalsContact O-CB 3.3Å; K122-T126 WeakPolarHBondContact O-CB 3.33Å; K122-T126 PolarHBondContact O-N 3.37Å; K122-T126 PolarHBondContact O-OG1 2.91Å; K122-C196 HydrophobicContact CB-CB 4.4Å |
| 123 | I | 91.3 | Very high | 88.4 | Confident | 4 Ų | 4 | 39 Ų | 39 | 2% | 0.021 | 22% | 0.224 | C | C | . | . | H | α-helix | trans | -63.3 | -51.1 | 176 | -66.9 | 165.1 | 0 | 0 | 0 | 109.3 | N120 L121 T126 A127 L146 L149 M150 L280 | N120-I123 WeakPolarHBondContact O-CB 3.3Å; N120-I123 PolarHBondContact O-N 3.19Å; L121-I123 PolarHBondContact O-N 3.46Å; I123-T126 PolarHBondContact O-N 3.25Å; I123-A127 PolarHBondContact O-N 3.32Å; I123-L146 HydrophobicContact CG2-CB 4.42Å; I123-L146 HydrophobicContact CG2-CD2 4.38Å; I123-L149 HydrophobicContact CD1-CG 4.39Å; I123-L149 HydrophobicContact CG2-CD2 4.49Å; I123-M150 HydrophobicContact CB-CB 4.47Å; I123-M150 HydrophobicContact CD1-CB 4.29Å; I123-M150 HydrophobicContact CG2-CB 4.46Å; I123-L280 HydrophobicContact CB-CD1 4.48Å; I123-L280 HydrophobicContact CG1-CD2 4.22Å; I123-L280 HydrophobicContact CG2-CD1 4.17Å |
| 124 | G | 91.6 | Very high | 88.8 | Confident | 29 Ų | 29 | 38.7 Ų | 38.7 | 30% | 0.299 | 22% | 0.219 | S | C | . | . | H | α-helix | trans | -62.1 | -44.9 | 176.7 | 0 | 0 | 0 | 0 | 0 | 112.3 | L121 T126 A127 V128 | L121-G124 PolarHBondContact O-N 3.02Å; L121-G124 VanDerWaalsContact O-N 3.11Å; G124-T126 PolarHBondContact O-N 3.43Å; G124-A127 WeakPolarHBondContact O-CB 3.29Å; G124-A127 PolarHBondContact O-N 2.91Å; G124-V128 WeakPolarHBondContact O-CG2 3.31Å; G124-V128 PolarHBondContact O-N 3.03Å |
| 125 | S | 92.6 | Very high | 88.9 | Confident | 17 Ų | 17 | 48.8 Ų | 48.8 | 12% | 0.119 | 26% | 0.256 | C | S | . | . | H | α-helix | trans | -60.2 | -44.3 | 177 | -179.9 | 0 | 0 | 0 | 0 | 112.4 | L121 A127 V128 L129 C196 L197 | L121-S125 PolarHBondContact O-N 3.42Å; S125-A127 VanDerWaalsContact C-N 3.32Å; S125-A127 PolarHBondContact O-N 3.5Å; S125-V128 PolarHBondContact O-N 3.03Å; S125-L129 WeakPolarHBondContact O-CB 3.36Å; S125-L129 WeakPolarHBondContact O-CG 3.31Å; S125-L129 PolarHBondContact O-N 3.04Å; S125-C196 PolarHBondContact OG-O 3.24Å; S125-L197 WeakPolarHBondContact OG-CA 3.33Å |
| 126 | T | 92.8 | Very high | 88.8 | Confident | 3 Ų | 3 | 50 Ų | 50 | 2% | 0.018 | 26% | 0.262 | C | S | . | . | H | α-helix | trans | -61.7 | -41.3 | 176 | -55.1 | 0 | 0 | 0 | 0 | 111 | K122 I123 G124 L129 Y130 G200 V204 L280 | K122-T126 VanDerWaalsContact O-CB 3.3Å; K122-T126 WeakPolarHBondContact O-CB 3.33Å; K122-T126 PolarHBondContact O-N 3.37Å; K122-T126 PolarHBondContact O-OG1 2.91Å; I123-T126 PolarHBondContact O-N 3.25Å; G124-T126 PolarHBondContact O-N 3.43Å; T126-L129 PolarHBondContact O-N 3.32Å; T126-Y130 WeakPolarHBondContact O-CB 3.37Å; T126-Y130 PolarHBondContact O-N 2.99Å; T126-G200 VanDerWaalsContact OG1-CA 3.3Å; T126-G200 WeakPolarHBondContact OG1-CA 3.42Å; T126-V204 HydrophobicContact CG2-CG2 3.94Å; T126-L280 HydrophobicContact CG2-CD1 3.91Å; T126-L280 HydrophobicContact CG2-CG 4.42Å |
| 127 | A | 92.9 | Very high | 88.9 | Confident | 11 Ų | 11 | 56.2 Ų | 56.2 | 9% | 0.091 | 28% | 0.282 | C | S | . | . | H | α-helix | trans | -63.4 | -45.5 | 178.2 | 0 | 0 | 0 | 0 | 0 | 112.4 | I123 G124 S125 Y130 C131 L138 L146 | I123-A127 PolarHBondContact O-N 3.32Å; G124-A127 WeakPolarHBondContact O-CB 3.29Å; G124-A127 PolarHBondContact O-N 2.91Å; S125-A127 VanDerWaalsContact C-N 3.32Å; S125-A127 PolarHBondContact O-N 3.5Å; A127-Y130 WeakPolarHBondContact O-CB 3.45Å; A127-Y130 PolarHBondContact O-N 2.86Å; A127-C131 PolarHBondContact O-N 3.36Å; A127-C131 PolarHBondContact O-SG 3.47Å; A127-C131 VanDerWaalsContact O-SG 3.35Å; A127-L138 HydrophobicContact CB-CD1 4.18Å; A127-L146 HydrophobicContact CB-CD1 3.69Å |
| 128 | V | 92.9 | Very high | 89 | Confident | 88 Ų | 88 | 55.4 Ų | 55.4 | 53% | 0.533 | 28% | 0.276 | S | S | . | . | H | α-helix | trans | -62.3 | -49.5 | 176.7 | 172.5 | 0 | 0 | 0 | 0 | 110.4 | G124 S125 Y130 C131 L132 | G124-V128 WeakPolarHBondContact O-CG2 3.31Å; G124-V128 PolarHBondContact O-N 3.03Å; S125-V128 PolarHBondContact O-N 3.03Å; V128-Y130 VanDerWaalsContact C-N 3.29Å; V128-Y130 PolarHBondContact O-N 2.87Å; V128-C131 WeakPolarHBondContact O-CB 3.04Å; V128-C131 PolarHBondContact O-N 2.99Å; V128-L132 HydrophobicContact CG1-CD1 3.81Å; V128-L132 HydrophobicContact CG1-CG 4.37Å; V128-L132 VanDerWaalsContact O-CG 3.31Å; V128-L132 WeakPolarHBondContact O-CG 3.34Å; V128-L132 PolarHBondContact O-N 3.36Å |
| 129 | L | 92.9 | Very high | 89.2 | Confident | 27 Ų | 27 | 56 Ų | 56 | 14% | 0.141 | 28% | 0.283 | C | S | . | . | H | α-helix | trans | -64.6 | -34.7 | 178.7 | -71.1 | 170 | 0 | 0 | 0 | 112.1 | S125 T126 L132 C133 L201 V204 | S125-L129 WeakPolarHBondContact O-CB 3.36Å; S125-L129 WeakPolarHBondContact O-CG 3.31Å; S125-L129 PolarHBondContact O-N 3.04Å; T126-L129 PolarHBondContact O-N 3.32Å; L129-L132 PolarHBondContact O-N 2.88Å; L129-C133 VanDerWaalsContact O-CB 3.26Å; L129-C133 WeakPolarHBondContact O-CB 3.46Å; L129-C133 PolarHBondContact O-N 2.69Å; L129-C133 PolarHBondContact O-SG 2.84Å; L129-L201 HydrophobicContact CD1-CB 3.97Å; L129-L201 VanDerWaalsContact CD1-N 3.26Å; L129-V204 HydrophobicContact CB-CB 4.48Å; L129-V204 HydrophobicContact CB-CG2 4.14Å |
| 130 | Y | 91.9 | Very high | 89.3 | Confident | 11 Ų | 11 | 61.6 Ų | 61.6 | 4% | 0.043 | 32% | 0.317 | C | S | . | . | H | α-helix | trans | -60.3 | -47.5 | 173.9 | 179.4 | -95.6 | 0 | 0 | 0 | 111.1 | T126 A127 V128 L132 L134 H136 L138 I277 | T126-Y130 WeakPolarHBondContact O-CB 3.37Å; T126-Y130 PolarHBondContact O-N 2.99Å; A127-Y130 WeakPolarHBondContact O-CB 3.45Å; A127-Y130 PolarHBondContact O-N 2.86Å; V128-Y130 VanDerWaalsContact C-N 3.29Å; V128-Y130 PolarHBondContact O-N 2.87Å; Y130-L132 PolarHBondContact O-N 2.95Å; Y130-L134 HydrophobicContact CD2-CD1 4.04Å; Y130-L134 HydrophobicContact CD2-CD2 4.36Å; Y130-L134 HydrophobicContact CE2-CD1 4.39Å; Y130-L134 HydrophobicContact CE2-CD2 3.88Å; Y130-L134 HydrophobicContact CE2-CG 4.5Å; Y130-L134 WeakPolarHBondContact O-CB 3.28Å; Y130-L134 PolarHBondContact O-N 3.21Å; Y130-H136 HydrophobicContact CD1-CB 4.25Å; Y130-H136 HydrophobicContact CE1-CB 3.59Å; Y130-L138 HydrophobicContact CE1-CD2 4.49Å; Y130-I277 HydrophobicContact CD1-CD1 3.53Å; Y130-I277 HydrophobicContact CD1-CG1 4.32Å; Y130-I277 HydrophobicContact CD2-CD1 4.46Å; Y130-I277 HydrophobicContact CD2-CG1 4.48Å; Y130-I277 HydrophobicContact CE1-CD1 3.61Å; Y130-I277 HydrophobicContact CG-CD1 3.98Å; Y130-I277 HydrophobicContact CG-CG1 4.27Å |
| 131 | C | 90.6 | Very high | 89.4 | Confident | 39 Ų | 39 | 67 Ų | 67 | 26% | 0.264 | 34% | 0.336 | S | S | . | . | H | α-helix | trans | -61.4 | -44 | 174.4 | -66.9 | 0 | 0 | 0 | 0 | 112.3 | A127 V128 R135 H136 L138 | A127-C131 PolarHBondContact O-N 3.36Å; A127-C131 PolarHBondContact O-SG 3.47Å; A127-C131 VanDerWaalsContact O-SG 3.35Å; V128-C131 WeakPolarHBondContact O-CB 3.04Å; V128-C131 PolarHBondContact O-N 2.99Å; C131-R135 WeakPolarHBondContact O-CA 3.44Å; C131-R135 PolarHBondContact O-N 3.36Å; C131-R135 VanDerWaalsContact O-N 3.11Å; C131-H136 WeakPolarHBondContact CA-O 3.34Å; C131-L138 VanDerWaalsContact SG-CD1 3.51Å; C131-L138 VanDerWaalsContact SG-CG 3.55Å |
| 132 | L | 90.3 | Very high | 89.6 | Confident | 120 Ų | 120 | 64.1 Ų | 64.1 | 63% | 0.628 | 32% | 0.32 | S | S | * | . | H | α-helix | trans | -71.1 | -47.4 | -176.5 | -67.3 | 174.4 | 0 | 0 | 0 | 112.7 | V128 L129 Y130 | V128-L132 HydrophobicContact CG1-CD1 3.81Å; V128-L132 HydrophobicContact CG1-CG 4.37Å; V128-L132 VanDerWaalsContact O-CG 3.31Å; V128-L132 WeakPolarHBondContact O-CG 3.34Å; V128-L132 PolarHBondContact O-N 3.36Å; L129-L132 PolarHBondContact O-N 2.88Å; Y130-L132 PolarHBondContact O-N 2.95Å |
| 133 | C | 88.5 | Confident | 89.7 | Confident | 52 Ų | 52 | 65.1 Ų | 65.1 | 35% | 0.351 | 33% | 0.33 | S | S | . | . | H | α-helix | trans | -84.3 | -40.4 | -173 | -63.1 | 0 | 0 | 0 | 0 | 113.2 | L129 V204 | L129-C133 VanDerWaalsContact O-CB 3.26Å; L129-C133 WeakPolarHBondContact O-CB 3.46Å; L129-C133 PolarHBondContact O-N 2.69Å; L129-C133 PolarHBondContact O-SG 2.84Å; C133-V204 HydrophobicContact CB-CG1 3.6Å |
| 134 | L | 86 | Confident | 89.8 | Confident | 33 Ų | 33 | 69.2 Ų | 69.2 | 17% | 0.173 | 35% | 0.351 | C | S | . | . | H | α-helix | trans | -92.1 | -3.9 | 178.3 | -76.2 | 88 | 0 | 0 | 0 | 112.9 | Y130 H136 V204 E207 L208 | Y130-L134 HydrophobicContact CD2-CD1 4.04Å; Y130-L134 HydrophobicContact CD2-CD2 4.36Å; Y130-L134 HydrophobicContact CE2-CD1 4.39Å; Y130-L134 HydrophobicContact CE2-CD2 3.88Å; Y130-L134 HydrophobicContact CE2-CG 4.5Å; Y130-L134 WeakPolarHBondContact O-CB 3.28Å; Y130-L134 PolarHBondContact O-N 3.21Å; L134-H136 PolarHBondContact O-N 2.88Å; L134-V204 HydrophobicContact CD1-CB 4.49Å; L134-V204 HydrophobicContact CD1-CG1 3.34Å; L134-E207 HydrophobicContact CD2-CG 4.1Å; L134-E207 WeakPolarHBondContact CD2-OE1 3.38Å; L134-L208 HydrophobicContact CD1-CB 4.46Å |
| 135 | R | 83.9 | Confident | 90 | Very high | 226 Ų | 226 | 67.8 Ų | 67.8 | 85% | 0.853 | 34% | 0.337 | S | S | * | . | trans | 56.5 | 26.3 | 179.7 | -59.4 | -174.3 | 175.9 | -175.2 | -2 | 114 | C131 | C131-R135 WeakPolarHBondContact O-CA 3.44Å; C131-R135 PolarHBondContact O-N 3.36Å; C131-R135 VanDerWaalsContact O-N 3.11Å | ||
| 136 | H | 81.6 | Confident | 90 | Very high | 54 Ų | 54 | 67.4 Ų | 67.4 | 25% | 0.25 | 33% | 0.334 | C | S | . | . | trans | -80.1 | 150.6 | 170.3 | -91.4 | -82.5 | 0 | 0 | 0 | 110.9 | E4 Y130 C131 L134 | E4-H136 IonicContact OE2-CE1 3.67Å; E4-H136 IonicContact OE2-CG 3.97Å; E4-H136 IonicContact OE2-ND1 2.88Å; E4-H136 PolarHBondContact OE2-ND1 2.85Å; Y130-H136 HydrophobicContact CD1-CB 4.25Å; Y130-H136 HydrophobicContact CE1-CB 3.59Å; C131-H136 WeakPolarHBondContact CA-O 3.34Å; L134-H136 PolarHBondContact O-N 2.88Å | ||
| 137 | R | 83.5 | Confident | 90.1 | Very high | 225 Ų | 225 | 71.6 Ų | 71.6 | 85% | 0.849 | 36% | 0.355 | S | S | * | . | trans | -109.3 | 114.2 | 174.7 | -66.1 | -168.1 | -180 | -149.2 | 1.2 | 108.8 | ||||
| 138 | L | 86.4 | Confident | 90.2 | Very high | 29 Ų | 29 | 73.1 Ų | 73.1 | 15% | 0.152 | 36% | 0.362 | C | S | . | . | trans | -76.3 | 130.8 | 173.8 | -64.6 | 171.8 | 0 | 0 | 0 | 110.1 | A127 Y130 C131 Q142 V143 L146 I277 | A127-L138 HydrophobicContact CB-CD1 4.18Å; Y130-L138 HydrophobicContact CE1-CD2 4.49Å; C131-L138 VanDerWaalsContact SG-CD1 3.51Å; C131-L138 VanDerWaalsContact SG-CG 3.55Å; L138-Q142 HydrophobicContact CB-CB 4.35Å; L138-Q142 HydrophobicContact CD2-CB 4.15Å; L138-V143 HydrophobicContact CB-CG2 3.84Å; L138-L146 HydrophobicContact CD1-CD1 3.81Å; L138-I277 HydrophobicContact CD1-CD1 4.46Å; L138-I277 HydrophobicContact CD2-CD1 3.73Å | ||
| 139 | S | 89.6 | Confident | 90.2 | Very high | 55 Ų | 55 | 68.9 Ų | 68.9 | 39% | 0.385 | 34% | 0.336 | S | S | . | . | trans | -67.7 | 158.9 | 169.8 | 66.3 | 0 | 0 | 0 | 0 | 111.4 | R141 Q142 V143 | S139-R141 PolarHBondContact O-N 3.05Å; S139-Q142 PolarHBondContact O-N 3.38Å; S139-Q142 VanDerWaalsContact OG-CG 3.29Å; S139-Q142 WeakPolarHBondContact OG-CG 3.14Å; S139-Q142 PolarHBondContact OG-N 3.46Å; S139-Q142 PolarHBondContact OG-OE1 3.24Å; S139-V143 WeakPolarHBondContact O-CG2 3.3Å; S139-V143 PolarHBondContact O-N 3.34Å | ||
| 140 | V | 89.1 | Confident | 90.2 | Very high | 126 Ų | 126 | 70.1 Ų | 70.1 | 76% | 0.764 | 34% | 0.342 | S | S | * | . | H | α-helix | trans | -55.5 | -37.8 | 175.8 | -179.4 | 0 | 0 | 0 | 0 | 111.5 | V143 L144 | V140-V143 PolarHBondContact O-N 2.92Å; V140-L144 WeakPolarHBondContact O-CB 3.5Å; V140-L144 PolarHBondContact O-N 3.19Å |
| 141 | R | 90.9 | Very high | 90.2 | Very high | 130 Ų | 130 | 71.5 Ų | 71.5 | 49% | 0.491 | 36% | 0.356 | S | S | . | . | H | α-helix | trans | -62.8 | -46.8 | 175.3 | -65.4 | -175.2 | -176.3 | 175 | 3 | 111.7 | S139 V143 L144 A145 L319 R324 | S139-R141 PolarHBondContact O-N 3.05Å; R141-V143 PolarHBondContact O-N 3.41Å; R141-L144 PolarHBondContact O-N 3.14Å; R141-A145 WeakPolarHBondContact O-CB 3.41Å; R141-A145 PolarHBondContact O-N 2.87Å; R141-L319 HydrophobicContact CB-CD1 4.03Å; R141-L319 HydrophobicContact CB-CG 4.24Å; R141-L319 HydrophobicContact CG-CD1 4.2Å; R141-L319 WeakPolarHBondContact O-CD2 3.38Å; R141-L319 WeakPolarHBondContact O-CG 3.37Å; R141-R324 PolarHBondContact NH1-OXT 3.01Å; R141-R324 PolarHBondContact NH2-OXT 3.31Å; R141-R324 VanDerWaalsContact NH2-OXT 3.14Å |
| 142 | Q | 91.3 | Very high | 90.2 | Very high | 24 Ų | 24 | 69.7 Ų | 69.7 | 11% | 0.112 | 34% | 0.343 | C | S | . | . | H | α-helix | trans | -64.8 | -39.1 | 177.4 | -71.8 | 166.9 | -34.6 | 0 | 0 | 111.8 | E4 L138 S139 A145 L146 Y320 | E4-Q142 PolarHBondContact OE1-NE2 2.87Å; E4-Q142 VanDerWaalsContact OE1-NE2 3.13Å; L138-Q142 HydrophobicContact CB-CB 4.35Å; L138-Q142 HydrophobicContact CD2-CB 4.15Å; S139-Q142 PolarHBondContact O-N 3.38Å; S139-Q142 VanDerWaalsContact OG-CG 3.29Å; S139-Q142 WeakPolarHBondContact OG-CG 3.14Å; S139-Q142 PolarHBondContact OG-N 3.46Å; S139-Q142 PolarHBondContact OG-OE1 3.24Å; Q142-A145 WeakPolarHBondContact O-CB 3.41Å; Q142-A145 PolarHBondContact O-N 3.04Å; Q142-L146 VanDerWaalsContact O-CG 3.27Å; Q142-L146 WeakPolarHBondContact O-CG 3.47Å; Q142-L146 PolarHBondContact O-N 2.96Å; Q142-Y320 HydrophobicContact CB-CD2 3.77Å; Q142-Y320 HydrophobicContact CB-CE2 3.73Å; Q142-Y320 HydrophobicContact CG-CD2 3.66Å; Q142-Y320 HydrophobicContact CG-CE2 3.62Å; Q142-Y320 HydrophobicContact CG-CG 4.38Å |
| 143 | V | 93.4 | Very high | 90 | Very high | 65 Ų | 65 | 64.1 Ų | 64.1 | 39% | 0.394 | 32% | 0.315 | S | S | . | . | H | α-helix | trans | -62.6 | -47.6 | 174.3 | 173.7 | 0 | 0 | 0 | 0 | 110.6 | L138 S139 V140 R141 A145 L146 L147 | L138-V143 HydrophobicContact CB-CG2 3.84Å; S139-V143 WeakPolarHBondContact O-CG2 3.3Å; S139-V143 PolarHBondContact O-N 3.34Å; V140-V143 PolarHBondContact O-N 2.92Å; R141-V143 PolarHBondContact O-N 3.41Å; V143-A145 VanDerWaalsContact C-N 3.28Å; V143-A145 PolarHBondContact O-N 3.25Å; V143-L146 PolarHBondContact O-N 2.65Å; V143-L146 VanDerWaalsContact O-N 3.14Å; V143-L147 HydrophobicContact CG1-CD1 4.35Å; V143-L147 WeakPolarHBondContact O-CG 3.46Å; V143-L147 PolarHBondContact O-N 3.5Å |
| 144 | L | 93.6 | Very high | 89.9 | Confident | 89 Ų | 89 | 63 Ų | 63 | 47% | 0.466 | 31% | 0.309 | S | S | . | . | H | α-helix | trans | -60.7 | -38.8 | 176.7 | -179.4 | 62.7 | 0 | 0 | 0 | 111.5 | V140 R141 L146 L147 L148 L319 | V140-L144 WeakPolarHBondContact O-CB 3.5Å; V140-L144 PolarHBondContact O-N 3.19Å; R141-L144 PolarHBondContact O-N 3.14Å; L144-L146 VanDerWaalsContact C-N 3.33Å; L144-L146 PolarHBondContact O-N 3.14Å; L144-L147 PolarHBondContact O-N 3.35Å; L144-L148 WeakPolarHBondContact O-CG 3.29Å; L144-L148 PolarHBondContact O-N 2.77Å; L144-L319 HydrophobicContact CB-CD2 3.8Å; L144-L319 HydrophobicContact CD2-CD2 3.73Å; L144-L319 HydrophobicContact CG-CD2 3.63Å |
| 145 | A | 94.4 | Very high | 89.9 | Confident | 0 Ų | 0 | 63 Ų | 63 | 0% | 0 | 31% | 0.312 | C | S | . | . | H | α-helix | trans | -61.6 | -40.8 | 175.1 | 0 | 0 | 0 | 0 | 0 | 112.3 | R141 Q142 V143 L148 L149 A316 L319 Y320 | R141-A145 WeakPolarHBondContact O-CB 3.41Å; R141-A145 PolarHBondContact O-N 2.87Å; Q142-A145 WeakPolarHBondContact O-CB 3.41Å; Q142-A145 PolarHBondContact O-N 3.04Å; V143-A145 VanDerWaalsContact C-N 3.28Å; V143-A145 PolarHBondContact O-N 3.25Å; A145-L148 PolarHBondContact O-N 3.26Å; A145-L149 WeakPolarHBondContact O-CB 3.26Å; A145-L149 PolarHBondContact O-N 2.91Å; A145-A316 HydrophobicContact CB-CB 4.49Å; A145-A316 WeakPolarHBondContact CB-O 3.2Å; A145-A316 VanDerWaalsContact O-CB 3.31Å; A145-A316 WeakPolarHBondContact O-CB 3.2Å; A145-L319 HydrophobicContact CB-CB 4.03Å; A145-L319 HydrophobicContact CB-CD2 4.09Å; A145-L319 HydrophobicContact CB-CG 4.16Å; A145-Y320 HydrophobicContact CB-CD2 4.23Å |
| 146 | L | 93.8 | Very high | 89.7 | Confident | 9 Ų | 9 | 53.6 Ų | 53.6 | 5% | 0.047 | 28% | 0.28 | C | S | . | . | H | α-helix | trans | -69.9 | -34.5 | 177 | -65.7 | 169.4 | 0 | 0 | 0 | 112.3 | I123 A127 L138 Q142 V143 L144 L149 M150 I277 F281 | I123-L146 HydrophobicContact CG2-CB 4.42Å; I123-L146 HydrophobicContact CG2-CD2 4.38Å; A127-L146 HydrophobicContact CB-CD1 3.69Å; L138-L146 HydrophobicContact CD1-CD1 3.81Å; Q142-L146 VanDerWaalsContact O-CG 3.27Å; Q142-L146 WeakPolarHBondContact O-CG 3.47Å; Q142-L146 PolarHBondContact O-N 2.96Å; V143-L146 PolarHBondContact O-N 2.65Å; V143-L146 VanDerWaalsContact O-N 3.14Å; L144-L146 VanDerWaalsContact C-N 3.33Å; L144-L146 PolarHBondContact O-N 3.14Å; L146-L149 WeakPolarHBondContact O-CB 3.35Å; L146-L149 PolarHBondContact O-N 3.07Å; L146-M150 PolarHBondContact O-N 3.39Å; L146-I277 HydrophobicContact CD2-CG2 3.84Å; L146-F281 HydrophobicContact CD2-CE2 4.42Å |
| 147 | L | 94.4 | Very high | 89.6 | Confident | 91 Ų | 91 | 51.1 Ų | 51.1 | 48% | 0.476 | 27% | 0.269 | S | S | . | . | H | α-helix | trans | -65.1 | -43.3 | 171.8 | -68.6 | 175.6 | 0 | 0 | 0 | 111.5 | V143 L144 L149 M150 A151 | V143-L147 HydrophobicContact CG1-CD1 4.35Å; V143-L147 WeakPolarHBondContact O-CG 3.46Å; V143-L147 PolarHBondContact O-N 3.5Å; L144-L147 PolarHBondContact O-N 3.35Å; L147-L149 VanDerWaalsContact C-N 3.29Å; L147-L149 PolarHBondContact O-N 3.5Å; L147-M150 HydrophobicContact CD2-CE 4.05Å; L147-M150 PolarHBondContact O-N 3.43Å; L147-A151 PolarHBondContact O-N 3.26Å |
| 148 | L | 94.3 | Very high | 89.1 | Confident | 42 Ų | 42 | 42.7 Ų | 42.7 | 22% | 0.22 | 25% | 0.247 | C | C | . | . | H | α-helix | trans | -61 | -39.7 | 173.1 | -70.5 | 171.4 | 0 | 0 | 0 | 111.5 | L144 A145 M150 A151 A152 L312 L315 A316 L319 | L144-L148 WeakPolarHBondContact O-CG 3.29Å; L144-L148 PolarHBondContact O-N 2.77Å; A145-L148 PolarHBondContact O-N 3.26Å; L148-M150 VanDerWaalsContact C-N 3.35Å; L148-A151 PolarHBondContact O-N 3.33Å; L148-A152 WeakPolarHBondContact O-CB 3.49Å; L148-A152 PolarHBondContact O-N 2.92Å; L148-L312 HydrophobicContact CD2-CD2 3.82Å; L148-L315 HydrophobicContact CD1-CB 4.38Å; L148-A316 HydrophobicContact CB-CB 3.98Å; L148-L319 HydrophobicContact CD1-CD2 4.07Å |
| 149 | L | 93.7 | Very high | 88 | Confident | 0 Ų | 0 | 41.6 Ų | 41.6 | 0% | 0 | 24% | 0.244 | C | C | . | . | H | α-helix | trans | -64 | -40.4 | 176.8 | -159.5 | 68.3 | 0 | 0 | 0 | 112 | I123 A145 L146 L147 A152 G153 L280 F281 S284 I313 A316 | I123-L149 HydrophobicContact CD1-CG 4.39Å; I123-L149 HydrophobicContact CG2-CD2 4.49Å; A145-L149 WeakPolarHBondContact O-CB 3.26Å; A145-L149 PolarHBondContact O-N 2.91Å; L146-L149 WeakPolarHBondContact O-CB 3.35Å; L146-L149 PolarHBondContact O-N 3.07Å; L147-L149 VanDerWaalsContact C-N 3.29Å; L147-L149 PolarHBondContact O-N 3.5Å; L149-A152 PolarHBondContact O-N 3.44Å; L149-G153 PolarHBondContact O-N 3.37Å; L149-G153 VanDerWaalsContact O-N 3.13Å; L149-L280 HydrophobicContact CD2-CB 4.14Å; L149-F281 HydrophobicContact CD1-CD1 3.9Å; L149-F281 HydrophobicContact CD1-CE1 3.93Å; L149-F281 HydrophobicContact CD2-CD1 4.11Å; L149-F281 HydrophobicContact CD2-CE1 4.16Å; L149-F281 HydrophobicContact CD2-CG 4.31Å; L149-F281 HydrophobicContact CD2-CZ 4.41Å; L149-S284 WeakPolarHBondContact CD1-OG 3.26Å; L149-S284 VanDerWaalsContact CG-OG 3.26Å; L149-S284 WeakPolarHBondContact CG-OG 3.35Å; L149-I313 HydrophobicContact CD1-CG1 4.33Å; L149-A316 HydrophobicContact CB-CB 4.39Å; L149-A316 HydrophobicContact CD1-CB 4.23Å |
| 150 | M | 93 | Very high | 86.4 | Confident | 53 Ų | 53 | 41.5 Ų | 41.5 | 26% | 0.261 | 25% | 0.251 | S | S | . | . | H | α-helix | trans | -66 | -43.6 | 175 | -172.1 | 175.6 | 70.4 | 0 | 0 | 111.8 | N120 I123 L146 L147 L148 A152 G153 A154 | N120-M150 HydrophobicContact CB-CG 4.01Å; I123-M150 HydrophobicContact CB-CB 4.47Å; I123-M150 HydrophobicContact CD1-CB 4.29Å; I123-M150 HydrophobicContact CG2-CB 4.46Å; L146-M150 PolarHBondContact O-N 3.39Å; L147-M150 HydrophobicContact CD2-CE 4.05Å; L147-M150 PolarHBondContact O-N 3.43Å; L148-M150 VanDerWaalsContact C-N 3.35Å; M150-A152 VanDerWaalsContact C-N 3.34Å; M150-A152 PolarHBondContact O-N 3.34Å; M150-G153 PolarHBondContact O-N 3.33Å; M150-A154 PolarHBondContact O-N 3.28Å |
| 151 | A | 92.1 | Very high | 84.2 | Confident | 40 Ų | 40 | 40.3 Ų | 40.3 | 33% | 0.331 | 24% | 0.24 | S | C | . | . | H | α-helix | trans | -61.4 | -42.2 | 174.6 | 0 | 0 | 0 | 0 | 0 | 111.6 | L147 L148 G153 A154 C155 L312 | L147-A151 PolarHBondContact O-N 3.26Å; L148-A151 PolarHBondContact O-N 3.33Å; A151-G153 PolarHBondContact O-N 2.83Å; A151-A154 PolarHBondContact O-N 2.9Å; A151-C155 PolarHBondContact O-N 2.89Å; A151-C155 PolarHBondContact O-SG 3.5Å; A151-L312 HydrophobicContact CB-CD1 4.27Å |
| 152 | A | 90.8 | Very high | 81.3 | Confident | 0 Ų | 0 | 40.6 Ų | 40.6 | 0% | 0 | 25% | 0.247 | C | C | . | . | H | α-helix | trans | -61 | -44.5 | 177.3 | 0 | 0 | 0 | 0 | 0 | 112.6 | L148 L149 M150 A154 C155 C156 A309 L312 I313 | L148-A152 WeakPolarHBondContact O-CB 3.49Å; L148-A152 PolarHBondContact O-N 2.92Å; L149-A152 PolarHBondContact O-N 3.44Å; M150-A152 VanDerWaalsContact C-N 3.34Å; M150-A152 PolarHBondContact O-N 3.34Å; A152-A154 VanDerWaalsContact C-N 3.31Å; A152-A154 PolarHBondContact O-N 3.38Å; A152-C155 PolarHBondContact O-N 2.86Å; A152-C156 PolarHBondContact O-N 3.4Å; A152-A309 HydrophobicContact CB-CB 4.38Å; A152-A309 WeakPolarHBondContact O-CB 3.26Å; A152-L312 HydrophobicContact CB-CB 3.68Å; A152-L312 HydrophobicContact CB-CD1 4.3Å; A152-I313 HydrophobicContact CB-CD1 4.28Å; A152-I313 HydrophobicContact CB-CG1 3.66Å |
| 153 | G | 85.6 | Confident | 78.5 | Confident | 4 Ų | 4 | 45 Ų | 45 | 4% | 0.041 | 28% | 0.275 | C | S | . | . | H | α-helix | trans | -60.9 | -40.8 | 175 | 0 | 0 | 0 | 0 | 0 | 112.3 | N120 L149 M150 A151 C156 A157 | N120-G153 PolarHBondContact ND2-O 3.26Å; L149-G153 PolarHBondContact O-N 3.37Å; L149-G153 VanDerWaalsContact O-N 3.13Å; M150-G153 PolarHBondContact O-N 3.33Å; A151-G153 PolarHBondContact O-N 2.83Å; G153-C156 PolarHBondContact O-N 2.89Å; G153-A157 WeakPolarHBondContact O-CB 3.4Å; G153-A157 PolarHBondContact O-N 3.44Å |
| 154 | A | 87.1 | Confident | 75.4 | Confident | 28 Ų | 28 | 46.5 Ų | 46.5 | 23% | 0.231 | 29% | 0.286 | C | S | . | . | H | α-helix | trans | -67 | -40.8 | 176.4 | 0 | 0 | 0 | 0 | 0 | 112.1 | V117 N120 M150 A151 A152 A157 A158 | V117-A154 HydrophobicContact CG1-CB 4.24Å; N120-A154 WeakPolarHBondContact ND2-CA 3.49Å; N120-A154 PolarHBondContact ND2-N 2.91Å; N120-A154 VanDerWaalsContact ND2-N 3.17Å; M150-A154 PolarHBondContact O-N 3.28Å; A151-A154 PolarHBondContact O-N 2.9Å; A152-A154 VanDerWaalsContact C-N 3.31Å; A152-A154 PolarHBondContact O-N 3.38Å; A154-A157 PolarHBondContact O-N 3.21Å; A154-A158 WeakPolarHBondContact O-CB 3.44Å; A154-A158 PolarHBondContact O-N 3.21Å |
| 155 | C | 85.6 | Confident | 72.6 | Confident | 33 Ų | 33 | 45.3 Ų | 45.3 | 22% | 0.223 | 30% | 0.295 | C | S | . | . | H | α-helix | trans | -62 | -45.5 | 174.2 | -70.5 | 0 | 0 | 0 | 0 | 111.8 | A151 A152 A157 A158 G159 A309 | A151-C155 PolarHBondContact O-N 2.89Å; A151-C155 PolarHBondContact O-SG 3.5Å; A152-C155 PolarHBondContact O-N 2.86Å; C155-A157 VanDerWaalsContact C-N 3.32Å; C155-A157 PolarHBondContact O-N 3.33Å; C155-A158 PolarHBondContact O-N 2.88Å; C155-G159 PolarHBondContact O-N 2.93Å; C155-A309 HydrophobicContact CB-CB 4.13Å |
| 156 | C | 79.8 | Confident | 69.4 | Low | 28 Ų | 28 | 52.5 Ų | 52.5 | 19% | 0.189 | 33% | 0.333 | C | S | . | . | H | α-helix | trans | -59.4 | -43.7 | 174.4 | -87.2 | 0 | 0 | 0 | 0 | 111.9 | A152 G153 G159 G160 L287 A309 | A152-C156 PolarHBondContact O-N 3.4Å; G153-C156 PolarHBondContact O-N 2.89Å; C156-G159 PolarHBondContact O-N 2.88Å; C156-G160 PolarHBondContact O-N 3.04Å; C156-L287 HydrophobicContact CB-CD1 4.44Å; C156-A309 HydrophobicContact CB-CB 4.37Å; C156-A309 WeakPolarHBondContact SG-CB 3.45Å |
| 157 | A | 78.5 | Confident | 66.4 | Low | 2 Ų | 2 | 58.3 Ų | 58.3 | 2% | 0.017 | 37% | 0.37 | C | S | . | . | H | α-helix | trans | -64.3 | -45.1 | 178.2 | 0 | 0 | 0 | 0 | 0 | 111.8 | Q116 V117 G153 A154 C155 G159 G160 | Q116-A157 HydrophobicContact CB-CB 3.94Å; Q116-A157 HydrophobicContact CG-CB 3.63Å; V117-A157 HydrophobicContact CB-CB 4.39Å; V117-A157 HydrophobicContact CG2-CB 3.65Å; G153-A157 WeakPolarHBondContact O-CB 3.4Å; G153-A157 PolarHBondContact O-N 3.44Å; A154-A157 PolarHBondContact O-N 3.21Å; C155-A157 VanDerWaalsContact C-N 3.32Å; C155-A157 PolarHBondContact O-N 3.33Å; A157-G159 PolarHBondContact O-N 3.27Å; A157-G160 PolarHBondContact O-N 3.43Å |
| 158 | A | 74.1 | Confident | 63.1 | Low | 48 Ų | 48 | 60.2 Ų | 60.2 | 40% | 0.397 | 39% | 0.385 | S | S | . | . | H | α-helix | trans | -65.9 | -35.9 | 177.6 | 0 | 0 | 0 | 0 | 0 | 112.8 | A154 C155 G160 L161 | A154-A158 WeakPolarHBondContact O-CB 3.44Å; A154-A158 PolarHBondContact O-N 3.21Å; C155-A158 PolarHBondContact O-N 2.88Å; A158-G160 PolarHBondContact O-N 3.19Å; A158-L161 WeakPolarHBondContact O-CB 3.28Å; A158-L161 PolarHBondContact O-N 3.48Å; A158-L161 VanDerWaalsContact O-N 3.11Å |
| 159 | G | 63.1 | Low | 59.9 | Low | 7 Ų | 7 | 64.2 Ų | 64.2 | 7% | 0.072 | 41% | 0.413 | C | S | . | . | H | α-helix | trans | -65.7 | -24.4 | 176.6 | 0 | 0 | 0 | 0 | 0 | 114.1 | C155 C156 A157 | C155-G159 PolarHBondContact O-N 2.93Å; C156-G159 PolarHBondContact O-N 2.88Å; A157-G159 PolarHBondContact O-N 3.27Å |
| 160 | G | 56.6 | Low | 56.5 | Low | 52 Ų | 52 | 69.3 Ų | 69.3 | 54% | 0.536 | 45% | 0.449 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -77.6 | -15.1 | 172.4 | 0 | 0 | 0 | 0 | 0 | 114.3 | C156 A157 A158 Q162 | C156-G160 PolarHBondContact O-N 3.04Å; A157-G160 PolarHBondContact O-N 3.43Å; A158-G160 PolarHBondContact O-N 3.19Å; G160-Q162 PolarHBondContact O-N 3.01Å |
| 161 | L | 41.6 | Very low | 53.4 | Low | 102 Ų | 102 | 72.9 Ų | 72.9 | 53% | 0.534 | 48% | 0.476 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -71.1 | -14.2 | 172.8 | -84.7 | 109.8 | 0 | 0 | 0 | 112.9 | A158 V163 | A158-L161 WeakPolarHBondContact O-CB 3.28Å; A158-L161 PolarHBondContact O-N 3.48Å; A158-L161 VanDerWaalsContact O-N 3.11Å; L161-V163 PolarHBondContact O-N 3.41Å |
| 162 | Q | 30.5 | Very low | 50.1 | Low | 136 Ų | 136 | 76.6 Ų | 76.6 | 64% | 0.636 | 50% | 0.5 | S | S | * | . | trans | -99.8 | 79.9 | 174.5 | -66.6 | -178.9 | -18.1 | 0 | 0 | 108.7 | G160 P164 | G160-Q162 PolarHBondContact O-N 3.01Å; Q162-P164 VanDerWaalsContact O-CD 3.26Å; Q162-P164 WeakPolarHBondContact O-CD 3.29Å | ||
| 163 | V | 33.3 | Very low | 47.4 | Very low | 116 Ų | 116 | 82.3 Ų | 82.3 | 70% | 0.703 | 54% | 0.537 | S | S | * | . | trans | -89.7 | 99.6 | 149.5 | 177.8 | 0 | 0 | 0 | 0 | 105.2 | L161 G165 | L161-V163 PolarHBondContact O-N 3.41Å; V163-G165 PolarHBondContact O-N 3.09Å | ||
| 164 | P | 28.6 | Very low | 44.5 | Very low | 97 Ų | 97 | 87.1 Ų | 87.1 | 63% | 0.63 | 58% | 0.576 | S | S | * | * | trans | -62.7 | 129.8 | 163 | -6.8 | 24.3 | 0 | 0 | 0 | 106.1 | Q162 N166 | Q162-P164 VanDerWaalsContact O-CD 3.26Å; Q162-P164 WeakPolarHBondContact O-CD 3.29Å; P164-N166 PolarHBondContact O-N 3.43Å | ||
| 165 | G | 33.2 | Very low | 41.6 | Very low | 63 Ų | 63 | 90.5 Ų | 90.5 | 65% | 0.649 | 60% | 0.604 | S | S | * | * | trans | -47.2 | 133.1 | -173.6 | 0 | 0 | 0 | 0 | 0 | 113.1 | V163 | V163-G165 PolarHBondContact O-N 3.09Š| ||
| 166 | N | 27.5 | Very low | 38.9 | Very low | 151 Ų | 151 | 93.5 Ų | 93.5 | 81% | 0.807 | 63% | 0.631 | S | S | * | * | trans | -169.2 | 131 | 131.6 | -92.2 | -14.1 | 0 | 0 | 0 | 111.5 | P164 | P164-N166 PolarHBondContact O-N 3.43Š| ||
| 167 | T | 30.3 | Very low | 36.8 | Very low | 132 Ų | 132 | 97.1 Ų | 97.1 | 81% | 0.81 | 66% | 0.663 | S | S | * | * | trans | 70.3 | 71 | 157.1 | 64.5 | 0 | 0 | 0 | 0 | 119.5 | ||||
| 168 | V | 26.3 | Very low | 34.4 | Very low | 131 Ų | 131 | 101.6 Ų | 101.6 | 79% | 0.794 | 69% | 0.694 | S | S | * | * | -131.1 | 124.9 | 128.1 | -179 | 0 | 0 | 0 | 0 | 106.5 | S170 | V168-S170 PolarHBondContact O-N 3.28Š| |||
| 169 | P | 26.3 | Very low | 32.5 | Very low | 125 Ų | 125 | 105 Ų | 105 | 81% | 0.812 | 71% | 0.713 | S | S | * | * | trans | -70.2 | 100.2 | 179.2 | 27.6 | -31 | 0 | 0 | 0 | 109.5 | ||||
| 170 | S | 22.7 | Very low | 31.2 | Very low | 107 Ų | 107 | 113.6 Ų | 113.6 | 75% | 0.748 | 75% | 0.753 | S | S | * | * | trans | -69.4 | 134.4 | 155.3 | -72.2 | 0 | 0 | 0 | 0 | 108.4 | V168 S172 | V168-S170 PolarHBondContact O-N 3.28Å; S170-S172 PolarHBondContact O-N 3.18Å; S170-S172 VanDerWaalsContact O-N 3.12Å | ||
| 171 | P | 27.2 | Very low | 30.5 | Very low | 129 Ų | 129 | 115.7 Ų | 115.7 | 84% | 0.838 | 76% | 0.757 | S | S | * | * | S | Bend | trans | -68.5 | 113.4 | 175 | 26.8 | -30.7 | 0 | 0 | 0 | 110.3 | ||
| 172 | S | 23.1 | Very low | 30.8 | Very low | 118 Ų | 118 | 116.9 Ų | 116.9 | 83% | 0.825 | 76% | 0.763 | S | S | * | * | trans | 50.2 | 149.1 | 156.4 | -96.3 | 0 | 0 | 0 | 0 | 123.3 | S170 | S170-S172 PolarHBondContact O-N 3.18Å; S170-S172 VanDerWaalsContact O-N 3.12Å | ||
| 173 | P | 34.6 | Very low | 31.9 | Very low | 120 Ų | 120 | 116.6 Ų | 116.6 | 78% | 0.779 | 76% | 0.762 | S | S | * | * | trans | -108.6 | 117.4 | -161.6 | 34.4 | -17.7 | 0 | 0 | 0 | 111.9 | ||||
| 174 | A | 25.3 | Very low | 33.2 | Very low | 104 Ų | 104 | 114 Ų | 114 | 86% | 0.86 | 74% | 0.743 | S | S | * | * | trans | -161.6 | 70.1 | 166.1 | 0 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 175 | A | 26.2 | Very low | 35.5 | Very low | 100 Ų | 100 | 111.1 Ų | 111.1 | 83% | 0.826 | 72% | 0.724 | S | S | * | * | S | Bend | trans | -170.8 | 119.6 | 147.5 | 0 | 0 | 0 | 0 | 0 | 108.4 | ||
| 176 | A | 27.7 | Very low | 37.9 | Very low | 96 Ų | 96 | 113.5 Ų | 113.5 | 79% | 0.793 | 73% | 0.728 | S | S | * | * | trans | -57.8 | 141.5 | -178.5 | 0 | 0 | 0 | 0 | 0 | 112.7 | S178 | A176-S178 PolarHBondContact O-N 3.05Š| ||
| 177 | A | 36.7 | Very low | 40.7 | Very low | 104 Ų | 104 | 110.1 Ų | 110.1 | 86% | 0.86 | 71% | 0.709 | S | S | * | * | trans | 15.6 | 94.1 | 146.6 | 0 | 0 | 0 | 0 | 0 | 116.6 | ||||
| 178 | S | 26.9 | Very low | 43.3 | Very low | 96 Ų | 96 | 103.9 Ų | 103.9 | 67% | 0.671 | 67% | 0.671 | S | S | * | * | trans | -114.7 | 128 | 143.9 | 49.3 | 0 | 0 | 0 | 0 | 107.2 | A176 M180 | A176-S178 PolarHBondContact O-N 3.05Å; S178-M180 PolarHBondContact O-N 2.69Å; S178-M180 VanDerWaalsContact O-N 3.1Å | ||
| 179 | P | 34.6 | Very low | 46.2 | Very low | 120 Ų | 120 | 101.1 Ų | 101.1 | 78% | 0.779 | 65% | 0.652 | S | S | * | * | trans | -60.5 | 117.8 | 168.1 | 25.4 | -29.3 | 0 | 0 | 0 | 105.8 | P181 | P179-P181 WeakPolarHBondContact O-CD 3.31Š| ||
| 180 | M | 36.9 | Very low | 49.3 | Very low | 186 Ų | 186 | 100.5 Ų | 100.5 | 92% | 0.916 | 64% | 0.641 | S | S | * | * | trans | -53 | 107.3 | 176.5 | -96.5 | -177.3 | -100.9 | 0 | 0 | 107.6 | S178 L182 | S178-M180 PolarHBondContact O-N 2.69Å; S178-M180 VanDerWaalsContact O-N 3.1Å; M180-L182 PolarHBondContact O-N 2.84Å | ||
| 181 | P | 42.1 | Very low | 52.5 | Low | 97 Ų | 97 | 96.6 Ų | 96.6 | 63% | 0.63 | 61% | 0.611 | S | S | * | * | trans | -67.4 | 133.6 | -179.2 | 27.5 | -29.7 | 0 | 0 | 0 | 106.7 | P179 H183 | P179-P181 WeakPolarHBondContact O-CD 3.31Å; P181-H183 PolarHBondContact O-N 3.39Å | ||
| 182 | L | 46.8 | Very low | 55.6 | Low | 126 Ų | 126 | 90.5 Ų | 90.5 | 66% | 0.66 | 57% | 0.572 | S | S | * | * | trans | -47.6 | 100.2 | 173 | -162.5 | 103.1 | 0 | 0 | 0 | 108.5 | M180 I184 | M180-L182 PolarHBondContact O-N 2.84Å; L182-I184 HydrophobicContact CD2-CD1 3.29Å; L182-I184 HydrophobicContact CD2-CG1 3.68Å; L182-I184 HydrophobicContact CG-CD1 4.16Å; L182-I184 HydrophobicContact CG-CG1 4.1Å; L182-I184 PolarHBondContact O-N 3.43Å | ||
| 183 | H | 53.5 | Low | 58.9 | Low | 130 Ų | 130 | 88.9 Ų | 88.9 | 60% | 0.602 | 55% | 0.553 | S | S | * | * | trans | -84.5 | 66.8 | -170 | -139.5 | 120.1 | 0 | 0 | 0 | 109.1 | P181 T185 | P181-H183 PolarHBondContact O-N 3.39Å; H183-T185 PolarHBondContact O-N 3.34Å | ||
| 184 | I | 61.5 | Low | 61.8 | Low | 62 Ų | 62 | 87.1 Ų | 87.1 | 32% | 0.318 | 54% | 0.537 | S | S | . | . | trans | -87.1 | 100.3 | 171.8 | -60.9 | -176.4 | 0 | 0 | 0 | 107.6 | M110 T114 L118 L182 L189 | M110-I184 HydrophobicContact CE-CG1 4.41Å; M110-I184 HydrophobicContact CE-CG2 4.36Å; T114-I184 HydrophobicContact CG2-CD1 3.82Å; T114-I184 HydrophobicContact CG2-CG1 3.85Å; L118-I184 HydrophobicContact CD1-CD1 4.21Å; L182-I184 HydrophobicContact CD2-CD1 3.29Å; L182-I184 HydrophobicContact CD2-CG1 3.68Å; L182-I184 HydrophobicContact CG-CD1 4.16Å; L182-I184 HydrophobicContact CG-CG1 4.1Å; L182-I184 PolarHBondContact O-N 3.43Å; I184-L189 HydrophobicContact CG2-CB 4.2Å | ||
| 185 | T | 75.9 | Confident | 65 | Low | 36 Ų | 36 | 82.7 Ų | 82.7 | 22% | 0.221 | 50% | 0.498 | C | S | . | . | trans | -71.5 | 139.6 | 164.2 | 59.7 | 0 | 0 | 0 | 0 | 109 | Y109 H183 L187 G188 L189 | Y109-T185 PolarHBondContact O-OG1 3.34Å; Y109-T185 VanDerWaalsContact O-OG1 3.08Å; H183-T185 PolarHBondContact O-N 3.34Å; T185-L187 PolarHBondContact O-N 2.56Å; T185-G188 WeakPolarHBondContact O-CA 3.43Å; T185-G188 PolarHBondContact O-N 2.86Å; T185-G188 PolarHBondContact OG1-N 3.08Å; T185-L189 PolarHBondContact O-N 3.23Å | ||
| 186 | P | 83.4 | Confident | 68.2 | Low | 113 Ų | 113 | 78.2 Ų | 78.2 | 73% | 0.734 | 46% | 0.46 | S | S | * | . | H | α-helix | trans | -58.8 | -32.3 | 176.6 | 21.5 | -32 | 0 | 0 | 0 | 111.9 | L189 L190 | P186-L189 PolarHBondContact O-N 3.05Å; P186-L190 PolarHBondContact O-N 3.06Å |
| 187 | L | 86.2 | Confident | 71.4 | Confident | 81 Ų | 81 | 77.8 Ų | 77.8 | 42% | 0.424 | 44% | 0.444 | S | S | . | . | H | α-helix | trans | -63.7 | -43.1 | 170.9 | -175.5 | 67.5 | 0 | 0 | 0 | 111.9 | Y109 T185 L189 L190 L191 | Y109-L187 HydrophobicContact CD1-CD2 4.14Å; Y109-L187 HydrophobicContact CE1-CD2 3.61Å; T185-L187 PolarHBondContact O-N 2.56Å; L187-L189 VanDerWaalsContact C-N 3.33Å; L187-L189 PolarHBondContact O-N 3.18Å; L187-L190 PolarHBondContact O-N 3.38Å; L187-L191 HydrophobicContact CG-CD1 4.05Å; L187-L191 HydrophobicContact CG-CG 4.48Å; L187-L191 WeakPolarHBondContact O-CB 3.34Å; L187-L191 VanDerWaalsContact O-CG 3.26Å; L187-L191 WeakPolarHBondContact O-CG 3.42Å; L187-L191 PolarHBondContact O-N 3.32Å |
| 188 | G | 85.6 | Confident | 74.2 | Confident | 0 Ų | 0 | 74.1 Ų | 74.1 | 0% | 0 | 41% | 0.41 | C | S | . | . | H | α-helix | trans | -59.3 | -41.5 | 173.7 | 0 | 0 | 0 | 0 | 0 | 112.5 | L106 T185 L191 L192 | L106-G188 WeakPolarHBondContact CD1-O 3.48Å; T185-G188 WeakPolarHBondContact O-CA 3.43Å; T185-G188 PolarHBondContact O-N 2.86Å; T185-G188 PolarHBondContact OG1-N 3.08Å; G188-L191 PolarHBondContact O-N 3.35Å; G188-L192 WeakPolarHBondContact O-CB 3.35Å; G188-L192 PolarHBondContact O-N 3.46Å |
| 189 | L | 87.5 | Confident | 77.3 | Confident | 74 Ų | 74 | 70.5 Ų | 70.5 | 39% | 0.387 | 38% | 0.384 | S | S | . | . | H | α-helix | trans | -63.9 | -43.9 | 175.2 | -174.9 | 65.7 | 0 | 0 | 0 | 112.1 | I184 T185 P186 L187 L192 I193 | I184-L189 HydrophobicContact CG2-CB 4.2Å; T185-L189 PolarHBondContact O-N 3.23Å; P186-L189 PolarHBondContact O-N 3.05Å; L187-L189 VanDerWaalsContact C-N 3.33Å; L187-L189 PolarHBondContact O-N 3.18Å; L189-L192 HydrophobicContact CD1-CD2 4.43Å; L189-L192 WeakPolarHBondContact O-CB 3.46Å; L189-L192 PolarHBondContact O-N 3.19Å; L189-I193 HydrophobicContact CG-CD1 4.43Å; L189-I193 WeakPolarHBondContact O-CG1 3.23Å; L189-I193 PolarHBondContact O-N 3.34Å |
| 190 | L | 91.4 | Very high | 80.1 | Confident | 112 Ų | 112 | 64.8 Ų | 64.8 | 59% | 0.586 | 35% | 0.347 | S | S | * | . | H | α-helix | trans | -60.4 | -46.7 | 176.2 | -179.8 | 67.4 | 0 | 0 | 0 | 111.6 | P186 L187 L192 I193 L194 | P186-L190 PolarHBondContact O-N 3.06Å; L187-L190 PolarHBondContact O-N 3.38Å; L190-L192 VanDerWaalsContact C-N 3.28Å; L190-L192 PolarHBondContact O-N 2.87Å; L190-I193 PolarHBondContact O-N 2.88Å; L190-L194 PolarHBondContact O-N 3.02Å |
| 191 | L | 90.4 | Very high | 82.9 | Confident | 25 Ų | 25 | 59 Ų | 59 | 13% | 0.131 | 32% | 0.32 | C | S | . | . | H | α-helix | trans | -64.4 | -33.5 | 177.8 | -69.7 | 168.9 | 0 | 0 | 0 | 111.9 | L102 Y105 L106 Y109 L187 G188 L194 Y195 | L102-L191 HydrophobicContact CD1-CD2 4.08Å; Y105-L191 HydrophobicContact CD1-CD1 3.92Å; Y105-L191 HydrophobicContact CE1-CD1 3.73Å; L106-L191 HydrophobicContact CD1-CB 3.35Å; L106-L191 HydrophobicContact CD1-CD1 4.4Å; Y109-L191 HydrophobicContact CD2-CD1 3.99Å; Y109-L191 HydrophobicContact CE2-CD1 4.22Å; Y109-L191 HydrophobicContact CG-CD1 4.49Å; L187-L191 HydrophobicContact CG-CD1 4.05Å; L187-L191 HydrophobicContact CG-CG 4.48Å; L187-L191 WeakPolarHBondContact O-CB 3.34Å; L187-L191 VanDerWaalsContact O-CG 3.26Å; L187-L191 WeakPolarHBondContact O-CG 3.42Å; L187-L191 PolarHBondContact O-N 3.32Å; G188-L191 PolarHBondContact O-N 3.35Å; L191-L194 PolarHBondContact O-N 2.96Å; L191-Y195 VanDerWaalsContact O-CB 3.3Å; L191-Y195 WeakPolarHBondContact O-CB 3.35Å; L191-Y195 PolarHBondContact O-N 3.5Å |
| 192 | L | 91.6 | Very high | 85.4 | Confident | 1 Ų | 1 | 54.4 Ų | 54.4 | 1% | 0.005 | 29% | 0.29 | C | S | . | . | H | α-helix | trans | -67.5 | -43.4 | 174 | -180 | 85.1 | 0 | 0 | 0 | 111.8 | L106 Y115 L118 G188 L189 L190 L194 Y195 C196 | L106-L192 HydrophobicContact CD1-CB 4.36Å; L106-L192 HydrophobicContact CD2-CB 4Å; L106-L192 HydrophobicContact CD2-CD1 3.59Å; L106-L192 HydrophobicContact CD2-CG 4.4Å; Y115-L192 HydrophobicContact CD2-CD1 3.88Å; Y115-L192 HydrophobicContact CE2-CD1 4.11Å; L118-L192 HydrophobicContact CB-CD1 4.36Å; L118-L192 HydrophobicContact CB-CD2 3.27Å; L118-L192 HydrophobicContact CB-CG 4.43Å; L118-L192 HydrophobicContact CD1-CD2 3.88Å; L118-L192 HydrophobicContact CG-CD2 4.2Å; G188-L192 WeakPolarHBondContact O-CB 3.35Å; G188-L192 PolarHBondContact O-N 3.46Å; L189-L192 HydrophobicContact CD1-CD2 4.43Å; L189-L192 WeakPolarHBondContact O-CB 3.46Å; L189-L192 PolarHBondContact O-N 3.19Å; L190-L192 VanDerWaalsContact C-N 3.28Å; L190-L192 PolarHBondContact O-N 2.87Å; L192-L194 VanDerWaalsContact C-N 3.3Å; L192-L194 PolarHBondContact O-N 3.27Å; L192-Y195 HydrophobicContact CD1-CD1 4.39Å; L192-Y195 WeakPolarHBondContact O-CB 3.17Å; L192-Y195 PolarHBondContact O-N 3.42Å; L192-C196 PolarHBondContact O-N 3.39Å; L192-C196 PolarHBondContact O-SG 3.05Å |
| 193 | I | 92.8 | Very high | 87.6 | Confident | 84 Ų | 84 | 48.6 Ų | 48.6 | 43% | 0.431 | 26% | 0.26 | S | S | . | . | H | α-helix | trans | -60.1 | -46.7 | 175.6 | -68.4 | 167 | 0 | 0 | 0 | 109.3 | L189 L190 Y195 C196 L197 | L189-I193 HydrophobicContact CG-CD1 4.43Å; L189-I193 WeakPolarHBondContact O-CG1 3.23Å; L189-I193 PolarHBondContact O-N 3.34Å; L190-I193 PolarHBondContact O-N 2.88Å; I193-Y195 VanDerWaalsContact C-N 3.31Å; I193-Y195 PolarHBondContact O-N 3.33Å; I193-C196 PolarHBondContact O-N 3Å; I193-L197 HydrophobicContact CG2-CD1 4.06Å; I193-L197 WeakPolarHBondContact O-CG 3.24Å; I193-L197 PolarHBondContact O-N 2.95Å |
| 194 | L | 94.1 | Very high | 89.6 | Confident | 83 Ų | 83 | 42.4 Ų | 42.4 | 44% | 0.435 | 23% | 0.232 | S | C | . | . | H | α-helix | trans | -58.4 | -43.9 | 174.5 | -178.8 | 62.3 | 0 | 0 | 0 | 111.6 | L102 L190 L191 L192 C196 L197 I198 | L102-L194 HydrophobicContact CD2-CB 4.49Å; L102-L194 HydrophobicContact CD2-CD2 4.37Å; L102-L194 HydrophobicContact CD2-CG 4.17Å; L190-L194 PolarHBondContact O-N 3.02Å; L191-L194 PolarHBondContact O-N 2.96Å; L192-L194 VanDerWaalsContact C-N 3.3Å; L192-L194 PolarHBondContact O-N 3.27Å; L194-C196 PolarHBondContact O-N 3.22Å; L194-L197 PolarHBondContact O-N 3.49Å; L194-I198 HydrophobicContact CD1-CD1 3.89Å; L194-I198 HydrophobicContact CD1-CG1 4.14Å; L194-I198 HydrophobicContact CD2-CD1 4.44Å; L194-I198 HydrophobicContact CG-CD1 3.79Å; L194-I198 HydrophobicContact CG-CG1 4.4Å; L194-I198 WeakPolarHBondContact O-CB 3.39Å; L194-I198 VanDerWaalsContact O-CG1 3.3Å; L194-I198 WeakPolarHBondContact O-CG1 3.26Å; L194-I198 PolarHBondContact O-N 3.48Å |
| 195 | Y | 94 | Very high | 91.2 | Very high | 10 Ų | 10 | 42.6 Ų | 42.6 | 4% | 0.039 | 23% | 0.229 | C | C | . | . | H | α-helix | trans | -57.9 | -46.9 | 175.3 | 165.5 | -97.6 | 0 | 0 | 0 | 112.2 | N99 L102 V103 Y115 L191 L192 I193 L197 I198 S199 | N99-Y195 VanDerWaalsContact CG-CE2 3.46Å; N99-Y195 VanDerWaalsContact ND2-CD2 3.26Å; N99-Y195 WeakPolarHBondContact ND2-CD2 3.37Å; N99-Y195 WeakPolarHBondContact ND2-CE2 3.46Å; N99-Y195 PolarHBondContact ND2-O 3.02Å; N99-Y195 VanDerWaalsContact ND2-O 3.15Å; N99-Y195 VanDerWaalsContact OD1-CE2 3.3Å; N99-Y195 WeakPolarHBondContact OD1-CE2 3.44Å; L102-Y195 HydrophobicContact CB-CD2 4.45Å; L102-Y195 VanDerWaalsContact CD2-CA 3.5Å; V103-Y195 HydrophobicContact CG2-CD2 3.8Å; V103-Y195 HydrophobicContact CG2-CE2 3.13Å; Y115-Y195 HydrophobicContact CE2-CD1 4.29Å; Y115-Y195 HydrophobicContact CE2-CE1 4.11Å; Y115-Y195 VanDerWaalsContact OH-CZ 3.25Å; Y115-Y195 PolarHBondContact OH-OH 3.47Å; L191-Y195 VanDerWaalsContact O-CB 3.3Å; L191-Y195 WeakPolarHBondContact O-CB 3.35Å; L191-Y195 PolarHBondContact O-N 3.5Å; L192-Y195 HydrophobicContact CD1-CD1 4.39Å; L192-Y195 WeakPolarHBondContact O-CB 3.17Å; L192-Y195 PolarHBondContact O-N 3.42Å; I193-Y195 VanDerWaalsContact C-N 3.31Å; I193-Y195 PolarHBondContact O-N 3.33Å; Y195-L197 VanDerWaalsContact C-N 3.35Å; Y195-L197 PolarHBondContact O-N 2.84Å; Y195-I198 PolarHBondContact O-N 3.11Å; Y195-S199 VanDerWaalsContact O-CB 3.27Å; Y195-S199 WeakPolarHBondContact O-CB 3.17Å; Y195-S199 PolarHBondContact O-N 3.31Å |
| 196 | C | 93.4 | Very high | 92 | Very high | 7 Ų | 7 | 40.9 Ų | 40.9 | 5% | 0.047 | 22% | 0.218 | C | C | . | . | H | α-helix | trans | -63.4 | -42.3 | 179.2 | -66.6 | 0 | 0 | 0 | 0 | 111.3 | K122 S125 L192 I193 L194 S199 G200 | K122-C196 HydrophobicContact CB-CB 4.4Å; S125-C196 PolarHBondContact OG-O 3.24Å; L192-C196 PolarHBondContact O-N 3.39Å; L192-C196 PolarHBondContact O-SG 3.05Å; I193-C196 PolarHBondContact O-N 3Å; L194-C196 PolarHBondContact O-N 3.22Å; C196-S199 PolarHBondContact O-N 3.03Å; C196-G200 PolarHBondContact O-N 3.12Å |
| 197 | L | 94.9 | Very high | 92.6 | Very high | 86 Ų | 86 | 35.5 Ų | 35.5 | 45% | 0.45 | 18% | 0.183 | S | C | . | . | H | α-helix | trans | -63.3 | -48.1 | 176.4 | -70.4 | 170.8 | 0 | 0 | 0 | 112.1 | S125 I193 L194 Y195 S199 G200 L201 | S125-L197 WeakPolarHBondContact OG-CA 3.33Å; I193-L197 HydrophobicContact CG2-CD1 4.06Å; I193-L197 WeakPolarHBondContact O-CG 3.24Å; I193-L197 PolarHBondContact O-N 2.95Å; L194-L197 PolarHBondContact O-N 3.49Å; Y195-L197 VanDerWaalsContact C-N 3.35Å; Y195-L197 PolarHBondContact O-N 2.84Å; L197-S199 VanDerWaalsContact C-N 3.31Å; L197-S199 PolarHBondContact O-N 3.25Å; L197-G200 PolarHBondContact O-N 3.31Å; L197-L201 WeakPolarHBondContact O-CB 3.16Å; L197-L201 PolarHBondContact O-N 2.69Å |
| 198 | I | 94.5 | Very high | 93 | Very high | 28 Ų | 28 | 33.5 Ų | 33.5 | 14% | 0.144 | 17% | 0.173 | C | C | . | . | H | α-helix | trans | -63 | -40.6 | 176.9 | -66.9 | 171.9 | 0 | 0 | 0 | 110.2 | L95 A98 N99 L102 L194 Y195 L201 S202 | L95-I198 HydrophobicContact CD2-CG2 4.23Å; L95-I198 WeakPolarHBondContact O-CG2 3.44Å; A98-I198 HydrophobicContact CB-CG2 4.41Å; N99-I198 HydrophobicContact CB-CG2 4.02Å; L102-I198 HydrophobicContact CD2-CD1 4.09Å; L194-I198 HydrophobicContact CD1-CD1 3.89Å; L194-I198 HydrophobicContact CD1-CG1 4.14Å; L194-I198 HydrophobicContact CD2-CD1 4.44Å; L194-I198 HydrophobicContact CG-CD1 3.79Å; L194-I198 HydrophobicContact CG-CG1 4.4Å; L194-I198 WeakPolarHBondContact O-CB 3.39Å; L194-I198 VanDerWaalsContact O-CG1 3.3Å; L194-I198 WeakPolarHBondContact O-CG1 3.26Å; L194-I198 PolarHBondContact O-N 3.48Å; Y195-I198 PolarHBondContact O-N 3.11Å; I198-L201 PolarHBondContact O-N 2.99Å; I198-S202 VanDerWaalsContact O-CB 3.26Å; I198-S202 WeakPolarHBondContact O-CB 3.31Å; I198-S202 PolarHBondContact O-N 3.29Å; I198-S202 PolarHBondContact O-OG 3.44Å |
| 199 | S | 93.1 | Very high | 93.3 | Very high | 19 Ų | 19 | 34.3 Ų | 34.3 | 13% | 0.133 | 18% | 0.177 | C | C | . | . | H | α-helix | trans | -60.1 | -51.7 | 178 | -162.1 | 0 | 0 | 0 | 0 | 111 | N99 Y195 C196 L197 S202 S203 | N99-S199 VanDerWaalsContact ND2-CA 3.31Å; N99-S199 WeakPolarHBondContact ND2-CA 3.27Å; N99-S199 VanDerWaalsContact ND2-CB 3.27Å; N99-S199 WeakPolarHBondContact ND2-CB 3.49Å; N99-S199 PolarHBondContact ND2-N 3.41Å; Y195-S199 VanDerWaalsContact O-CB 3.27Å; Y195-S199 WeakPolarHBondContact O-CB 3.17Å; Y195-S199 PolarHBondContact O-N 3.31Å; C196-S199 PolarHBondContact O-N 3.03Å; L197-S199 VanDerWaalsContact C-N 3.31Å; L197-S199 PolarHBondContact O-N 3.25Å; S199-S202 PolarHBondContact O-N 2.6Å; S199-S202 PolarHBondContact O-OG 3.32Å; S199-S203 PolarHBondContact O-N 2.95Å |
| 200 | G | 93.3 | Very high | 93.5 | Very high | 0 Ų | 0 | 30.8 Ų | 30.8 | 0% | 0 | 16% | 0.158 | C | C | . | . | H | α-helix | trans | -63.2 | -44.4 | 177.7 | 0 | 0 | 0 | 0 | 0 | 112.4 | T126 C196 L197 S202 S203 V204 | T126-G200 VanDerWaalsContact OG1-CA 3.3Å; T126-G200 WeakPolarHBondContact OG1-CA 3.42Å; C196-G200 PolarHBondContact O-N 3.12Å; L197-G200 PolarHBondContact O-N 3.31Å; G200-S202 PolarHBondContact O-N 2.72Å; G200-S203 PolarHBondContact O-N 3.41Å; G200-V204 WeakPolarHBondContact O-CB 3.05Å; G200-V204 VanDerWaalsContact O-CG2 3.25Å; G200-V204 WeakPolarHBondContact O-CG2 3.43Å; G200-V204 PolarHBondContact O-N 2.97Å |
| 201 | L | 95.3 | Very high | 93.6 | Very high | 64 Ų | 64 | 29.5 Ų | 29.5 | 34% | 0.335 | 15% | 0.148 | S | C | . | . | H | α-helix | trans | -63 | -43.7 | -179.7 | -174.1 | 63.6 | 0 | 0 | 0 | 111.1 | L95 L129 L197 I198 S203 V204 Y205 | L95-L201 HydrophobicContact CD1-CD2 4.21Å; L95-L201 HydrophobicContact CD1-CG 4.04Å; L95-L201 HydrophobicContact CD2-CD2 4.15Å; L129-L201 HydrophobicContact CD1-CB 3.97Å; L129-L201 VanDerWaalsContact CD1-N 3.26Å; L197-L201 WeakPolarHBondContact O-CB 3.16Å; L197-L201 PolarHBondContact O-N 2.69Å; I198-L201 PolarHBondContact O-N 2.99Å; L201-S203 VanDerWaalsContact C-N 3.34Å; L201-S203 PolarHBondContact O-N 3.23Å; L201-V204 PolarHBondContact O-N 3.45Å; L201-Y205 WeakPolarHBondContact O-CB 3.26Å; L201-Y205 PolarHBondContact O-N 3.27Å |
| 202 | S | 93.8 | Very high | 93.6 | Very high | 1 Ų | 1 | 37.6 Ų | 37.6 | 1% | 0.007 | 18% | 0.177 | C | C | . | . | H | α-helix | trans | -57.5 | -45.7 | 177.6 | 74.3 | 0 | 0 | 0 | 0 | 111.8 | Y96 I198 S199 G200 T206 | Y96-S202 WeakPolarHBondContact CE1-OG 3.44Å; I198-S202 VanDerWaalsContact O-CB 3.26Å; I198-S202 WeakPolarHBondContact O-CB 3.31Å; I198-S202 PolarHBondContact O-N 3.29Å; I198-S202 PolarHBondContact O-OG 3.44Å; S199-S202 PolarHBondContact O-N 2.6Å; S199-S202 PolarHBondContact O-OG 3.32Å; G200-S202 PolarHBondContact O-N 2.72Å; S202-T206 VanDerWaalsContact O-CB 3.28Å; S202-T206 WeakPolarHBondContact O-CB 3.26Å; S202-T206 PolarHBondContact O-N 2.67Å; S202-T206 VanDerWaalsContact O-N 3.12Å; S202-T206 PolarHBondContact O-OG1 3.29Å |
| 203 | S | 93 | Very high | 93.4 | Very high | 5 Ų | 5 | 38.7 Ų | 38.7 | 4% | 0.035 | 18% | 0.182 | C | C | . | . | H | α-helix | trans | -67.4 | -52.6 | -179.6 | -169 | 0 | 0 | 0 | 0 | 111.4 | S199 G200 L201 Y205 T206 E207 S276 R279 | S199-S203 PolarHBondContact O-N 2.95Å; G200-S203 PolarHBondContact O-N 3.41Å; L201-S203 VanDerWaalsContact C-N 3.34Å; L201-S203 PolarHBondContact O-N 3.23Å; S203-Y205 PolarHBondContact O-N 2.93Å; S203-T206 PolarHBondContact O-N 2.86Å; S203-E207 WeakPolarHBondContact O-CB 3.43Å; S203-E207 PolarHBondContact O-N 2.87Å; S203-S276 PolarHBondContact O-OG 2.98Å; S203-S276 WeakPolarHBondContact OG-CB 3.35Å; S203-S276 PolarHBondContact OG-OG 3.34Å; S203-R279 VanDerWaalsContact CB-NH1 3.34Å; S203-R279 PolarHBondContact OG-NH1 3.31Å |
| 204 | V | 95.2 | Very high | 93 | Very high | 0 Ų | 0 | 46.7 Ų | 46.7 | 0% | 0 | 21% | 0.207 | C | C | . | . | H | α-helix | trans | -66.5 | -40.5 | -174.6 | 174.1 | 0 | 0 | 0 | 0 | 111.3 | T126 L129 C133 L134 G200 L201 E207 L208 | T126-V204 HydrophobicContact CG2-CG2 3.94Å; L129-V204 HydrophobicContact CB-CB 4.48Å; L129-V204 HydrophobicContact CB-CG2 4.14Å; C133-V204 HydrophobicContact CB-CG1 3.6Å; L134-V204 HydrophobicContact CD1-CB 4.49Å; L134-V204 HydrophobicContact CD1-CG1 3.34Å; G200-V204 WeakPolarHBondContact O-CB 3.05Å; G200-V204 VanDerWaalsContact O-CG2 3.25Å; G200-V204 WeakPolarHBondContact O-CG2 3.43Å; G200-V204 PolarHBondContact O-N 2.97Å; L201-V204 PolarHBondContact O-N 3.45Å; V204-E207 PolarHBondContact O-N 3.37Å; V204-L208 WeakPolarHBondContact O-CB 3.34Å; V204-L208 PolarHBondContact O-N 2.88Å |
| 205 | Y | 95.1 | Very high | 92.6 | Very high | 65 Ų | 65 | 43.6 Ų | 43.6 | 26% | 0.255 | 19% | 0.191 | S | C | . | . | H | α-helix | trans | -64.9 | -42.8 | 175.6 | -178.8 | -98.8 | 0 | 0 | 0 | 111.7 | P88 V91 L201 S203 L208 L209 | P88-Y205 WeakPolarHBondContact O-CE1 3.4Å; V91-Y205 HydrophobicContact CB-CE1 4.03Å; V91-Y205 HydrophobicContact CG1-CE1 4.11Å; L201-Y205 WeakPolarHBondContact O-CB 3.26Å; L201-Y205 PolarHBondContact O-N 3.27Å; S203-Y205 PolarHBondContact O-N 2.93Å; Y205-L208 PolarHBondContact O-N 3.33Å; Y205-L209 HydrophobicContact CE1-CD2 4.32Å; Y205-L209 VanDerWaalsContact O-CB 3.31Å; Y205-L209 WeakPolarHBondContact O-CB 3.33Å; Y205-L209 PolarHBondContact O-N 3.11Å |
| 206 | T | 94.3 | Very high | 92.4 | Very high | 0 Ų | 0 | 44.8 Ų | 44.8 | 0% | 0 | 20% | 0.2 | C | C | . | . | H | α-helix | trans | -64 | -44.5 | 177.3 | -55 | 0 | 0 | 0 | 0 | 111.3 | S92 Y96 S202 S203 L208 L209 M210 L224 M271 | S92-T206 PolarHBondContact OG-OG1 3.39Å; Y96-T206 HydrophobicContact CE2-CG2 4.28Å; Y96-T206 VanDerWaalsContact CE2-OG1 3.27Å; Y96-T206 WeakPolarHBondContact CE2-OG1 3.33Å; S202-T206 VanDerWaalsContact O-CB 3.28Å; S202-T206 WeakPolarHBondContact O-CB 3.26Å; S202-T206 PolarHBondContact O-N 2.67Å; S202-T206 VanDerWaalsContact O-N 3.12Å; S202-T206 PolarHBondContact O-OG1 3.29Å; S203-T206 PolarHBondContact O-N 2.86Å; T206-L208 PolarHBondContact O-N 3.21Å; T206-L209 PolarHBondContact O-N 3.45Å; T206-M210 HydrophobicContact CG2-CE 4.18Å; T206-M210 HydrophobicContact CG2-CG 4.29Å; T206-M210 HydrophobicContact CG2-SD 4.03Å; T206-M210 VanDerWaalsContact O-CB 3.3Å; T206-M210 WeakPolarHBondContact O-CB 3.25Å; T206-M210 VanDerWaalsContact O-CG 3.25Å; T206-M210 WeakPolarHBondContact O-CG 3.41Å; T206-M210 PolarHBondContact O-N 3.38Å; T206-L224 HydrophobicContact CG2-CD2 4.34Å; T206-M271 HydrophobicContact CG2-CE 3.95Å; T206-M271 HydrophobicContact CG2-SD 4.36Å |
| 207 | E | 95.1 | Very high | 92.2 | Very high | 0 Ų | 0 | 45.6 Ų | 45.6 | 0% | 0 | 20% | 0.203 | C | C | . | . | H | α-helix | trans | -56.7 | -50.2 | 173.2 | 173.5 | -178.8 | -177.3 | 0 | 0 | 111.4 | L134 S203 V204 L209 M210 K211 M271 S275 S276 | L134-E207 HydrophobicContact CD2-CG 4.1Å; L134-E207 WeakPolarHBondContact CD2-OE1 3.38Å; S203-E207 WeakPolarHBondContact O-CB 3.43Å; S203-E207 PolarHBondContact O-N 2.87Å; V204-E207 PolarHBondContact O-N 3.37Å; E207-L209 VanDerWaalsContact C-N 3.33Å; E207-L209 PolarHBondContact O-N 3.02Å; E207-M210 PolarHBondContact O-N 3.33Å; E207-K211 HydrophobicContact CG-CD 3.88Å; E207-K211 WeakPolarHBondContact O-CB 3.09Å; E207-K211 WeakPolarHBondContact O-CG 3.16Å; E207-K211 PolarHBondContact O-N 3.49Å; E207-K211 IonicContact OE1-NZ 2.69Å; E207-K211 PolarHBondContact OE1-NZ 3.15Å; E207-M271 HydrophobicContact CB-CB 4.46Å; E207-S275 WeakPolarHBondContact OE1-CA 3.32Å; E207-S276 WeakPolarHBondContact OE2-CA 3.45Å; E207-S276 WeakPolarHBondContact OE2-CB 3.48Å; E207-S276 PolarHBondContact OE2-N 3.22Å; E207-S276 PolarHBondContact OE2-OG 3.23Å |
| 208 | L | 94.2 | Very high | 92 | Very high | 39 Ų | 39 | 41.8 Ų | 41.8 | 20% | 0.204 | 18% | 0.184 | C | C | . | . | H | α-helix | trans | -59.3 | -45.3 | 179.9 | 177.2 | 65.3 | 0 | 0 | 0 | 111.3 | L134 V204 Y205 T206 K211 R212 | L134-L208 HydrophobicContact CD1-CB 4.46Å; V204-L208 WeakPolarHBondContact O-CB 3.34Å; V204-L208 PolarHBondContact O-N 2.88Å; Y205-L208 PolarHBondContact O-N 3.33Å; T206-L208 PolarHBondContact O-N 3.21Å; L208-K211 PolarHBondContact O-N 3.39Å; L208-R212 HydrophobicContact CD1-CG 4.12Å; L208-R212 VanDerWaalsContact O-CB 3.31Å; L208-R212 WeakPolarHBondContact O-CB 3.36Å; L208-R212 WeakPolarHBondContact O-CG 3.3Å; L208-R212 PolarHBondContact O-N 3.36Å |
| 209 | L | 93.2 | Very high | 91.8 | Very high | 17 Ų | 17 | 40.5 Ų | 40.5 | 9% | 0.089 | 18% | 0.177 | C | C | . | . | H | α-helix | trans | -63.7 | -48.1 | 179.5 | -177.9 | 60.5 | 0 | 0 | 0 | 111.4 | P88 F89 Y205 T206 E207 K211 R212 Q213 | P88-L209 HydrophobicContact CB-CD1 3.57Å; P88-L209 HydrophobicContact CB-CD2 3.76Å; P88-L209 HydrophobicContact CB-CG 4.33Å; P88-L209 HydrophobicContact CG-CD1 4.27Å; F89-L209 HydrophobicContact CB-CD2 4.38Å; F89-L209 HydrophobicContact CD1-CD2 3.49Å; F89-L209 VanDerWaalsContact CD1-CD2 3.49Å; F89-L209 HydrophobicContact CD1-CG 4.36Å; F89-L209 HydrophobicContact CD2-CD2 3.88Å; F89-L209 HydrophobicContact CE1-CD2 3.57Å; F89-L209 HydrophobicContact CE1-CG 3.93Å; F89-L209 HydrophobicContact CE2-CD2 3.97Å; F89-L209 HydrophobicContact CE2-CG 4.17Å; F89-L209 HydrophobicContact CG-CD2 3.65Å; F89-L209 HydrophobicContact CZ-CD2 3.8Å; F89-L209 HydrophobicContact CZ-CG 3.82Å; Y205-L209 HydrophobicContact CE1-CD2 4.32Å; Y205-L209 VanDerWaalsContact O-CB 3.31Å; Y205-L209 WeakPolarHBondContact O-CB 3.33Å; Y205-L209 PolarHBondContact O-N 3.11Å; T206-L209 PolarHBondContact O-N 3.45Å; E207-L209 VanDerWaalsContact C-N 3.33Å; E207-L209 PolarHBondContact O-N 3.02Å; L209-K211 VanDerWaalsContact C-N 3.33Å; L209-K211 PolarHBondContact O-N 2.81Å; L209-R212 PolarHBondContact O-N 2.99Å; L209-Q213 HydrophobicContact CD1-CG 4.29Å; L209-Q213 VanDerWaalsContact CD1-NE2 3.33Å; L209-Q213 PolarHBondContact O-N 3.49Å |
| 210 | M | 91.8 | Very high | 91.8 | Very high | 0 Ų | 0 | 39.6 Ų | 39.6 | 0% | 0 | 17% | 0.171 | C | C | . | . | H | α-helix | trans | -60.4 | -44.2 | 179.1 | -76.6 | -175.3 | 158.1 | 0 | 0 | 111.2 | F89 T206 E207 L217 Q220 N221 L224 M271 K272 | F89-M210 HydrophobicContact CE1-CG 4.45Å; T206-M210 HydrophobicContact CG2-CE 4.18Å; T206-M210 HydrophobicContact CG2-CG 4.29Å; T206-M210 HydrophobicContact CG2-SD 4.03Å; T206-M210 VanDerWaalsContact O-CB 3.3Å; T206-M210 WeakPolarHBondContact O-CB 3.25Å; T206-M210 VanDerWaalsContact O-CG 3.25Å; T206-M210 WeakPolarHBondContact O-CG 3.41Å; T206-M210 PolarHBondContact O-N 3.38Å; E207-M210 PolarHBondContact O-N 3.33Å; M210-L217 HydrophobicContact CE-CD1 4Å; M210-L217 HydrophobicContact SD-CD1 4.23Å; M210-Q220 PolarHBondContact O-NE2 3.2Å; M210-Q220 PolarHBondContact O-OE1 3.36Å; M210-N221 WeakPolarHBondContact CE-OD1 3.35Å; M210-L224 HydrophobicContact CE-CD2 4.49Å; M210-M271 HydrophobicContact SD-CB 4.35Å; M210-K272 HydrophobicContact CB-CD 3.89Å; M210-K272 WeakPolarHBondContact O-CD 3.02Å; M210-K272 WeakPolarHBondContact O-CE 3.19Å; M210-K272 PolarHBondContact O-NZ 3.2Å; M210-K272 HydrophobicContact SD-CB 4.43Å |
| 211 | K | 92.3 | Very high | 91.8 | Very high | 85 Ų | 85 | 39.8 Ų | 39.8 | 37% | 0.37 | 17% | 0.172 | S | C | . | . | H | α-helix | trans | -72.6 | -32.8 | -179.7 | -72.2 | 179.6 | 175.8 | 179.9 | 0 | 113.6 | E207 L208 L209 M271 G274 | E207-K211 HydrophobicContact CG-CD 3.88Å; E207-K211 WeakPolarHBondContact O-CB 3.09Å; E207-K211 WeakPolarHBondContact O-CG 3.16Å; E207-K211 PolarHBondContact O-N 3.49Å; E207-K211 IonicContact OE1-NZ 2.69Å; E207-K211 PolarHBondContact OE1-NZ 3.15Å; L208-K211 PolarHBondContact O-N 3.39Å; L209-K211 VanDerWaalsContact C-N 3.33Å; L209-K211 PolarHBondContact O-N 2.81Å; K211-M271 WeakPolarHBondContact CE-O 3.26Å; K211-G274 WeakPolarHBondContact CE-O 3.38Å; K211-G274 PolarHBondContact NZ-O 3.47Å |
| 212 | R | 90.3 | Very high | 91.7 | Very high | 196 Ų | 196 | 38.1 Ų | 38.1 | 74% | 0.74 | 16% | 0.164 | S | C | * | . | H | α-helix | trans | -72.5 | -35.4 | 179.1 | -83.1 | -170.3 | 165.7 | -171.6 | -1.3 | 113.5 | L208 L209 | L208-R212 HydrophobicContact CD1-CG 4.12Å; L208-R212 VanDerWaalsContact O-CB 3.31Å; L208-R212 WeakPolarHBondContact O-CB 3.36Å; L208-R212 WeakPolarHBondContact O-CG 3.3Å; L208-R212 PolarHBondContact O-N 3.36Å; L209-R212 PolarHBondContact O-N 2.99Å |
| 213 | Q | 87.3 | Confident | 91.7 | Very high | 23 Ų | 23 | 39.1 Ų | 39.1 | 11% | 0.107 | 17% | 0.168 | C | C | . | . | trans | -85.6 | 129.5 | -178.3 | -64.7 | -171.7 | 5.4 | 0 | 0 | 111.7 | Q85 F89 L209 L215 Q220 K272 | Q85-Q213 PolarHBondContact O-NE2 2.93Å; F89-Q213 VanDerWaalsContact CE2-OE1 3.29Å; L209-Q213 HydrophobicContact CD1-CG 4.29Å; L209-Q213 VanDerWaalsContact CD1-NE2 3.33Å; L209-Q213 PolarHBondContact O-N 3.49Å; Q213-L215 HydrophobicContact CB-CG 4.45Å; Q213-L215 PolarHBondContact O-N 2.91Å; Q213-Q220 PolarHBondContact O-NE2 3.46Å; Q213-K272 PolarHBondContact O-NZ 2.87Å; Q213-K272 VanDerWaalsContact O-NZ 3.14Å | ||
| 214 | R | 84.1 | Confident | 91.7 | Very high | 252 Ų | 252 | 39.3 Ų | 39.3 | 95% | 0.951 | 17% | 0.168 | S | C | * | . | trans | -82.9 | 41.4 | 173.2 | -61.5 | -174.2 | -177 | -179.9 | 1.2 | 112.2 | ||||
| 215 | L | 86.8 | Confident | 91.7 | Very high | 19 Ų | 19 | 39.7 Ų | 39.7 | 10% | 0.099 | 17% | 0.17 | C | C | . | . | S | Bend | trans | -98.6 | 152.6 | 174.8 | -64.9 | -177.7 | 0 | 0 | 0 | 110.9 | P77 Q85 Q213 L219 Q220 F223 | P77-L215 HydrophobicContact CG-CD2 3.97Å; Q85-L215 HydrophobicContact CB-CD1 4.33Å; Q85-L215 VanDerWaalsContact OE1-CD1 3.28Å; Q213-L215 HydrophobicContact CB-CG 4.45Å; Q213-L215 PolarHBondContact O-N 2.91Å; L215-L219 HydrophobicContact CD1-CD2 4.25Å; L215-L219 HydrophobicContact CD2-CD2 4.23Å; L215-Q220 HydrophobicContact CB-CG 3.83Å; L215-Q220 PolarHBondContact O-NE2 2.83Å; L215-Q220 VanDerWaalsContact O-NE2 3.15Å; L215-F223 HydrophobicContact CD1-CE2 3.92Å |
| 216 | P | 88.8 | Confident | 91.6 | Very high | 35 Ų | 35 | 39.1 Ų | 39.1 | 23% | 0.227 | 17% | 0.173 | C | C | . | . | trans | -55.5 | 143.5 | 168.2 | -19.1 | 29 | 0 | 0 | 0 | 111.2 | Q74 A75 A218 L219 Q220 | Q74-P216 HydrophobicContact CB-CB 4.18Å; A75-P216 VanDerWaalsContact O-CG 3.28Å; A75-P216 WeakPolarHBondContact O-CG 3.26Å; P216-A218 VanDerWaalsContact C-N 3.3Å; P216-A218 PolarHBondContact O-N 3.46Å; P216-L219 HydrophobicContact CB-CB 4.48Å; P216-L219 PolarHBondContact O-N 3.47Å; P216-L219 VanDerWaalsContact O-N 3.13Å; P216-Q220 PolarHBondContact O-N 3.27Å; P216-Q220 VanDerWaalsContact O-N 3.14Å | ||
| 217 | L | 90.3 | Very high | 91.6 | Very high | 24 Ų | 24 | 42 Ų | 42 | 13% | 0.126 | 19% | 0.186 | C | C | . | . | H | α-helix | trans | -61.4 | -38.7 | -176.6 | 179.9 | 61.7 | 0 | 0 | 0 | 112.1 | M210 L219 Q220 N221 A269 K272 | M210-L217 HydrophobicContact CE-CD1 4Å; M210-L217 HydrophobicContact SD-CD1 4.23Å; L217-L219 VanDerWaalsContact C-N 3.26Å; L217-L219 PolarHBondContact O-N 3.49Å; L217-Q220 PolarHBondContact O-N 3.32Å; L217-N221 VanDerWaalsContact O-CB 3.31Å; L217-N221 WeakPolarHBondContact O-CB 3.28Å; L217-N221 PolarHBondContact O-N 2.91Å; L217-A269 HydrophobicContact CD2-CB 3.79Å; L217-K272 HydrophobicContact CD1-CB 3.84Å; L217-K272 HydrophobicContact CD1-CD 4.38Å; L217-K272 HydrophobicContact CD1-CG 4.04Å; L217-K272 HydrophobicContact CD2-CB 4.48Å |
| 218 | A | 90.3 | Very high | 91.5 | Very high | 5 Ų | 5 | 42.3 Ų | 42.3 | 4% | 0.041 | 19% | 0.189 | C | C | . | . | H | α-helix | trans | -62.1 | -35.2 | 178.3 | 0 | 0 | 0 | 0 | 0 | 111.7 | L69 Q74 P216 L222 | L69-A218 HydrophobicContact CD1-CB 4.35Å; L69-A218 HydrophobicContact CD2-CB 3.92Å; L69-A218 HydrophobicContact CG-CB 3.88Å; Q74-A218 HydrophobicContact CG-CB 4.47Å; P216-A218 VanDerWaalsContact C-N 3.3Å; P216-A218 PolarHBondContact O-N 3.46Å; A218-L222 VanDerWaalsContact O-CB 3.29Å; A218-L222 WeakPolarHBondContact O-CB 3.4Å; A218-L222 PolarHBondContact O-N 3.37Å |
| 219 | L | 90.2 | Very high | 91.5 | Very high | 1 Ų | 1 | 41.5 Ų | 41.5 | 1% | 0.005 | 19% | 0.186 | C | C | . | . | H | α-helix | trans | -72.7 | -40.7 | 176.6 | -174.2 | 59.3 | 0 | 0 | 0 | 112.3 | L69 W76 P77 L215 P216 L217 N221 L222 F223 | L69-L219 HydrophobicContact CD1-CD1 4.37Å; W76-L219 HydrophobicContact CE3-CD1 4.23Å; W76-L219 HydrophobicContact CH2-CD1 3.7Å; W76-L219 HydrophobicContact CZ2-CD1 4.45Å; W76-L219 HydrophobicContact CZ3-CD1 3.57Å; P77-L219 HydrophobicContact CG-CD2 3.59Å; L215-L219 HydrophobicContact CD1-CD2 4.25Å; L215-L219 HydrophobicContact CD2-CD2 4.23Å; P216-L219 HydrophobicContact CB-CB 4.48Å; P216-L219 PolarHBondContact O-N 3.47Å; P216-L219 VanDerWaalsContact O-N 3.13Å; L217-L219 VanDerWaalsContact C-N 3.26Å; L217-L219 PolarHBondContact O-N 3.49Å; L219-N221 VanDerWaalsContact C-N 3.32Å; L219-N221 PolarHBondContact O-N 3.25Å; L219-L222 HydrophobicContact CD1-CD2 4.01Å; L219-L222 WeakPolarHBondContact O-CB 3.38Å; L219-L222 PolarHBondContact O-N 2.98Å; L219-F223 HydrophobicContact CD1-CE1 3.97Å; L219-F223 HydrophobicContact CD1-CE2 4.27Å; L219-F223 HydrophobicContact CD1-CZ 3.73Å; L219-F223 HydrophobicContact CD2-CE2 4.47Å; L219-F223 HydrophobicContact CD2-CZ 4.34Å; L219-F223 HydrophobicContact CG-CE2 3.93Å; L219-F223 HydrophobicContact CG-CZ 3.87Å; L219-F223 WeakPolarHBondContact O-CD2 3.39Å; L219-F223 WeakPolarHBondContact O-CG 3.47Å; L219-F223 PolarHBondContact O-N 3.44Å; L219-F223 VanDerWaalsContact O-N 3.08Å |
| 220 | Q | 92.6 | Very high | 91.5 | Very high | 0 Ų | 0 | 45.7 Ų | 45.7 | 0% | 0 | 21% | 0.207 | C | C | . | . | H | α-helix | trans | -61.1 | -44.7 | 173.9 | -65 | -176.4 | 3.2 | 0 | 0 | 111.2 | F89 M210 Q213 L215 P216 L217 F223 L224 | F89-Q220 HydrophobicContact CE1-CB 3.9Å; F89-Q220 HydrophobicContact CE2-CB 4.45Å; F89-Q220 HydrophobicContact CZ-CB 3.57Å; F89-Q220 HydrophobicContact CZ-CG 3.77Å; M210-Q220 PolarHBondContact O-NE2 3.2Å; M210-Q220 PolarHBondContact O-OE1 3.36Å; Q213-Q220 PolarHBondContact O-NE2 3.46Å; L215-Q220 HydrophobicContact CB-CG 3.83Å; L215-Q220 PolarHBondContact O-NE2 2.83Å; L215-Q220 VanDerWaalsContact O-NE2 3.15Å; P216-Q220 PolarHBondContact O-N 3.27Å; P216-Q220 VanDerWaalsContact O-N 3.14Å; L217-Q220 PolarHBondContact O-N 3.32Å; Q220-F223 PolarHBondContact O-N 2.88Å; Q220-L224 PolarHBondContact O-N 3.37Å |
| 221 | N | 93.7 | Very high | 91.5 | Very high | 5 Ų | 5 | 48.4 Ų | 48.4 | 3% | 0.027 | 22% | 0.222 | C | C | . | . | H | α-helix | trans | -64.2 | -39.7 | 174.5 | -81.8 | -10.5 | 0 | 0 | 0 | 112.1 | C65 M210 L217 L219 F223 L224 Y225 S268 | C65-N221 WeakPolarHBondContact SG-CB 3.47Å; M210-N221 WeakPolarHBondContact CE-OD1 3.35Å; L217-N221 VanDerWaalsContact O-CB 3.31Å; L217-N221 WeakPolarHBondContact O-CB 3.28Å; L217-N221 PolarHBondContact O-N 2.91Å; L219-N221 VanDerWaalsContact C-N 3.32Å; L219-N221 PolarHBondContact O-N 3.25Å; N221-F223 VanDerWaalsContact C-N 3.32Å; N221-F223 PolarHBondContact O-N 2.96Å; N221-L224 PolarHBondContact O-N 3.13Å; N221-Y225 HydrophobicContact CB-CD2 4.02Å; N221-Y225 HydrophobicContact CB-CE2 3.49Å; N221-Y225 VanDerWaalsContact CB-CE2 3.49Å; N221-Y225 WeakPolarHBondContact O-CB 3.44Å; N221-Y225 WeakPolarHBondContact O-CD2 3.27Å; N221-Y225 PolarHBondContact O-N 2.95Å; N221-S268 WeakPolarHBondContact OD1-CB 3.41Å; N221-S268 PolarHBondContact OD1-OG 3.14Å |
| 222 | L | 93.1 | Very high | 91.3 | Very high | 29 Ų | 29 | 45.2 Ų | 45.2 | 15% | 0.152 | 21% | 0.209 | C | C | . | . | H | α-helix | trans | -55.9 | -47.9 | 175 | -168.6 | 83.1 | 0 | 0 | 0 | 110.6 | L62 C65 A66 L69 W76 A218 L219 T226 | L62-L222 HydrophobicContact CD1-CD1 3.63Å; L62-L222 HydrophobicContact CD1-CG 4.12Å; C65-L222 HydrophobicContact CB-CD1 4.28Å; A66-L222 HydrophobicContact CB-CD1 3.98Å; L69-L222 HydrophobicContact CD1-CB 4.46Å; L69-L222 HydrophobicContact CD1-CD2 4.12Å; W76-L222 HydrophobicContact CZ3-CD2 4.37Å; A218-L222 VanDerWaalsContact O-CB 3.29Å; A218-L222 WeakPolarHBondContact O-CB 3.4Å; A218-L222 PolarHBondContact O-N 3.37Å; L219-L222 HydrophobicContact CD1-CD2 4.01Å; L219-L222 WeakPolarHBondContact O-CB 3.38Å; L219-L222 PolarHBondContact O-N 2.98Å; L222-T226 VanDerWaalsContact O-CB 3.3Å; L222-T226 WeakPolarHBondContact O-CB 3.27Å; L222-T226 PolarHBondContact O-N 2.67Å; L222-T226 PolarHBondContact O-OG1 3.18Å |
| 223 | F | 93.3 | Very high | 91.2 | Very high | 21 Ų | 21 | 40.1 Ų | 40.1 | 9% | 0.092 | 20% | 0.196 | C | C | . | . | H | α-helix | trans | -62.6 | -48 | 176.6 | -61.3 | -32.9 | 0 | 0 | 0 | 111.9 | P81 A86 F89 L215 L219 Q220 N221 Y225 T226 F227 | P81-F223 HydrophobicContact CB-CZ 4.47Å; A86-F223 HydrophobicContact CB-CB 4.29Å; A86-F223 HydrophobicContact CB-CD1 3.83Å; A86-F223 HydrophobicContact CB-CD2 3.87Å; A86-F223 HydrophobicContact CB-CE1 4.06Å; A86-F223 HydrophobicContact CB-CE2 4.09Å; A86-F223 HydrophobicContact CB-CG 3.74Å; A86-F223 HydrophobicContact CB-CZ 4.19Å; F89-F223 HydrophobicContact CB-CB 4.03Å; F89-F223 HydrophobicContact CD2-CB 3.79Å; F89-F223 AromaticContact CD2-CD2 3.97Å; F89-F223 HydrophobicContact CD2-CD2 3.97Å; F89-F223 HydrophobicContact CD2-CG 4.37Å; F89-F223 HydrophobicContact CE2-CB 4.46Å; F89-F223 HydrophobicContact CE2-CD2 4Å; F89-F223 HydrophobicContact CG-CB 3.96Å; L215-F223 HydrophobicContact CD1-CE2 3.92Å; L219-F223 HydrophobicContact CD1-CE1 3.97Å; L219-F223 HydrophobicContact CD1-CE2 4.27Å; L219-F223 HydrophobicContact CD1-CZ 3.73Å; L219-F223 HydrophobicContact CD2-CE2 4.47Å; L219-F223 HydrophobicContact CD2-CZ 4.34Å; L219-F223 HydrophobicContact CG-CE2 3.93Å; L219-F223 HydrophobicContact CG-CZ 3.87Å; L219-F223 WeakPolarHBondContact O-CD2 3.39Å; L219-F223 WeakPolarHBondContact O-CG 3.47Å; L219-F223 PolarHBondContact O-N 3.44Å; L219-F223 VanDerWaalsContact O-N 3.08Å; Q220-F223 PolarHBondContact O-N 2.88Å; N221-F223 VanDerWaalsContact C-N 3.32Å; N221-F223 PolarHBondContact O-N 2.96Å; F223-Y225 PolarHBondContact O-N 3.19Å; F223-T226 PolarHBondContact O-N 2.89Å; F223-F227 WeakPolarHBondContact O-CD2 3.43Å; F223-F227 PolarHBondContact O-N 3.31Å |
| 224 | L | 93.8 | Very high | 91.2 | Very high | 10 Ų | 10 | 41.3 Ų | 41.3 | 5% | 0.052 | 21% | 0.214 | C | C | . | . | H | α-helix | trans | -57.2 | -50.3 | 179.7 | -178 | 60.7 | 0 | 0 | 0 | 112.3 | F89 S92 A93 T206 M210 Q220 N221 F227 G228 | F89-L224 HydrophobicContact CB-CB 4.49Å; F89-L224 HydrophobicContact CD1-CB 3.95Å; F89-L224 HydrophobicContact CD1-CD1 4.46Å; S92-L224 VanDerWaalsContact OG-CD1 3.23Å; S92-L224 WeakPolarHBondContact OG-CD1 3.39Å; A93-L224 HydrophobicContact CB-CD1 4.14Å; T206-L224 HydrophobicContact CG2-CD2 4.34Å; M210-L224 HydrophobicContact CE-CD2 4.49Å; Q220-L224 PolarHBondContact O-N 3.37Å; N221-L224 PolarHBondContact O-N 3.13Å; L224-F227 PolarHBondContact O-N 3.05Å; L224-G228 PolarHBondContact O-N 3Å |
| 225 | Y | 94.6 | Very high | 91.1 | Very high | 7 Ų | 7 | 32.8 Ų | 32.8 | 3% | 0.027 | 19% | 0.187 | C | C | . | . | H | α-helix | trans | -75.3 | -26.8 | -177.5 | -53 | -38.4 | 0 | 0 | 0 | 112.3 | E58 K61 N221 F223 G228 V229 G264 L265 S268 | E58-Y225 WeakPolarHBondContact OE2-CD1 3.28Å; K61-Y225 HydrophobicContact CB-CD1 4.24Å; K61-Y225 HydrophobicContact CB-CD2 3.53Å; K61-Y225 HydrophobicContact CB-CE1 4.38Å; K61-Y225 HydrophobicContact CB-CE2 3.65Å; K61-Y225 HydrophobicContact CB-CG 3.85Å; K61-Y225 HydrophobicContact CD-CD1 3.98Å; K61-Y225 HydrophobicContact CD-CE1 3.68Å; K61-Y225 HydrophobicContact CD-CE2 4.26Å; K61-Y225 HydrophobicContact CD-CG 4.44Å; K61-Y225 HydrophobicContact CG-CE2 4.35Å; N221-Y225 HydrophobicContact CB-CD2 4.02Å; N221-Y225 HydrophobicContact CB-CE2 3.49Å; N221-Y225 VanDerWaalsContact CB-CE2 3.49Å; N221-Y225 WeakPolarHBondContact O-CB 3.44Å; N221-Y225 WeakPolarHBondContact O-CD2 3.27Å; N221-Y225 PolarHBondContact O-N 2.95Å; F223-Y225 PolarHBondContact O-N 3.19Å; Y225-G228 PolarHBondContact O-N 3.44Å; Y225-V229 WeakPolarHBondContact O-CB 3.33Å; Y225-V229 VanDerWaalsContact O-CG2 3.32Å; Y225-V229 WeakPolarHBondContact O-CG2 3.37Å; Y225-V229 PolarHBondContact O-N 3.38Å; Y225-G264 PolarHBondContact OH-O 2.86Å; Y225-L265 HydrophobicContact CE2-CD2 3.56Å; Y225-S268 PolarHBondContact OH-OG 2.94Å |
| 226 | T | 94.3 | Very high | 90.9 | Very high | 54 Ų | 54 | 33.6 Ų | 33.6 | 33% | 0.331 | 19% | 0.19 | S | C | . | . | H | α-helix | trans | -60.4 | -50.8 | 171.2 | -59.7 | 0 | 0 | 0 | 0 | 110.2 | L62 L222 F223 G228 V229 L230 | L62-T226 WeakPolarHBondContact CD1-OG1 3.49Å; L222-T226 VanDerWaalsContact O-CB 3.3Å; L222-T226 WeakPolarHBondContact O-CB 3.27Å; L222-T226 PolarHBondContact O-N 2.67Å; L222-T226 PolarHBondContact O-OG1 3.18Å; F223-T226 PolarHBondContact O-N 2.89Å; T226-G228 VanDerWaalsContact C-N 3.31Å; T226-G228 PolarHBondContact O-N 3.43Å; T226-V229 PolarHBondContact O-N 3.39Å; T226-L230 WeakPolarHBondContact O-CG 3.23Å; T226-L230 PolarHBondContact O-N 3.36Å; T226-L230 VanDerWaalsContact O-N 3.11Å |
| 227 | F | 94.4 | Very high | 90.7 | Very high | 61 Ų | 61 | 35.9 Ų | 35.9 | 27% | 0.268 | 21% | 0.212 | S | C | . | . | H | α-helix | trans | -65.6 | -35.4 | 175.3 | -68.9 | -65.6 | 0 | 0 | 0 | 112.3 | A86 F89 A90 A93 F223 L224 L230 L231 | A86-F227 HydrophobicContact CB-CE2 4.47Å; A86-F227 WeakPolarHBondContact O-CE2 3.48Å; F89-F227 HydrophobicContact CB-CD2 4.26Å; A90-F227 HydrophobicContact CB-CB 4.4Å; A90-F227 HydrophobicContact CB-CD1 3.66Å; A90-F227 HydrophobicContact CB-CD2 3.81Å; A90-F227 HydrophobicContact CB-CE1 3.78Å; A90-F227 HydrophobicContact CB-CE2 3.94Å; A90-F227 HydrophobicContact CB-CG 3.69Å; A90-F227 HydrophobicContact CB-CZ 3.92Å; A93-F227 HydrophobicContact CB-CB 3.6Å; F223-F227 WeakPolarHBondContact O-CD2 3.43Å; F223-F227 PolarHBondContact O-N 3.31Å; L224-F227 PolarHBondContact O-N 3.05Å; F227-L230 HydrophobicContact CD1-CD1 4.38Å; F227-L230 PolarHBondContact O-N 3.16Å; F227-L231 WeakPolarHBondContact O-CG 3.46Å; F227-L231 PolarHBondContact O-N 3.3Å |
| 228 | G | 92.5 | Very high | 90.2 | Very high | 6 Ų | 6 | 38 Ų | 38 | 6% | 0.062 | 24% | 0.24 | C | C | . | . | H | α-helix | trans | -59.5 | -46.7 | 174.1 | 0 | 0 | 0 | 0 | 0 | 113.1 | L224 Y225 T226 L231 N232 | L224-G228 PolarHBondContact O-N 3Å; Y225-G228 PolarHBondContact O-N 3.44Å; T226-G228 VanDerWaalsContact C-N 3.31Å; T226-G228 PolarHBondContact O-N 3.43Å; G228-L231 PolarHBondContact O-N 2.97Å; G228-N232 WeakPolarHBondContact O-CB 3.37Å; G228-N232 PolarHBondContact O-N 3.11Å; G228-N232 PolarHBondContact O-ND2 3.49Å |
| 229 | V | 93.7 | Very high | 89.3 | Confident | 22 Ų | 22 | 40.4 Ų | 40.4 | 13% | 0.133 | 27% | 0.265 | C | S | . | . | H | α-helix | trans | -62.2 | -46 | 176 | 169.1 | 0 | 0 | 0 | 0 | 110.6 | L55 E58 L59 L62 Y225 T226 L231 N232 L233 | L55-V229 HydrophobicContact CD1-CG1 4.15Å; E58-V229 HydrophobicContact CB-CG2 3.78Å; L59-V229 HydrophobicContact CB-CG2 4.41Å; L62-V229 HydrophobicContact CD2-CG2 4.26Å; Y225-V229 WeakPolarHBondContact O-CB 3.33Å; Y225-V229 VanDerWaalsContact O-CG2 3.32Å; Y225-V229 WeakPolarHBondContact O-CG2 3.37Å; Y225-V229 PolarHBondContact O-N 3.38Å; T226-V229 PolarHBondContact O-N 3.39Å; V229-L231 VanDerWaalsContact C-N 3.34Å; V229-L231 PolarHBondContact O-N 2.97Å; V229-N232 PolarHBondContact O-N 3.37Å; V229-L233 VanDerWaalsContact O-CB 3.23Å; V229-L233 WeakPolarHBondContact O-CB 3.32Å; V229-L233 PolarHBondContact O-N 2.94Å |
| 230 | L | 93.7 | Very high | 88.3 | Confident | 104 Ų | 104 | 42.3 Ų | 42.3 | 55% | 0.545 | 29% | 0.285 | S | S | . | . | H | α-helix | trans | -58.6 | -45 | 178.7 | -68.8 | 173.7 | 0 | 0 | 0 | 112 | T226 F227 G234 | T226-L230 WeakPolarHBondContact O-CG 3.23Å; T226-L230 PolarHBondContact O-N 3.36Å; T226-L230 VanDerWaalsContact O-N 3.11Å; F227-L230 HydrophobicContact CD1-CD1 4.38Å; F227-L230 PolarHBondContact O-N 3.16Å; L230-G234 PolarHBondContact O-N 2.8Å; L230-G234 VanDerWaalsContact O-N 3.13Å |
| 231 | L | 90.7 | Very high | 87.1 | Confident | 58 Ų | 58 | 48.9 Ų | 48.9 | 30% | 0.304 | 33% | 0.328 | S | S | . | . | H | α-helix | trans | -64.8 | -46.4 | 177.4 | -72.3 | 170.3 | 0 | 0 | 0 | 112.1 | A93 L94 F227 G228 V229 L233 G234 L235 | A93-L231 HydrophobicContact CB-CD1 3.96Å; L94-L231 HydrophobicContact CB-CD1 4.32Å; L94-L231 HydrophobicContact CD1-CD1 4.49Å; L94-L231 HydrophobicContact CD1-CD2 4.22Å; F227-L231 WeakPolarHBondContact O-CG 3.46Å; F227-L231 PolarHBondContact O-N 3.3Å; G228-L231 PolarHBondContact O-N 2.97Å; V229-L231 VanDerWaalsContact C-N 3.34Å; V229-L231 PolarHBondContact O-N 2.97Å; L231-L233 VanDerWaalsContact C-N 3.32Å; L231-L233 PolarHBondContact O-N 3.45Å; L231-G234 PolarHBondContact O-N 3.31Å; L231-L235 WeakPolarHBondContact O-CG 3.34Å; L231-L235 PolarHBondContact O-N 3.42Å |
| 232 | N | 88.3 | Confident | 85.9 | Confident | 18 Ų | 18 | 50.8 Ų | 50.8 | 10% | 0.096 | 35% | 0.349 | C | S | . | . | H | α-helix | trans | -69.8 | -30.4 | -179.4 | -76 | -72.3 | 0 | 0 | 0 | 112.6 | V54 L55 G228 V229 L235 H236 | V54-N232 VanDerWaalsContact CG1-OD1 3.24Å; V54-N232 WeakPolarHBondContact CG1-OD1 3.3Å; L55-N232 HydrophobicContact CB-CB 4.31Å; L55-N232 HydrophobicContact CD1-CB 3.95Å; G228-N232 WeakPolarHBondContact O-CB 3.37Å; G228-N232 PolarHBondContact O-N 3.11Å; G228-N232 PolarHBondContact O-ND2 3.49Å; V229-N232 PolarHBondContact O-N 3.37Å; N232-L235 PolarHBondContact O-N 2.95Å; N232-H236 WeakPolarHBondContact O-CB 3.39Å; N232-H236 PolarHBondContact O-N 2.78Å |
| 233 | L | 89.3 | Confident | 84.7 | Confident | 89 Ų | 89 | 51.7 Ų | 51.7 | 47% | 0.466 | 36% | 0.357 | S | S | . | . | H | α-helix | trans | -65.5 | -44.7 | 173.2 | -174.8 | 65 | 0 | 0 | 0 | 110.8 | L55 V229 L231 L235 H236 A237 | L55-L233 HydrophobicContact CD1-CB 4.3Å; L55-L233 HydrophobicContact CD2-CD1 4.09Å; V229-L233 VanDerWaalsContact O-CB 3.23Å; V229-L233 WeakPolarHBondContact O-CB 3.32Å; V229-L233 PolarHBondContact O-N 2.94Å; L231-L233 VanDerWaalsContact C-N 3.32Å; L231-L233 PolarHBondContact O-N 3.45Å; L233-L235 VanDerWaalsContact C-N 3.34Å; L233-L235 PolarHBondContact O-N 3.42Å; L233-H236 PolarHBondContact O-N 3.35Å; L233-A237 WeakPolarHBondContact O-CB 3.49Å; L233-A237 PolarHBondContact O-N 3.43Å |
| 234 | G | 86.4 | Confident | 84 | Confident | 48 Ų | 48 | 52.5 Ų | 52.5 | 50% | 0.495 | 37% | 0.371 | S | S | . | . | H | α-helix | trans | -59.8 | -42.9 | 174.1 | 0 | 0 | 0 | 0 | 0 | 112.7 | L230 L231 A237 G238 | L230-G234 PolarHBondContact O-N 2.8Å; L230-G234 VanDerWaalsContact O-N 3.13Å; L231-G234 PolarHBondContact O-N 3.31Å; G234-A237 PolarHBondContact O-N 3.46Å; G234-G238 PolarHBondContact O-N 2.96Å |
| 235 | L | 83.1 | Confident | 83.3 | Confident | 72 Ų | 72 | 55.1 Ų | 55.1 | 38% | 0.377 | 39% | 0.385 | S | S | . | . | H | α-helix | trans | -65.9 | -39.4 | 175.9 | -70.6 | 168.3 | 0 | 0 | 0 | 112.8 | N101 L231 N232 L233 G238 G239 | N101-L235 WeakPolarHBondContact ND2-CD1 3.37Å; L231-L235 WeakPolarHBondContact O-CG 3.34Å; L231-L235 PolarHBondContact O-N 3.42Å; N232-L235 PolarHBondContact O-N 2.95Å; L233-L235 VanDerWaalsContact C-N 3.34Å; L233-L235 PolarHBondContact O-N 3.42Å; L235-G238 PolarHBondContact O-N 3.37Å; L235-G239 PolarHBondContact O-N 2.73Å; L235-G239 VanDerWaalsContact O-N 3.17Å |
| 236 | H | 82.1 | Confident | 82.7 | Confident | 36 Ų | 36 | 60.5 Ų | 60.5 | 17% | 0.167 | 41% | 0.413 | C | S | . | . | H | α-helix | trans | -66.5 | -44.3 | 176.9 | -175.1 | 77.7 | 0 | 0 | 0 | 111.3 | S51 S52 L55 N232 L233 G238 G239 | S51-H236 PolarHBondContact OG-ND1 2.97Å; S52-H236 PolarHBondContact OG-CE1 2.85Å; L55-H236 HydrophobicContact CD2-CB 4.34Å; N232-H236 WeakPolarHBondContact O-CB 3.39Å; N232-H236 PolarHBondContact O-N 2.78Å; L233-H236 PolarHBondContact O-N 3.35Å; H236-G238 VanDerWaalsContact C-N 3.31Å; H236-G238 PolarHBondContact O-N 3.45Å; H236-G239 PolarHBondContact O-N 2.84Å |
| 237 | A | 83.9 | Confident | 82.1 | Confident | 83 Ų | 83 | 63.6 Ų | 63.6 | 69% | 0.686 | 42% | 0.424 | S | S | * | . | H | α-helix | trans | -63.4 | -35.6 | 176.5 | 0 | 0 | 0 | 0 | 0 | 112.6 | L233 G234 G239 | L233-A237 WeakPolarHBondContact O-CB 3.49Å; L233-A237 PolarHBondContact O-N 3.43Å; G234-A237 PolarHBondContact O-N 3.46Å; A237-G239 VanDerWaalsContact C-N 3.32Å |
| 238 | G | 79.8 | Confident | 81.2 | Confident | 69 Ų | 69 | 62.2 Ų | 62.2 | 71% | 0.711 | 43% | 0.427 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -78.7 | -8.3 | 175.9 | 0 | 0 | 0 | 0 | 0 | 115.1 | G234 L235 H236 G240 | G234-G238 PolarHBondContact O-N 2.96Å; L235-G238 PolarHBondContact O-N 3.37Å; H236-G238 VanDerWaalsContact C-N 3.31Å; H236-G238 PolarHBondContact O-N 3.45Å; G238-G240 VanDerWaalsContact C-N 3.27Å; G238-G240 PolarHBondContact O-N 2.85Å |
| 239 | G | 71.1 | Confident | 80.8 | Confident | 56 Ų | 56 | 64.3 Ų | 64.3 | 58% | 0.577 | 43% | 0.434 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -77.4 | 1.4 | -171.7 | 0 | 0 | 0 | 0 | 0 | 116.4 | L235 H236 A237 | L235-G239 PolarHBondContact O-N 2.73Å; L235-G239 VanDerWaalsContact O-N 3.17Å; H236-G239 PolarHBondContact O-N 2.84Å; A237-G239 VanDerWaalsContact C-N 3.32Å |
| 240 | G | 70.9 | Confident | 80.3 | Confident | 41 Ų | 41 | 65.5 Ų | 65.5 | 42% | 0.423 | 44% | 0.443 | S | S | . | . | trans | 77.4 | 173.7 | -179.8 | 0 | 0 | 0 | 0 | 0 | 115.1 | R49 G238 | R49-G240 PolarHBondContact NH2-O 3.27Å; R49-G240 VanDerWaalsContact NH2-O 3.13Å; G238-G240 VanDerWaalsContact C-N 3.27Å; G238-G240 PolarHBondContact O-N 2.85Å | ||
| 241 | P | 67.3 | Low | 79.9 | Confident | 137 Ų | 137 | 63.6 Ų | 63.6 | 89% | 0.89 | 45% | 0.449 | S | S | * | . | S | Bend | trans | -67 | 147.1 | -175.6 | 28.4 | -34.3 | 0 | 0 | 0 | 112.1 | R49 | R49-P241 PolarHBondContact NH2-O 3.04Š|
| 242 | G | 66.8 | Low | 79.7 | Confident | 46 Ų | 46 | 67 Ų | 67 | 47% | 0.474 | 46% | 0.458 | S | S | . | . | trans | 156.6 | -163.1 | 173.2 | 0 | 0 | 0 | 0 | 0 | 110.4 | R49 | R49-G242 PolarHBondContact NH1-O 3.27Å; R49-G242 VanDerWaalsContact NH1-O 3.08Å | ||
| 243 | P | 68.8 | Low | 79.6 | Confident | 48 Ų | 48 | 66.1 Ų | 66.1 | 31% | 0.312 | 45% | 0.453 | S | S | . | . | S | Bend | trans | -53.6 | 141.7 | -163.9 | 2.9 | -15.9 | 0 | 0 | 0 | 113.4 | R49 E247 | R49-P243 WeakPolarHBondContact CD-O 3.37Å; R49-P243 HydrophobicContact CG-CG 3.98Å; R49-P243 VanDerWaalsContact NE-CD 3.31Å; R49-P243 PolarHBondContact NH1-O 3.46Å; P243-E247 WeakPolarHBondContact CA-OE2 3.34Å; P243-E247 HydrophobicContact CB-CB 3.77Å; P243-E247 HydrophobicContact CB-CG 3.96Å; P243-E247 WeakPolarHBondContact CB-OE2 3.31Å |
| 244 | G | 78 | Confident | 79.6 | Confident | 38 Ų | 38 | 64.5 Ų | 64.5 | 39% | 0.392 | 45% | 0.453 | S | S | . | . | trans | -56.2 | 164.5 | 178.4 | 0 | 0 | 0 | 0 | 0 | 112.1 | L246 E247 | G244-L246 PolarHBondContact O-N 3.36Å; G244-L246 VanDerWaalsContact O-N 3.08Å; G244-E247 PolarHBondContact N-OE2 3.03Å; G244-E247 WeakPolarHBondContact O-CB 3.22Å; G244-E247 PolarHBondContact O-N 2.84Å | ||
| 245 | L | 79.8 | Confident | 79.8 | Confident | 65 Ų | 65 | 65.9 Ų | 65.9 | 34% | 0.34 | 45% | 0.448 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -54.7 | -35.4 | -173.3 | -168.7 | 150.2 | 0 | 0 | 0 | 113.3 | S52 L55 L56 | S52-L245 VanDerWaalsContact CB-O 3.31Å; S52-L245 WeakPolarHBondContact CB-O 3.12Å; L55-L245 HydrophobicContact CD2-CD1 3.83Å; L56-L245 HydrophobicContact CD1-CD2 4.06Å; L56-L245 HydrophobicContact CD2-CD2 3.69Å; L56-L245 HydrophobicContact CG-CD2 3.88Å |
| 246 | L | 82.4 | Confident | 80.2 | Confident | 119 Ų | 119 | 63 Ų | 63 | 62% | 0.623 | 43% | 0.433 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -106.1 | 5.4 | -179.9 | -61.4 | 174.4 | 0 | 0 | 0 | 113.4 | L56 G244 F249 | L56-L246 HydrophobicContact CD1-CD2 3.91Å; L56-L246 HydrophobicContact CD2-CD2 4.2Å; G244-L246 PolarHBondContact O-N 3.36Å; G244-L246 VanDerWaalsContact O-N 3.08Å; L246-F249 WeakPolarHBondContact O-CB 3.42Å; L246-F249 PolarHBondContact O-N 3.3Å |
| 247 | E | 81 | Confident | 80.7 | Confident | 120 Ų | 120 | 61.7 Ų | 61.7 | 56% | 0.561 | 43% | 0.428 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -73.5 | 132.7 | -177.3 | -164.7 | 171.9 | 173.6 | 0 | 0 | 110.3 | P243 G244 F249 | P243-E247 WeakPolarHBondContact CA-OE2 3.34Å; P243-E247 HydrophobicContact CB-CB 3.77Å; P243-E247 HydrophobicContact CB-CG 3.96Å; P243-E247 WeakPolarHBondContact CB-OE2 3.31Å; G244-E247 PolarHBondContact N-OE2 3.03Å; G244-E247 WeakPolarHBondContact O-CB 3.22Å; G244-E247 PolarHBondContact O-N 2.84Å; E247-F249 VanDerWaalsContact C-N 3.28Å; E247-F249 PolarHBondContact O-N 2.98Å |
| 248 | G | 76.7 | Confident | 81.2 | Confident | 32 Ų | 32 | 61.6 Ų | 61.6 | 33% | 0.33 | 42% | 0.416 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 76.7 | 6.7 | -174.8 | 0 | 0 | 0 | 0 | 0 | 115.1 | P47 S250 | P47-G248 WeakPolarHBondContact CG-O 3.35Å; G248-S250 PolarHBondContact O-N 3.37Å |
| 249 | F | 82.8 | Confident | 81.8 | Confident | 50 Ų | 50 | 59 Ų | 59 | 22% | 0.219 | 39% | 0.386 | C | S | . | . | trans | -76.6 | 109.6 | 174.8 | -95.9 | -98.7 | 0 | 0 | 0 | 111.9 | F48 A53 L56 L246 E247 A253 V257 | F48-F249 HydrophobicContact CB-CD2 3.75Å; F48-F249 HydrophobicContact CB-CE2 3.6Å; F48-F249 HydrophobicContact CB-CZ 4.36Å; F48-F249 HydrophobicContact CD2-CE2 4.18Å; F48-F249 HydrophobicContact CD2-CZ 4.19Å; F48-F249 HydrophobicContact CG-CD2 4.33Å; F48-F249 AromaticContact CG-CE2 3.93Å; F48-F249 HydrophobicContact CG-CE2 3.93Å; F48-F249 HydrophobicContact CG-CZ 4.19Å; A53-F249 HydrophobicContact CB-CZ 4.06Å; L56-F249 HydrophobicContact CD1-CD1 4.34Å; L56-F249 HydrophobicContact CD1-CD2 4.36Å; L56-F249 HydrophobicContact CD1-CE1 3.73Å; L56-F249 HydrophobicContact CD1-CE2 3.74Å; L56-F249 HydrophobicContact CD1-CZ 3.41Å; L56-F249 VanDerWaalsContact CD1-CZ 3.41Å; L246-F249 WeakPolarHBondContact O-CB 3.42Å; L246-F249 PolarHBondContact O-N 3.3Å; E247-F249 VanDerWaalsContact C-N 3.28Å; E247-F249 PolarHBondContact O-N 2.98Å; F249-A253 HydrophobicContact CD1-CB 3.56Å; F249-A253 HydrophobicContact CE1-CB 3.85Å; F249-A253 HydrophobicContact CG-CB 4.19Å; F249-V257 HydrophobicContact CE1-CG2 3.77Å; F249-V257 HydrophobicContact CZ-CG2 4.27Å | ||
| 250 | S | 84.4 | Confident | 82.8 | Confident | 46 Ų | 46 | 58.1 Ų | 58.1 | 32% | 0.322 | 37% | 0.367 | S | S | . | . | trans | -88.7 | 170.3 | 170.1 | 67.4 | 0 | 0 | 0 | 0 | 111.9 | G248 W252 A253 A254 | G248-S250 PolarHBondContact O-N 3.37Å; S250-W252 PolarHBondContact O-N 3.17Å; S250-A253 WeakPolarHBondContact O-CB 3.23Å; S250-A253 PolarHBondContact O-N 2.91Å; S250-A253 PolarHBondContact OG-N 2.98Å; S250-A254 PolarHBondContact O-N 3.23Å | ||
| 251 | G | 85.3 | Confident | 83.9 | Confident | 64 Ų | 64 | 56.1 Ų | 56.1 | 66% | 0.66 | 35% | 0.347 | S | S | * | . | H | α-helix | trans | -56.7 | -33.4 | 171.9 | 0 | 0 | 0 | 0 | 0 | 113.1 | A254 L255 | G251-A254 PolarHBondContact O-N 2.95Å; G251-L255 PolarHBondContact O-N 3.42Å |
| 252 | W | 85 | Confident | 85.2 | Confident | 130 Ų | 130 | 52.9 Ų | 52.9 | 49% | 0.492 | 32% | 0.322 | S | S | . | . | H | α-helix | trans | -66.8 | -41 | 173.1 | -66 | 111.2 | 0 | 0 | 0 | 112.4 | L36 L39 C40 S250 A254 L255 V256 | L36-W252 HydrophobicContact CD2-CE3 4.44Å; L36-W252 HydrophobicContact CD2-CZ3 4.28Å; L39-W252 HydrophobicContact CD1-CE3 4.49Å; L39-W252 HydrophobicContact CD1-CH2 4.43Å; L39-W252 HydrophobicContact CD1-CZ3 4.19Å; C40-W252 VanDerWaalsContact SG-C 3.54Å; S250-W252 PolarHBondContact O-N 3.17Å; W252-A254 VanDerWaalsContact C-N 3.32Å; W252-A254 PolarHBondContact O-N 3.25Å; W252-L255 HydrophobicContact CE3-CD2 4.05Å; W252-L255 HydrophobicContact CZ3-CD2 4.05Å; W252-L255 WeakPolarHBondContact O-CB 3.44Å; W252-L255 PolarHBondContact O-N 3.21Å; W252-V256 WeakPolarHBondContact O-CG2 3.34Å; W252-V256 PolarHBondContact O-N 3.12Å |
| 253 | A | 86.9 | Confident | 86.4 | Confident | 0 Ų | 0 | 50.9 Ų | 50.9 | 0% | 0 | 30% | 0.3 | C | S | . | . | H | α-helix | trans | -63 | -40.1 | 175.9 | 0 | 0 | 0 | 0 | 0 | 111.5 | F48 F249 S250 V256 V257 | F48-A253 HydrophobicContact CD1-CB 3.68Å; F48-A253 HydrophobicContact CE1-CB 3.52Å; F48-A253 HydrophobicContact CZ-CB 4.4Å; F249-A253 HydrophobicContact CD1-CB 3.56Å; F249-A253 HydrophobicContact CE1-CB 3.85Å; F249-A253 HydrophobicContact CG-CB 4.19Å; S250-A253 WeakPolarHBondContact O-CB 3.23Å; S250-A253 PolarHBondContact O-N 2.91Å; S250-A253 PolarHBondContact OG-N 2.98Å; A253-V256 PolarHBondContact O-N 3.43Å; A253-V257 WeakPolarHBondContact O-CG2 3.44Å; A253-V257 PolarHBondContact O-N 3.33Å |
| 254 | A | 89.9 | Confident | 87.6 | Confident | 55 Ų | 55 | 49.2 Ų | 49.2 | 46% | 0.455 | 29% | 0.292 | S | S | . | . | H | α-helix | trans | -62.5 | -41.7 | 173.3 | 0 | 0 | 0 | 0 | 0 | 112.1 | S250 G251 W252 V257 L258 | S250-A254 PolarHBondContact O-N 3.23Å; G251-A254 PolarHBondContact O-N 2.95Å; W252-A254 VanDerWaalsContact C-N 3.32Å; W252-A254 PolarHBondContact O-N 3.25Å; A254-V257 PolarHBondContact O-N 2.86Å; A254-L258 WeakPolarHBondContact O-CB 3.3Å; A254-L258 PolarHBondContact O-N 3.47Å |
| 255 | L | 90.8 | Very high | 88.3 | Confident | 77 Ų | 77 | 49 Ų | 49 | 40% | 0.403 | 28% | 0.282 | S | S | . | . | H | α-helix | trans | -63.4 | -40.4 | 175.3 | -176.3 | 62.7 | 0 | 0 | 0 | 112.1 | L36 G251 W252 L258 S259 | L36-L255 HydrophobicContact CD2-CD2 4.14Å; G251-L255 PolarHBondContact O-N 3.42Å; W252-L255 HydrophobicContact CE3-CD2 4.05Å; W252-L255 HydrophobicContact CZ3-CD2 4.05Å; W252-L255 WeakPolarHBondContact O-CB 3.44Å; W252-L255 PolarHBondContact O-N 3.21Å; L255-L258 PolarHBondContact O-N 2.79Å; L255-S259 WeakPolarHBondContact O-CB 3.39Å; L255-S259 PolarHBondContact O-N 2.98Å |
| 256 | V | 89.8 | Confident | 89 | Confident | 10 Ų | 10 | 47.5 Ų | 47.5 | 6% | 0.061 | 27% | 0.273 | C | S | . | . | H | α-helix | trans | -61.3 | -46.7 | 174.5 | 169.4 | 0 | 0 | 0 | 0 | 110.8 | L36 W252 A253 S259 Q260 | L36-V256 HydrophobicContact CB-CG2 3.74Å; W252-V256 WeakPolarHBondContact O-CG2 3.34Å; W252-V256 PolarHBondContact O-N 3.12Å; A253-V256 PolarHBondContact O-N 3.43Å; V256-S259 PolarHBondContact O-N 3.13Å; V256-Q260 VanDerWaalsContact O-CB 3.32Å; V256-Q260 WeakPolarHBondContact O-CB 3.44Å; V256-Q260 WeakPolarHBondContact O-CG 3.31Å; V256-Q260 PolarHBondContact O-N 2.88Å |
| 257 | V | 92.6 | Very high | 89.4 | Confident | 10 Ų | 10 | 42.3 Ų | 42.3 | 6% | 0.061 | 25% | 0.246 | C | C | . | . | H | α-helix | trans | -61.8 | -47.2 | 177.8 | 167.8 | 0 | 0 | 0 | 0 | 111.3 | L56 F249 A253 A254 Q260 A261 | L56-V257 HydrophobicContact CB-CG1 4.08Å; L56-V257 HydrophobicContact CB-CG2 4.4Å; F249-V257 HydrophobicContact CE1-CG2 3.77Å; F249-V257 HydrophobicContact CZ-CG2 4.27Å; A253-V257 WeakPolarHBondContact O-CG2 3.44Å; A253-V257 PolarHBondContact O-N 3.33Å; A254-V257 PolarHBondContact O-N 2.86Å; V257-Q260 PolarHBondContact O-N 3.43Å; V257-A261 WeakPolarHBondContact O-CB 3.13Å; V257-A261 PolarHBondContact O-N 3Å |
| 258 | L | 94.1 | Very high | 89.9 | Confident | 81 Ų | 81 | 36.8 Ų | 36.8 | 42% | 0.424 | 22% | 0.221 | S | C | . | . | H | α-helix | trans | -63.4 | -46.7 | 179.2 | 179.7 | 61.6 | 0 | 0 | 0 | 111.6 | T60 A254 L255 Q260 A261 L262 | T60-L258 HydrophobicContact CG2-CD1 4.4Å; A254-L258 WeakPolarHBondContact O-CB 3.3Å; A254-L258 PolarHBondContact O-N 3.47Å; L255-L258 PolarHBondContact O-N 2.79Å; L258-Q260 VanDerWaalsContact C-N 3.32Å; L258-Q260 PolarHBondContact O-N 3.31Å; L258-A261 PolarHBondContact O-N 3.08Å; L258-L262 HydrophobicContact CD1-CD1 4.34Å; L258-L262 HydrophobicContact CD1-CG 4.4Å; L258-L262 HydrophobicContact CG-CD1 4.24Å; L258-L262 WeakPolarHBondContact O-CG 3.46Å; L258-L262 PolarHBondContact O-N 3.32Å |
| 259 | S | 92.6 | Very high | 90.7 | Very high | 14 Ų | 14 | 35.9 Ų | 35.9 | 10% | 0.098 | 21% | 0.21 | C | C | . | . | H | α-helix | trans | -59.8 | -43.5 | 176.5 | -175.7 | 0 | 0 | 0 | 0 | 111 | M29 L255 V256 A261 L262 N263 | M29-S259 VanDerWaalsContact CE-O 3.26Å; M29-S259 WeakPolarHBondContact CE-O 3.45Å; L255-S259 WeakPolarHBondContact O-CB 3.39Å; L255-S259 PolarHBondContact O-N 2.98Å; V256-S259 PolarHBondContact O-N 3.13Å; S259-A261 PolarHBondContact O-N 2.82Å; S259-L262 PolarHBondContact O-N 3.47Å; S259-N263 VanDerWaalsContact O-CB 3.23Å; S259-N263 WeakPolarHBondContact O-CB 3.44Å; S259-N263 PolarHBondContact O-N 2.87Å |
| 260 | Q | 92.4 | Very high | 91.1 | Very high | 37 Ų | 37 | 33.5 Ų | 33.5 | 17% | 0.173 | 20% | 0.2 | C | C | . | . | H | α-helix | trans | -68.4 | -34.4 | 177.5 | -79.3 | -69.1 | 16.6 | 0 | 0 | 113.6 | H33 T57 V256 V257 L258 N263 G264 | H33-Q260 PolarHBondContact CD2-NE2 3.4Å; H33-Q260 PolarHBondContact CE1-NE2 3.01Å; H33-Q260 PolarHBondContact ND1-NE2 3.04Å; H33-Q260 PolarHBondContact NE2-NE2 3.35Å; T57-Q260 HydrophobicContact CG2-CB 3.82Å; V256-Q260 VanDerWaalsContact O-CB 3.32Å; V256-Q260 WeakPolarHBondContact O-CB 3.44Å; V256-Q260 WeakPolarHBondContact O-CG 3.31Å; V256-Q260 PolarHBondContact O-N 2.88Å; V257-Q260 PolarHBondContact O-N 3.43Å; L258-Q260 VanDerWaalsContact C-N 3.32Å; L258-Q260 PolarHBondContact O-N 3.31Å; Q260-N263 PolarHBondContact OE1-ND2 3.37Å; Q260-N263 VanDerWaalsContact OE1-ND2 3.16Å; Q260-G264 PolarHBondContact O-N 3.46Å |
| 261 | A | 94.3 | Very high | 91.4 | Very high | 0 Ų | 0 | 31.5 Ų | 31.5 | 0% | 0 | 19% | 0.186 | C | C | . | . | H | α-helix | trans | -63.3 | -51 | 174.8 | 0 | 0 | 0 | 0 | 0 | 110.9 | T60 K61 L64 V257 L258 S259 N263 G264 L265 | T60-A261 HydrophobicContact CG2-CB 3.6Å; K61-A261 HydrophobicContact CG-CB 3.78Å; L64-A261 HydrophobicContact CD1-CB 4.35Å; V257-A261 WeakPolarHBondContact O-CB 3.13Å; V257-A261 PolarHBondContact O-N 3Å; L258-A261 PolarHBondContact O-N 3.08Å; S259-A261 PolarHBondContact O-N 2.82Å; A261-N263 PolarHBondContact O-N 3.11Å; A261-G264 PolarHBondContact O-N 3.3Å; A261-L265 PolarHBondContact O-N 3Å; A261-L265 VanDerWaalsContact O-N 3.09Å |
| 262 | L | 94.6 | Very high | 91.7 | Very high | 68 Ų | 68 | 30.3 Ų | 30.3 | 36% | 0.356 | 16% | 0.162 | S | C | . | . | H | α-helix | trans | -60.8 | -45.1 | 177.4 | -71.4 | 174.6 | 0 | 0 | 0 | 112.3 | M29 L64 L258 S259 G264 L265 L266 | M29-L262 HydrophobicContact CE-CB 3.33Å; M29-L262 HydrophobicContact CE-CD1 3.86Å; M29-L262 HydrophobicContact CE-CG 4.24Å; M29-L262 HydrophobicContact SD-CB 4.25Å; L64-L262 HydrophobicContact CD1-CD2 4.11Å; L258-L262 HydrophobicContact CD1-CD1 4.34Å; L258-L262 HydrophobicContact CD1-CG 4.4Å; L258-L262 HydrophobicContact CG-CD1 4.24Å; L258-L262 WeakPolarHBondContact O-CG 3.46Å; L258-L262 PolarHBondContact O-N 3.32Å; S259-L262 PolarHBondContact O-N 3.47Å; L262-G264 VanDerWaalsContact C-N 3.3Å; L262-G264 PolarHBondContact O-N 3.5Å; L262-L265 WeakPolarHBondContact O-CB 3.49Å; L262-L265 PolarHBondContact O-N 3.5Å; L262-L266 WeakPolarHBondContact O-CG 3.36Å; L262-L266 PolarHBondContact O-N 3.46Å |
| 263 | N | 93.1 | Very high | 92 | Very high | 4 Ų | 4 | 30.4 Ų | 30.4 | 2% | 0.021 | 17% | 0.168 | C | C | . | . | H | α-helix | trans | -58.6 | -41.2 | 174.5 | 175 | 51.4 | 0 | 0 | 0 | 111.7 | M29 Y30 S259 Q260 A261 L265 L266 M267 | M29-N263 HydrophobicContact CB-CB 4.06Å; Y30-N263 VanDerWaalsContact CD2-ND2 3.3Å; Y30-N263 WeakPolarHBondContact CD2-ND2 3.29Å; S259-N263 VanDerWaalsContact O-CB 3.23Å; S259-N263 WeakPolarHBondContact O-CB 3.44Å; S259-N263 PolarHBondContact O-N 2.87Å; Q260-N263 PolarHBondContact OE1-ND2 3.37Å; Q260-N263 VanDerWaalsContact OE1-ND2 3.16Å; A261-N263 PolarHBondContact O-N 3.11Å; N263-L265 PolarHBondContact O-N 3.34Å; N263-L266 PolarHBondContact O-N 3.47Å; N263-M267 WeakPolarHBondContact O-CB 3.41Å; N263-M267 VanDerWaalsContact O-CG 3.24Å; N263-M267 WeakPolarHBondContact O-CG 3.26Å; N263-M267 PolarHBondContact O-N 3.02Å |
| 264 | G | 92.3 | Very high | 92 | Very high | 13 Ų | 13 | 31.2 Ų | 31.2 | 13% | 0.134 | 18% | 0.176 | C | C | . | . | H | α-helix | trans | -61.9 | -40.2 | 175.1 | 0 | 0 | 0 | 0 | 0 | 113.6 | Y225 Q260 A261 L262 M267 S268 | Y225-G264 PolarHBondContact OH-O 2.86Å; Q260-G264 PolarHBondContact O-N 3.46Å; A261-G264 PolarHBondContact O-N 3.3Å; L262-G264 VanDerWaalsContact C-N 3.3Å; L262-G264 PolarHBondContact O-N 3.5Å; G264-M267 PolarHBondContact O-N 3.15Å; G264-S268 PolarHBondContact O-N 3.3Å; G264-S268 PolarHBondContact O-OG 3.17Å |
| 265 | L | 93.6 | Very high | 92.1 | Very high | 35 Ų | 35 | 29 Ų | 29 | 18% | 0.183 | 16% | 0.157 | C | C | . | . | H | α-helix | trans | -64.4 | -43.8 | 174.6 | -66.2 | 175.5 | 0 | 0 | 0 | 111.9 | L64 C65 Y225 A261 L262 N263 S268 A269 | L64-L265 HydrophobicContact CB-CD1 3.89Å; L64-L265 HydrophobicContact CD1-CD1 3.9Å; C65-L265 WeakPolarHBondContact SG-CD2 3.27Å; Y225-L265 HydrophobicContact CE2-CD2 3.56Å; A261-L265 PolarHBondContact O-N 3Å; A261-L265 VanDerWaalsContact O-N 3.09Å; L262-L265 WeakPolarHBondContact O-CB 3.49Å; L262-L265 PolarHBondContact O-N 3.5Å; N263-L265 PolarHBondContact O-N 3.34Å; L265-S268 WeakPolarHBondContact O-CB 3.47Å; L265-S268 PolarHBondContact O-N 3.02Å; L265-A269 PolarHBondContact O-N 3.4Å; L265-A269 VanDerWaalsContact O-N 3.08Å |
| 266 | L | 93.8 | Very high | 92.1 | Very high | 32 Ų | 32 | 25.3 Ų | 25.3 | 17% | 0.168 | 14% | 0.138 | C | C | . | . | H | α-helix | trans | -62.9 | -43.1 | 176 | -67.3 | 170.6 | 0 | 0 | 0 | 111.2 | M22 L25 S26 M29 L262 N263 S268 A269 V270 | M22-L266 HydrophobicContact CG-CD2 3.64Å; L25-L266 HydrophobicContact CB-CD1 4.39Å; L25-L266 HydrophobicContact CD2-CD1 3.88Å; L25-L266 HydrophobicContact CG-CD1 3.88Å; S26-L266 WeakPolarHBondContact OG-CB 3.49Å; M29-L266 HydrophobicContact SD-CD1 3.8Å; L262-L266 WeakPolarHBondContact O-CG 3.36Å; L262-L266 PolarHBondContact O-N 3.46Å; N263-L266 PolarHBondContact O-N 3.47Å; L266-S268 VanDerWaalsContact C-N 3.33Å; L266-S268 PolarHBondContact O-N 3.4Å; L266-A269 CarbonylContact O-C 3.56Å; L266-A269 WeakPolarHBondContact O-CA 3.27Å; L266-A269 WeakPolarHBondContact O-CB 3.3Å; L266-A269 PolarHBondContact O-N 3.12Å; L266-V270 WeakPolarHBondContact O-CG2 3.3Å; L266-V270 PolarHBondContact O-N 3.42Å |
| 267 | M | 91.6 | Very high | 92.2 | Very high | 11 Ų | 11 | 24.9 Ų | 24.9 | 5% | 0.054 | 14% | 0.135 | C | C | . | . | H | α-helix | trans | -63.2 | -37.6 | 176.6 | -72.4 | -64.6 | 179.5 | 0 | 0 | 112.5 | Y30 N263 G264 A269 V270 M271 R279 V282 V283 | Y30-M267 HydrophobicContact CD2-CE 3.7Å; Y30-M267 HydrophobicContact CE2-CE 4.43Å; Y30-M267 HydrophobicContact CG-CE 4.33Å; N263-M267 WeakPolarHBondContact O-CB 3.41Å; N263-M267 VanDerWaalsContact O-CG 3.24Å; N263-M267 WeakPolarHBondContact O-CG 3.26Å; N263-M267 PolarHBondContact O-N 3.02Å; G264-M267 PolarHBondContact O-N 3.15Å; M267-A269 VanDerWaalsContact C-N 3.32Å; M267-A269 PolarHBondContact O-N 3.05Å; M267-V270 PolarHBondContact O-N 3.04Å; M267-M271 WeakPolarHBondContact O-CG 3.31Å; M267-M271 PolarHBondContact O-N 3.14Å; M267-R279 HydrophobicContact SD-CG 3.91Å; M267-V282 HydrophobicContact CE-CB 4.21Å; M267-V282 HydrophobicContact CE-CG1 3.39Å; M267-V282 HydrophobicContact SD-CG1 4.28Å; M267-V283 HydrophobicContact CE-CG2 4.35Å |
| 268 | S | 92.1 | Very high | 92.2 | Very high | 4 Ų | 4 | 25.1 Ų | 25.1 | 3% | 0.028 | 14% | 0.137 | C | C | . | . | H | α-helix | trans | -60.4 | -41.1 | 169.9 | -73.4 | 0 | 0 | 0 | 0 | 112 | N221 Y225 G264 L265 L266 M271 K272 | N221-S268 WeakPolarHBondContact OD1-CB 3.41Å; N221-S268 PolarHBondContact OD1-OG 3.14Å; Y225-S268 PolarHBondContact OH-OG 2.94Å; G264-S268 PolarHBondContact O-N 3.3Å; G264-S268 PolarHBondContact O-OG 3.17Å; L265-S268 WeakPolarHBondContact O-CB 3.47Å; L265-S268 PolarHBondContact O-N 3.02Å; L266-S268 VanDerWaalsContact C-N 3.33Å; L266-S268 PolarHBondContact O-N 3.4Å; S268-M271 PolarHBondContact O-N 3.25Å; S268-K272 WeakPolarHBondContact O-CB 3.42Å; S268-K272 PolarHBondContact O-N 3.15Å |
| 269 | A | 92.1 | Very high | 92.2 | Very high | 13 Ų | 13 | 24 Ų | 24 | 11% | 0.107 | 13% | 0.127 | C | C | . | . | H | α-helix | trans | -65.9 | -40.2 | 174.9 | 0 | 0 | 0 | 0 | 0 | 112.3 | M22 L217 L265 L266 M267 M271 K272 H273 | M22-A269 HydrophobicContact CE-CB 4.35Å; M22-A269 HydrophobicContact SD-CB 3.78Å; L217-A269 HydrophobicContact CD2-CB 3.79Å; L265-A269 PolarHBondContact O-N 3.4Å; L265-A269 VanDerWaalsContact O-N 3.08Å; L266-A269 CarbonylContact O-C 3.56Å; L266-A269 WeakPolarHBondContact O-CA 3.27Å; L266-A269 WeakPolarHBondContact O-CB 3.3Å; L266-A269 PolarHBondContact O-N 3.12Å; M267-A269 VanDerWaalsContact C-N 3.32Å; M267-A269 PolarHBondContact O-N 3.05Å; A269-M271 VanDerWaalsContact C-N 3.31Å; A269-M271 PolarHBondContact O-N 3.38Å; A269-K272 PolarHBondContact O-N 3.21Å; A269-H273 WeakPolarHBondContact O-CB 3.38Å; A269-H273 PolarHBondContact O-N 2.76Å |
| 270 | V | 92.4 | Very high | 92.2 | Very high | 0 Ų | 0 | 24.1 Ų | 24.1 | 0% | 0 | 13% | 0.126 | C | C | . | . | H | α-helix | trans | -59.5 | -41.4 | 173.2 | 173.7 | 0 | 0 | 0 | 0 | 111 | M22 L23 L266 M267 G274 S275 T278 R279 | M22-V270 HydrophobicContact CE-CG2 3.65Å; L23-V270 HydrophobicContact CD2-CG1 4.45Å; L23-V270 HydrophobicContact CD2-CG2 3.84Å; L266-V270 WeakPolarHBondContact O-CG2 3.3Å; L266-V270 PolarHBondContact O-N 3.42Å; M267-V270 PolarHBondContact O-N 3.04Å; V270-G274 CarbonylContact O-C 3.32Å; V270-G274 VanDerWaalsContact O-C 3.32Å; V270-G274 WeakPolarHBondContact O-CA 3.24Å; V270-G274 PolarHBondContact O-N 2.95Å; V270-S275 PolarHBondContact O-N 3.09Å; V270-T278 HydrophobicContact CG1-CG2 4.01Å; V270-R279 HydrophobicContact CG1-CB 4.15Å |
| 271 | M | 90.6 | Very high | 92.2 | Very high | 4 Ų | 4 | 22.7 Ų | 22.7 | 2% | 0.02 | 12% | 0.12 | C | C | . | . | H | α-helix | trans | -71.3 | -40.6 | 177.3 | -69.7 | -176.3 | -65 | 0 | 0 | 112.3 | T206 E207 M210 K211 M267 S268 A269 | T206-M271 HydrophobicContact CG2-CE 3.95Å; T206-M271 HydrophobicContact CG2-SD 4.36Å; E207-M271 HydrophobicContact CB-CB 4.46Å; M210-M271 HydrophobicContact SD-CB 4.35Å; K211-M271 WeakPolarHBondContact CE-O 3.26Å; M267-M271 WeakPolarHBondContact O-CG 3.31Å; M267-M271 PolarHBondContact O-N 3.14Å; S268-M271 PolarHBondContact O-N 3.25Å; A269-M271 VanDerWaalsContact C-N 3.31Å; A269-M271 PolarHBondContact O-N 3.38Å |
| 272 | K | 91.9 | Very high | 92.1 | Very high | 38 Ų | 38 | 23 Ų | 23 | 17% | 0.165 | 12% | 0.121 | C | C | . | . | H | α-helix | trans | -65.1 | -46 | 179.5 | 178.7 | 72.5 | -178.5 | -160.9 | 0 | 112.5 | M210 Q213 L217 S268 A269 | M210-K272 HydrophobicContact CB-CD 3.89Å; M210-K272 WeakPolarHBondContact O-CD 3.02Å; M210-K272 WeakPolarHBondContact O-CE 3.19Å; M210-K272 PolarHBondContact O-NZ 3.2Å; M210-K272 HydrophobicContact SD-CB 4.43Å; Q213-K272 PolarHBondContact O-NZ 2.87Å; Q213-K272 VanDerWaalsContact O-NZ 3.14Å; L217-K272 HydrophobicContact CD1-CB 3.84Å; L217-K272 HydrophobicContact CD1-CD 4.38Å; L217-K272 HydrophobicContact CD1-CG 4.04Å; L217-K272 HydrophobicContact CD2-CB 4.48Å; S268-K272 WeakPolarHBondContact O-CB 3.42Å; S268-K272 PolarHBondContact O-N 3.15Å; A269-K272 PolarHBondContact O-N 3.21Å |
| 273 | H | 89.7 | Confident | 92 | Very high | 132 Ų | 132 | 20.8 Ų | 20.8 | 61% | 0.611 | 11% | 0.111 | S | C | * | . | H | α-helix | trans | -105.6 | -17.2 | -171.2 | -63.8 | -64.7 | 0 | 0 | 0 | 114.2 | W19 A269 | W19-H273 HydrophobicContact CH2-CB 3.93Å; W19-H273 HydrophobicContact CZ3-CB 3.59Å; A269-H273 WeakPolarHBondContact O-CB 3.38Å; A269-H273 PolarHBondContact O-N 2.76Å |
| 274 | G | 88.9 | Confident | 91.9 | Very high | 17 Ų | 17 | 20.9 Ų | 20.9 | 18% | 0.175 | 11% | 0.112 | C | C | . | . | S | Bend | trans | -113.2 | -121.2 | 176.7 | 0 | 0 | 0 | 0 | 0 | 110.7 | K211 V270 | K211-G274 WeakPolarHBondContact CE-O 3.38Å; K211-G274 PolarHBondContact NZ-O 3.47Å; V270-G274 CarbonylContact O-C 3.32Å; V270-G274 VanDerWaalsContact O-C 3.32Å; V270-G274 WeakPolarHBondContact O-CA 3.24Å; V270-G274 PolarHBondContact O-N 2.95Å |
| 275 | S | 91.9 | Very high | 91.8 | Very high | 9 Ų | 9 | 21.3 Ų | 21.3 | 6% | 0.063 | 11% | 0.113 | C | C | . | . | trans | -153.7 | 162.8 | 178.1 | 62.5 | 0 | 0 | 0 | 0 | 111.9 | E207 V270 I277 T278 R279 | E207-S275 WeakPolarHBondContact OE1-CA 3.32Å; V270-S275 PolarHBondContact O-N 3.09Å; S275-I277 PolarHBondContact O-N 3.31Å; S275-I277 PolarHBondContact OG-N 3.49Å; S275-T278 WeakPolarHBondContact O-CB 3.24Å; S275-T278 PolarHBondContact O-N 3.04Å; S275-T278 VanDerWaalsContact O-N 3.08Å; S275-T278 PolarHBondContact OG-N 3.11Å; S275-T278 PolarHBondContact OG-OG1 3.39Å; S275-R279 PolarHBondContact O-N 3.25Å | ||
| 276 | S | 90.7 | Very high | 91.6 | Very high | 0 Ų | 0 | 19.8 Ų | 19.8 | 0% | 0 | 11% | 0.105 | C | C | . | . | H | α-helix | trans | -58.9 | -30.1 | 169.2 | -66.3 | 0 | 0 | 0 | 0 | 111.4 | S203 E207 R279 L280 | S203-S276 PolarHBondContact O-OG 2.98Å; S203-S276 WeakPolarHBondContact OG-CB 3.35Å; S203-S276 PolarHBondContact OG-OG 3.34Å; E207-S276 WeakPolarHBondContact OE2-CA 3.45Å; E207-S276 WeakPolarHBondContact OE2-CB 3.48Å; E207-S276 PolarHBondContact OE2-N 3.22Å; E207-S276 PolarHBondContact OE2-OG 3.23Å; S276-R279 WeakPolarHBondContact O-CB 3.47Å; S276-R279 PolarHBondContact O-N 3.45Å; S276-L280 WeakPolarHBondContact O-CG 3.42Å; S276-L280 PolarHBondContact O-N 3.44Å; S276-L280 VanDerWaalsContact O-N 3.08Å |
| 277 | I | 92 | Very high | 91.3 | Very high | 0 Ų | 0 | 20.4 Ų | 20.4 | 0% | 0 | 11% | 0.108 | C | C | . | . | H | α-helix | trans | -68.3 | -43.4 | 173.8 | -62.8 | 171.6 | 0 | 0 | 0 | 111.2 | Y130 L138 L146 S275 R279 L280 F281 Y320 | Y130-I277 HydrophobicContact CD1-CD1 3.53Å; Y130-I277 HydrophobicContact CD1-CG1 4.32Å; Y130-I277 HydrophobicContact CD2-CD1 4.46Å; Y130-I277 HydrophobicContact CD2-CG1 4.48Å; Y130-I277 HydrophobicContact CE1-CD1 3.61Å; Y130-I277 HydrophobicContact CG-CD1 3.98Å; Y130-I277 HydrophobicContact CG-CG1 4.27Å; L138-I277 HydrophobicContact CD1-CD1 4.46Å; L138-I277 HydrophobicContact CD2-CD1 3.73Å; L146-I277 HydrophobicContact CD2-CG2 3.84Å; S275-I277 PolarHBondContact O-N 3.31Å; S275-I277 PolarHBondContact OG-N 3.49Å; I277-R279 PolarHBondContact O-N 3.2Å; I277-L280 WeakPolarHBondContact O-CA 3.31Å; I277-L280 WeakPolarHBondContact O-CB 3.37Å; I277-L280 PolarHBondContact O-N 3.23Å; I277-F281 HydrophobicContact CG2-CD2 3.94Å; I277-F281 HydrophobicContact CG2-CE2 3.77Å; I277-F281 WeakPolarHBondContact O-CD2 3.23Å; I277-F281 PolarHBondContact O-N 2.88Å; I277-Y320 HydrophobicContact CD1-CE2 4.44Å; I277-Y320 WeakPolarHBondContact CD1-OH 3.45Å; I277-Y320 HydrophobicContact CG2-CD2 4.45Å; I277-Y320 HydrophobicContact CG2-CE1 4.11Å; I277-Y320 HydrophobicContact CG2-CE2 3.67Å; I277-Y320 VanDerWaalsContact CG2-CZ 3.47Å; I277-Y320 WeakPolarHBondContact CG2-OH 3.26Å |
| 278 | T | 92.4 | Very high | 91.2 | Very high | 15 Ų | 15 | 21.4 Ų | 21.4 | 9% | 0.092 | 12% | 0.115 | C | C | . | . | H | α-helix | trans | -59.7 | -39.7 | 174.9 | -55 | 0 | 0 | 0 | 0 | 110.7 | L23 V270 S275 L280 F281 V282 Y321 | L23-T278 HydrophobicContact CD2-CG2 3.96Å; V270-T278 HydrophobicContact CG1-CG2 4.01Å; S275-T278 WeakPolarHBondContact O-CB 3.24Å; S275-T278 PolarHBondContact O-N 3.04Å; S275-T278 VanDerWaalsContact O-N 3.08Å; S275-T278 PolarHBondContact OG-N 3.11Å; S275-T278 PolarHBondContact OG-OG1 3.39Å; T278-L280 VanDerWaalsContact C-N 3.33Å; T278-L280 PolarHBondContact O-N 3.28Å; T278-F281 PolarHBondContact O-N 3.43Å; T278-V282 WeakPolarHBondContact O-CG2 3.35Å; T278-V282 PolarHBondContact O-N 3.45Å; T278-Y321 WeakPolarHBondContact CA-OH 3.32Å; T278-Y321 PolarHBondContact OG1-OH 2.85Å; T278-Y321 VanDerWaalsContact OG1-OH 3.11Å |
| 279 | R | 92.7 | Very high | 91.1 | Very high | 57 Ų | 57 | 23 Ų | 23 | 22% | 0.215 | 13% | 0.125 | C | C | . | . | H | α-helix | trans | -58.1 | -41.7 | 171.6 | 173.9 | -174.7 | 174.9 | -169.7 | 5.5 | 112.2 | Y96 S203 M267 V270 S275 S276 I277 V282 V283 | Y96-R279 PolarHBondContact OH-NH1 3.15Å; S203-R279 VanDerWaalsContact CB-NH1 3.34Å; S203-R279 PolarHBondContact OG-NH1 3.31Å; M267-R279 HydrophobicContact SD-CG 3.91Å; V270-R279 HydrophobicContact CG1-CB 4.15Å; S275-R279 PolarHBondContact O-N 3.25Å; S276-R279 WeakPolarHBondContact O-CB 3.47Å; S276-R279 PolarHBondContact O-N 3.45Å; I277-R279 PolarHBondContact O-N 3.2Å; R279-V282 PolarHBondContact O-N 3.34Å; R279-V283 WeakPolarHBondContact O-CG2 3.34Å; R279-V283 PolarHBondContact O-N 2.78Å |
| 280 | L | 92.6 | Very high | 90.9 | Very high | 17 Ų | 17 | 24.5 Ų | 24.5 | 9% | 0.089 | 13% | 0.13 | C | C | . | . | H | α-helix | trans | -61.2 | -44 | 175.3 | -64.1 | 172.6 | 0 | 0 | 0 | 111.5 | I123 T126 L149 S276 I277 T278 V282 V283 S284 | I123-L280 HydrophobicContact CB-CD1 4.48Å; I123-L280 HydrophobicContact CG1-CD2 4.22Å; I123-L280 HydrophobicContact CG2-CD1 4.17Å; T126-L280 HydrophobicContact CG2-CD1 3.91Å; T126-L280 HydrophobicContact CG2-CG 4.42Å; L149-L280 HydrophobicContact CD2-CB 4.14Å; S276-L280 WeakPolarHBondContact O-CG 3.42Å; S276-L280 PolarHBondContact O-N 3.44Å; S276-L280 VanDerWaalsContact O-N 3.08Å; I277-L280 WeakPolarHBondContact O-CA 3.31Å; I277-L280 WeakPolarHBondContact O-CB 3.37Å; I277-L280 PolarHBondContact O-N 3.23Å; T278-L280 VanDerWaalsContact C-N 3.33Å; T278-L280 PolarHBondContact O-N 3.28Å; L280-V282 PolarHBondContact O-N 2.92Å; L280-V283 PolarHBondContact O-N 3.46Å; L280-S284 PolarHBondContact O-N 3.32Å; L280-S284 PolarHBondContact O-OG 3.08Å |
| 281 | F | 93.4 | Very high | 90.5 | Very high | 7 Ų | 7 | 25.5 Ų | 25.5 | 3% | 0.031 | 14% | 0.139 | C | C | . | . | H | α-helix | trans | -60.8 | -43.5 | 174.8 | -81.5 | -75.1 | 0 | 0 | 0 | 112.4 | L146 L149 I277 T278 V283 S284 C285 A316 M317 Y320 Y321 | L146-F281 HydrophobicContact CD2-CE2 4.42Å; L149-F281 HydrophobicContact CD1-CD1 3.9Å; L149-F281 HydrophobicContact CD1-CE1 3.93Å; L149-F281 HydrophobicContact CD2-CD1 4.11Å; L149-F281 HydrophobicContact CD2-CE1 4.16Å; L149-F281 HydrophobicContact CD2-CG 4.31Å; L149-F281 HydrophobicContact CD2-CZ 4.41Å; I277-F281 HydrophobicContact CG2-CD2 3.94Å; I277-F281 HydrophobicContact CG2-CE2 3.77Å; I277-F281 WeakPolarHBondContact O-CD2 3.23Å; I277-F281 PolarHBondContact O-N 2.88Å; T278-F281 PolarHBondContact O-N 3.43Å; F281-V283 VanDerWaalsContact C-N 3.33Å; F281-V283 PolarHBondContact O-N 2.79Å; F281-S284 PolarHBondContact O-N 3.08Å; F281-C285 WeakPolarHBondContact O-CB 3.38Å; F281-C285 PolarHBondContact O-N 3.17Å; F281-C285 PolarHBondContact O-SG 2.91Å; F281-A316 HydrophobicContact CE1-CB 3.94Å; F281-M317 HydrophobicContact CD1-CG 3.71Å; F281-M317 HydrophobicContact CE1-CG 4.01Å; F281-Y320 AromaticContact CE2-CD1 3.74Å; F281-Y320 HydrophobicContact CE2-CD1 3.74Å; F281-Y320 AromaticContact CE2-CD2 3.81Å; F281-Y320 HydrophobicContact CE2-CD2 3.81Å; F281-Y320 HydrophobicContact CE2-CE1 4.22Å; F281-Y320 HydrophobicContact CE2-CE2 4.3Å; F281-Y320 AromaticContact CE2-CG 3.53Å; F281-Y320 HydrophobicContact CE2-CG 3.53Å; F281-Y320 HydrophobicContact CZ-CD1 4.27Å; F281-Y320 HydrophobicContact CZ-CD2 4.06Å; F281-Y320 AromaticContact CZ-CG 3.7Å; F281-Y320 HydrophobicContact CZ-CG 3.7Å; F281-Y321 HydrophobicContact CD1-CE2 4.48Å; F281-Y321 AromaticContact CD2-CE2 3.82Å; F281-Y321 HydrophobicContact CD2-CE2 3.82Å; F281-Y321 HydrophobicContact CE2-CE2 4.09Å; F281-Y321 HydrophobicContact CG-CE2 4.05Å |
| 282 | V | 92.8 | Very high | 90.3 | Very high | 6 Ų | 6 | 28.4 Ų | 28.4 | 4% | 0.036 | 16% | 0.157 | C | C | . | . | H | α-helix | trans | -58.6 | -45.6 | 175.8 | 174.6 | 0 | 0 | 0 | 0 | 110.8 | L23 T27 M267 T278 R279 L280 S286 | L23-V282 HydrophobicContact CD2-CG2 3.7Å; T27-V282 WeakPolarHBondContact OG1-CG1 3.28Å; M267-V282 HydrophobicContact CE-CB 4.21Å; M267-V282 HydrophobicContact CE-CG1 3.39Å; M267-V282 HydrophobicContact SD-CG1 4.28Å; T278-V282 WeakPolarHBondContact O-CG2 3.35Å; T278-V282 PolarHBondContact O-N 3.45Å; R279-V282 PolarHBondContact O-N 3.34Å; L280-V282 PolarHBondContact O-N 2.92Å; V282-S286 WeakPolarHBondContact O-CB 3.49Å; V282-S286 PolarHBondContact O-N 3.29Å |
| 283 | V | 90.8 | Very high | 90 | Very high | 22 Ų | 22 | 29.2 Ų | 29.2 | 13% | 0.133 | 16% | 0.162 | C | C | . | . | H | α-helix | trans | -64.2 | -43.8 | 177.3 | 172.6 | 0 | 0 | 0 | 0 | 111.1 | Y30 M267 R279 L280 F281 S286 L287 | Y30-V283 HydrophobicContact CD2-CG2 4.36Å; Y30-V283 HydrophobicContact CE1-CG1 3.88Å; Y30-V283 HydrophobicContact CE1-CG2 4.25Å; Y30-V283 HydrophobicContact CE2-CG2 3.99Å; M267-V283 HydrophobicContact CE-CG2 4.35Å; R279-V283 WeakPolarHBondContact O-CG2 3.34Å; R279-V283 PolarHBondContact O-N 2.78Å; L280-V283 PolarHBondContact O-N 3.46Å; F281-V283 VanDerWaalsContact C-N 3.33Å; F281-V283 PolarHBondContact O-N 2.79Å; V283-S286 WeakPolarHBondContact O-CB 3.48Å; V283-S286 PolarHBondContact O-N 3.47Å; V283-S286 PolarHBondContact O-OG 3.17Å; V283-L287 PolarHBondContact O-N 3.47Å |
| 284 | S | 91 | Very high | 89.7 | Confident | 7 Ų | 7 | 23.6 Ų | 23.6 | 5% | 0.049 | 14% | 0.138 | C | C | . | . | H | α-helix | trans | -66.7 | -43.6 | 178.5 | -65.8 | 0 | 0 | 0 | 0 | 112.5 | L149 L280 F281 S286 L287 I313 | L149-S284 WeakPolarHBondContact CD1-OG 3.26Å; L149-S284 VanDerWaalsContact CG-OG 3.26Å; L149-S284 WeakPolarHBondContact CG-OG 3.35Å; L280-S284 PolarHBondContact O-N 3.32Å; L280-S284 PolarHBondContact O-OG 3.08Å; F281-S284 PolarHBondContact O-N 3.08Å; S284-S286 PolarHBondContact O-N 2.78Å; S284-L287 VanDerWaalsContact O-CB 3.24Å; S284-L287 WeakPolarHBondContact O-CB 3.39Å; S284-L287 PolarHBondContact O-N 2.81Å; S284-L287 VanDerWaalsContact O-N 3.09Å; S284-I313 WeakPolarHBondContact O-CD1 3.36Å |
| 285 | C | 91.3 | Very high | 89.4 | Confident | 22 Ų | 22 | 23.9 Ų | 23.9 | 15% | 0.149 | 14% | 0.139 | C | C | . | . | H | α-helix | trans | -61 | -31.5 | 173.5 | -68.7 | 0 | 0 | 0 | 0 | 111.9 | T27 F281 L287 V288 V289 I313 M317 | T27-C285 HydrophobicContact CG2-CB 3.64Å; F281-C285 WeakPolarHBondContact O-CB 3.38Å; F281-C285 PolarHBondContact O-N 3.17Å; F281-C285 PolarHBondContact O-SG 2.91Å; C285-L287 PolarHBondContact O-N 3.43Å; C285-V288 WeakPolarHBondContact O-CB 3.28Å; C285-V288 PolarHBondContact O-N 3.48Å; C285-V288 VanDerWaalsContact O-N 3.07Å; C285-V289 PolarHBondContact O-N 2.57Å; C285-I313 VanDerWaalsContact SG-CG2 3.59Å; C285-M317 VanDerWaalsContact SG-SD 3.62Å |
| 286 | S | 89.3 | Confident | 89 | Confident | 2 Ų | 2 | 28.7 Ų | 28.7 | 1% | 0.014 | 17% | 0.168 | C | C | . | . | H | α-helix | trans | -66.9 | -22.8 | 178.3 | 83.1 | 0 | 0 | 0 | 0 | 112.6 | T27 Y30 G31 V282 V283 S284 V288 V289 N290 | T27-S286 WeakPolarHBondContact O-CB 3.33Å; Y30-S286 WeakPolarHBondContact CD1-OG 3.34Å; G31-S286 VanDerWaalsContact CA-O 3.28Å; G31-S286 WeakPolarHBondContact CA-O 3.31Å; V282-S286 WeakPolarHBondContact O-CB 3.49Å; V282-S286 PolarHBondContact O-N 3.29Å; V283-S286 WeakPolarHBondContact O-CB 3.48Å; V283-S286 PolarHBondContact O-N 3.47Å; V283-S286 PolarHBondContact O-OG 3.17Å; S284-S286 PolarHBondContact O-N 2.78Å; S286-V288 VanDerWaalsContact C-N 3.26Å; S286-V288 PolarHBondContact O-N 2.99Å; S286-V289 PolarHBondContact O-N 3.44Å; S286-N290 VanDerWaalsContact O-CB 3.26Å; S286-N290 WeakPolarHBondContact O-CB 3.35Å; S286-N290 PolarHBondContact O-N 3.21Å |
| 287 | L | 87.2 | Confident | 88.4 | Confident | 45 Ų | 45 | 32.9 Ų | 32.9 | 24% | 0.236 | 19% | 0.189 | C | C | . | . | H | α-helix | trans | -63 | -36.1 | 172.5 | -61.4 | 173.1 | 0 | 0 | 0 | 111.3 | C156 V283 S284 C285 A291 | C156-L287 HydrophobicContact CB-CD1 4.44Å; V283-L287 PolarHBondContact O-N 3.47Å; S284-L287 VanDerWaalsContact O-CB 3.24Å; S284-L287 WeakPolarHBondContact O-CB 3.39Å; S284-L287 PolarHBondContact O-N 2.81Å; S284-L287 VanDerWaalsContact O-N 3.09Å; C285-L287 PolarHBondContact O-N 3.43Å; L287-A291 WeakPolarHBondContact O-CB 3.43Å; L287-A291 PolarHBondContact O-N 3.19Å |
| 288 | V | 89.4 | Confident | 87.7 | Confident | 32 Ų | 32 | 36.1 Ų | 36.1 | 19% | 0.194 | 21% | 0.207 | C | C | . | . | H | α-helix | trans | -67 | -48.3 | 176.8 | -176.9 | 0 | 0 | 0 | 0 | 109.7 | C285 S286 N290 A291 V292 F306 T310 I313 | C285-V288 WeakPolarHBondContact O-CB 3.28Å; C285-V288 PolarHBondContact O-N 3.48Å; C285-V288 VanDerWaalsContact O-N 3.07Å; S286-V288 VanDerWaalsContact C-N 3.26Å; S286-V288 PolarHBondContact O-N 2.99Å; V288-N290 VanDerWaalsContact C-N 3.33Å; V288-N290 PolarHBondContact O-N 3.37Å; V288-A291 PolarHBondContact O-N 3.37Å; V288-V292 WeakPolarHBondContact O-CG2 3.46Å; V288-V292 PolarHBondContact O-N 2.98Å; V288-F306 HydrophobicContact CG1-CE2 4.03Å; V288-F306 HydrophobicContact CG1-CZ 4.05Å; V288-T310 HydrophobicContact CG1-CG2 4.09Å; V288-T310 HydrophobicContact CG2-CG2 4.19Å; V288-I313 HydrophobicContact CG2-CD1 3.75Å |
| 289 | V | 90.1 | Very high | 87 | Confident | 39 Ų | 39 | 46.2 Ų | 46.2 | 24% | 0.236 | 24% | 0.243 | C | C | . | . | H | α-helix | trans | -58.4 | -47 | 176.2 | 174.3 | 0 | 0 | 0 | 0 | 111 | T27 C285 S286 A291 V292 L293 | T27-V289 HydrophobicContact CG2-CG2 3.91Å; C285-V289 PolarHBondContact O-N 2.57Å; S286-V289 PolarHBondContact O-N 3.44Å; V289-A291 VanDerWaalsContact C-N 3.35Å; V289-A291 PolarHBondContact O-N 2.91Å; V289-V292 PolarHBondContact O-N 2.95Å; V289-L293 HydrophobicContact CG1-CD1 3.52Å; V289-L293 WeakPolarHBondContact O-CD1 3.12Å; V289-L293 PolarHBondContact O-N 3.29Å |
| 290 | N | 87.5 | Confident | 85.9 | Confident | 43 Ų | 43 | 48 Ų | 48 | 23% | 0.23 | 26% | 0.256 | C | S | . | . | H | α-helix | trans | -55.2 | -48.8 | 176.9 | 173.1 | 62.5 | 0 | 0 | 0 | 111.9 | G31 P35 S286 V288 L293 S294 | G31-N290 VanDerWaalsContact O-CA 3.26Å; G31-N290 WeakPolarHBondContact O-CA 3.07Å; G31-N290 VanDerWaalsContact O-CB 3.31Å; G31-N290 WeakPolarHBondContact O-CB 3.47Å; G31-N290 PolarHBondContact O-OD1 3.41Å; P35-N290 WeakPolarHBondContact CD-OD1 3.19Å; P35-N290 WeakPolarHBondContact CG-OD1 3.41Å; S286-N290 VanDerWaalsContact O-CB 3.26Å; S286-N290 WeakPolarHBondContact O-CB 3.35Å; S286-N290 PolarHBondContact O-N 3.21Å; V288-N290 VanDerWaalsContact C-N 3.33Å; V288-N290 PolarHBondContact O-N 3.37Å; N290-L293 PolarHBondContact O-N 2.81Å; N290-S294 WeakPolarHBondContact O-CB 3.26Å; N290-S294 PolarHBondContact O-N 3.38Å; N290-S294 PolarHBondContact O-OG 2.99Å |
| 291 | A | 84.9 | Confident | 85.1 | Confident | 21 Ų | 21 | 55.2 Ų | 55.2 | 17% | 0.174 | 29% | 0.29 | C | S | . | . | H | α-helix | trans | -65 | -40.9 | -179.6 | 0 | 0 | 0 | 0 | 0 | 112 | L287 V288 V289 S294 A295 L302 F306 | L287-A291 WeakPolarHBondContact O-CB 3.43Å; L287-A291 PolarHBondContact O-N 3.19Å; V288-A291 PolarHBondContact O-N 3.37Å; V289-A291 VanDerWaalsContact C-N 3.35Å; V289-A291 PolarHBondContact O-N 2.91Å; A291-S294 PolarHBondContact O-N 3.46Å; A291-A295 WeakPolarHBondContact O-CB 3.33Å; A291-A295 PolarHBondContact O-N 3.5Å; A291-L302 HydrophobicContact CB-CD2 4.2Å; A291-F306 HydrophobicContact CB-CD2 3.44Å; A291-F306 VanDerWaalsContact CB-CD2 3.44Å; A291-F306 HydrophobicContact CB-CE2 3.38Å; A291-F306 HydrophobicContact CB-CG 4.46Å; A291-F306 HydrophobicContact CB-CZ 4.36Å |
| 292 | V | 86.9 | Confident | 84.2 | Confident | 66 Ų | 66 | 58.4 Ų | 58.4 | 40% | 0.4 | 31% | 0.306 | S | S | . | . | H | α-helix | trans | -64.5 | -48.4 | 176.2 | 173.5 | 0 | 0 | 0 | 0 | 111.3 | V288 V289 S294 A295 V296 F306 | V288-V292 WeakPolarHBondContact O-CG2 3.46Å; V288-V292 PolarHBondContact O-N 2.98Å; V289-V292 PolarHBondContact O-N 2.95Å; V292-S294 VanDerWaalsContact C-N 3.32Å; V292-S294 PolarHBondContact O-N 3.47Å; V292-A295 PolarHBondContact O-N 2.99Å; V292-V296 WeakPolarHBondContact O-CG2 3.3Å; V292-V296 PolarHBondContact O-N 3.26Å; V292-F306 HydrophobicContact CG2-CZ 4.09Å |
| 293 | L | 85.7 | Confident | 83.7 | Confident | 54 Ų | 54 | 59.8 Ų | 59.8 | 28% | 0.283 | 32% | 0.315 | S | S | . | . | H | α-helix | trans | -63.4 | -39.6 | 177 | -90.5 | 82.3 | 0 | 0 | 0 | 111.7 | A32 P35 V289 N290 A295 V296 L297 | A32-L293 HydrophobicContact CB-CD2 3.91Å; P35-L293 HydrophobicContact CB-CB 4.35Å; P35-L293 HydrophobicContact CG-CB 3.97Å; V289-L293 HydrophobicContact CG1-CD1 3.52Å; V289-L293 WeakPolarHBondContact O-CD1 3.12Å; V289-L293 PolarHBondContact O-N 3.29Å; N290-L293 PolarHBondContact O-N 2.81Å; L293-A295 VanDerWaalsContact C-N 3.34Å; L293-V296 PolarHBondContact O-N 2.99Å; L293-L297 HydrophobicContact CB-CD1 4.33Å; L293-L297 HydrophobicContact CD2-CD1 4.36Å; L293-L297 VanDerWaalsContact O-CB 3.24Å; L293-L297 WeakPolarHBondContact O-CB 3.23Å; L293-L297 WeakPolarHBondContact O-CG 3.35Å; L293-L297 PolarHBondContact O-N 3.19Å |
| 294 | S | 82.1 | Confident | 83.3 | Confident | 15 Ų | 15 | 62.9 Ų | 62.9 | 11% | 0.105 | 34% | 0.343 | C | S | . | . | H | α-helix | trans | -62.7 | -40.8 | 175.8 | -62.1 | 0 | 0 | 0 | 0 | 111.5 | P35 N290 A291 V292 L298 R299 | P35-S294 WeakPolarHBondContact CG-OG 3.49Å; N290-S294 WeakPolarHBondContact O-CB 3.26Å; N290-S294 PolarHBondContact O-N 3.38Å; N290-S294 PolarHBondContact O-OG 2.99Å; A291-S294 PolarHBondContact O-N 3.46Å; V292-S294 VanDerWaalsContact C-N 3.32Å; V292-S294 PolarHBondContact O-N 3.47Å; S294-L298 CarbonylContact O-C 3.57Å; S294-L298 WeakPolarHBondContact O-CA 3.48Å; S294-L298 VanDerWaalsContact O-CB 3.23Å; S294-L298 WeakPolarHBondContact O-CB 3.4Å; S294-L298 PolarHBondContact O-N 3.49Å; S294-R299 PolarHBondContact O-N 3.26Å |
| 295 | A | 82.1 | Confident | 82.9 | Confident | 23 Ų | 23 | 63.7 Ų | 63.7 | 19% | 0.19 | 35% | 0.35 | C | S | . | . | H | α-helix | trans | -65.4 | -41.2 | 175.7 | 0 | 0 | 0 | 0 | 0 | 112.2 | A291 V292 L293 R299 L300 L302 | A291-A295 WeakPolarHBondContact O-CB 3.33Å; A291-A295 PolarHBondContact O-N 3.5Å; V292-A295 PolarHBondContact O-N 2.99Å; L293-A295 VanDerWaalsContact C-N 3.34Å; A295-R299 WeakPolarHBondContact O-CA 3.4Å; A295-R299 PolarHBondContact O-N 2.91Å; A295-L300 WeakPolarHBondContact CB-O 3.23Å; A295-L302 HydrophobicContact CB-CD1 4.36Å; A295-L302 HydrophobicContact CB-CD2 4.04Å; A295-L302 HydrophobicContact CB-CG 4.03Å |
| 296 | V | 83.9 | Confident | 82.5 | Confident | 110 Ų | 110 | 63.6 Ų | 63.6 | 67% | 0.667 | 35% | 0.347 | S | S | * | . | H | α-helix | trans | -74.1 | -48 | -179.3 | 174.1 | 0 | 0 | 0 | 0 | 112.1 | V292 L293 | V292-V296 WeakPolarHBondContact O-CG2 3.3Å; V292-V296 PolarHBondContact O-N 3.26Å; L293-V296 PolarHBondContact O-N 2.99Å |
| 297 | L | 79.3 | Confident | 82.5 | Confident | 87 Ų | 87 | 69.6 Ų | 69.6 | 46% | 0.455 | 37% | 0.373 | S | S | . | . | H | α-helix | trans | -81.8 | -40.2 | -173.3 | -65 | 171.5 | 0 | 0 | 0 | 112.6 | P35 L293 | P35-L297 HydrophobicContact CB-CD1 4.18Å; L293-L297 HydrophobicContact CB-CD1 4.33Å; L293-L297 HydrophobicContact CD2-CD1 4.36Å; L293-L297 VanDerWaalsContact O-CB 3.24Å; L293-L297 WeakPolarHBondContact O-CB 3.23Å; L293-L297 WeakPolarHBondContact O-CG 3.35Å; L293-L297 PolarHBondContact O-N 3.19Å |
| 298 | L | 76.9 | Confident | 82.7 | Confident | 69 Ų | 69 | 71.5 Ų | 71.5 | 36% | 0.361 | 38% | 0.383 | S | S | . | . | H | α-helix | trans | -106.5 | 3.5 | -173.3 | -49.3 | 172.6 | 0 | 0 | 0 | 112.5 | A38 L39 S294 L300 | A38-L298 HydrophobicContact CB-CD1 3.9Å; A38-L298 HydrophobicContact CB-CD2 4.37Å; L39-L298 HydrophobicContact CD2-CD2 4.38Å; S294-L298 CarbonylContact O-C 3.57Å; S294-L298 WeakPolarHBondContact O-CA 3.48Å; S294-L298 VanDerWaalsContact O-CB 3.23Å; S294-L298 WeakPolarHBondContact O-CB 3.4Å; S294-L298 PolarHBondContact O-N 3.49Å; L298-L300 HydrophobicContact CB-CD1 3.88Å; L298-L300 HydrophobicContact CB-CG 4.22Å; L298-L300 HydrophobicContact CD1-CD1 4.01Å; L298-L300 PolarHBondContact O-N 3.41Å |
| 299 | R | 76.3 | Confident | 82.7 | Confident | 226 Ų | 226 | 70 Ų | 70 | 85% | 0.853 | 37% | 0.374 | S | S | * | . | trans | 54.8 | 32 | -179.3 | -58.9 | -172.2 | -179.8 | -156.5 | 1.1 | 114.1 | S294 A295 | S294-R299 PolarHBondContact O-N 3.26Å; A295-R299 WeakPolarHBondContact O-CA 3.4Å; A295-R299 PolarHBondContact O-N 2.91Å | ||
| 300 | L | 71.3 | Confident | 82.7 | Confident | 94 Ų | 94 | 70.3 Ų | 70.3 | 49% | 0.492 | 38% | 0.376 | S | S | . | . | P | Polyproline II helix | trans | -71.7 | 142.8 | 177 | -76.8 | 154.7 | 0 | 0 | 0 | 111.6 | A295 L298 | A295-L300 WeakPolarHBondContact CB-O 3.23Å; L298-L300 HydrophobicContact CB-CD1 3.88Å; L298-L300 HydrophobicContact CB-CG 4.22Å; L298-L300 HydrophobicContact CD1-CD1 4.01Å; L298-L300 PolarHBondContact O-N 3.41Å |
| 301 | Q | 74.4 | Confident | 83.1 | Confident | 170 Ų | 170 | 72.9 Ų | 72.9 | 79% | 0.794 | 39% | 0.389 | S | S | * | . | P | Polyproline II helix | trans | -80.7 | 128.4 | 175.4 | -67.3 | -171.5 | -17.8 | 0 | 0 | 110.9 | T303 | Q301-T303 PolarHBondContact O-N 3.42Š|
| 302 | L | 75.8 | Confident | 83.5 | Confident | 73 Ų | 73 | 73.1 Ų | 73.1 | 38% | 0.382 | 39% | 0.388 | S | S | . | . | P | Polyproline II helix | trans | -76.3 | 122.2 | 175.3 | -65.2 | 170.2 | 0 | 0 | 0 | 109.7 | A291 A295 F306 F307 | A291-L302 HydrophobicContact CB-CD2 4.2Å; A295-L302 HydrophobicContact CB-CD1 4.36Å; A295-L302 HydrophobicContact CB-CD2 4.04Å; A295-L302 HydrophobicContact CB-CG 4.03Å; L302-F306 HydrophobicContact CB-CD1 4.15Å; L302-F306 HydrophobicContact CD1-CD1 4.25Å; L302-F306 HydrophobicContact CD1-CE1 4.03Å; L302-F306 HydrophobicContact CD2-CD1 3.85Å; L302-F306 HydrophobicContact CD2-CD2 4.29Å; L302-F306 HydrophobicContact CD2-CE1 4.04Å; L302-F306 HydrophobicContact CD2-CE2 4.46Å; L302-F306 HydrophobicContact CD2-CG 3.97Å; L302-F306 HydrophobicContact CD2-CZ 4.34Å; L302-F306 HydrophobicContact CG-CD1 4.31Å; L302-F307 HydrophobicContact CB-CE2 4.36Å |
| 303 | T | 81.2 | Confident | 83.9 | Confident | 35 Ų | 35 | 70.2 Ų | 70.2 | 22% | 0.215 | 37% | 0.37 | C | S | . | . | P | Polyproline II helix | trans | -83.9 | 161.2 | 179.1 | 58.2 | 0 | 0 | 0 | 0 | 111.9 | Q301 A305 F306 | Q301-T303 PolarHBondContact O-N 3.42Å; T303-A305 PolarHBondContact O-N 3.37Å; T303-A305 VanDerWaalsContact O-N 3.15Å; T303-F306 WeakPolarHBondContact O-CB 3.41Å; T303-F306 PolarHBondContact O-N 3.49Å |
| 304 | A | 82.5 | Confident | 84.2 | Confident | 87 Ų | 87 | 68.7 Ų | 68.7 | 72% | 0.719 | 37% | 0.367 | S | S | * | . | H | α-helix | trans | -56.5 | -30.7 | 174.1 | 0 | 0 | 0 | 0 | 0 | 112.6 | F306 F307 L308 | A304-F306 VanDerWaalsContact C-N 3.27Å; A304-F306 PolarHBondContact O-N 3.21Å; A304-F307 PolarHBondContact O-N 3Å; A304-L308 PolarHBondContact O-N 3.16Å; A304-L308 VanDerWaalsContact O-N 3.07Å |
| 305 | A | 82.7 | Confident | 84.8 | Confident | 24 Ų | 24 | 71 Ų | 71 | 20% | 0.198 | 38% | 0.378 | C | S | . | . | H | α-helix | trans | -61.7 | -32.3 | 175.6 | 0 | 0 | 0 | 0 | 0 | 113.1 | T303 A309 | T303-A305 PolarHBondContact O-N 3.37Å; T303-A305 VanDerWaalsContact O-N 3.15Å; A305-A309 VanDerWaalsContact O-CB 3.31Å; A305-A309 WeakPolarHBondContact O-CB 3.34Å; A305-A309 PolarHBondContact O-N 3.13Å |
| 306 | F | 83.9 | Confident | 85.4 | Confident | 21 Ų | 21 | 70 Ų | 70 | 9% | 0.092 | 37% | 0.369 | C | S | . | . | H | α-helix | trans | -65.6 | -45.4 | 174.4 | 163.4 | -99.1 | 0 | 0 | 0 | 112 | V288 A291 V292 L302 T303 A304 L308 A309 T310 | V288-F306 HydrophobicContact CG1-CE2 4.03Å; V288-F306 HydrophobicContact CG1-CZ 4.05Å; A291-F306 HydrophobicContact CB-CD2 3.44Å; A291-F306 VanDerWaalsContact CB-CD2 3.44Å; A291-F306 HydrophobicContact CB-CE2 3.38Å; A291-F306 HydrophobicContact CB-CG 4.46Å; A291-F306 HydrophobicContact CB-CZ 4.36Å; V292-F306 HydrophobicContact CG2-CZ 4.09Å; L302-F306 HydrophobicContact CB-CD1 4.15Å; L302-F306 HydrophobicContact CD1-CD1 4.25Å; L302-F306 HydrophobicContact CD1-CE1 4.03Å; L302-F306 HydrophobicContact CD2-CD1 3.85Å; L302-F306 HydrophobicContact CD2-CD2 4.29Å; L302-F306 HydrophobicContact CD2-CE1 4.04Å; L302-F306 HydrophobicContact CD2-CE2 4.46Å; L302-F306 HydrophobicContact CD2-CG 3.97Å; L302-F306 HydrophobicContact CD2-CZ 4.34Å; L302-F306 HydrophobicContact CG-CD1 4.31Å; T303-F306 WeakPolarHBondContact O-CB 3.41Å; T303-F306 PolarHBondContact O-N 3.49Å; A304-F306 VanDerWaalsContact C-N 3.27Å; A304-F306 PolarHBondContact O-N 3.21Å; F306-L308 VanDerWaalsContact C-N 3.34Å; F306-L308 PolarHBondContact O-N 3.37Å; F306-A309 PolarHBondContact O-N 3.22Å; F306-T310 WeakPolarHBondContact O-CB 3.13Å; F306-T310 PolarHBondContact O-N 2.84Å; F306-T310 PolarHBondContact O-OG1 3.44Å |
| 307 | F | 88.5 | Confident | 85.8 | Confident | 128 Ų | 128 | 68.3 Ų | 68.3 | 56% | 0.561 | 36% | 0.355 | S | S | * | . | H | α-helix | trans | -64.3 | -41.8 | 178.1 | -68.8 | -76.5 | 0 | 0 | 0 | 111.3 | L302 A304 T310 L311 | L302-F307 HydrophobicContact CB-CE2 4.36Å; A304-F307 PolarHBondContact O-N 3Å; F307-T310 PolarHBondContact O-N 3.35Å; F307-L311 WeakPolarHBondContact O-CB 3.48Å; F307-L311 PolarHBondContact O-N 2.7Å |
| 308 | L | 91 | Very high | 86.4 | Confident | 84 Ų | 84 | 72 Ų | 72 | 44% | 0.44 | 36% | 0.363 | S | S | . | . | H | α-helix | trans | -61 | -47.5 | 174.1 | -179 | 60.6 | 0 | 0 | 0 | 111.6 | A304 F306 T310 L311 L312 | A304-L308 PolarHBondContact O-N 3.16Å; A304-L308 VanDerWaalsContact O-N 3.07Å; F306-L308 VanDerWaalsContact C-N 3.34Å; F306-L308 PolarHBondContact O-N 3.37Å; L308-T310 VanDerWaalsContact C-N 3.34Å; L308-T310 PolarHBondContact O-N 2.81Å; L308-L311 WeakPolarHBondContact O-CB 3.36Å; L308-L311 PolarHBondContact O-N 3.16Å; L308-L312 HydrophobicContact CD1-CD1 4.44Å; L308-L312 HydrophobicContact CD1-CG 4.36Å; L308-L312 HydrophobicContact CG-CD1 4.17Å; L308-L312 VanDerWaalsContact O-CG 3.29Å; L308-L312 WeakPolarHBondContact O-CG 3.4Å; L308-L312 PolarHBondContact O-N 2.96Å |
| 309 | A | 89.9 | Confident | 87.2 | Confident | 0 Ų | 0 | 71.1 Ų | 71.1 | 0% | 0 | 36% | 0.359 | C | S | . | . | H | α-helix | trans | -62.5 | -40.5 | 178.3 | 0 | 0 | 0 | 0 | 0 | 112.4 | A152 C155 C156 A305 F306 L311 L312 I313 | A152-A309 HydrophobicContact CB-CB 4.38Å; A152-A309 WeakPolarHBondContact O-CB 3.26Å; C155-A309 HydrophobicContact CB-CB 4.13Å; C156-A309 HydrophobicContact CB-CB 4.37Å; C156-A309 WeakPolarHBondContact SG-CB 3.45Å; A305-A309 VanDerWaalsContact O-CB 3.31Å; A305-A309 WeakPolarHBondContact O-CB 3.34Å; A305-A309 PolarHBondContact O-N 3.13Å; F306-A309 PolarHBondContact O-N 3.22Å; A309-L311 PolarHBondContact O-N 2.95Å; A309-L312 PolarHBondContact O-N 3.01Å; A309-I313 VanDerWaalsContact O-CG1 3.28Å; A309-I313 WeakPolarHBondContact O-CG1 3.47Å; A309-I313 PolarHBondContact O-N 3.25Å |
| 310 | T | 90.8 | Very high | 87.9 | Confident | 47 Ų | 47 | 61.5 Ų | 61.5 | 29% | 0.288 | 32% | 0.322 | S | S | . | . | H | α-helix | trans | -62.1 | -43.6 | 175.9 | -56.3 | 0 | 0 | 0 | 0 | 111.2 | V288 F306 F307 L308 I313 G314 | V288-T310 HydrophobicContact CG1-CG2 4.09Å; V288-T310 HydrophobicContact CG2-CG2 4.19Å; F306-T310 WeakPolarHBondContact O-CB 3.13Å; F306-T310 PolarHBondContact O-N 2.84Å; F306-T310 PolarHBondContact O-OG1 3.44Å; F307-T310 PolarHBondContact O-N 3.35Å; L308-T310 VanDerWaalsContact C-N 3.34Å; L308-T310 PolarHBondContact O-N 2.81Å; T310-I313 PolarHBondContact O-N 3.12Å; T310-G314 PolarHBondContact O-N 2.88Å |
| 311 | L | 94.5 | Very high | 88.7 | Confident | 97 Ų | 97 | 60.6 Ų | 60.6 | 51% | 0.508 | 31% | 0.313 | S | S | . | . | H | α-helix | trans | -60.7 | -46.5 | 174.6 | 178.4 | 65.6 | 0 | 0 | 0 | 111.4 | F307 L308 A309 G314 L315 | F307-L311 WeakPolarHBondContact O-CB 3.48Å; F307-L311 PolarHBondContact O-N 2.7Å; L308-L311 WeakPolarHBondContact O-CB 3.36Å; L308-L311 PolarHBondContact O-N 3.16Å; A309-L311 PolarHBondContact O-N 2.95Å; L311-G314 PolarHBondContact O-N 3.09Å; L311-L315 HydrophobicContact CD1-CD1 4.3Å; L311-L315 HydrophobicContact CD1-CG 4.42Å; L311-L315 HydrophobicContact CG-CD1 4.03Å; L311-L315 WeakPolarHBondContact O-CB 3.46Å; L311-L315 WeakPolarHBondContact O-CG 3.49Å; L311-L315 PolarHBondContact O-N 2.91Å |
| 312 | L | 94.7 | Very high | 89 | Confident | 26 Ų | 26 | 54.7 Ų | 54.7 | 14% | 0.136 | 30% | 0.297 | C | S | . | . | H | α-helix | trans | -62.8 | -41.4 | 178.9 | -70.2 | 173.8 | 0 | 0 | 0 | 112.1 | L148 A151 A152 L308 A309 L315 A316 | L148-L312 HydrophobicContact CD2-CD2 3.82Å; A151-L312 HydrophobicContact CB-CD1 4.27Å; A152-L312 HydrophobicContact CB-CB 3.68Å; A152-L312 HydrophobicContact CB-CD1 4.3Å; L308-L312 HydrophobicContact CD1-CD1 4.44Å; L308-L312 HydrophobicContact CD1-CG 4.36Å; L308-L312 HydrophobicContact CG-CD1 4.17Å; L308-L312 VanDerWaalsContact O-CG 3.29Å; L308-L312 WeakPolarHBondContact O-CG 3.4Å; L308-L312 PolarHBondContact O-N 2.96Å; A309-L312 PolarHBondContact O-N 3.01Å; L312-L315 PolarHBondContact O-N 3.27Å; L312-A316 VanDerWaalsContact O-CB 3.29Å; L312-A316 WeakPolarHBondContact O-CB 3.36Å; L312-A316 PolarHBondContact O-N 3.04Å |
| 313 | I | 94 | Very high | 88.4 | Confident | 4 Ų | 4 | 55.3 Ų | 55.3 | 2% | 0.021 | 31% | 0.308 | C | S | . | . | H | α-helix | trans | -62.6 | -44.5 | 174.7 | -68.6 | 161.1 | 0 | 0 | 0 | 110.4 | L149 A152 S284 C285 V288 A309 T310 A316 M317 | L149-I313 HydrophobicContact CD1-CG1 4.33Å; A152-I313 HydrophobicContact CB-CD1 4.28Å; A152-I313 HydrophobicContact CB-CG1 3.66Å; S284-I313 WeakPolarHBondContact O-CD1 3.36Å; C285-I313 VanDerWaalsContact SG-CG2 3.59Å; V288-I313 HydrophobicContact CG2-CD1 3.75Å; A309-I313 VanDerWaalsContact O-CG1 3.28Å; A309-I313 WeakPolarHBondContact O-CG1 3.47Å; A309-I313 PolarHBondContact O-N 3.25Å; T310-I313 PolarHBondContact O-N 3.12Å; I313-A316 PolarHBondContact O-N 3.37Å; I313-M317 HydrophobicContact CG2-CE 4.33Å; I313-M317 PolarHBondContact O-N 3.46Å |
| 314 | G | 93.2 | Very high | 86.9 | Confident | 23 Ų | 23 | 66.1 Ų | 66.1 | 24% | 0.237 | 35% | 0.345 | C | S | . | . | H | α-helix | trans | -62.9 | -41 | 176.9 | 0 | 0 | 0 | 0 | 0 | 113 | T310 L311 R318 | T310-G314 PolarHBondContact O-N 2.88Å; L311-G314 PolarHBondContact O-N 3.09Å; G314-R318 WeakPolarHBondContact O-CG 3.19Å; G314-R318 PolarHBondContact O-N 3.42Å; G314-R318 VanDerWaalsContact O-N 3.08Å |
| 315 | L | 94.6 | Very high | 87.2 | Confident | 64 Ų | 64 | 65.1 Ų | 65.1 | 34% | 0.335 | 33% | 0.326 | S | S | . | . | H | α-helix | trans | -65.2 | -44.2 | 173.5 | -72.9 | 169.1 | 0 | 0 | 0 | 111.6 | L148 L311 L312 M317 R318 L319 | L148-L315 HydrophobicContact CD1-CB 4.38Å; L311-L315 HydrophobicContact CD1-CD1 4.3Å; L311-L315 HydrophobicContact CD1-CG 4.42Å; L311-L315 HydrophobicContact CG-CD1 4.03Å; L311-L315 WeakPolarHBondContact O-CB 3.46Å; L311-L315 WeakPolarHBondContact O-CG 3.49Å; L311-L315 PolarHBondContact O-N 2.91Å; L312-L315 PolarHBondContact O-N 3.27Å; L315-M317 PolarHBondContact O-N 3.1Å; L315-R318 PolarHBondContact O-N 2.82Å; L315-L319 VanDerWaalsContact O-CB 3.28Å; L315-L319 WeakPolarHBondContact O-CB 3.41Å; L315-L319 PolarHBondContact O-N 2.88Å |
| 316 | A | 94.4 | Very high | 87.4 | Confident | 0 Ų | 0 | 67.2 Ų | 67.2 | 0% | 0 | 33% | 0.333 | C | S | . | . | H | α-helix | trans | -60.4 | -45 | 177 | 0 | 0 | 0 | 0 | 0 | 111.8 | A145 L148 L149 F281 L312 I313 L319 Y320 | A145-A316 HydrophobicContact CB-CB 4.49Å; A145-A316 WeakPolarHBondContact CB-O 3.2Å; A145-A316 VanDerWaalsContact O-CB 3.31Å; A145-A316 WeakPolarHBondContact O-CB 3.2Å; L148-A316 HydrophobicContact CB-CB 3.98Å; L149-A316 HydrophobicContact CB-CB 4.39Å; L149-A316 HydrophobicContact CD1-CB 4.23Å; F281-A316 HydrophobicContact CE1-CB 3.94Å; L312-A316 VanDerWaalsContact O-CB 3.29Å; L312-A316 WeakPolarHBondContact O-CB 3.36Å; L312-A316 PolarHBondContact O-N 3.04Å; I313-A316 PolarHBondContact O-N 3.37Å; A316-L319 PolarHBondContact O-N 3.37Å; A316-Y320 VanDerWaalsContact O-CB 3.32Å; A316-Y320 WeakPolarHBondContact O-CB 3.3Å; A316-Y320 PolarHBondContact O-N 3.1Å |
| 317 | M | 92.2 | Very high | 87.6 | Confident | 75 Ų | 75 | 69.8 Ų | 69.8 | 37% | 0.369 | 35% | 0.346 | S | S | . | . | H | α-helix | trans | -61.4 | -46.2 | 176 | -78.8 | -162.5 | -67.3 | 0 | 0 | 111.8 | F281 C285 I313 L315 L319 Y320 Y321 | F281-M317 HydrophobicContact CD1-CG 3.71Å; F281-M317 HydrophobicContact CE1-CG 4.01Å; C285-M317 VanDerWaalsContact SG-SD 3.62Å; I313-M317 HydrophobicContact CG2-CE 4.33Å; I313-M317 PolarHBondContact O-N 3.46Å; L315-M317 PolarHBondContact O-N 3.1Å; M317-L319 VanDerWaalsContact C-N 3.32Å; M317-L319 PolarHBondContact O-N 3.08Å; M317-Y320 PolarHBondContact O-N 3.34Å; M317-Y321 WeakPolarHBondContact O-CB 3.36Å; M317-Y321 PolarHBondContact O-N 3.04Å |
| 318 | R | 92.4 | Very high | 87.5 | Confident | 166 Ų | 166 | 66.4 Ų | 66.4 | 63% | 0.626 | 33% | 0.333 | S | S | * | . | H | α-helix | trans | -63.2 | -37.9 | 176.7 | -75.7 | -167.2 | -69.7 | 179.4 | -2.5 | 112.2 | G314 L315 G322 | G314-R318 WeakPolarHBondContact O-CG 3.19Å; G314-R318 PolarHBondContact O-N 3.42Å; G314-R318 VanDerWaalsContact O-N 3.08Å; L315-R318 PolarHBondContact O-N 2.82Å; R318-G322 WeakPolarHBondContact O-CA 3.04Å; R318-G322 PolarHBondContact O-N 2.92Å |
| 319 | L | 92.9 | Very high | 87.3 | Confident | 50 Ų | 50 | 65.3 Ų | 65.3 | 26% | 0.262 | 33% | 0.327 | S | S | . | . | H | α-helix | trans | -74.6 | -32.2 | -179.2 | -172.7 | 64.9 | 0 | 0 | 0 | 112.7 | R141 L144 A145 L148 L315 A316 M317 | R141-L319 HydrophobicContact CB-CD1 4.03Å; R141-L319 HydrophobicContact CB-CG 4.24Å; R141-L319 HydrophobicContact CG-CD1 4.2Å; R141-L319 WeakPolarHBondContact O-CD2 3.38Å; R141-L319 WeakPolarHBondContact O-CG 3.37Å; L144-L319 HydrophobicContact CB-CD2 3.8Å; L144-L319 HydrophobicContact CD2-CD2 3.73Å; L144-L319 HydrophobicContact CG-CD2 3.63Å; A145-L319 HydrophobicContact CB-CB 4.03Å; A145-L319 HydrophobicContact CB-CD2 4.09Å; A145-L319 HydrophobicContact CB-CG 4.16Å; L148-L319 HydrophobicContact CD1-CD2 4.07Å; L315-L319 VanDerWaalsContact O-CB 3.28Å; L315-L319 WeakPolarHBondContact O-CB 3.41Å; L315-L319 PolarHBondContact O-N 2.88Å; A316-L319 PolarHBondContact O-N 3.37Å; M317-L319 VanDerWaalsContact C-N 3.32Å; M317-L319 PolarHBondContact O-N 3.08Å |
| 320 | Y | 91 | Very high | 87.1 | Confident | 24 Ų | 24 | 69.6 Ų | 69.6 | 9% | 0.094 | 35% | 0.348 | C | S | . | . | H | α-helix | trans | -82.7 | -44.9 | 179.9 | -168.6 | -87.3 | 0 | 0 | 0 | 112.9 | Q142 A145 I277 F281 A316 M317 | Q142-Y320 HydrophobicContact CB-CD2 3.77Å; Q142-Y320 HydrophobicContact CB-CE2 3.73Å; Q142-Y320 HydrophobicContact CG-CD2 3.66Å; Q142-Y320 HydrophobicContact CG-CE2 3.62Å; Q142-Y320 HydrophobicContact CG-CG 4.38Å; A145-Y320 HydrophobicContact CB-CD2 4.23Å; I277-Y320 HydrophobicContact CD1-CE2 4.44Å; I277-Y320 WeakPolarHBondContact CD1-OH 3.45Å; I277-Y320 HydrophobicContact CG2-CD2 4.45Å; I277-Y320 HydrophobicContact CG2-CE1 4.11Å; I277-Y320 HydrophobicContact CG2-CE2 3.67Å; I277-Y320 VanDerWaalsContact CG2-CZ 3.47Å; I277-Y320 WeakPolarHBondContact CG2-OH 3.26Å; F281-Y320 AromaticContact CE2-CD1 3.74Å; F281-Y320 HydrophobicContact CE2-CD1 3.74Å; F281-Y320 AromaticContact CE2-CD2 3.81Å; F281-Y320 HydrophobicContact CE2-CD2 3.81Å; F281-Y320 HydrophobicContact CE2-CE1 4.22Å; F281-Y320 HydrophobicContact CE2-CE2 4.3Å; F281-Y320 AromaticContact CE2-CG 3.53Å; F281-Y320 HydrophobicContact CE2-CG 3.53Å; F281-Y320 HydrophobicContact CZ-CD1 4.27Å; F281-Y320 HydrophobicContact CZ-CD2 4.06Å; F281-Y320 AromaticContact CZ-CG 3.7Å; F281-Y320 HydrophobicContact CZ-CG 3.7Å; A316-Y320 VanDerWaalsContact O-CB 3.32Å; A316-Y320 WeakPolarHBondContact O-CB 3.3Å; A316-Y320 PolarHBondContact O-N 3.1Å; M317-Y320 PolarHBondContact O-N 3.34Å |
| 321 | Y | 88.6 | Confident | 86.9 | Confident | 75 Ų | 75 | 71.2 Ų | 71.2 | 29% | 0.294 | 35% | 0.353 | S | S | . | . | H | α-helix | trans | -103.9 | -17.8 | -175.4 | -63.1 | -71.3 | 0 | 0 | 0 | 113.7 | G6 T278 F281 M317 S323 | G6-Y321 VanDerWaalsContact O-CD1 3.29Å; G6-Y321 WeakPolarHBondContact O-CD1 3.47Å; T278-Y321 WeakPolarHBondContact CA-OH 3.32Å; T278-Y321 PolarHBondContact OG1-OH 2.85Å; T278-Y321 VanDerWaalsContact OG1-OH 3.11Å; F281-Y321 HydrophobicContact CD1-CE2 4.48Å; F281-Y321 AromaticContact CD2-CE2 3.82Å; F281-Y321 HydrophobicContact CD2-CE2 3.82Å; F281-Y321 HydrophobicContact CE2-CE2 4.09Å; F281-Y321 HydrophobicContact CG-CE2 4.05Å; M317-Y321 WeakPolarHBondContact O-CB 3.36Å; M317-Y321 PolarHBondContact O-N 3.04Å; Y321-S323 PolarHBondContact O-N 3.22Å |
| 322 | G | 80.3 | Confident | 86.3 | Confident | 45 Ų | 45 | 69.2 Ų | 69.2 | 46% | 0.464 | 34% | 0.341 | S | S | . | . | S | Bend | trans | -71.9 | 96.4 | 171.6 | 0 | 0 | 0 | 0 | 0 | 109.4 | R318 | R318-G322 WeakPolarHBondContact O-CA 3.04Å; R318-G322 PolarHBondContact O-N 2.92Å |
| 323 | S | 63.1 | Low | 85.6 | Confident | 86 Ų | 86 | 72.8 Ų | 72.8 | 60% | 0.601 | 36% | 0.358 | S | S | * | . | trans | -72.8 | 148.8 | -178.3 | 88.8 | 0 | 0 | 0 | 0 | 111.9 | Y321 | Y321-S323 PolarHBondContact O-N 3.22Š| ||
| 324 | R | 50.3 | Low | 84.8 | Confident | 262 Ų | 262 | 79.1 Ų | 79.1 | 99% | 0.989 | 39% | 0.388 | S | S | * | . | trans | 79.7 | 0 | 161.4 | -60.5 | 175.4 | -177 | -172.4 | 1 | 115.4 | R141 | R141-R324 PolarHBondContact NH1-OXT 3.01Å; R141-R324 PolarHBondContact NH2-OXT 3.31Å; R141-R324 VanDerWaalsContact NH2-OXT 3.14Å |
Retrieved 324 of 324 residues in 71.7 ms
(Link to these results)