| 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 | 62.8 | Low | 81.2 | Confident | 196 Ų | 196 | 72.8 Ų | 72.8 | 97% | 0.966 | 41% | 0.412 | S | S | * | . | 0 | -62.1 | 0 | -65.3 | -56.7 | 138.7 | 0 | 0 | 111.6 | V3 V4 G5 | M1-V3 PolarHBondContact O-N 2.72Å; M1-V4 PolarHBondContact O-N 2.75Å; M1-G5 PolarHBondContact O-N 3.48Å; M1-G5 VanDerWaalsContact O-N 3.16Å | |||
| 2 | V | 77 | Confident | 81.5 | Confident | 115 Ų | 115 | 68.2 Ų | 68.2 | 70% | 0.697 | 39% | 0.39 | S | S | * | . | H | α-helix | trans | -57.1 | -51.1 | -179.5 | 179.8 | 0 | 0 | 0 | 0 | 113.5 | V4 G5 I6 | V2-V4 VanDerWaalsContact C-N 3.27Å; V2-V4 PolarHBondContact O-N 2.89Å; V2-G5 WeakPolarHBondContact O-CA 3.16Å; V2-G5 PolarHBondContact O-N 3.31Å; V2-I6 HydrophobicContact CG1-CD1 4.11Å; V2-I6 PolarHBondContact O-N 2.99Å |
| 3 | V | 80.4 | Confident | 81.4 | Confident | 18 Ų | 18 | 65.5 Ų | 65.5 | 11% | 0.109 | 39% | 0.386 | C | S | . | . | H | α-helix | trans | -61.7 | -31.5 | -179.6 | -72.3 | 0 | 0 | 0 | 0 | 114.1 | M1 I6 L7 Q139 V140 T143 | M1-V3 PolarHBondContact O-N 2.72Å; V3-I6 PolarHBondContact O-N 3.38Å; V3-L7 PolarHBondContact O-N 2.96Å; V3-Q139 HydrophobicContact CB-CG 4.38Å; V3-Q139 HydrophobicContact CG1-CB 4.45Å; V3-Q139 HydrophobicContact CG1-CG 3.61Å; V3-V140 HydrophobicContact CB-CG2 4.07Å; V3-V140 HydrophobicContact CG2-CG2 4.28Å; V3-V140 WeakPolarHBondContact O-CG2 3.4Å; V3-T143 HydrophobicContact CG2-CG2 3.84Å |
| 4 | V | 83.9 | Confident | 81.1 | Confident | 64 Ų | 64 | 70.9 Ų | 70.9 | 39% | 0.388 | 40% | 0.396 | S | S | . | . | H | α-helix | trans | -70.1 | -40.3 | 174.9 | 175.1 | 0 | 0 | 0 | 0 | 109.9 | M1 V2 L7 L8 V140 | M1-V4 PolarHBondContact O-N 2.75Å; V2-V4 VanDerWaalsContact C-N 3.27Å; V2-V4 PolarHBondContact O-N 2.89Å; V4-L7 PolarHBondContact O-N 2.86Å; V4-L8 HydrophobicContact CG1-CD1 4.24Å; V4-L8 WeakPolarHBondContact O-CG 3.33Å; V4-L8 PolarHBondContact O-N 3.43Å; V4-V140 HydrophobicContact CG2-CG1 4.29Å; V4-V140 HydrophobicContact CG2-CG2 4.28Å |
| 5 | G | 83.3 | Confident | 81.1 | Confident | 40 Ų | 40 | 74.3 Ų | 74.3 | 41% | 0.412 | 42% | 0.42 | S | S | . | . | H | α-helix | trans | -61.5 | -41.5 | 173.2 | 0 | 0 | 0 | 0 | 0 | 112.7 | M1 V2 L8 A9 | M1-G5 PolarHBondContact O-N 3.48Å; M1-G5 VanDerWaalsContact O-N 3.16Å; V2-G5 WeakPolarHBondContact O-CA 3.16Å; V2-G5 PolarHBondContact O-N 3.31Å; G5-L8 PolarHBondContact O-N 3.43Å; G5-A9 WeakPolarHBondContact O-CB 3.35Å; G5-A9 PolarHBondContact O-N 3.13Å |
| 6 | I | 82.1 | Confident | 81.2 | Confident | 50 Ų | 50 | 74.1 Ų | 74.1 | 26% | 0.256 | 42% | 0.416 | S | S | . | . | H | α-helix | trans | -61.4 | -47.4 | 174.7 | -65.4 | 170.2 | 0 | 0 | 0 | 110.6 | V2 V3 L8 A9 Y10 | V2-I6 HydrophobicContact CG1-CD1 4.11Å; V2-I6 PolarHBondContact O-N 2.99Å; V3-I6 PolarHBondContact O-N 3.38Å; I6-L8 PolarHBondContact O-N 3.18Å; I6-A9 WeakPolarHBondContact O-CB 3.28Å; I6-A9 PolarHBondContact O-N 3.4Å; I6-A9 VanDerWaalsContact O-N 3.16Å; I6-Y10 HydrophobicContact CG2-CD2 3.87Å; I6-Y10 HydrophobicContact CG2-CE1 4.23Å; I6-Y10 HydrophobicContact CG2-CE2 3.33Å; I6-Y10 PolarHBondContact O-N 3.42Å |
| 7 | L | 84.9 | Confident | 81.4 | Confident | 28 Ų | 28 | 77.5 Ų | 77.5 | 15% | 0.147 | 43% | 0.428 | C | S | . | . | H | α-helix | trans | -60.7 | -43.5 | 177.1 | 176.8 | 60.7 | 0 | 0 | 0 | 112.1 | V3 V4 A9 Y10 L11 V133 V137 V140 | V3-L7 PolarHBondContact O-N 2.96Å; V4-L7 PolarHBondContact O-N 2.86Å; L7-A9 VanDerWaalsContact C-N 3.3Å; L7-A9 PolarHBondContact O-N 3.35Å; L7-Y10 PolarHBondContact O-N 3.09Å; L7-L11 HydrophobicContact CD1-CD1 4.24Å; L7-L11 HydrophobicContact CD1-CG 4.2Å; L7-L11 HydrophobicContact CG-CD1 4.07Å; L7-L11 HydrophobicContact CG-CG 4.47Å; L7-L11 WeakPolarHBondContact O-CB 3.27Å; L7-L11 WeakPolarHBondContact O-CG 3.46Å; L7-L11 PolarHBondContact O-N 2.68Å; L7-V133 HydrophobicContact CD1-CG1 4.47Å; L7-V137 HydrophobicContact CD1-CG2 3.82Å; L7-V137 HydrophobicContact CD2-CG2 4.34Å; L7-V140 HydrophobicContact CB-CG2 3.92Å; L7-V140 HydrophobicContact CD2-CB 4.35Å; L7-V140 HydrophobicContact CD2-CG2 3.84Å |
| 8 | L | 85.5 | Confident | 81.5 | Confident | 108 Ų | 108 | 84 Ų | 84 | 57% | 0.565 | 45% | 0.445 | S | S | * | . | H | α-helix | trans | -61.9 | -38.7 | 175.4 | -72.6 | 172 | 0 | 0 | 0 | 111.8 | V4 G5 I6 L11 A12 | V4-L8 HydrophobicContact CG1-CD1 4.24Å; V4-L8 WeakPolarHBondContact O-CG 3.33Å; V4-L8 PolarHBondContact O-N 3.43Å; G5-L8 PolarHBondContact O-N 3.43Å; I6-L8 PolarHBondContact O-N 3.18Å; L8-L11 PolarHBondContact O-N 3.12Å; L8-A12 WeakPolarHBondContact O-CB 3.26Å; L8-A12 PolarHBondContact O-N 3.09Å |
| 9 | A | 84.8 | Confident | 81.9 | Confident | 44 Ų | 44 | 88.2 Ų | 88.2 | 36% | 0.364 | 45% | 0.454 | S | S | . | . | H | α-helix | trans | -65.2 | -41.1 | 175.1 | 0 | 0 | 0 | 0 | 0 | 111.9 | G5 I6 L7 A12 G13 | G5-A9 WeakPolarHBondContact O-CB 3.35Å; G5-A9 PolarHBondContact O-N 3.13Å; I6-A9 WeakPolarHBondContact O-CB 3.28Å; I6-A9 PolarHBondContact O-N 3.4Å; I6-A9 VanDerWaalsContact O-N 3.16Å; L7-A9 VanDerWaalsContact C-N 3.3Å; L7-A9 PolarHBondContact O-N 3.35Å; A9-A12 PolarHBondContact O-N 3.46Å; A9-G13 PolarHBondContact O-N 3.31Å |
| 10 | Y | 83.5 | Confident | 82.2 | Confident | 70 Ų | 70 | 91.9 Ų | 91.9 | 28% | 0.275 | 46% | 0.462 | S | S | . | . | H | α-helix | trans | -66.4 | -41.5 | 175 | -65 | -26.2 | 0 | 0 | 0 | 112.5 | I6 L7 G13 W14 S132 | I6-Y10 HydrophobicContact CG2-CD2 3.87Å; I6-Y10 HydrophobicContact CG2-CE1 4.23Å; I6-Y10 HydrophobicContact CG2-CE2 3.33Å; I6-Y10 PolarHBondContact O-N 3.42Å; L7-Y10 PolarHBondContact O-N 3.09Å; Y10-G13 PolarHBondContact O-N 2.92Å; Y10-W14 PolarHBondContact O-N 2.72Å; Y10-W14 VanDerWaalsContact O-N 3.11Å; Y10-S132 WeakPolarHBondContact CD2-O 3.45Å; Y10-S132 WeakPolarHBondContact CE2-O 3.33Å |
| 11 | L | 84.7 | Confident | 82.5 | Confident | 68 Ų | 68 | 89.9 Ų | 89.9 | 36% | 0.356 | 45% | 0.453 | S | S | . | . | H | α-helix | trans | -64.7 | -41.4 | 174.7 | -71.6 | 171.3 | 0 | 0 | 0 | 112 | L7 L8 W14 V133 | L7-L11 HydrophobicContact CD1-CD1 4.24Å; L7-L11 HydrophobicContact CD1-CG 4.2Å; L7-L11 HydrophobicContact CG-CD1 4.07Å; L7-L11 HydrophobicContact CG-CG 4.47Å; L7-L11 WeakPolarHBondContact O-CB 3.27Å; L7-L11 WeakPolarHBondContact O-CG 3.46Å; L7-L11 PolarHBondContact O-N 2.68Å; L8-L11 PolarHBondContact O-N 3.12Å; L11-W14 WeakPolarHBondContact O-CB 3.49Å; L11-W14 PolarHBondContact O-N 3.33Å; L11-V133 HydrophobicContact CD2-CG1 3.88Å; L11-V133 HydrophobicContact CD2-CG2 4.33Å |
| 12 | A | 84.5 | Confident | 83.6 | Confident | 17 Ų | 17 | 83.2 Ų | 83.2 | 14% | 0.14 | 43% | 0.429 | C | S | . | . | H | α-helix | trans | -67.3 | -40.7 | 176.1 | 0 | 0 | 0 | 0 | 0 | 111.5 | L8 A9 W14 V15 L16 L21 L24 | L8-A12 WeakPolarHBondContact O-CB 3.26Å; L8-A12 PolarHBondContact O-N 3.09Å; A9-A12 PolarHBondContact O-N 3.46Å; A12-W14 PolarHBondContact O-N 3.34Å; A12-V15 PolarHBondContact O-N 3.23Å; A12-V15 VanDerWaalsContact O-N 3.11Å; A12-L16 HydrophobicContact CB-CD1 4.31Å; A12-L16 VanDerWaalsContact O-CB 3.29Å; A12-L16 WeakPolarHBondContact O-CB 3.41Å; A12-L16 PolarHBondContact O-N 2.71Å; A12-L21 HydrophobicContact CB-CD1 3.56Å; A12-L24 HydrophobicContact CB-CD2 3.68Å |
| 13 | G | 80.7 | Confident | 84.3 | Confident | 33 Ų | 33 | 81.7 Ų | 81.7 | 34% | 0.34 | 42% | 0.42 | S | S | . | . | H | α-helix | trans | -67.3 | -16.9 | 176.9 | 0 | 0 | 0 | 0 | 0 | 114 | A9 Y10 | A9-G13 PolarHBondContact O-N 3.31Å; Y10-G13 PolarHBondContact O-N 2.92Å |
| 14 | W | 77.1 | Confident | 84.7 | Confident | 141 Ų | 141 | 84.9 Ų | 84.9 | 53% | 0.534 | 44% | 0.435 | S | S | . | . | H | α-helix | trans | -72.7 | -31.8 | 171 | -173.8 | 17.8 | 0 | 0 | 0 | 112.5 | Y10 L11 A12 L130 | Y10-W14 PolarHBondContact O-N 2.72Å; Y10-W14 VanDerWaalsContact O-N 3.11Å; L11-W14 WeakPolarHBondContact O-CB 3.49Å; L11-W14 PolarHBondContact O-N 3.33Å; A12-W14 PolarHBondContact O-N 3.34Å; W14-L130 HydrophobicContact CH2-CD2 3.92Å; W14-L130 HydrophobicContact CZ2-CD2 3.83Å; W14-L130 HydrophobicContact CZ3-CD2 4.41Å |
| 15 | V | 81.6 | Confident | 84.8 | Confident | 123 Ų | 123 | 84.1 Ų | 84.1 | 75% | 0.745 | 44% | 0.441 | S | S | * | . | H | α-helix | trans | -105.1 | -29.4 | -174 | -174.2 | 0 | 0 | 0 | 0 | 112.3 | A12 | A12-V15 PolarHBondContact O-N 3.23Å; A12-V15 VanDerWaalsContact O-N 3.11Å |
| 16 | L | 82.6 | Confident | 85.1 | Confident | 70 Ų | 70 | 85.8 Ų | 85.8 | 37% | 0.366 | 45% | 0.445 | S | S | . | . | S | Bend | trans | -108.3 | 142.7 | -172 | -61.9 | 173.2 | 0 | 0 | 0 | 111.7 | A12 W20 L24 | A12-L16 HydrophobicContact CB-CD1 4.31Å; A12-L16 VanDerWaalsContact O-CB 3.29Å; A12-L16 WeakPolarHBondContact O-CB 3.41Å; A12-L16 PolarHBondContact O-N 2.71Å; L16-W20 HydrophobicContact CB-CB 4.27Å; L16-W20 HydrophobicContact CD2-CB 4.38Å; L16-L24 HydrophobicContact CD1-CD2 3.97Å |
| 17 | E | 84.3 | Confident | 85.4 | Confident | 132 Ų | 132 | 87.3 Ų | 87.3 | 62% | 0.617 | 46% | 0.457 | S | S | * | . | trans | -62.3 | 152.6 | 166.9 | -64.3 | -176.3 | 170 | 0 | 0 | 111.4 | R19 W20 L21 | E17-R19 PolarHBondContact O-N 2.86Å; E17-W20 PolarHBondContact O-N 3.12Å; E17-L21 PolarHBondContact O-N 2.87Å | ||
| 18 | W | 83.6 | Confident | 85.7 | Confident | 195 Ų | 195 | 90 Ų | 90 | 74% | 0.739 | 48% | 0.476 | S | S | * | . | H | α-helix | trans | -51.9 | -31.4 | -176.6 | 72.6 | -92.8 | 0 | 0 | 0 | 114.2 | A22 | W18-A22 WeakPolarHBondContact O-CB 3.4Å; W18-A22 PolarHBondContact O-N 2.98Å |
| 19 | R | 88.9 | Confident | 85.9 | Confident | 163 Ų | 163 | 88.5 Ų | 88.5 | 62% | 0.615 | 47% | 0.473 | S | S | * | . | H | α-helix | trans | -67.9 | -46.4 | 177.9 | -60.9 | 179.9 | 76.3 | -173.2 | 3.6 | 111.7 | E17 L21 A22 V23 | E17-R19 PolarHBondContact O-N 2.86Å; R19-L21 VanDerWaalsContact C-N 3.35Å; R19-A22 PolarHBondContact O-N 3.45Å; R19-V23 WeakPolarHBondContact O-CG2 3.16Å; R19-V23 PolarHBondContact O-N 2.89Å; R19-V23 VanDerWaalsContact O-N 3.13Å |
| 20 | W | 88.7 | Confident | 86.2 | Confident | 163 Ų | 163 | 90 Ų | 90 | 62% | 0.617 | 48% | 0.48 | S | S | * | . | H | α-helix | trans | -73.2 | -31.9 | 178.6 | -69 | 111.3 | 0 | 0 | 0 | 111.6 | L16 E17 A22 V23 L24 | L16-W20 HydrophobicContact CB-CB 4.27Å; L16-W20 HydrophobicContact CD2-CB 4.38Å; E17-W20 PolarHBondContact O-N 3.12Å; W20-A22 VanDerWaalsContact C-N 3.34Å; W20-V23 PolarHBondContact O-N 3.37Å; W20-L24 WeakPolarHBondContact O-CB 3.28Å; W20-L24 PolarHBondContact O-N 2.91Å |
| 21 | L | 87.4 | Confident | 86.6 | Confident | 50 Ų | 50 | 91.3 Ų | 91.3 | 26% | 0.262 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -61 | -43.2 | 170.1 | -174 | 64.4 | 0 | 0 | 0 | 111.6 | A12 E17 R19 L24 G25 | A12-L21 HydrophobicContact CB-CD1 3.56Å; E17-L21 PolarHBondContact O-N 2.87Å; R19-L21 VanDerWaalsContact C-N 3.35Å; L21-L24 PolarHBondContact O-N 3.5Å; L21-G25 PolarHBondContact O-N 3.11Å |
| 22 | A | 86.9 | Confident | 86.8 | Confident | 56 Ų | 56 | 93.4 Ų | 93.4 | 46% | 0.463 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -63 | -42.8 | 175.6 | 0 | 0 | 0 | 0 | 0 | 112 | W18 R19 W20 G25 C26 | W18-A22 WeakPolarHBondContact O-CB 3.4Å; W18-A22 PolarHBondContact O-N 2.98Å; R19-A22 PolarHBondContact O-N 3.45Å; W20-A22 VanDerWaalsContact C-N 3.34Å; A22-G25 PolarHBondContact O-N 3.37Å; A22-C26 PolarHBondContact O-N 2.83Å; A22-C26 PolarHBondContact O-SG 3.33Å |
| 23 | V | 89.9 | Confident | 87.2 | Confident | 83 Ų | 83 | 98.4 Ų | 98.4 | 50% | 0.503 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -62.1 | -44.4 | 175.4 | 174.1 | 0 | 0 | 0 | 0 | 111.2 | R19 W20 G25 C26 | R19-V23 WeakPolarHBondContact O-CG2 3.16Å; R19-V23 PolarHBondContact O-N 2.89Å; R19-V23 VanDerWaalsContact O-N 3.13Å; W20-V23 PolarHBondContact O-N 3.37Å; V23-G25 VanDerWaalsContact C-N 3.27Å; V23-G25 PolarHBondContact O-N 2.91Å; V23-C26 WeakPolarHBondContact O-CB 3.5Å; V23-C26 PolarHBondContact O-N 3.39Å; V23-C26 VanDerWaalsContact O-N 3.12Å |
| 24 | L | 89.1 | Confident | 87.8 | Confident | 84 Ų | 84 | 101.6 Ų | 101.6 | 44% | 0.44 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -61.3 | -37.8 | 175.6 | -175 | 66.2 | 0 | 0 | 0 | 111.4 | A12 L16 W20 L21 C26 V27 P28 | A12-L24 HydrophobicContact CB-CD2 3.68Å; L16-L24 HydrophobicContact CD1-CD2 3.97Å; W20-L24 WeakPolarHBondContact O-CB 3.28Å; W20-L24 PolarHBondContact O-N 2.91Å; L21-L24 PolarHBondContact O-N 3.5Å; L24-C26 PolarHBondContact O-N 3.37Å; L24-V27 WeakPolarHBondContact O-CB 3.31Å; L24-V27 PolarHBondContact O-N 3.06Å; L24-P28 VanDerWaalsContact O-CD 3.32Å; L24-P28 WeakPolarHBondContact O-CD 3.45Å |
| 25 | G | 86.6 | Confident | 88.5 | Confident | 48 Ų | 48 | 99.7 Ų | 99.7 | 50% | 0.495 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -63.1 | -24.4 | 175.3 | 0 | 0 | 0 | 0 | 0 | 114.3 | L21 A22 V23 V27 P29 | L21-G25 PolarHBondContact O-N 3.11Å; A22-G25 PolarHBondContact O-N 3.37Å; V23-G25 VanDerWaalsContact C-N 3.27Å; V23-G25 PolarHBondContact O-N 2.91Å; G25-V27 VanDerWaalsContact C-N 3.33Å; G25-P29 WeakPolarHBondContact O-CD 3.36Å |
| 26 | C | 88.9 | Confident | 88.8 | Confident | 76 Ų | 76 | 99.3 Ų | 99.3 | 51% | 0.514 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -75.8 | -20.7 | 173.5 | -63.6 | 0 | 0 | 0 | 0 | 113.1 | A22 V23 L24 P29 S30 | A22-C26 PolarHBondContact O-N 2.83Å; A22-C26 PolarHBondContact O-SG 3.33Å; V23-C26 WeakPolarHBondContact O-CB 3.5Å; V23-C26 PolarHBondContact O-N 3.39Å; V23-C26 VanDerWaalsContact O-N 3.12Å; L24-C26 PolarHBondContact O-N 3.37Å; C26-P29 WeakPolarHBondContact O-CD 3.29Å; C26-S30 WeakPolarHBondContact O-CB 3.5Å; C26-S30 PolarHBondContact O-N 3.14Å; C26-S30 PolarHBondContact O-OG 3.08Å; C26-S30 VanDerWaalsContact O-OG 3.04Å |
| 27 | V | 90.1 | Very high | 89.1 | Confident | 81 Ų | 81 | 100.9 Ų | 100.9 | 49% | 0.491 | 54% | 0.54 | S | S | . | . | H | α-helix | trans | -62.8 | -50.9 | -175.1 | 175.5 | 0 | 0 | 0 | 0 | 112.5 | L24 G25 S30 L31 | L24-V27 WeakPolarHBondContact O-CB 3.31Å; L24-V27 PolarHBondContact O-N 3.06Å; G25-V27 VanDerWaalsContact C-N 3.33Å; V27-S30 PolarHBondContact O-N 3.42Å; V27-L31 WeakPolarHBondContact O-CB 3.49Å; V27-L31 PolarHBondContact O-N 3.34Å |
| 28 | P | 89.3 | Confident | 89.3 | Confident | 84 Ų | 84 | 102 Ų | 102 | 55% | 0.545 | 54% | 0.543 | S | S | . | . | H | α-helix | trans | -62.9 | -44.3 | -179.3 | -16.8 | 28 | 0 | 0 | 0 | 113.9 | L24 L31 M32 | L24-P28 VanDerWaalsContact O-CD 3.32Å; L24-P28 WeakPolarHBondContact O-CD 3.45Å; P28-L31 PolarHBondContact O-N 3.38Å; P28-M32 WeakPolarHBondContact O-CB 3.45Å; P28-M32 PolarHBondContact O-N 3.33Å |
| 29 | P | 89.9 | Confident | 89.5 | Confident | 78 Ų | 78 | 97.7 Ų | 97.7 | 51% | 0.506 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -61.6 | -42.4 | 174 | -25.1 | 34.4 | 0 | 0 | 0 | 113.7 | G25 C26 M32 L33 | G25-P29 WeakPolarHBondContact O-CD 3.36Å; C26-P29 WeakPolarHBondContact O-CD 3.29Å; P29-M32 PolarHBondContact O-N 3.41Å; P29-L33 WeakPolarHBondContact O-CB 3.44Å; P29-L33 PolarHBondContact O-N 3.39Å |
| 30 | S | 91.3 | Very high | 89.3 | Confident | 74 Ų | 74 | 92.1 Ų | 92.1 | 52% | 0.517 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -65.4 | -40.5 | 177.7 | -65.5 | 0 | 0 | 0 | 0 | 112.2 | C26 V27 L33 L34 | C26-S30 WeakPolarHBondContact O-CB 3.5Å; C26-S30 PolarHBondContact O-N 3.14Å; C26-S30 PolarHBondContact O-OG 3.08Å; C26-S30 VanDerWaalsContact O-OG 3.04Å; V27-S30 PolarHBondContact O-N 3.42Å; S30-L33 PolarHBondContact O-N 3.22Å; S30-L34 PolarHBondContact O-N 3Å |
| 31 | L | 91.9 | Very high | 89.1 | Confident | 99 Ų | 99 | 89.3 Ų | 89.3 | 52% | 0.518 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -63.2 | -43.8 | 173.6 | -179.5 | 62.7 | 0 | 0 | 0 | 111.1 | V27 P28 L33 L34 L35 | V27-L31 WeakPolarHBondContact O-CB 3.49Å; V27-L31 PolarHBondContact O-N 3.34Å; P28-L31 PolarHBondContact O-N 3.38Å; L31-L33 VanDerWaalsContact C-N 3.34Å; L31-L33 PolarHBondContact O-N 3.13Å; L31-L34 PolarHBondContact O-N 3.02Å; L31-L35 HydrophobicContact CD1-CD1 4.36Å; L31-L35 HydrophobicContact CD1-CG 4.36Å; L31-L35 HydrophobicContact CG-CD1 4.1Å; L31-L35 HydrophobicContact CG-CG 4.5Å; L31-L35 WeakPolarHBondContact O-CB 3.4Å; L31-L35 VanDerWaalsContact O-CG 3.29Å; L31-L35 WeakPolarHBondContact O-CG 3.3Å; L31-L35 PolarHBondContact O-N 3.46Å |
| 32 | M | 90.1 | Very high | 88.8 | Confident | 111 Ų | 111 | 90.7 Ų | 90.7 | 55% | 0.547 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -61.4 | -41.6 | 176.4 | -178.2 | 176 | 169.5 | 0 | 0 | 111.9 | P28 P29 L35 M36 | P28-M32 WeakPolarHBondContact O-CB 3.45Å; P28-M32 PolarHBondContact O-N 3.33Å; P29-M32 PolarHBondContact O-N 3.41Å; M32-L35 PolarHBondContact O-N 3.08Å; M32-M36 HydrophobicContact CE-CE 3.54Å; M32-M36 HydrophobicContact CE-SD 4.11Å; M32-M36 WeakPolarHBondContact O-CB 3.38Å; M32-M36 WeakPolarHBondContact O-CG 3.49Å; M32-M36 PolarHBondContact O-N 3.27Å |
| 33 | L | 92.2 | Very high | 88.3 | Confident | 123 Ų | 123 | 88.4 Ų | 88.4 | 64% | 0.644 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -59.8 | -46.8 | 175.4 | -169.5 | 91.7 | 0 | 0 | 0 | 111.1 | P29 S30 L31 L35 M36 C37 | P29-L33 WeakPolarHBondContact O-CB 3.44Å; P29-L33 PolarHBondContact O-N 3.39Å; S30-L33 PolarHBondContact O-N 3.22Å; L31-L33 VanDerWaalsContact C-N 3.34Å; L31-L33 PolarHBondContact O-N 3.13Å; L33-L35 PolarHBondContact O-N 3.43Å; L33-M36 PolarHBondContact O-N 2.83Å; L33-C37 PolarHBondContact O-N 3.3Å; L33-C37 PolarHBondContact O-SG 2.9Å; L33-C37 VanDerWaalsContact O-SG 3.34Å |
| 34 | L | 93.8 | Very high | 87.6 | Confident | 100 Ų | 100 | 91.2 Ų | 91.2 | 52% | 0.524 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -64 | -41.1 | 179.1 | -174.9 | 142 | 0 | 0 | 0 | 111.8 | S30 L31 C37 F38 | S30-L34 PolarHBondContact O-N 3Å; L31-L34 PolarHBondContact O-N 3.02Å; L34-C37 WeakPolarHBondContact O-CB 3.47Å; L34-C37 PolarHBondContact O-N 3.32Å; L34-F38 HydrophobicContact CD2-CE2 3.92Å; L34-F38 HydrophobicContact CG-CE2 4.43Å; L34-F38 WeakPolarHBondContact O-CD2 3.26Å; L34-F38 WeakPolarHBondContact O-CE2 3.33Å |
| 35 | L | 90.9 | Very high | 87 | Confident | 100 Ų | 100 | 91.3 Ų | 91.3 | 52% | 0.524 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -67.7 | -36.4 | 175.8 | -69 | 174.8 | 0 | 0 | 0 | 112.3 | L31 M32 L33 C37 F38 | L31-L35 HydrophobicContact CD1-CD1 4.36Å; L31-L35 HydrophobicContact CD1-CG 4.36Å; L31-L35 HydrophobicContact CG-CD1 4.1Å; L31-L35 HydrophobicContact CG-CG 4.5Å; L31-L35 WeakPolarHBondContact O-CB 3.4Å; L31-L35 VanDerWaalsContact O-CG 3.29Å; L31-L35 WeakPolarHBondContact O-CG 3.3Å; L31-L35 PolarHBondContact O-N 3.46Å; M32-L35 PolarHBondContact O-N 3.08Å; L33-L35 PolarHBondContact O-N 3.43Å; L35-C37 VanDerWaalsContact C-N 3.26Å; L35-C37 PolarHBondContact O-N 3.15Å; L35-F38 PolarHBondContact O-N 3.46Å; L35-F38 VanDerWaalsContact O-N 3.11Å |
| 36 | M | 89 | Confident | 86.8 | Confident | 115 Ų | 115 | 89.4 Ų | 89.4 | 57% | 0.567 | 48% | 0.479 | S | S | * | . | H | α-helix | trans | -63.6 | -30.1 | 176.1 | -85.9 | -172.4 | 156.2 | 0 | 0 | 112.8 | M32 L33 F38 M39 | M32-M36 HydrophobicContact CE-CE 3.54Å; M32-M36 HydrophobicContact CE-SD 4.11Å; M32-M36 WeakPolarHBondContact O-CB 3.38Å; M32-M36 WeakPolarHBondContact O-CG 3.49Å; M32-M36 PolarHBondContact O-N 3.27Å; L33-M36 PolarHBondContact O-N 2.83Å; M36-F38 PolarHBondContact O-N 3.28Å; M36-F38 VanDerWaalsContact O-N 3.14Å; M36-M39 PolarHBondContact O-N 3.47Å |
| 37 | C | 89.1 | Confident | 86.2 | Confident | 104 Ų | 104 | 87.3 Ų | 87.3 | 70% | 0.703 | 46% | 0.463 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -60.3 | -21.7 | 173.9 | -64.1 | 0 | 0 | 0 | 0 | 113.6 | L33 L34 L35 | L33-C37 PolarHBondContact O-N 3.3Å; L33-C37 PolarHBondContact O-SG 2.9Å; L33-C37 VanDerWaalsContact O-SG 3.34Å; L34-C37 WeakPolarHBondContact O-CB 3.47Å; L34-C37 PolarHBondContact O-N 3.32Å; L35-C37 VanDerWaalsContact C-N 3.26Å; L35-C37 PolarHBondContact O-N 3.15Å |
| 38 | F | 88 | Confident | 85.2 | Confident | 154 Ų | 154 | 86.1 Ų | 86.1 | 68% | 0.675 | 46% | 0.456 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -96.8 | -7.4 | 177.8 | -59.3 | -73.9 | 0 | 0 | 0 | 113.5 | L34 L35 M36 | L34-F38 HydrophobicContact CD2-CE2 3.92Å; L34-F38 HydrophobicContact CG-CE2 4.43Å; L34-F38 WeakPolarHBondContact O-CD2 3.26Å; L34-F38 WeakPolarHBondContact O-CE2 3.33Å; L35-F38 PolarHBondContact O-N 3.46Å; L35-F38 VanDerWaalsContact O-N 3.11Å; M36-F38 PolarHBondContact O-N 3.28Å; M36-F38 VanDerWaalsContact O-N 3.14Å |
| 39 | M | 86.9 | Confident | 84.6 | Confident | 106 Ų | 106 | 87.4 Ų | 87.4 | 52% | 0.522 | 46% | 0.455 | S | S | . | . | S | Bend | trans | -87.6 | 130.8 | -178.4 | -76.3 | -67.9 | -71.2 | 0 | 0 | 110.7 | M36 F61 L62 | M36-M39 PolarHBondContact O-N 3.47Å; M39-F61 HydrophobicContact SD-CE1 4.02Å; M39-L62 HydrophobicContact CE-CD2 3.98Å |
| 40 | P | 85 | Confident | 84.1 | Confident | 46 Ų | 46 | 91.3 Ų | 91.3 | 30% | 0.299 | 47% | 0.466 | S | S | . | . | P | Polyproline II helix | trans | -69.6 | 152.1 | 174.4 | 30 | -33.8 | 0 | 0 | 0 | 110.9 | A58 F61 | P40-A58 HydrophobicContact CB-CB 3.94Å; P40-A58 HydrophobicContact CG-CB 4.33Å; P40-F61 VanDerWaalsContact CD-CE1 3.44Å; P40-F61 HydrophobicContact CG-CB 4.23Å; P40-F61 HydrophobicContact CG-CD1 3.38Å; P40-F61 HydrophobicContact CG-CE1 3.9Å; P40-F61 HydrophobicContact CG-CG 3.93Å |
| 41 | E | 84.4 | Confident | 83.7 | Confident | 104 Ų | 104 | 93.5 Ų | 93.5 | 49% | 0.486 | 46% | 0.463 | S | S | . | . | P | Polyproline II helix | trans | -63.5 | 156.6 | 177.2 | -165.6 | 52.2 | -113.4 | 0 | 0 | 111.6 | F45 L46 | E41-F45 HydrophobicContact CG-CB 4.41Å; E41-F45 HydrophobicContact CG-CD1 3.41Å; E41-F45 VanDerWaalsContact CG-CD1 3.41Å; E41-F45 HydrophobicContact CG-CE1 4Å; E41-F45 HydrophobicContact CG-CG 4.21Å; E41-L46 HydrophobicContact CB-CD1 4.24Å; E41-L46 HydrophobicContact CB-CD2 4.27Å; E41-L46 HydrophobicContact CB-CG 4.17Å; E41-L46 HydrophobicContact CG-CG 4.45Å |
| 42 | T | 81.7 | Confident | 83.2 | Confident | 78 Ų | 78 | 94.9 Ų | 94.9 | 48% | 0.479 | 46% | 0.461 | S | S | . | . | P | Polyproline II helix | trans | -61.4 | 132.1 | -177.5 | 53.3 | 0 | 0 | 0 | 0 | 111.8 | R44 F45 L46 | T42-R44 PolarHBondContact O-N 3.04Å; T42-R44 VanDerWaalsContact O-N 3.08Å; T42-F45 WeakPolarHBondContact O-CB 3.32Å; T42-F45 PolarHBondContact O-N 3.04Å; T42-F45 VanDerWaalsContact OG1-CB 3.3Å; T42-F45 WeakPolarHBondContact OG1-CB 3.42Å; T42-L46 PolarHBondContact O-N 3.38Å; T42-L46 VanDerWaalsContact O-N 3.13Å |
| 43 | P | 76.9 | Confident | 82.8 | Confident | 8 Ų | 8 | 98.1 Ų | 98.1 | 5% | 0.052 | 48% | 0.475 | C | S | . | . | H | α-helix | trans | -55.1 | -34.2 | -178.3 | -27.9 | 33.2 | 0 | 0 | 0 | 113.5 | L46 L47 A58 L59 L62 | P43-L46 PolarHBondContact O-N 2.88Å; P43-L47 VanDerWaalsContact O-CG 3.31Å; P43-L47 WeakPolarHBondContact O-CG 3.42Å; P43-L47 PolarHBondContact O-N 3.13Å; P43-A58 HydrophobicContact CG-CB 4.02Å; P43-L59 HydrophobicContact CB-CD1 4.44Å; P43-L59 HydrophobicContact CG-CB 4.26Å; P43-L62 HydrophobicContact CG-CD1 3.99Å |
| 44 | R | 74.1 | Confident | 82.5 | Confident | 142 Ų | 142 | 96.1 Ų | 96.1 | 54% | 0.536 | 46% | 0.462 | S | S | . | . | H | α-helix | trans | -64.5 | -43.2 | 177.5 | -61.2 | -176.7 | -164.4 | -173.6 | 2 | 112.1 | T42 L47 T48 W69 | T42-R44 PolarHBondContact O-N 3.04Å; T42-R44 VanDerWaalsContact O-N 3.08Å; R44-L47 PolarHBondContact O-N 3.06Å; R44-T48 WeakPolarHBondContact O-CG2 3.36Å; R44-T48 PolarHBondContact O-N 3.28Å; R44-T48 VanDerWaalsContact O-N 3.13Å; R44-W69 HydrophobicContact CG-CH2 3.94Å; R44-W69 HydrophobicContact CG-CZ2 4.45Å |
| 45 | F | 77.2 | Confident | 81.9 | Confident | 87 Ų | 87 | 91.5 Ų | 91.5 | 38% | 0.382 | 44% | 0.438 | S | S | . | . | H | α-helix | trans | -66.4 | -38.9 | 176.4 | 176.4 | -94.4 | 0 | 0 | 0 | 111.8 | E41 T42 L47 T48 Q49 | E41-F45 HydrophobicContact CG-CB 4.41Å; E41-F45 HydrophobicContact CG-CD1 3.41Å; E41-F45 VanDerWaalsContact CG-CD1 3.41Å; E41-F45 HydrophobicContact CG-CE1 4Å; E41-F45 HydrophobicContact CG-CG 4.21Å; T42-F45 WeakPolarHBondContact O-CB 3.32Å; T42-F45 PolarHBondContact O-N 3.04Å; T42-F45 VanDerWaalsContact OG1-CB 3.3Å; T42-F45 WeakPolarHBondContact OG1-CB 3.42Å; F45-L47 VanDerWaalsContact C-N 3.29Å; F45-L47 PolarHBondContact O-N 3.18Å; F45-T48 PolarHBondContact O-N 3.08Å; F45-T48 PolarHBondContact O-OG1 2.87Å; F45-Q49 HydrophobicContact CD1-CG 4.45Å; F45-Q49 HydrophobicContact CE1-CG 4.05Å; F45-Q49 HydrophobicContact CZ-CG 4.09Å; F45-Q49 WeakPolarHBondContact O-CG 3.38Å; F45-Q49 PolarHBondContact O-N 3.3Å; F45-Q49 VanDerWaalsContact O-N 3.15Å |
| 46 | L | 81.2 | Confident | 81.5 | Confident | 7 Ų | 7 | 88.7 Ų | 88.7 | 4% | 0.037 | 42% | 0.423 | C | S | . | . | H | α-helix | trans | -65.3 | -34.4 | 176 | -68.3 | 170.1 | 0 | 0 | 0 | 112.1 | E41 T42 P43 Q49 H50 R51 E54 A55 A58 | E41-L46 HydrophobicContact CB-CD1 4.24Å; E41-L46 HydrophobicContact CB-CD2 4.27Å; E41-L46 HydrophobicContact CB-CG 4.17Å; E41-L46 HydrophobicContact CG-CG 4.45Å; T42-L46 PolarHBondContact O-N 3.38Å; T42-L46 VanDerWaalsContact O-N 3.13Å; P43-L46 PolarHBondContact O-N 2.88Å; L46-Q49 PolarHBondContact O-N 3.07Å; L46-H50 PolarHBondContact O-N 3.37Å; L46-R51 WeakPolarHBondContact O-CA 3.18Å; L46-R51 PolarHBondContact O-N 3.4Å; L46-E54 HydrophobicContact CD1-CB 4.04Å; L46-E54 HydrophobicContact CD2-CB 4.34Å; L46-A55 HydrophobicContact CB-CB 3.74Å; L46-A58 HydrophobicContact CD1-CB 4.01Å |
| 47 | L | 76.4 | Confident | 81.4 | Confident | 32 Ų | 32 | 86 Ų | 86 | 17% | 0.168 | 42% | 0.419 | C | S | . | . | H | α-helix | trans | -68.3 | -37.1 | 173.9 | -71.9 | 170.8 | 0 | 0 | 0 | 112.9 | P43 R44 F45 Q49 H50 R52 A55 W69 P72 | P43-L47 VanDerWaalsContact O-CG 3.31Å; P43-L47 WeakPolarHBondContact O-CG 3.42Å; P43-L47 PolarHBondContact O-N 3.13Å; R44-L47 PolarHBondContact O-N 3.06Å; F45-L47 VanDerWaalsContact C-N 3.29Å; F45-L47 PolarHBondContact O-N 3.18Å; L47-Q49 VanDerWaalsContact C-N 3.27Å; L47-Q49 PolarHBondContact O-N 3.43Å; L47-H50 PolarHBondContact O-N 2.93Å; L47-H50 VanDerWaalsContact O-N 3.08Å; L47-R52 HydrophobicContact CD2-CB 4.39Å; L47-R52 HydrophobicContact CD2-CG 4.1Å; L47-A55 HydrophobicContact CD2-CB 3.86Å; L47-A55 HydrophobicContact CG-CB 3.74Å; L47-W69 HydrophobicContact CD1-CZ2 4.23Å; L47-P72 HydrophobicContact CD1-CG 3.91Å |
| 48 | T | 69.3 | Low | 81.2 | Confident | 57 Ų | 57 | 81.2 Ų | 81.2 | 35% | 0.35 | 39% | 0.387 | S | S | . | . | H | α-helix | trans | -68.1 | -30 | 176 | 59.2 | 0 | 0 | 0 | 0 | 112 | R44 F45 H50 E77 | R44-T48 WeakPolarHBondContact O-CG2 3.36Å; R44-T48 PolarHBondContact O-N 3.28Å; R44-T48 VanDerWaalsContact O-N 3.13Å; F45-T48 PolarHBondContact O-N 3.08Å; F45-T48 PolarHBondContact O-OG1 2.87Å; T48-H50 PolarHBondContact O-N 3.12Å; T48-E77 HydrophobicContact CG2-CG 3.95Å |
| 49 | Q | 78.3 | Confident | 80.9 | Confident | 110 Ų | 110 | 73.9 Ų | 73.9 | 51% | 0.514 | 36% | 0.355 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -80.7 | 10 | 171.9 | -64.9 | -68.1 | -24.8 | 0 | 0 | 113.6 | F45 L46 L47 R51 | F45-Q49 HydrophobicContact CD1-CG 4.45Å; F45-Q49 HydrophobicContact CE1-CG 4.05Å; F45-Q49 HydrophobicContact CZ-CG 4.09Å; F45-Q49 WeakPolarHBondContact O-CG 3.38Å; F45-Q49 PolarHBondContact O-N 3.3Å; F45-Q49 VanDerWaalsContact O-N 3.15Å; L46-Q49 PolarHBondContact O-N 3.07Å; L47-Q49 VanDerWaalsContact C-N 3.27Å; L47-Q49 PolarHBondContact O-N 3.43Å; Q49-R51 HydrophobicContact CB-CG 4.36Å; Q49-R51 PolarHBondContact O-N 3.06Å; Q49-R51 VanDerWaalsContact O-N 3.12Å |
| 50 | H | 78.3 | Confident | 80.8 | Confident | 160 Ų | 160 | 76.1 Ų | 76.1 | 74% | 0.741 | 36% | 0.357 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 58.2 | 18.1 | -175.7 | -59.6 | -66.1 | 0 | 0 | 0 | 115.1 | L46 L47 T48 R52 | L46-H50 PolarHBondContact O-N 3.37Å; L47-H50 PolarHBondContact O-N 2.93Å; L47-H50 VanDerWaalsContact O-N 3.08Å; T48-H50 PolarHBondContact O-N 3.12Å; H50-R52 PolarHBondContact O-N 3.11Å |
| 51 | R | 82.4 | Confident | 80.8 | Confident | 121 Ų | 121 | 80.1 Ų | 80.1 | 46% | 0.457 | 37% | 0.37 | S | S | . | . | trans | -92.9 | 63.7 | 179.8 | -66.8 | 169.6 | 76.1 | -177.1 | 9.9 | 111.6 | L46 Q49 Q53 E54 A55 | L46-R51 WeakPolarHBondContact O-CA 3.18Å; L46-R51 PolarHBondContact O-N 3.4Å; Q49-R51 HydrophobicContact CB-CG 4.36Å; Q49-R51 PolarHBondContact O-N 3.06Å; Q49-R51 VanDerWaalsContact O-N 3.12Å; R51-Q53 PolarHBondContact O-N 3.24Å; R51-E54 HydrophobicContact CB-CB 4.48Å; R51-E54 IonicContact CZ-OE1 2.86Å; R51-E54 IonicContact CZ-OE2 3.75Å; R51-E54 IonicContact NE-OE1 3.74Å; R51-E54 PolarHBondContact NE-OE1 3.34Å; R51-E54 IonicContact NE-OE2 2.71Å; R51-E54 PolarHBondContact NE-OE2 3.35Å; R51-E54 VanDerWaalsContact NE-OE2 3.12Å; R51-E54 IonicContact NH1-OE2 3.14Å; R51-E54 IonicContact NH2-OE1 2.83Å; R51-E54 PolarHBondContact NH2-OE1 3.13Å; R51-E54 IonicContact NH2-OE2 3.12Å; R51-E54 PolarHBondContact NH2-OE2 3.01Å; R51-E54 PolarHBondContact O-N 2.78Å; R51-A55 PolarHBondContact O-N 2.96Å; R51-A55 VanDerWaalsContact O-N 3.09Å | ||
| 52 | R | 81.2 | Confident | 80.8 | Confident | 128 Ų | 128 | 78.5 Ų | 78.5 | 48% | 0.483 | 37% | 0.365 | S | S | . | . | H | α-helix | trans | -60.3 | -39.3 | -173 | -169.3 | 172 | 177.9 | 111 | 5.5 | 114 | L47 H50 E54 A55 M56 D71 | L47-R52 HydrophobicContact CD2-CB 4.39Å; L47-R52 HydrophobicContact CD2-CG 4.1Å; H50-R52 PolarHBondContact O-N 3.11Å; R52-E54 PolarHBondContact O-N 2.87Å; R52-A55 WeakPolarHBondContact O-CB 3.33Å; R52-A55 PolarHBondContact O-N 2.96Å; R52-M56 WeakPolarHBondContact O-CG 3.49Å; R52-M56 PolarHBondContact O-N 3.21Å; R52-M56 VanDerWaalsContact O-N 3.09Å; R52-D71 IonicContact CZ-OD2 3.2Å; R52-D71 IonicContact NH1-OD2 3.55Å; R52-D71 PolarHBondContact NH1-OD2 3.36Å; R52-D71 IonicContact NH2-OD1 3.93Å; R52-D71 IonicContact NH2-OD2 2.72Å; R52-D71 PolarHBondContact NH2-OD2 2.98Å |
| 53 | Q | 83.4 | Confident | 80.5 | Confident | 178 Ų | 178 | 81.5 Ų | 81.5 | 83% | 0.832 | 37% | 0.368 | S | S | * | . | H | α-helix | trans | -62.9 | -42.2 | -179.6 | -72.1 | -177.1 | -13.4 | 0 | 0 | 112.4 | R51 M56 A57 | R51-Q53 PolarHBondContact O-N 3.24Å; Q53-M56 PolarHBondContact O-N 2.9Å; Q53-A57 PolarHBondContact O-N 3.16Å; Q53-A57 VanDerWaalsContact O-N 3.13Å |
| 54 | E | 84.5 | Confident | 80.5 | Confident | 82 Ų | 82 | 84.2 Ų | 84.2 | 38% | 0.383 | 40% | 0.396 | S | S | . | . | H | α-helix | trans | -71.7 | -36 | 177.7 | -65.1 | 179.5 | -142.7 | 0 | 0 | 112.1 | L46 R51 R52 M56 A57 A58 | L46-E54 HydrophobicContact CD1-CB 4.04Å; L46-E54 HydrophobicContact CD2-CB 4.34Å; R51-E54 HydrophobicContact CB-CB 4.48Å; R51-E54 IonicContact CZ-OE1 2.86Å; R51-E54 IonicContact CZ-OE2 3.75Å; R51-E54 IonicContact NE-OE1 3.74Å; R51-E54 PolarHBondContact NE-OE1 3.34Å; R51-E54 IonicContact NE-OE2 2.71Å; R51-E54 PolarHBondContact NE-OE2 3.35Å; R51-E54 VanDerWaalsContact NE-OE2 3.12Å; R51-E54 IonicContact NH1-OE2 3.14Å; R51-E54 IonicContact NH2-OE1 2.83Å; R51-E54 PolarHBondContact NH2-OE1 3.13Å; R51-E54 IonicContact NH2-OE2 3.12Å; R51-E54 PolarHBondContact NH2-OE2 3.01Å; R51-E54 PolarHBondContact O-N 2.78Å; R52-E54 PolarHBondContact O-N 2.87Å; E54-M56 VanDerWaalsContact C-N 3.29Å; E54-M56 PolarHBondContact O-N 3.35Å; E54-A57 PolarHBondContact O-N 3.08Å; E54-A58 WeakPolarHBondContact O-CB 3.29Å; E54-A58 PolarHBondContact O-N 3.17Å |
| 55 | A | 81.9 | Confident | 80.6 | Confident | 2 Ų | 2 | 80 Ų | 80 | 2% | 0.017 | 39% | 0.389 | C | S | . | . | H | α-helix | trans | -57.8 | -43.7 | 173.6 | 0 | 0 | 0 | 0 | 0 | 111.5 | L46 L47 R51 R52 A58 L59 | L46-A55 HydrophobicContact CB-CB 3.74Å; L47-A55 HydrophobicContact CD2-CB 3.86Å; L47-A55 HydrophobicContact CG-CB 3.74Å; R51-A55 PolarHBondContact O-N 2.96Å; R51-A55 VanDerWaalsContact O-N 3.09Å; R52-A55 WeakPolarHBondContact O-CB 3.33Å; R52-A55 PolarHBondContact O-N 2.96Å; A55-A58 PolarHBondContact O-N 3.08Å; A55-L59 VanDerWaalsContact O-CB 3.27Å; A55-L59 WeakPolarHBondContact O-CB 3.4Å; A55-L59 PolarHBondContact O-N 3.23Å |
| 56 | M | 82.9 | Confident | 80.2 | Confident | 41 Ų | 41 | 79.6 Ų | 79.6 | 20% | 0.202 | 39% | 0.388 | C | S | . | . | H | α-helix | trans | -67.5 | -36.7 | 176.9 | -62.4 | -58.5 | -74.7 | 0 | 0 | 112.1 | R52 Q53 E54 L59 R60 E66 | R52-M56 WeakPolarHBondContact O-CG 3.49Å; R52-M56 PolarHBondContact O-N 3.21Å; R52-M56 VanDerWaalsContact O-N 3.09Å; Q53-M56 PolarHBondContact O-N 2.9Å; E54-M56 VanDerWaalsContact C-N 3.29Å; E54-M56 PolarHBondContact O-N 3.35Å; M56-L59 PolarHBondContact O-N 3.43Å; M56-R60 WeakPolarHBondContact O-CG 3.3Å; M56-R60 PolarHBondContact O-N 2.77Å; M56-E66 HydrophobicContact CE-CG 3.76Å; M56-E66 VanDerWaalsContact CE-OE1 3.28Å; M56-E66 WeakPolarHBondContact CE-OE1 3.21Å; M56-E66 VanDerWaalsContact CE-OE2 3.26Å; M56-E66 WeakPolarHBondContact CE-OE2 3.45Å |
| 57 | A | 85.6 | Confident | 79.1 | Confident | 59 Ų | 59 | 87.8 Ų | 87.8 | 49% | 0.488 | 43% | 0.426 | S | S | . | . | H | α-helix | trans | -65 | -44.9 | 174.7 | 0 | 0 | 0 | 0 | 0 | 112 | Q53 E54 L59 R60 F61 | Q53-A57 PolarHBondContact O-N 3.16Å; Q53-A57 VanDerWaalsContact O-N 3.13Å; E54-A57 PolarHBondContact O-N 3.08Å; A57-L59 VanDerWaalsContact C-N 3.28Å; A57-L59 PolarHBondContact O-N 3.17Å; A57-R60 PolarHBondContact O-N 2.89Å; A57-F61 PolarHBondContact O-N 3.11Å |
| 58 | A | 84.8 | Confident | 78.4 | Confident | 3 Ų | 3 | 90.2 Ų | 90.2 | 3% | 0.025 | 46% | 0.459 | C | S | . | . | H | α-helix | trans | -61.8 | -38.2 | 174.2 | 0 | 0 | 0 | 0 | 0 | 111.6 | P40 P43 L46 E54 A55 F61 L62 | P40-A58 HydrophobicContact CB-CB 3.94Å; P40-A58 HydrophobicContact CG-CB 4.33Å; P43-A58 HydrophobicContact CG-CB 4.02Å; L46-A58 HydrophobicContact CD1-CB 4.01Å; E54-A58 WeakPolarHBondContact O-CB 3.29Å; E54-A58 PolarHBondContact O-N 3.17Å; A55-A58 PolarHBondContact O-N 3.08Å; A58-F61 PolarHBondContact O-N 3.44Å; A58-L62 WeakPolarHBondContact O-CB 3.26Å; A58-L62 VanDerWaalsContact O-CG 3.28Å; A58-L62 WeakPolarHBondContact O-CG 3.42Å; A58-L62 PolarHBondContact O-N 3.37Å |
| 59 | L | 83.6 | Confident | 78.3 | Confident | 1 Ų | 1 | 90.2 Ų | 90.2 | 1% | 0.005 | 45% | 0.453 | C | S | . | . | H | α-helix | trans | -66.4 | -43.4 | 178.2 | -161.7 | 143.3 | 0 | 0 | 0 | 112.3 | P43 A55 M56 A57 F61 L62 W63 S65 E66 W69 | P43-L59 HydrophobicContact CB-CD1 4.44Å; P43-L59 HydrophobicContact CG-CB 4.26Å; A55-L59 VanDerWaalsContact O-CB 3.27Å; A55-L59 WeakPolarHBondContact O-CB 3.4Å; A55-L59 PolarHBondContact O-N 3.23Å; M56-L59 PolarHBondContact O-N 3.43Å; A57-L59 VanDerWaalsContact C-N 3.28Å; A57-L59 PolarHBondContact O-N 3.17Å; L59-F61 VanDerWaalsContact C-N 3.33Å; L59-F61 PolarHBondContact O-N 2.85Å; L59-L62 PolarHBondContact O-N 3.46Å; L59-W63 HydrophobicContact CD1-CE3 3.98Å; L59-W63 HydrophobicContact CD1-CZ3 3.68Å; L59-W63 HydrophobicContact CD2-CE3 3.92Å; L59-W63 HydrophobicContact CD2-CZ3 4.47Å; L59-W63 HydrophobicContact CG-CE3 3.55Å; L59-W63 HydrophobicContact CG-CZ3 3.76Å; L59-W63 PolarHBondContact O-N 2.88Å; L59-S65 WeakPolarHBondContact CD2-O 3.33Å; L59-E66 HydrophobicContact CD2-CB 4.48Å; L59-E66 HydrophobicContact CD2-CG 4.15Å; L59-W69 HydrophobicContact CD1-CB 4.14Å; L59-W69 HydrophobicContact CD1-CD2 3.42Å; L59-W69 VanDerWaalsContact CD1-CD2 3.42Å; L59-W69 VanDerWaalsContact CD1-CE2 3.46Å; L59-W69 HydrophobicContact CD1-CE3 4.07Å; L59-W69 HydrophobicContact CD1-CG 3.46Å; L59-W69 VanDerWaalsContact CD1-CG 3.46Å; L59-W69 HydrophobicContact CD1-CZ2 4.05Å |
| 60 | R | 84 | Confident | 77.7 | Confident | 152 Ų | 152 | 93.2 Ų | 93.2 | 57% | 0.574 | 47% | 0.467 | S | S | * | . | H | α-helix | trans | -63 | -38.3 | 172.6 | -71.2 | 174.7 | -172.3 | 179.4 | 1.5 | 112.1 | M56 A57 G64 E66 | M56-R60 WeakPolarHBondContact O-CG 3.3Å; M56-R60 PolarHBondContact O-N 2.77Å; A57-R60 PolarHBondContact O-N 2.89Å; R60-G64 WeakPolarHBondContact O-CA 3.48Å; R60-G64 PolarHBondContact O-N 3.25Å; R60-E66 HydrophobicContact CG-CG 4.46Å; R60-E66 IonicContact CZ-OE1 3.16Å; R60-E66 IonicContact NE-OE1 2.75Å; R60-E66 PolarHBondContact NE-OE1 3.36Å; R60-E66 IonicContact NH2-OE1 2.72Å; R60-E66 PolarHBondContact NH2-OE1 3.24Å |
| 61 | F | 85.6 | Confident | 77 | Confident | 130 Ų | 130 | 88.8 Ų | 88.8 | 57% | 0.57 | 45% | 0.448 | S | S | * | . | H | α-helix | trans | -66 | -44 | 175.7 | -179 | -89.9 | 0 | 0 | 0 | 112.3 | M39 P40 A57 A58 L59 | M39-F61 HydrophobicContact SD-CE1 4.02Å; P40-F61 VanDerWaalsContact CD-CE1 3.44Å; P40-F61 HydrophobicContact CG-CB 4.23Å; P40-F61 HydrophobicContact CG-CD1 3.38Å; P40-F61 HydrophobicContact CG-CE1 3.9Å; P40-F61 HydrophobicContact CG-CG 3.93Å; A57-F61 PolarHBondContact O-N 3.11Å; A58-F61 PolarHBondContact O-N 3.44Å; L59-F61 VanDerWaalsContact C-N 3.33Å; L59-F61 PolarHBondContact O-N 2.85Å |
| 62 | L | 82.8 | Confident | 76.1 | Confident | 71 Ų | 71 | 85.1 Ų | 85.1 | 37% | 0.372 | 44% | 0.441 | S | S | . | . | H | α-helix | trans | -80.2 | -39.3 | -174.4 | -70.1 | 169 | 0 | 0 | 0 | 114 | M39 P43 A58 L59 | M39-L62 HydrophobicContact CE-CD2 3.98Å; P43-L62 HydrophobicContact CG-CD1 3.99Å; A58-L62 WeakPolarHBondContact O-CB 3.26Å; A58-L62 VanDerWaalsContact O-CG 3.28Å; A58-L62 WeakPolarHBondContact O-CG 3.42Å; A58-L62 PolarHBondContact O-N 3.37Å; L59-L62 PolarHBondContact O-N 3.46Å |
| 63 | W | 76.9 | Confident | 75 | Confident | 141 Ų | 141 | 84 Ų | 84 | 53% | 0.534 | 45% | 0.449 | S | S | . | . | H | α-helix | trans | -116.1 | -5.3 | -174.1 | -68.4 | -33.4 | 0 | 0 | 0 | 114.5 | L59 S65 W69 | L59-W63 HydrophobicContact CD1-CE3 3.98Å; L59-W63 HydrophobicContact CD1-CZ3 3.68Å; L59-W63 HydrophobicContact CD2-CE3 3.92Å; L59-W63 HydrophobicContact CD2-CZ3 4.47Å; L59-W63 HydrophobicContact CG-CE3 3.55Å; L59-W63 HydrophobicContact CG-CZ3 3.76Å; L59-W63 PolarHBondContact O-N 2.88Å; W63-S65 PolarHBondContact O-N 2.92Å; W63-W69 HydrophobicContact CE3-CE3 4.19Å; W63-W69 AromaticContact CH2-CE3 3.61Å; W63-W69 HydrophobicContact CH2-CE3 3.61Å; W63-W69 AromaticContact CH2-CH2 3.91Å; W63-W69 HydrophobicContact CH2-CH2 3.91Å; W63-W69 AromaticContact CH2-CZ3 3.17Å; W63-W69 HydrophobicContact CH2-CZ3 3.17Å; W63-W69 HydrophobicContact CZ2-CZ3 4.44Å; W63-W69 AromaticContact CZ3-CD2 3.92Å; W63-W69 HydrophobicContact CZ3-CD2 3.92Å; W63-W69 AromaticContact CZ3-CE3 3.16Å; W63-W69 HydrophobicContact CZ3-CE3 3.16Å; W63-W69 AromaticContact CZ3-CH2 3.98Å; W63-W69 HydrophobicContact CZ3-CH2 3.98Å; W63-W69 AromaticContact CZ3-CZ3 3.23Å; W63-W69 HydrophobicContact CZ3-CZ3 3.23Å |
| 64 | G | 77.3 | Confident | 73.5 | Confident | 64 Ų | 64 | 82.4 Ų | 82.4 | 66% | 0.66 | 45% | 0.445 | S | S | * | . | S | Bend | trans | 70 | -18 | 178.5 | 0 | 0 | 0 | 0 | 0 | 115.2 | R60 | R60-G64 WeakPolarHBondContact O-CA 3.48Å; R60-G64 PolarHBondContact O-N 3.25Å |
| 65 | S | 74.4 | Confident | 71.9 | Confident | 54 Ų | 54 | 82.1 Ų | 82.1 | 38% | 0.378 | 46% | 0.464 | S | S | . | . | trans | -147.5 | 158.7 | 178.1 | 85.2 | 0 | 0 | 0 | 0 | 112.1 | L59 W63 Q67 | L59-S65 WeakPolarHBondContact CD2-O 3.33Å; W63-S65 PolarHBondContact O-N 2.92Å; S65-Q67 PolarHBondContact OG-N 3.44Å | ||
| 66 | E | 69.3 | Low | 70.4 | Confident | 79 Ų | 79 | 84.9 Ų | 84.9 | 37% | 0.369 | 49% | 0.487 | S | S | . | . | trans | -90.9 | -1.3 | 175.3 | -62.5 | 175.1 | -171.3 | 0 | 0 | 112.5 | M56 L59 R60 G68 W69 | M56-E66 HydrophobicContact CE-CG 3.76Å; M56-E66 VanDerWaalsContact CE-OE1 3.28Å; M56-E66 WeakPolarHBondContact CE-OE1 3.21Å; M56-E66 VanDerWaalsContact CE-OE2 3.26Å; M56-E66 WeakPolarHBondContact CE-OE2 3.45Å; L59-E66 HydrophobicContact CD2-CB 4.48Å; L59-E66 HydrophobicContact CD2-CG 4.15Å; R60-E66 HydrophobicContact CG-CG 4.46Å; R60-E66 IonicContact CZ-OE1 3.16Å; R60-E66 IonicContact NE-OE1 2.75Å; R60-E66 PolarHBondContact NE-OE1 3.36Å; R60-E66 IonicContact NH2-OE1 2.72Å; R60-E66 PolarHBondContact NH2-OE1 3.24Å; E66-G68 PolarHBondContact O-N 3.16Å; E66-W69 PolarHBondContact O-N 2.91Å | ||
| 67 | Q | 57.7 | Low | 68.8 | Low | 178 Ų | 178 | 89.6 Ų | 89.6 | 83% | 0.832 | 51% | 0.509 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -72.1 | 121.4 | -173.8 | -78.6 | 178.6 | -18.6 | 0 | 0 | 111.3 | S65 | S65-Q67 PolarHBondContact OG-N 3.44Š|
| 68 | G | 63 | Low | 67.3 | Low | 83 Ų | 83 | 92.4 Ų | 92.4 | 86% | 0.856 | 51% | 0.512 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 88.9 | 6.5 | 179.5 | 0 | 0 | 0 | 0 | 0 | 114.9 | E66 | E66-G68 PolarHBondContact O-N 3.16Š|
| 69 | W | 66.9 | Low | 65.7 | Low | 57 Ų | 57 | 95.9 Ų | 95.9 | 22% | 0.216 | 54% | 0.536 | C | S | . | . | trans | -83.2 | 112.8 | 170.9 | 180 | -106.6 | 0 | 0 | 0 | 111 | R44 L47 L59 W63 E66 D71 | R44-W69 HydrophobicContact CG-CH2 3.94Å; R44-W69 HydrophobicContact CG-CZ2 4.45Å; L47-W69 HydrophobicContact CD1-CZ2 4.23Å; L59-W69 HydrophobicContact CD1-CB 4.14Å; L59-W69 HydrophobicContact CD1-CD2 3.42Å; L59-W69 VanDerWaalsContact CD1-CD2 3.42Å; L59-W69 VanDerWaalsContact CD1-CE2 3.46Å; L59-W69 HydrophobicContact CD1-CE3 4.07Å; L59-W69 HydrophobicContact CD1-CG 3.46Å; L59-W69 VanDerWaalsContact CD1-CG 3.46Å; L59-W69 HydrophobicContact CD1-CZ2 4.05Å; W63-W69 HydrophobicContact CE3-CE3 4.19Å; W63-W69 AromaticContact CH2-CE3 3.61Å; W63-W69 HydrophobicContact CH2-CE3 3.61Å; W63-W69 AromaticContact CH2-CH2 3.91Å; W63-W69 HydrophobicContact CH2-CH2 3.91Å; W63-W69 AromaticContact CH2-CZ3 3.17Å; W63-W69 HydrophobicContact CH2-CZ3 3.17Å; W63-W69 HydrophobicContact CZ2-CZ3 4.44Å; W63-W69 AromaticContact CZ3-CD2 3.92Å; W63-W69 HydrophobicContact CZ3-CD2 3.92Å; W63-W69 AromaticContact CZ3-CE3 3.16Å; W63-W69 HydrophobicContact CZ3-CE3 3.16Å; W63-W69 AromaticContact CZ3-CH2 3.98Å; W63-W69 HydrophobicContact CZ3-CH2 3.98Å; W63-W69 AromaticContact CZ3-CZ3 3.23Å; W63-W69 HydrophobicContact CZ3-CZ3 3.23Å; E66-W69 PolarHBondContact O-N 2.91Å; W69-D71 PolarHBondContact NE1-OD1 3.44Å | ||
| 70 | E | 64.6 | Low | 64.4 | Low | 173 Ų | 173 | 99.5 Ų | 99.5 | 81% | 0.808 | 55% | 0.552 | S | S | * | * | P | Polyproline II helix | trans | -89.5 | 128.6 | 165.8 | -71.7 | -179.2 | 168.7 | 0 | 0 | 109.3 | P72 | E70-P72 WeakPolarHBondContact O-CD 3.46Š|
| 71 | D | 64.4 | Low | 63.4 | Low | 67 Ų | 67 | 97.8 Ų | 97.8 | 36% | 0.358 | 55% | 0.55 | S | S | . | . | P | Polyproline II helix | trans | -59.9 | 124.8 | 175.3 | -86.4 | -24.3 | 0 | 0 | 0 | 109 | R52 W69 | R52-D71 IonicContact CZ-OD2 3.2Å; R52-D71 IonicContact NH1-OD2 3.55Å; R52-D71 PolarHBondContact NH1-OD2 3.36Å; R52-D71 IonicContact NH2-OD1 3.93Å; R52-D71 IonicContact NH2-OD2 2.72Å; R52-D71 PolarHBondContact NH2-OD2 2.98Å; W69-D71 PolarHBondContact NE1-OD1 3.44Å |
| 72 | P | 64.2 | Low | 62.4 | Low | 45 Ų | 45 | 98.2 Ų | 98.2 | 29% | 0.292 | 56% | 0.558 | S | S | . | * | P | Polyproline II helix | trans | -59.1 | 141.4 | 172.3 | 23.9 | -31.4 | 0 | 0 | 0 | 108.9 | L47 E70 I74 | L47-P72 HydrophobicContact CD1-CG 3.91Å; E70-P72 WeakPolarHBondContact O-CD 3.46Å; P72-I74 PolarHBondContact O-N 2.92Å |
| 73 | P | 57.9 | Low | 61.6 | Low | 103 Ų | 103 | 98.5 Ų | 98.5 | 67% | 0.669 | 57% | 0.57 | S | S | * | * | P | Polyproline II helix | trans | -54.2 | 119.9 | -179.6 | 15.1 | -25.8 | 0 | 0 | 0 | 110.3 | G75 A76 | P73-G75 PolarHBondContact O-N 3.34Å; P73-A76 HydrophobicContact CB-CB 4.44Å; P73-A76 HydrophobicContact CG-CB 3.97Å; P73-A76 VanDerWaalsContact O-CB 3.26Å; P73-A76 WeakPolarHBondContact O-CB 3.46Å; P73-A76 PolarHBondContact O-N 3.01Å; P73-A76 VanDerWaalsContact O-N 3.08Å |
| 74 | I | 51.1 | Low | 61.1 | Low | 146 Ų | 146 | 93.1 Ų | 93.1 | 75% | 0.749 | 55% | 0.551 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -60.6 | 118.2 | -178.3 | -59.2 | 170.6 | 0 | 0 | 0 | 107.8 | P72 | P72-I74 PolarHBondContact O-N 2.92Š|
| 75 | G | 52 | Low | 60.7 | Low | 75 Ų | 75 | 92 Ų | 92 | 77% | 0.773 | 53% | 0.53 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 102.9 | 5.3 | -175.8 | 0 | 0 | 0 | 0 | 0 | 115.6 | P73 E77 | P73-G75 PolarHBondContact O-N 3.34Å; G75-E77 PolarHBondContact O-N 3.44Å |
| 76 | A | 49.6 | Very low | 60.7 | Low | 61 Ų | 61 | 100 Ų | 100 | 50% | 0.504 | 55% | 0.552 | S | S | . | * | trans | -81 | 18.9 | 177.7 | 0 | 0 | 0 | 0 | 0 | 115.3 | P73 Q78 | P73-A76 HydrophobicContact CB-CB 4.44Å; P73-A76 HydrophobicContact CG-CB 3.97Å; P73-A76 VanDerWaalsContact O-CB 3.26Å; P73-A76 WeakPolarHBondContact O-CB 3.46Å; P73-A76 PolarHBondContact O-N 3.01Å; P73-A76 VanDerWaalsContact O-N 3.08Å; A76-Q78 PolarHBondContact O-N 3.04Å; A76-Q78 VanDerWaalsContact O-N 3.11Å | ||
| 77 | E | 49.5 | Very low | 61.1 | Low | 140 Ų | 140 | 100.6 Ų | 100.6 | 65% | 0.654 | 56% | 0.555 | S | S | * | * | trans | -79.3 | 83.1 | 154.8 | -78.8 | -159.9 | -176.5 | 0 | 0 | 107.7 | T48 G75 S79 | T48-E77 HydrophobicContact CG2-CG 3.95Å; G75-E77 PolarHBondContact O-N 3.44Å; E77-S79 PolarHBondContact O-N 2.99Å | ||
| 78 | Q | 53.3 | Low | 61.8 | Low | 117 Ų | 117 | 95.1 Ų | 95.1 | 55% | 0.547 | 54% | 0.535 | S | S | . | . | trans | -61.9 | 106.5 | 161.1 | -78.9 | 179.1 | -18.2 | 0 | 0 | 106.9 | A76 F80 | A76-Q78 PolarHBondContact O-N 3.04Å; A76-Q78 VanDerWaalsContact O-N 3.11Å; Q78-F80 PolarHBondContact O-N 3.16Å | ||
| 79 | S | 50.9 | Low | 62.5 | Low | 77 Ų | 77 | 91.3 Ų | 91.3 | 54% | 0.538 | 50% | 0.496 | S | S | . | . | trans | -40.5 | 124.8 | 160.1 | 37.9 | 0 | 0 | 0 | 0 | 108.5 | E77 H81 | E77-S79 PolarHBondContact O-N 2.99Å; S79-H81 PolarHBondContact O-CD2 3.16Å; S79-H81 PolarHBondContact O-N 3.28Å; S79-H81 PolarHBondContact OG-NE2 2.93Å | ||
| 80 | F | 56.2 | Low | 63.1 | Low | 76 Ų | 76 | 89 Ų | 89 | 33% | 0.333 | 49% | 0.488 | S | S | . | . | trans | -60.6 | 97 | -177.1 | -178.4 | -98.8 | 0 | 0 | 0 | 109.7 | Q78 L82 L85 V242 V245 | Q78-F80 PolarHBondContact O-N 3.16Å; F80-L82 HydrophobicContact CE1-CG 4.45Å; F80-L85 HydrophobicContact CE1-CD1 4.36Å; F80-L85 HydrophobicContact CZ-CD1 3.79Å; F80-L85 HydrophobicContact CZ-CD2 4.36Å; F80-L85 HydrophobicContact CZ-CG 3.98Å; F80-V242 HydrophobicContact CE2-CG1 4.48Å; F80-V245 HydrophobicContact CB-CG2 4.21Å; F80-V245 HydrophobicContact CD1-CG1 4.15Å; F80-V245 HydrophobicContact CD1-CG2 4.5Å; F80-V245 HydrophobicContact CD2-CB 3.79Å; F80-V245 HydrophobicContact CD2-CG1 3.97Å; F80-V245 HydrophobicContact CD2-CG2 3.71Å; F80-V245 HydrophobicContact CE1-CG1 3.79Å; F80-V245 HydrophobicContact CE2-CB 3.69Å; F80-V245 HydrophobicContact CE2-CG1 3.59Å; F80-V245 HydrophobicContact CE2-CG2 4.15Å; F80-V245 HydrophobicContact CG-CB 4.31Å; F80-V245 HydrophobicContact CG-CG1 4.22Å; F80-V245 HydrophobicContact CG-CG2 3.89Å; F80-V245 HydrophobicContact CZ-CB 4.14Å; F80-V245 HydrophobicContact CZ-CG1 3.48Å; F80-V245 VanDerWaalsContact CZ-CG1 3.48Å | ||
| 81 | H | 63.4 | Low | 64.1 | Low | 116 Ų | 116 | 85.3 Ų | 85.3 | 54% | 0.537 | 47% | 0.467 | S | S | . | . | trans | -87.8 | 121.8 | 171.8 | -75.3 | -77.1 | 0 | 0 | 0 | 108.1 | S79 A83 L84 | S79-H81 PolarHBondContact O-CD2 3.16Å; S79-H81 PolarHBondContact O-N 3.28Å; S79-H81 PolarHBondContact OG-NE2 2.93Å; H81-A83 PolarHBondContact O-N 3.28Å; H81-L84 HydrophobicContact CB-CD1 4.23Å; H81-L84 WeakPolarHBondContact O-CB 3.1Å; H81-L84 PolarHBondContact O-N 3.45Å | ||
| 82 | L | 64.6 | Low | 65.1 | Low | 140 Ų | 140 | 85.7 Ų | 85.7 | 73% | 0.733 | 47% | 0.465 | S | S | * | . | G | 310 helix | trans | -49.7 | -23.5 | 173.2 | -80.7 | 148 | 0 | 0 | 0 | 113 | F80 L84 L85 | F80-L82 HydrophobicContact CE1-CG 4.45Å; L82-L84 VanDerWaalsContact C-N 3.3Å; L82-L84 PolarHBondContact O-N 2.7Å; L82-L85 HydrophobicContact CD2-CD1 4.15Å; L82-L85 WeakPolarHBondContact O-CB 3.45Å; L82-L85 PolarHBondContact O-N 3.25Å |
| 83 | A | 65.4 | Low | 66.2 | Low | 76 Ų | 76 | 83.6 Ų | 83.6 | 63% | 0.628 | 45% | 0.452 | S | S | * | . | G | 310 helix | trans | -63.4 | -29 | 174 | 0 | 0 | 0 | 0 | 0 | 114.2 | H81 L85 R86 | H81-A83 PolarHBondContact O-N 3.28Å; A83-L85 VanDerWaalsContact C-N 3.28Å; A83-L85 PolarHBondContact O-N 2.92Å; A83-R86 WeakPolarHBondContact O-CB 3.45Å; A83-R86 PolarHBondContact O-N 3.41Å; A83-R86 VanDerWaalsContact O-N 3.13Å |
| 84 | L | 67.8 | Low | 67.7 | Low | 28 Ų | 28 | 80.7 Ų | 80.7 | 15% | 0.147 | 43% | 0.429 | C | S | . | . | G | 310 helix | trans | -65.4 | -32 | 177.6 | -73.2 | 156.1 | 0 | 0 | 0 | 111.6 | H81 L82 R86 Q87 I90 | H81-L84 HydrophobicContact CB-CD1 4.23Å; H81-L84 WeakPolarHBondContact O-CB 3.1Å; H81-L84 PolarHBondContact O-N 3.45Å; L82-L84 VanDerWaalsContact C-N 3.3Å; L82-L84 PolarHBondContact O-N 2.7Å; L84-R86 PolarHBondContact O-N 2.74Å; L84-Q87 WeakPolarHBondContact O-CB 3.5Å; L84-Q87 PolarHBondContact O-N 3.12Å; L84-Q87 VanDerWaalsContact O-N 3.09Å; L84-I90 HydrophobicContact CB-CD1 4.23Å; L84-I90 WeakPolarHBondContact O-CD1 3.15Å |
| 85 | L | 68.9 | Low | 69.5 | Low | 41 Ų | 41 | 77.9 Ų | 77.9 | 22% | 0.215 | 41% | 0.414 | C | S | . | . | G | 310 helix | trans | -62.4 | -13.3 | 174.7 | -72.4 | 167.4 | 0 | 0 | 0 | 113.3 | F80 L82 A83 Q87 I90 Y91 F94 | F80-L85 HydrophobicContact CE1-CD1 4.36Å; F80-L85 HydrophobicContact CZ-CD1 3.79Å; F80-L85 HydrophobicContact CZ-CD2 4.36Å; F80-L85 HydrophobicContact CZ-CG 3.98Å; L82-L85 HydrophobicContact CD2-CD1 4.15Å; L82-L85 WeakPolarHBondContact O-CB 3.45Å; L82-L85 PolarHBondContact O-N 3.25Å; A83-L85 VanDerWaalsContact C-N 3.28Å; A83-L85 PolarHBondContact O-N 2.92Å; L85-Q87 VanDerWaalsContact C-N 3.32Å; L85-I90 HydrophobicContact CD2-CG2 4.19Å; L85-Y91 VanDerWaalsContact O-CB 3.31Å; L85-Y91 WeakPolarHBondContact O-CB 2.99Å; L85-F94 HydrophobicContact CD2-CD2 4.4Å; L85-F94 HydrophobicContact CD2-CG 4.43Å |
| 86 | R | 73.3 | Confident | 71.4 | Confident | 223 Ų | 223 | 74.9 Ų | 74.9 | 84% | 0.842 | 38% | 0.38 | S | S | * | . | G | 310 helix | trans | -83.9 | -7.7 | 178.1 | -152.7 | 172 | -178.1 | 173.3 | 0 | 113 | A83 L84 | A83-R86 WeakPolarHBondContact O-CB 3.45Å; A83-R86 PolarHBondContact O-N 3.41Å; A83-R86 VanDerWaalsContact O-N 3.13Å; L84-R86 PolarHBondContact O-N 2.74Å |
| 87 | Q | 77.3 | Confident | 73.4 | Confident | 91 Ų | 91 | 72.1 Ų | 72.1 | 43% | 0.425 | 36% | 0.357 | S | S | . | . | S | Bend | trans | -79.5 | 138.1 | -179.2 | -64.2 | -176.7 | -1.1 | 0 | 0 | 111.9 | L84 L85 G89 I90 Y91 | L84-Q87 WeakPolarHBondContact O-CB 3.5Å; L84-Q87 PolarHBondContact O-N 3.12Å; L84-Q87 VanDerWaalsContact O-N 3.09Å; L85-Q87 VanDerWaalsContact C-N 3.32Å; Q87-G89 VanDerWaalsContact C-N 3.28Å; Q87-G89 PolarHBondContact O-N 3.03Å; Q87-I90 HydrophobicContact CB-CD1 4.42Å; Q87-I90 HydrophobicContact CB-CG1 4.38Å; Q87-I90 PolarHBondContact O-N 3.27Å; Q87-Y91 VanDerWaalsContact O-CD1 3.26Å; Q87-Y91 WeakPolarHBondContact O-CD1 3.37Å; Q87-Y91 PolarHBondContact O-N 2.85Å |
| 88 | P | 74.3 | Confident | 75.5 | Confident | 62 Ų | 62 | 67 Ų | 67 | 40% | 0.403 | 34% | 0.336 | S | S | . | . | H | α-helix | trans | -61.8 | -29.2 | -178 | 22.3 | -31.1 | 0 | 0 | 0 | 115.4 | I90 Y91 K92 | P88-I90 PolarHBondContact O-N 3.46Å; P88-Y91 VanDerWaalsContact CA-CD1 3.46Å; P88-Y91 HydrophobicContact CB-CD1 4.4Å; P88-Y91 HydrophobicContact CB-CE1 3.74Å; P88-K92 WeakPolarHBondContact O-CG 3.34Å |
| 89 | G | 76 | Confident | 77.4 | Confident | 4 Ų | 4 | 62.9 Ų | 62.9 | 4% | 0.041 | 32% | 0.32 | C | S | . | . | H | α-helix | trans | -68.7 | -16.6 | 172.2 | 0 | 0 | 0 | 0 | 0 | 114 | Q87 P93 | Q87-G89 VanDerWaalsContact C-N 3.28Å; Q87-G89 PolarHBondContact O-N 3.03Å; G89-P93 WeakPolarHBondContact O-CD 2.98Å; G89-P93 VanDerWaalsContact O-CG 3.26Å; G89-P93 WeakPolarHBondContact O-CG 3.36Å |
| 90 | I | 81.2 | Confident | 79.4 | Confident | 8 Ų | 8 | 59.3 Ų | 59.3 | 4% | 0.041 | 30% | 0.295 | C | S | . | . | H | α-helix | trans | -110.6 | -48.2 | -174.4 | -58.4 | -177.9 | 0 | 0 | 0 | 111.3 | L84 L85 Q87 P88 K92 P93 F94 P239 V242 | L84-I90 HydrophobicContact CB-CD1 4.23Å; L84-I90 WeakPolarHBondContact O-CD1 3.15Å; L85-I90 HydrophobicContact CD2-CG2 4.19Å; Q87-I90 HydrophobicContact CB-CD1 4.42Å; Q87-I90 HydrophobicContact CB-CG1 4.38Å; Q87-I90 PolarHBondContact O-N 3.27Å; P88-I90 PolarHBondContact O-N 3.46Å; I90-K92 VanDerWaalsContact C-N 3.34Å; I90-K92 PolarHBondContact O-N 2.84Å; I90-P93 WeakPolarHBondContact O-CD 3.36Å; I90-F94 WeakPolarHBondContact O-CB 3.26Å; I90-F94 PolarHBondContact O-N 3.28Å; I90-P239 HydrophobicContact CG1-CG 4.31Å; I90-V242 HydrophobicContact CD1-CG1 4.07Å; I90-V242 HydrophobicContact CD1-CG2 4.5Å; I90-V242 HydrophobicContact CG2-CG1 4.48Å; I90-V242 HydrophobicContact CG2-CG2 4.13Å |
| 91 | Y | 83.8 | Confident | 81.2 | Confident | 95 Ų | 95 | 55.7 Ų | 55.7 | 37% | 0.373 | 28% | 0.279 | S | S | . | . | H | α-helix | trans | -68.2 | -33.1 | -175.3 | 84.1 | -105.5 | 0 | 0 | 0 | 112.6 | L85 Q87 P88 F94 I95 | L85-Y91 VanDerWaalsContact O-CB 3.31Å; L85-Y91 WeakPolarHBondContact O-CB 2.99Å; Q87-Y91 VanDerWaalsContact O-CD1 3.26Å; Q87-Y91 WeakPolarHBondContact O-CD1 3.37Å; Q87-Y91 PolarHBondContact O-N 2.85Å; P88-Y91 VanDerWaalsContact CA-CD1 3.46Å; P88-Y91 HydrophobicContact CB-CD1 4.4Å; P88-Y91 HydrophobicContact CB-CE1 3.74Å; Y91-F94 PolarHBondContact O-N 2.82Å; Y91-I95 HydrophobicContact CD2-CD1 3.82Å; Y91-I95 HydrophobicContact CE2-CD1 4.45Å; Y91-I95 VanDerWaalsContact O-CG1 3.29Å; Y91-I95 WeakPolarHBondContact O-CG1 3.47Å; Y91-I95 PolarHBondContact O-N 2.86Å |
| 92 | K | 86.7 | Confident | 82.6 | Confident | 76 Ų | 76 | 51 Ų | 51 | 33% | 0.33 | 26% | 0.26 | S | S | . | . | H | α-helix | trans | -65.4 | -54.8 | 179.3 | -68.6 | 177.8 | -172.2 | 169.3 | 0 | 111.5 | P88 I90 F94 I95 I96 F311 | P88-K92 WeakPolarHBondContact O-CG 3.34Å; I90-K92 VanDerWaalsContact C-N 3.34Å; I90-K92 PolarHBondContact O-N 2.84Å; K92-F94 PolarHBondContact O-N 3.19Å; K92-I95 PolarHBondContact O-N 2.98Å; K92-I96 WeakPolarHBondContact O-CD1 3.28Å; K92-I96 VanDerWaalsContact O-CG1 3.28Å; K92-I96 WeakPolarHBondContact O-CG1 3.35Å; K92-I96 PolarHBondContact O-N 3.25Å; K92-I96 VanDerWaalsContact O-N 3.12Å; K92-F311 HydrophobicContact CB-CD1 3.69Å; K92-F311 HydrophobicContact CB-CE1 4.16Å; K92-F311 HydrophobicContact CB-CG 4.47Å; K92-F311 HydrophobicContact CD-CD1 4.13Å; K92-F311 PolarHBondContact NZ-O 2.84Å |
| 93 | P | 87.4 | Confident | 84 | Confident | 1 Ų | 1 | 46.1 Ų | 46.1 | 1% | 0.006 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -55.8 | -39.2 | 170.8 | -22.8 | 27.5 | 0 | 0 | 0 | 113.2 | G89 I90 I96 G97 I237 F238 F311 | G89-P93 WeakPolarHBondContact O-CD 2.98Å; G89-P93 VanDerWaalsContact O-CG 3.26Å; G89-P93 WeakPolarHBondContact O-CG 3.36Å; I90-P93 WeakPolarHBondContact O-CD 3.36Å; P93-I96 PolarHBondContact O-N 3.3Å; P93-G97 PolarHBondContact O-N 3.32Å; P93-I237 HydrophobicContact CB-CB 4.17Å; P93-I237 HydrophobicContact CB-CD1 4.25Å; P93-I237 HydrophobicContact CB-CG1 4.04Å; P93-I237 WeakPolarHBondContact O-CD1 2.98Å; P93-F238 HydrophobicContact CB-CD1 4Å; P93-F238 HydrophobicContact CB-CE1 4.07Å; P93-F311 HydrophobicContact CB-CE2 4.3Å; P93-F311 HydrophobicContact CG-CB 4.39Å; P93-F311 HydrophobicContact CG-CD1 4.29Å; P93-F311 HydrophobicContact CG-CD2 3.56Å; P93-F311 HydrophobicContact CG-CE1 4.43Å; P93-F311 HydrophobicContact CG-CE2 3.71Å; P93-F311 HydrophobicContact CG-CG 3.85Å; P93-F311 HydrophobicContact CG-CZ 4.13Å |
| 94 | F | 88.7 | Confident | 85.3 | Confident | 42 Ų | 42 | 42.9 Ų | 42.9 | 18% | 0.184 | 21% | 0.205 | C | C | . | . | H | α-helix | trans | -62.3 | -50 | -178.4 | -179.4 | -100.4 | 0 | 0 | 0 | 112.4 | L85 I90 Y91 K92 I96 G97 V98 F238 A246 I249 | L85-F94 HydrophobicContact CD2-CD2 4.4Å; L85-F94 HydrophobicContact CD2-CG 4.43Å; I90-F94 WeakPolarHBondContact O-CB 3.26Å; I90-F94 PolarHBondContact O-N 3.28Å; Y91-F94 PolarHBondContact O-N 2.82Å; K92-F94 PolarHBondContact O-N 3.19Å; F94-I96 VanDerWaalsContact C-N 3.28Å; F94-I96 PolarHBondContact O-N 2.65Å; F94-G97 PolarHBondContact O-N 2.92Å; F94-V98 HydrophobicContact CD1-CG2 4.43Å; F94-V98 HydrophobicContact CD2-CG2 4.38Å; F94-V98 HydrophobicContact CE1-CG2 4.06Å; F94-V98 HydrophobicContact CE2-CG2 4.01Å; F94-V98 HydrophobicContact CZ-CG2 3.85Å; F94-V98 WeakPolarHBondContact O-CB 3.48Å; F94-V98 WeakPolarHBondContact O-CG2 3.44Å; F94-V98 PolarHBondContact O-N 3.26Å; F94-F238 HydrophobicContact CB-CE1 4.43Å; F94-A246 HydrophobicContact CD2-CB 4.17Å; F94-I249 HydrophobicContact CE2-CB 4.03Å; F94-I249 HydrophobicContact CE2-CD1 3.84Å; F94-I249 HydrophobicContact CE2-CG2 3.95Å; F94-I249 HydrophobicContact CZ-CB 4.31Å; F94-I249 HydrophobicContact CZ-CD1 4Å; F94-I249 HydrophobicContact CZ-CG2 3.75Å |
| 95 | I | 90.2 | Very high | 86.4 | Confident | 87 Ų | 87 | 42.2 Ų | 42.2 | 45% | 0.446 | 20% | 0.201 | S | C | . | . | H | α-helix | trans | -59.9 | -42.7 | 175.2 | -68 | 172.2 | 0 | 0 | 0 | 109.9 | Y91 K92 G97 V98 S99 | Y91-I95 HydrophobicContact CD2-CD1 3.82Å; Y91-I95 HydrophobicContact CE2-CD1 4.45Å; Y91-I95 VanDerWaalsContact O-CG1 3.29Å; Y91-I95 WeakPolarHBondContact O-CG1 3.47Å; Y91-I95 PolarHBondContact O-N 2.86Å; K92-I95 PolarHBondContact O-N 2.98Å; I95-G97 PolarHBondContact O-N 2.97Å; I95-V98 PolarHBondContact O-N 3.11Å; I95-S99 WeakPolarHBondContact O-CB 3.42Å; I95-S99 PolarHBondContact O-N 3.19Å; I95-S99 PolarHBondContact O-OG 3.02Å |
| 96 | I | 91.3 | Very high | 87.4 | Confident | 12 Ų | 12 | 42.3 Ų | 42.3 | 6% | 0.062 | 20% | 0.202 | C | C | . | . | H | α-helix | trans | -59.7 | -48.7 | 177.8 | -66.2 | 162.9 | 0 | 0 | 0 | 111.5 | K92 P93 F94 S99 L100 I237 F291 C295 V296 F311 | K92-I96 WeakPolarHBondContact O-CD1 3.28Å; K92-I96 VanDerWaalsContact O-CG1 3.28Å; K92-I96 WeakPolarHBondContact O-CG1 3.35Å; K92-I96 PolarHBondContact O-N 3.25Å; K92-I96 VanDerWaalsContact O-N 3.12Å; P93-I96 PolarHBondContact O-N 3.3Å; F94-I96 VanDerWaalsContact C-N 3.28Å; F94-I96 PolarHBondContact O-N 2.65Å; I96-S99 PolarHBondContact O-N 2.88Å; I96-L100 HydrophobicContact CG2-CD1 3.82Å; I96-L100 HydrophobicContact CG2-CG 4.3Å; I96-L100 WeakPolarHBondContact O-CB 3.37Å; I96-L100 VanDerWaalsContact O-CG 3.23Å; I96-L100 WeakPolarHBondContact O-CG 3.45Å; I96-L100 PolarHBondContact O-N 3.27Å; I96-I237 HydrophobicContact CB-CD1 4.41Å; I96-I237 HydrophobicContact CG2-CD1 4.2Å; I96-F291 HydrophobicContact CG1-CZ 4.45Å; I96-C295 WeakPolarHBondContact CD1-O 3.43Å; I96-V296 HydrophobicContact CG2-CG2 4.1Å; I96-F311 HydrophobicContact CD1-CE1 3.56Å; I96-F311 HydrophobicContact CD1-CZ 3.77Å |
| 97 | G | 91.5 | Very high | 88.1 | Confident | 2 Ų | 2 | 31.8 Ų | 31.8 | 2% | 0.021 | 16% | 0.162 | C | C | . | . | H | α-helix | trans | -62.5 | -47 | 179.6 | 0 | 0 | 0 | 0 | 0 | 112.9 | P93 F94 I95 L100 M101 | P93-G97 PolarHBondContact O-N 3.32Å; F94-G97 PolarHBondContact O-N 2.92Å; I95-G97 PolarHBondContact O-N 2.97Å; G97-L100 PolarHBondContact O-N 2.99Å; G97-M101 WeakPolarHBondContact O-CG 3.15Å; G97-M101 PolarHBondContact O-N 2.91Å; G97-M101 VanDerWaalsContact O-N 3.11Å |
| 98 | V | 93.1 | Very high | 88.4 | Confident | 33 Ų | 33 | 27.8 Ų | 27.8 | 20% | 0.2 | 15% | 0.145 | C | C | . | . | H | α-helix | trans | -63.7 | -45.5 | 178.4 | 172.8 | 0 | 0 | 0 | 0 | 111 | F94 I95 M101 A102 I249 T253 | F94-V98 HydrophobicContact CD1-CG2 4.43Å; F94-V98 HydrophobicContact CD2-CG2 4.38Å; F94-V98 HydrophobicContact CE1-CG2 4.06Å; F94-V98 HydrophobicContact CE2-CG2 4.01Å; F94-V98 HydrophobicContact CZ-CG2 3.85Å; F94-V98 WeakPolarHBondContact O-CB 3.48Å; F94-V98 WeakPolarHBondContact O-CG2 3.44Å; F94-V98 PolarHBondContact O-N 3.26Å; I95-V98 PolarHBondContact O-N 3.11Å; V98-M101 PolarHBondContact O-N 2.96Å; V98-A102 WeakPolarHBondContact O-CB 3.37Å; V98-A102 PolarHBondContact O-N 3.36Å; V98-I249 HydrophobicContact CG2-CG2 4.44Å; V98-T253 HydrophobicContact CG1-CG2 3.98Å |
| 99 | S | 93.6 | Very high | 88.8 | Confident | 31 Ų | 31 | 25.4 Ų | 25.4 | 22% | 0.217 | 13% | 0.129 | C | C | . | . | H | α-helix | trans | -65.1 | -40.7 | 177.9 | -67.6 | 0 | 0 | 0 | 0 | 112.3 | I95 I96 M101 A102 F103 | I95-S99 WeakPolarHBondContact O-CB 3.42Å; I95-S99 PolarHBondContact O-N 3.19Å; I95-S99 PolarHBondContact O-OG 3.02Å; I96-S99 PolarHBondContact O-N 2.88Å; S99-M101 PolarHBondContact O-N 3.43Å; S99-A102 PolarHBondContact O-N 3.24Å; S99-F103 WeakPolarHBondContact O-CB 3.2Å; S99-F103 WeakPolarHBondContact O-CD2 3.39Å; S99-F103 WeakPolarHBondContact O-CG 3.35Å; S99-F103 PolarHBondContact O-N 3.15Å |
| 100 | L | 92.8 | Very high | 89.2 | Confident | 1 Ų | 1 | 27.2 Ų | 27.2 | 1% | 0.005 | 14% | 0.138 | C | C | . | . | H | α-helix | trans | -60.4 | -44.8 | 176.1 | -79 | 173 | 0 | 0 | 0 | 111.7 | I96 G97 F103 Q104 L159 W226 P230 L233 F291 V296 | I96-L100 HydrophobicContact CG2-CD1 3.82Å; I96-L100 HydrophobicContact CG2-CG 4.3Å; I96-L100 WeakPolarHBondContact O-CB 3.37Å; I96-L100 VanDerWaalsContact O-CG 3.23Å; I96-L100 WeakPolarHBondContact O-CG 3.45Å; I96-L100 PolarHBondContact O-N 3.27Å; G97-L100 PolarHBondContact O-N 2.99Å; L100-F103 PolarHBondContact O-N 3.02Å; L100-Q104 WeakPolarHBondContact O-CB 3.33Å; L100-Q104 PolarHBondContact O-N 2.86Å; L100-L159 HydrophobicContact CD2-CD1 4.28Å; L100-W226 HydrophobicContact CD2-CH2 3.92Å; L100-W226 HydrophobicContact CD2-CZ3 3.78Å; L100-P230 HydrophobicContact CB-CB 4.25Å; L100-L233 HydrophobicContact CD1-CB 4.38Å; L100-L233 HydrophobicContact CD1-CD1 3.79Å; L100-F291 HydrophobicContact CD2-CE1 4.48Å; L100-F291 HydrophobicContact CG-CE1 4.37Å; L100-V296 HydrophobicContact CD1-CG2 4.38Å; L100-V296 HydrophobicContact CD2-CG2 4.08Å; L100-V296 HydrophobicContact CG-CG2 4.43Å |
| 101 | M | 93.8 | Very high | 89.1 | Confident | 1 Ų | 1 | 26.9 Ų | 26.9 | 1% | 0.005 | 14% | 0.137 | C | C | . | . | H | α-helix | trans | -65.6 | -40.1 | 176.6 | -71.2 | -56.7 | 176.1 | 0 | 0 | 112.4 | G97 V98 S99 Q104 Q105 P230 W231 M234 C250 N254 | G97-M101 WeakPolarHBondContact O-CG 3.15Å; G97-M101 PolarHBondContact O-N 2.91Å; G97-M101 VanDerWaalsContact O-N 3.11Å; V98-M101 PolarHBondContact O-N 2.96Å; S99-M101 PolarHBondContact O-N 3.43Å; M101-Q104 PolarHBondContact O-N 2.96Å; M101-Q105 PolarHBondContact O-N 3.23Å; M101-P230 HydrophobicContact CE-CB 4.22Å; M101-P230 HydrophobicContact SD-CB 4.23Å; M101-W231 HydrophobicContact CE-CD2 3.72Å; M101-W231 HydrophobicContact CE-CE3 3.93Å; M101-W231 HydrophobicContact CE-CG 4.04Å; M101-W231 HydrophobicContact CE-CZ2 4.39Å; M101-W231 HydrophobicContact CE-CZ3 4.37Å; M101-W231 HydrophobicContact SD-CZ2 4.38Å; M101-M234 HydrophobicContact CE-CB 4.42Å; M101-M234 HydrophobicContact CE-SD 3.37Å; M101-M234 WeakPolarHBondContact CE-SD 3.31Å; M101-C250 HydrophobicContact CG-CB 4.01Å; M101-N254 HydrophobicContact CB-CB 4.01Å; M101-N254 HydrophobicContact CG-CB 4.26Å; M101-N254 HydrophobicContact SD-CB 4.11Å |
| 102 | A | 93.8 | Very high | 88.9 | Confident | 17 Ų | 17 | 22.6 Ų | 22.6 | 14% | 0.14 | 12% | 0.121 | C | C | . | . | H | α-helix | trans | -64 | -48.5 | 175.6 | 0 | 0 | 0 | 0 | 0 | 111.6 | V98 S99 Q104 Q105 L106 T253 M257 | V98-A102 WeakPolarHBondContact O-CB 3.37Å; V98-A102 PolarHBondContact O-N 3.36Å; S99-A102 PolarHBondContact O-N 3.24Å; A102-Q104 VanDerWaalsContact C-N 3.3Å; A102-Q104 PolarHBondContact O-N 2.78Å; A102-Q105 PolarHBondContact O-N 3.19Å; A102-L106 WeakPolarHBondContact O-CB 3.47Å; A102-L106 VanDerWaalsContact O-CG 3.3Å; A102-L106 WeakPolarHBondContact O-CG 3.18Å; A102-L106 PolarHBondContact O-N 3.43Å; A102-T253 HydrophobicContact CB-CG2 4.25Å; A102-M257 HydrophobicContact CB-CG 4.23Å |
| 103 | F | 92.9 | Very high | 88.5 | Confident | 38 Ų | 38 | 21 Ų | 21 | 17% | 0.167 | 12% | 0.115 | C | C | . | . | H | α-helix | trans | -64.9 | -33.2 | 178.5 | -75 | -50.8 | 0 | 0 | 0 | 113.1 | S99 L100 Q105 L106 S107 W226 F287 F291 | S99-F103 WeakPolarHBondContact O-CB 3.2Å; S99-F103 WeakPolarHBondContact O-CD2 3.39Å; S99-F103 WeakPolarHBondContact O-CG 3.35Å; S99-F103 PolarHBondContact O-N 3.15Å; L100-F103 PolarHBondContact O-N 3.02Å; F103-Q105 VanDerWaalsContact C-N 3.27Å; F103-Q105 PolarHBondContact O-N 3.43Å; F103-L106 PolarHBondContact O-N 3.23Å; F103-S107 PolarHBondContact O-N 3.34Å; F103-W226 HydrophobicContact CB-CH2 4.25Å; F103-W226 HydrophobicContact CB-CZ3 3.93Å; F103-F287 HydrophobicContact CE1-CB 4.25Å; F103-F291 HydrophobicContact CD2-CB 4.38Å; F103-F291 AromaticContact CD2-CD1 3.96Å; F103-F291 HydrophobicContact CD2-CD1 3.96Å; F103-F291 HydrophobicContact CD2-CG 4.17Å; F103-F291 HydrophobicContact CE2-CB 3.77Å; F103-F291 AromaticContact CE2-CD1 3.84Å; F103-F291 HydrophobicContact CE2-CD1 3.84Å; F103-F291 HydrophobicContact CE2-CD2 4.04Å; F103-F291 HydrophobicContact CE2-CE1 4.46Å; F103-F291 AromaticContact CE2-CG 3.59Å; F103-F291 HydrophobicContact CE2-CG 3.59Å; F103-F291 HydrophobicContact CZ-CB 4.4Å |
| 104 | Q | 92.3 | Very high | 87.8 | Confident | 7 Ų | 7 | 27.1 Ų | 27.1 | 3% | 0.033 | 14% | 0.142 | C | C | . | . | H | α-helix | trans | -56.2 | -43.9 | 173.4 | -174.5 | 179.2 | 22 | 0 | 0 | 111.1 | L100 M101 A102 S107 F222 W226 G227 | L100-Q104 WeakPolarHBondContact O-CB 3.33Å; L100-Q104 PolarHBondContact O-N 2.86Å; M101-Q104 PolarHBondContact O-N 2.96Å; A102-Q104 VanDerWaalsContact C-N 3.3Å; A102-Q104 PolarHBondContact O-N 2.78Å; Q104-S107 PolarHBondContact O-OG 3Å; Q104-F222 HydrophobicContact CG-CE2 3.82Å; Q104-F222 HydrophobicContact CG-CZ 3.85Å; Q104-W226 VanDerWaalsContact CD-O 3.28Å; Q104-W226 WeakPolarHBondContact CG-O 3.39Å; Q104-W226 PolarHBondContact NE2-O 3.38Å; Q104-G227 PolarHBondContact NE2-O 3.18Å |
| 105 | Q | 92.3 | Very high | 87 | Confident | 14 Ų | 14 | 28.2 Ų | 28.2 | 7% | 0.065 | 15% | 0.145 | C | C | . | . | H | α-helix | trans | -81.2 | -39.4 | -179.5 | -62.1 | -61.4 | -24.5 | 0 | 0 | 113 | M101 A102 F103 S107 G108 N110 N254 M257 A258 | M101-Q105 PolarHBondContact O-N 3.23Å; A102-Q105 PolarHBondContact O-N 3.19Å; F103-Q105 VanDerWaalsContact C-N 3.27Å; F103-Q105 PolarHBondContact O-N 3.43Å; Q105-S107 PolarHBondContact O-N 2.82Å; Q105-G108 PolarHBondContact O-N 3.2Å; Q105-N110 PolarHBondContact OE1-ND2 3.34Å; Q105-N254 WeakPolarHBondContact CG-O 3.21Å; Q105-N254 WeakPolarHBondContact CG-OD1 3.32Å; Q105-N254 PolarHBondContact NE2-OD1 3.04Å; Q105-M257 HydrophobicContact CB-CB 3.69Å; Q105-M257 HydrophobicContact CG-CB 4.06Å; Q105-A258 HydrophobicContact CG-CB 4.19Å |
| 106 | L | 89.2 | Confident | 86.1 | Confident | 44 Ų | 44 | 24.2 Ų | 24.2 | 23% | 0.23 | 13% | 0.125 | C | C | . | . | H | α-helix | trans | -65.1 | -17.1 | 177 | -70 | 171.7 | 0 | 0 | 0 | 113.5 | A102 F103 G108 V261 F284 | A102-L106 WeakPolarHBondContact O-CB 3.47Å; A102-L106 VanDerWaalsContact O-CG 3.3Å; A102-L106 WeakPolarHBondContact O-CG 3.18Å; A102-L106 PolarHBondContact O-N 3.43Å; F103-L106 PolarHBondContact O-N 3.23Å; L106-G108 PolarHBondContact O-N 2.86Å; L106-G108 VanDerWaalsContact O-N 3.07Å; L106-V261 HydrophobicContact CD2-CG2 4.03Å; L106-F284 HydrophobicContact CB-CB 4.26Å; L106-F284 HydrophobicContact CB-CD1 4.33Å; L106-F284 HydrophobicContact CB-CG 4.14Å; L106-F284 HydrophobicContact CD1-CD1 4.23Å; L106-F284 HydrophobicContact CD1-CE1 4.26Å |
| 107 | S | 87.1 | Confident | 85 | Confident | 1 Ų | 1 | 28 Ų | 28 | 1% | 0.007 | 14% | 0.143 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -57.7 | -16.2 | 168.8 | 74.1 | 0 | 0 | 0 | 0 | 113.4 | F103 Q104 Q105 V109 | F103-S107 PolarHBondContact O-N 3.34Å; Q104-S107 PolarHBondContact O-OG 3Å; Q105-S107 PolarHBondContact O-N 2.82Å; S107-V109 PolarHBondContact OG-N 3.47Å |
| 108 | G | 83.5 | Confident | 84 | Confident | 7 Ų | 7 | 30.8 Ų | 30.8 | 7% | 0.072 | 16% | 0.159 | C | C | . | . | T | Hydrogen-bonded Turn | trans | 83 | 16.5 | 179.5 | 0 | 0 | 0 | 0 | 0 | 113.4 | Q105 L106 N110 A111 V112 | Q105-G108 PolarHBondContact O-N 3.2Å; L106-G108 PolarHBondContact O-N 2.86Å; L106-G108 VanDerWaalsContact O-N 3.07Å; G108-N110 VanDerWaalsContact C-N 3.31Å; G108-N110 PolarHBondContact O-N 2.9Å; G108-A111 WeakPolarHBondContact O-CB 3.31Å; G108-A111 PolarHBondContact O-N 2.69Å; G108-V112 WeakPolarHBondContact O-CG2 3.34Å; G108-V112 PolarHBondContact O-N 2.87Å |
| 109 | V | 84.6 | Confident | 82.8 | Confident | 12 Ų | 12 | 29.7 Ų | 29.7 | 7% | 0.073 | 15% | 0.152 | C | C | . | . | H | α-helix | trans | -54.8 | -43 | -177.7 | 66.5 | 0 | 0 | 0 | 0 | 113.3 | S107 A111 V112 M113 F218 F222 | S107-V109 PolarHBondContact OG-N 3.47Å; V109-A111 VanDerWaalsContact C-N 3.32Å; V109-A111 PolarHBondContact O-N 3.32Å; V109-V112 PolarHBondContact O-N 3.27Å; V109-M113 HydrophobicContact CG2-CG 4.48Å; V109-M113 VanDerWaalsContact O-CG 3.26Å; V109-M113 WeakPolarHBondContact O-CG 3.43Å; V109-M113 PolarHBondContact O-N 3.48Å; V109-F218 HydrophobicContact CB-CE1 4.25Å; V109-F218 HydrophobicContact CG2-CE1 4.28Å; V109-F222 HydrophobicContact CB-CD2 4.15Å; V109-F222 HydrophobicContact CB-CE2 3.89Å; V109-F222 HydrophobicContact CB-CZ 4.16Å; V109-F222 HydrophobicContact CG1-CE2 3.92Å; V109-F222 HydrophobicContact CG1-CZ 3.93Å; V109-F222 HydrophobicContact CG2-CD1 3.97Å; V109-F222 HydrophobicContact CG2-CD2 4.03Å; V109-F222 HydrophobicContact CG2-CE1 3.89Å; V109-F222 HydrophobicContact CG2-CE2 3.95Å; V109-F222 HydrophobicContact CG2-CG 4.04Å; V109-F222 HydrophobicContact CG2-CZ 3.88Å |
| 110 | N | 83.4 | Confident | 81.7 | Confident | 42 Ų | 42 | 28.9 Ų | 28.9 | 23% | 0.225 | 15% | 0.145 | C | C | . | . | H | α-helix | trans | -64.6 | -40.6 | 178.1 | -62.3 | -28.6 | 0 | 0 | 0 | 111.2 | Q105 G108 M113 F114 A258 | Q105-N110 PolarHBondContact OE1-ND2 3.34Å; G108-N110 VanDerWaalsContact C-N 3.31Å; G108-N110 PolarHBondContact O-N 2.9Å; N110-M113 PolarHBondContact O-N 3.19Å; N110-F114 HydrophobicContact CB-CD2 4.45Å; N110-F114 HydrophobicContact CB-CE2 4.13Å; N110-F114 WeakPolarHBondContact O-CD2 3.49Å; N110-F114 WeakPolarHBondContact O-CG 3.46Å; N110-F114 PolarHBondContact O-N 2.92Å; N110-A258 WeakPolarHBondContact ND2-CB 3.39Å |
| 111 | A | 78.6 | Confident | 80.6 | Confident | 2 Ų | 2 | 33.8 Ų | 33.8 | 2% | 0.017 | 17% | 0.168 | C | C | . | . | H | α-helix | trans | -64.5 | -45.1 | 177.1 | 0 | 0 | 0 | 0 | 0 | 111.5 | G108 V109 M113 F114 Y115 F265 | G108-A111 WeakPolarHBondContact O-CB 3.31Å; G108-A111 PolarHBondContact O-N 2.69Å; V109-A111 VanDerWaalsContact C-N 3.32Å; V109-A111 PolarHBondContact O-N 3.32Å; A111-M113 VanDerWaalsContact C-N 3.27Å; A111-M113 PolarHBondContact O-N 3.46Å; A111-F114 PolarHBondContact O-N 3.32Å; A111-Y115 VanDerWaalsContact O-CD2 3.25Å; A111-Y115 WeakPolarHBondContact O-CD2 3.36Å; A111-Y115 PolarHBondContact O-N 3.28Å; A111-F265 HydrophobicContact CB-CD1 3.96Å; A111-F265 HydrophobicContact CB-CD2 3.3Å; A111-F265 HydrophobicContact CB-CE1 3.92Å; A111-F265 HydrophobicContact CB-CE2 3.26Å; A111-F265 HydrophobicContact CB-CG 3.66Å; A111-F265 HydrophobicContact CB-CZ 3.58Å |
| 112 | V | 79.3 | Confident | 79.1 | Confident | 5 Ų | 5 | 39.8 Ų | 39.8 | 3% | 0.03 | 20% | 0.196 | C | C | . | . | H | α-helix | trans | -59.2 | -41.1 | 174.9 | 176 | 0 | 0 | 0 | 0 | 111 | G108 V109 A116 M215 F218 F278 | G108-V112 WeakPolarHBondContact O-CG2 3.34Å; G108-V112 PolarHBondContact O-N 2.87Å; V109-V112 PolarHBondContact O-N 3.27Å; V112-A116 WeakPolarHBondContact O-CB 3.37Å; V112-A116 PolarHBondContact O-N 2.92Å; V112-M215 HydrophobicContact CG1-CG 3.64Å; V112-M215 HydrophobicContact CG1-SD 4.2Å; V112-F218 HydrophobicContact CB-CD1 4.14Å; V112-F218 HydrophobicContact CB-CE1 4.01Å; V112-F218 HydrophobicContact CG1-CD1 3.82Å; V112-F218 HydrophobicContact CG1-CE1 4.2Å; V112-F218 HydrophobicContact CG2-CD1 4.04Å; V112-F218 HydrophobicContact CG2-CE1 3.83Å; V112-F218 HydrophobicContact CG2-CZ 4.3Å; V112-F278 HydrophobicContact CG2-CE1 4.05Å |
| 113 | M | 78.6 | Confident | 77.6 | Confident | 41 Ų | 41 | 40 Ų | 40 | 20% | 0.202 | 20% | 0.197 | C | C | . | . | H | α-helix | trans | -65.2 | -41.7 | 177.2 | -70.5 | -65.2 | -136.8 | 0 | 0 | 112.8 | V109 N110 A111 A116 V135 | V109-M113 HydrophobicContact CG2-CG 4.48Å; V109-M113 VanDerWaalsContact O-CG 3.26Å; V109-M113 WeakPolarHBondContact O-CG 3.43Å; V109-M113 PolarHBondContact O-N 3.48Å; N110-M113 PolarHBondContact O-N 3.19Å; A111-M113 VanDerWaalsContact C-N 3.27Å; A111-M113 PolarHBondContact O-N 3.46Å; M113-A116 WeakPolarHBondContact O-CB 2.98Å; M113-A116 PolarHBondContact O-N 3.41Å; M113-V135 HydrophobicContact CE-CG1 4.07Å; M113-V135 HydrophobicContact SD-CG1 3.69Å |
| 114 | F | 74 | Confident | 76.1 | Confident | 131 Ų | 131 | 45.5 Ų | 45.5 | 58% | 0.575 | 22% | 0.221 | S | C | * | . | H | α-helix | trans | -68.2 | -36.3 | 178.4 | -72.1 | -53.7 | 0 | 0 | 0 | 113 | N110 A111 A116 T262 | N110-F114 HydrophobicContact CB-CD2 4.45Å; N110-F114 HydrophobicContact CB-CE2 4.13Å; N110-F114 WeakPolarHBondContact O-CD2 3.49Å; N110-F114 WeakPolarHBondContact O-CG 3.46Å; N110-F114 PolarHBondContact O-N 2.92Å; A111-F114 PolarHBondContact O-N 3.32Å; F114-A116 VanDerWaalsContact C-N 3.33Å; F114-T262 HydrophobicContact CD2-CG2 4.2Å; F114-T262 HydrophobicContact CE2-CG2 3.49Å; F114-T262 VanDerWaalsContact CE2-CG2 3.49Å; F114-T262 HydrophobicContact CZ-CG2 4.18Å |
| 115 | Y | 71.1 | Confident | 74.5 | Confident | 64 Ų | 64 | 50.9 Ų | 50.9 | 25% | 0.251 | 25% | 0.245 | S | C | . | . | H | α-helix | trans | -85.2 | -9.4 | -179.9 | -77.8 | -97.4 | 0 | 0 | 0 | 113 | A111 E117 T118 I119 F265 M269 | A111-Y115 VanDerWaalsContact O-CD2 3.25Å; A111-Y115 WeakPolarHBondContact O-CD2 3.36Å; A111-Y115 PolarHBondContact O-N 3.28Å; Y115-E117 VanDerWaalsContact C-N 3.31Å; Y115-E117 PolarHBondContact O-N 3.31Å; Y115-T118 PolarHBondContact O-N 2.95Å; Y115-I119 WeakPolarHBondContact O-CD1 3.43Å; Y115-I119 WeakPolarHBondContact O-CG1 3.24Å; Y115-I119 PolarHBondContact O-N 3.31Å; Y115-F265 HydrophobicContact CD2-CD1 4.15Å; Y115-F265 AromaticContact CD2-CE1 3.56Å; Y115-F265 HydrophobicContact CD2-CE1 3.56Å; Y115-F265 HydrophobicContact CD2-CZ 4.38Å; Y115-F265 HydrophobicContact CE1-CE1 4.43Å; Y115-F265 AromaticContact CE2-CD1 3.37Å; Y115-F265 HydrophobicContact CE2-CD1 3.37Å; Y115-F265 AromaticContact CE2-CE1 3.08Å; Y115-F265 HydrophobicContact CE2-CE1 3.08Å; Y115-F265 HydrophobicContact CE2-CZ 4.25Å; Y115-F265 HydrophobicContact CG-CE1 4.42Å; Y115-F265 AromaticContact CZ-CD1 3.93Å; Y115-F265 AromaticContact CZ-CE1 3.55Å; Y115-M269 HydrophobicContact CD1-CE 3.78Å; Y115-M269 HydrophobicContact CE1-CE 3.29Å; Y115-M269 HydrophobicContact CE2-CE 4.16Å; Y115-M269 HydrophobicContact CG-CE 4.34Å; Y115-M269 VanDerWaalsContact CZ-CE 3.49Å |
| 116 | A | 71.9 | Confident | 72.7 | Confident | 4 Ų | 4 | 60 Ų | 60 | 3% | 0.033 | 28% | 0.284 | C | S | . | . | H | α-helix | trans | -53.6 | -48 | -180 | 0 | 0 | 0 | 0 | 0 | 112.1 | V112 M113 F114 T118 I119 F120 V135 M215 | V112-A116 WeakPolarHBondContact O-CB 3.37Å; V112-A116 PolarHBondContact O-N 2.92Å; M113-A116 WeakPolarHBondContact O-CB 2.98Å; M113-A116 PolarHBondContact O-N 3.41Å; F114-A116 VanDerWaalsContact C-N 3.33Å; A116-T118 PolarHBondContact O-N 3.4Å; A116-I119 PolarHBondContact O-N 3.39Å; A116-F120 VanDerWaalsContact O-CD2 3.32Å; A116-F120 WeakPolarHBondContact O-CD2 3.46Å; A116-F120 PolarHBondContact O-N 3.22Å; A116-V135 HydrophobicContact CB-CG2 4.47Å; A116-M215 VanDerWaalsContact CA-SD 3.5Å; A116-M215 HydrophobicContact CB-CE 3.65Å; A116-M215 HydrophobicContact CB-SD 3.59Å; A116-M215 VanDerWaalsContact CB-SD 3.59Å |
| 117 | E | 67.8 | Low | 71.4 | Confident | 92 Ų | 92 | 62.6 Ų | 62.6 | 43% | 0.43 | 30% | 0.298 | S | S | . | . | H | α-helix | trans | -61.7 | -45.6 | 179.4 | -64.6 | -176 | 172.2 | 0 | 0 | 111.4 | Y115 I119 F120 E121 S132 | Y115-E117 VanDerWaalsContact C-N 3.31Å; Y115-E117 PolarHBondContact O-N 3.31Å; E117-I119 PolarHBondContact O-N 2.92Å; E117-F120 PolarHBondContact O-N 3.18Å; E117-E121 WeakPolarHBondContact O-CG 3.49Å; E117-E121 PolarHBondContact O-N 2.96Å; E117-S132 VanDerWaalsContact CG-OG 3.28Å; E117-S132 WeakPolarHBondContact CG-OG 3.32Å; E117-S132 PolarHBondContact OE1-OG 3.2Å |
| 118 | T | 70.1 | Confident | 70.1 | Confident | 60 Ų | 60 | 64 Ų | 64 | 37% | 0.368 | 31% | 0.308 | S | S | . | . | H | α-helix | trans | -62.4 | -41.6 | 178.4 | -45.9 | 0 | 0 | 0 | 0 | 112.6 | Y115 A116 F120 E121 E122 | Y115-T118 PolarHBondContact O-N 2.95Å; A116-T118 PolarHBondContact O-N 3.4Å; T118-F120 VanDerWaalsContact C-N 3.35Å; T118-F120 PolarHBondContact O-N 3.05Å; T118-E121 PolarHBondContact O-N 3.11Å; T118-E122 WeakPolarHBondContact O-CG 3.4Å; T118-E122 PolarHBondContact O-N 3.18Å |
| 119 | I | 68.7 | Low | 69.2 | Low | 9 Ų | 9 | 66.7 Ų | 66.7 | 5% | 0.046 | 33% | 0.326 | C | S | . | . | H | α-helix | trans | -65.9 | -40.1 | 179 | -63.5 | 152 | 0 | 0 | 0 | 110.8 | Y115 A116 E117 A123 F173 A211 M215 | Y115-I119 WeakPolarHBondContact O-CD1 3.43Å; Y115-I119 WeakPolarHBondContact O-CG1 3.24Å; Y115-I119 PolarHBondContact O-N 3.31Å; A116-I119 PolarHBondContact O-N 3.39Å; E117-I119 PolarHBondContact O-N 2.92Å; I119-A123 WeakPolarHBondContact O-CB 3.43Å; I119-A123 PolarHBondContact O-N 3.12Å; I119-A123 VanDerWaalsContact O-N 3.13Å; I119-F173 HydrophobicContact CD1-CE1 3.95Å; I119-F173 HydrophobicContact CD1-CE2 4.03Å; I119-F173 HydrophobicContact CD1-CZ 3.21Å; I119-F173 HydrophobicContact CG1-CZ 3.82Å; I119-F173 HydrophobicContact CG2-CE2 4.39Å; I119-F173 HydrophobicContact CG2-CZ 4.49Å; I119-A211 HydrophobicContact CG2-CB 4.06Å; I119-M215 HydrophobicContact CD1-SD 3.71Å |
| 120 | F | 69.9 | Low | 68.7 | Low | 14 Ų | 14 | 69.1 Ų | 69.1 | 6% | 0.061 | 34% | 0.338 | C | S | . | . | H | α-helix | trans | -70.3 | -35 | 177.4 | -92.5 | -86.3 | 0 | 0 | 0 | 112.4 | A116 E117 T118 A123 F125 A131 V135 V212 M215 | A116-F120 VanDerWaalsContact O-CD2 3.32Å; A116-F120 WeakPolarHBondContact O-CD2 3.46Å; A116-F120 PolarHBondContact O-N 3.22Å; E117-F120 PolarHBondContact O-N 3.18Å; T118-F120 VanDerWaalsContact C-N 3.35Å; T118-F120 PolarHBondContact O-N 3.05Å; F120-A123 PolarHBondContact O-N 3.2Å; F120-F125 AromaticContact CD1-CD2 3.98Å; F120-F125 HydrophobicContact CD1-CD2 3.98Å; F120-F125 HydrophobicContact CD1-CG 4.44Å; F120-A131 HydrophobicContact CB-CB 3.43Å; F120-A131 VanDerWaalsContact CB-CB 3.43Å; F120-A131 HydrophobicContact CD1-CB 3.8Å; F120-A131 HydrophobicContact CD2-CB 3.39Å; F120-A131 HydrophobicContact CE1-CB 4.34Å; F120-A131 HydrophobicContact CE2-CB 3.94Å; F120-A131 HydrophobicContact CG-CB 3.28Å; F120-A131 HydrophobicContact CZ-CB 4.39Å; F120-V135 HydrophobicContact CE2-CG2 4.46Å; F120-V212 HydrophobicContact CD1-CG2 4.42Å; F120-V212 HydrophobicContact CE1-CG1 3.74Å; F120-V212 HydrophobicContact CE1-CG2 4.37Å; F120-V212 HydrophobicContact CE2-CG1 4.23Å; F120-V212 HydrophobicContact CZ-CG1 3.56Å; F120-M215 HydrophobicContact CD2-CE 3.55Å; F120-M215 HydrophobicContact CE2-CE 3.19Å; F120-M215 HydrophobicContact CZ-CE 4.35Å |
| 121 | E | 69 | Low | 68.1 | Low | 105 Ų | 105 | 67.2 Ų | 67.2 | 49% | 0.491 | 33% | 0.328 | S | S | . | . | H | α-helix | trans | -62.9 | -48.3 | 171.9 | -81.2 | -177.5 | 171.9 | 0 | 0 | 112.2 | E117 T118 A123 K124 S128 | E117-E121 WeakPolarHBondContact O-CG 3.49Å; E117-E121 PolarHBondContact O-N 2.96Å; T118-E121 PolarHBondContact O-N 3.11Å; E121-A123 PolarHBondContact O-N 3.4Å; E121-K124 PolarHBondContact O-N 3.5Å; E121-S128 VanDerWaalsContact CD-OG 3.27Å; E121-S128 WeakPolarHBondContact CG-OG 3.15Å; E121-S128 VanDerWaalsContact OE1-CB 3.26Å; E121-S128 WeakPolarHBondContact OE1-CB 3.07Å; E121-S128 PolarHBondContact OE1-OG 2.93Å |
| 122 | E | 63.5 | Low | 68 | Low | 127 Ų | 127 | 67.6 Ų | 67.6 | 59% | 0.593 | 33% | 0.331 | S | S | * | . | H | α-helix | trans | -61.1 | -30.4 | 176.6 | -75.3 | -176.3 | 175.6 | 0 | 0 | 112.3 | T118 K124 | T118-E122 WeakPolarHBondContact O-CG 3.4Å; T118-E122 PolarHBondContact O-N 3.18Å; E122-K124 PolarHBondContact O-N 3.32Å |
| 123 | A | 62.6 | Low | 68.1 | Low | 21 Ų | 21 | 68.2 Ų | 68.2 | 17% | 0.174 | 33% | 0.334 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -73.6 | 5.1 | 175.3 | 0 | 0 | 0 | 0 | 0 | 114.4 | I119 F120 E121 F125 A208 V212 | I119-A123 WeakPolarHBondContact O-CB 3.43Å; I119-A123 PolarHBondContact O-N 3.12Å; I119-A123 VanDerWaalsContact O-N 3.13Å; F120-A123 PolarHBondContact O-N 3.2Å; E121-A123 PolarHBondContact O-N 3.4Å; A123-F125 HydrophobicContact CB-CD2 3.86Å; A123-F125 HydrophobicContact CB-CE2 4.16Å; A123-F125 PolarHBondContact O-N 2.79Å; A123-A208 HydrophobicContact CB-CB 3.92Å; A123-V212 HydrophobicContact CB-CG2 4.19Å |
| 124 | K | 60 | Low | 68.2 | Low | 153 Ų | 153 | 69.3 Ų | 69.3 | 67% | 0.665 | 34% | 0.343 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 59.9 | 21.6 | -179.1 | -66.7 | -171.7 | 178.2 | 177.7 | 0 | 115 | E121 E122 K126 | E121-K124 PolarHBondContact O-N 3.5Å; E122-K124 PolarHBondContact O-N 3.32Å; K124-K126 PolarHBondContact O-N 2.96Å |
| 125 | F | 59 | Low | 68.6 | Low | 121 Ų | 121 | 63.1 Ų | 63.1 | 53% | 0.531 | 32% | 0.316 | S | S | . | . | trans | -69.9 | 112.2 | 163.8 | -73.6 | -79.1 | 0 | 0 | 0 | 107.6 | F120 A123 D127 | F120-F125 AromaticContact CD1-CD2 3.98Å; F120-F125 HydrophobicContact CD1-CD2 3.98Å; F120-F125 HydrophobicContact CD1-CG 4.44Å; A123-F125 HydrophobicContact CB-CD2 3.86Å; A123-F125 HydrophobicContact CB-CE2 4.16Å; A123-F125 PolarHBondContact O-N 2.79Å; F125-D127 PolarHBondContact O-N 3.48Å | ||
| 126 | K | 54.9 | Low | 69.2 | Low | 204 Ų | 204 | 60.1 Ų | 60.1 | 89% | 0.887 | 30% | 0.304 | S | S | * | . | S | Bend | trans | -63.1 | -11.7 | -171.5 | -80.9 | -177.3 | 173.5 | -178.9 | 0 | 115 | K124 | K124-K126 PolarHBondContact O-N 2.96Š|
| 127 | D | 61 | Low | 70 | Confident | 99 Ų | 99 | 62.8 Ų | 62.8 | 53% | 0.529 | 32% | 0.32 | S | S | . | . | trans | -118.6 | 86.8 | -179.1 | -62.1 | -47.2 | 0 | 0 | 0 | 110.6 | F125 S129 L130 | F125-D127 PolarHBondContact O-N 3.48Å; D127-S129 PolarHBondContact O-N 2.63Å; D127-S129 VanDerWaalsContact O-N 3.16Å; D127-L130 HydrophobicContact CB-CB 4.13Å; D127-L130 HydrophobicContact CB-CD1 3.58Å; D127-L130 HydrophobicContact CB-CG 3.61Å; D127-L130 WeakPolarHBondContact O-CB 3.37Å; D127-L130 PolarHBondContact O-N 3.32Å | ||
| 128 | S | 61.3 | Low | 70.9 | Confident | 31 Ų | 31 | 59.7 Ų | 59.7 | 22% | 0.217 | 31% | 0.306 | C | S | . | . | H | α-helix | trans | -54.1 | -33.7 | 178 | -44.8 | 0 | 0 | 0 | 0 | 112.7 | E121 L130 A131 | E121-S128 VanDerWaalsContact CD-OG 3.27Å; E121-S128 WeakPolarHBondContact CG-OG 3.15Å; E121-S128 VanDerWaalsContact OE1-CB 3.26Å; E121-S128 WeakPolarHBondContact OE1-CB 3.07Å; E121-S128 PolarHBondContact OE1-OG 2.93Å; S128-L130 VanDerWaalsContact C-N 3.29Å; S128-L130 PolarHBondContact O-N 3.32Å; S128-A131 WeakPolarHBondContact O-CB 3.35Å; S128-A131 PolarHBondContact O-N 3.41Å |
| 129 | S | 64.6 | Low | 71.8 | Confident | 63 Ų | 63 | 57.6 Ų | 57.6 | 44% | 0.441 | 29% | 0.292 | S | S | . | . | H | α-helix | trans | -68 | -25.2 | 178.4 | -51.3 | 0 | 0 | 0 | 0 | 113.6 | D127 A131 V133 | D127-S129 PolarHBondContact O-N 2.63Å; D127-S129 VanDerWaalsContact O-N 3.16Å; S129-A131 VanDerWaalsContact C-N 3.26Å; S129-A131 PolarHBondContact O-N 2.97Å; S129-V133 WeakPolarHBondContact O-CG2 3.4Å; S129-V133 PolarHBondContact O-N 3.11Å |
| 130 | L | 72.4 | Confident | 72.8 | Confident | 64 Ų | 64 | 58.8 Ų | 58.8 | 34% | 0.335 | 30% | 0.3 | S | S | . | . | H | α-helix | trans | -69.1 | -26.9 | 175.2 | -69.2 | -178.5 | 0 | 0 | 0 | 111.7 | W14 D127 S128 V133 V134 | W14-L130 HydrophobicContact CH2-CD2 3.92Å; W14-L130 HydrophobicContact CZ2-CD2 3.83Å; W14-L130 HydrophobicContact CZ3-CD2 4.41Å; D127-L130 HydrophobicContact CB-CB 4.13Å; D127-L130 HydrophobicContact CB-CD1 3.58Å; D127-L130 HydrophobicContact CB-CG 3.61Å; D127-L130 WeakPolarHBondContact O-CB 3.37Å; D127-L130 PolarHBondContact O-N 3.32Å; S128-L130 VanDerWaalsContact C-N 3.29Å; S128-L130 PolarHBondContact O-N 3.32Å; L130-V133 PolarHBondContact O-N 3Å; L130-V134 VanDerWaalsContact O-CG2 3.29Å; L130-V134 WeakPolarHBondContact O-CG2 3.42Å; L130-V134 PolarHBondContact O-N 3.07Å |
| 131 | A | 71.3 | Confident | 73.8 | Confident | 2 Ų | 2 | 63.1 Ų | 63.1 | 2% | 0.017 | 32% | 0.323 | C | S | . | . | H | α-helix | trans | -58.6 | -52.9 | 177.7 | 0 | 0 | 0 | 0 | 0 | 111.8 | F120 S128 S129 V133 V134 V135 | F120-A131 HydrophobicContact CB-CB 3.43Å; F120-A131 VanDerWaalsContact CB-CB 3.43Å; F120-A131 HydrophobicContact CD1-CB 3.8Å; F120-A131 HydrophobicContact CD2-CB 3.39Å; F120-A131 HydrophobicContact CE1-CB 4.34Å; F120-A131 HydrophobicContact CE2-CB 3.94Å; F120-A131 HydrophobicContact CG-CB 3.28Å; F120-A131 HydrophobicContact CZ-CB 4.39Å; S128-A131 WeakPolarHBondContact O-CB 3.35Å; S128-A131 PolarHBondContact O-N 3.41Å; S129-A131 VanDerWaalsContact C-N 3.26Å; S129-A131 PolarHBondContact O-N 2.97Å; A131-V133 VanDerWaalsContact C-N 3.29Å; A131-V133 PolarHBondContact O-N 3.13Å; A131-V134 PolarHBondContact O-N 2.85Å; A131-V135 VanDerWaalsContact O-CG2 3.31Å; A131-V135 WeakPolarHBondContact O-CG2 3.26Å; A131-V135 PolarHBondContact O-N 3.43Å |
| 132 | S | 76.1 | Confident | 74.8 | Confident | 10 Ų | 10 | 62 Ų | 62 | 7% | 0.07 | 32% | 0.317 | C | S | . | . | H | α-helix | trans | -64.1 | -35.9 | -179.5 | -59.7 | 0 | 0 | 0 | 0 | 111.5 | Y10 E117 V135 G136 | Y10-S132 WeakPolarHBondContact CD2-O 3.45Å; Y10-S132 WeakPolarHBondContact CE2-O 3.33Å; E117-S132 VanDerWaalsContact CG-OG 3.28Å; E117-S132 WeakPolarHBondContact CG-OG 3.32Å; E117-S132 PolarHBondContact OE1-OG 3.2Å; S132-V135 PolarHBondContact O-N 3.44Å; S132-G136 PolarHBondContact O-N 2.85Å |
| 133 | V | 81.3 | Confident | 76 | Confident | 17 Ų | 17 | 57.4 Ų | 57.4 | 10% | 0.103 | 30% | 0.298 | C | S | . | . | H | α-helix | trans | -64.5 | -46.4 | 173.1 | 178 | 0 | 0 | 0 | 0 | 111.5 | L7 L11 S129 L130 A131 V135 G136 V137 | L7-V133 HydrophobicContact CD1-CG1 4.47Å; L11-V133 HydrophobicContact CD2-CG1 3.88Å; L11-V133 HydrophobicContact CD2-CG2 4.33Å; S129-V133 WeakPolarHBondContact O-CG2 3.4Å; S129-V133 PolarHBondContact O-N 3.11Å; L130-V133 PolarHBondContact O-N 3Å; A131-V133 VanDerWaalsContact C-N 3.29Å; A131-V133 PolarHBondContact O-N 3.13Å; V133-V135 VanDerWaalsContact C-N 3.34Å; V133-V135 PolarHBondContact O-N 3.34Å; V133-G136 PolarHBondContact O-N 3Å; V133-V137 HydrophobicContact CG1-CG2 4.4Å; V133-V137 WeakPolarHBondContact O-CG2 3.4Å; V133-V137 PolarHBondContact O-N 3.2Å |
| 134 | V | 82.1 | Confident | 77.3 | Confident | 64 Ų | 64 | 59 Ų | 59 | 39% | 0.388 | 31% | 0.31 | S | S | . | . | H | α-helix | trans | -60.1 | -45.1 | 177 | 169.1 | 0 | 0 | 0 | 0 | 111 | L130 A131 G136 V137 I138 | L130-V134 VanDerWaalsContact O-CG2 3.29Å; L130-V134 WeakPolarHBondContact O-CG2 3.42Å; L130-V134 PolarHBondContact O-N 3.07Å; A131-V134 PolarHBondContact O-N 2.85Å; V134-G136 VanDerWaalsContact C-N 3.34Å; V134-G136 PolarHBondContact O-N 2.95Å; V134-V137 PolarHBondContact O-N 3.14Å; V134-I138 HydrophobicContact CG1-CD1 3.9Å; V134-I138 HydrophobicContact CG1-CG1 4.5Å; V134-I138 WeakPolarHBondContact O-CG1 3.28Å; V134-I138 PolarHBondContact O-N 3.13Å |
| 135 | V | 82.1 | Confident | 78.7 | Confident | 2 Ų | 2 | 54.8 Ų | 54.8 | 1% | 0.012 | 30% | 0.297 | C | S | . | . | H | α-helix | trans | -55.9 | -48.8 | 174.1 | 165.7 | 0 | 0 | 0 | 0 | 110.7 | M113 A116 F120 A131 S132 V133 V137 I138 Q139 M215 I219 | M113-V135 HydrophobicContact CE-CG1 4.07Å; M113-V135 HydrophobicContact SD-CG1 3.69Å; A116-V135 HydrophobicContact CB-CG2 4.47Å; F120-V135 HydrophobicContact CE2-CG2 4.46Å; A131-V135 VanDerWaalsContact O-CG2 3.31Å; A131-V135 WeakPolarHBondContact O-CG2 3.26Å; A131-V135 PolarHBondContact O-N 3.43Å; S132-V135 PolarHBondContact O-N 3.44Å; V133-V135 VanDerWaalsContact C-N 3.34Å; V133-V135 PolarHBondContact O-N 3.34Å; V135-V137 PolarHBondContact O-N 3.47Å; V135-I138 PolarHBondContact O-N 3.04Å; V135-Q139 WeakPolarHBondContact O-CB 3.16Å; V135-Q139 PolarHBondContact O-N 3.36Å; V135-M215 HydrophobicContact CG2-CE 4.19Å; V135-I219 HydrophobicContact CB-CD1 4.23Å; V135-I219 HydrophobicContact CG1-CD1 3.74Å; V135-I219 HydrophobicContact CG1-CG2 4.38Å; V135-I219 HydrophobicContact CG2-CD1 3.72Å |
| 136 | G | 83.9 | Confident | 80.1 | Confident | 0 Ų | 0 | 49 Ų | 49 | 0% | 0 | 27% | 0.272 | C | S | . | . | H | α-helix | trans | -61.9 | -41.5 | 178 | 0 | 0 | 0 | 0 | 0 | 113.3 | S132 V133 V134 Q139 V140 | S132-G136 PolarHBondContact O-N 2.85Å; V133-G136 PolarHBondContact O-N 3Å; V134-G136 VanDerWaalsContact C-N 3.34Å; V134-G136 PolarHBondContact O-N 2.95Å; G136-Q139 PolarHBondContact O-N 3.3Å; G136-V140 WeakPolarHBondContact O-CG2 3.4Å; G136-V140 PolarHBondContact O-N 2.95Å |
| 137 | V | 88.4 | Confident | 81.6 | Confident | 60 Ų | 60 | 42.1 Ų | 42.1 | 36% | 0.364 | 25% | 0.253 | S | S | . | . | H | α-helix | trans | -64.1 | -48 | 177.7 | 170.1 | 0 | 0 | 0 | 0 | 110.7 | L7 V133 V134 V135 Q139 V140 L141 | L7-V137 HydrophobicContact CD1-CG2 3.82Å; L7-V137 HydrophobicContact CD2-CG2 4.34Å; V133-V137 HydrophobicContact CG1-CG2 4.4Å; V133-V137 WeakPolarHBondContact O-CG2 3.4Å; V133-V137 PolarHBondContact O-N 3.2Å; V134-V137 PolarHBondContact O-N 3.14Å; V135-V137 PolarHBondContact O-N 3.47Å; V137-Q139 VanDerWaalsContact C-N 3.28Å; V137-Q139 PolarHBondContact O-N 3.4Å; V137-V140 PolarHBondContact O-N 3.27Å; V137-L141 HydrophobicContact CG1-CD1 3.75Å; V137-L141 HydrophobicContact CG1-CG 4.26Å; V137-L141 WeakPolarHBondContact O-CB 3.26Å; V137-L141 VanDerWaalsContact O-CG 3.28Å; V137-L141 WeakPolarHBondContact O-CG 3.44Å; V137-L141 PolarHBondContact O-N 3.38Å |
| 138 | I | 87.5 | Confident | 82.9 | Confident | 28 Ų | 28 | 43.9 Ų | 43.9 | 14% | 0.144 | 26% | 0.262 | C | S | . | . | H | α-helix | trans | -56.1 | -47.9 | 174.9 | -70.3 | 172.3 | 0 | 0 | 0 | 109.4 | V134 V135 V140 L141 F142 C216 I219 A220 | V134-I138 HydrophobicContact CG1-CD1 3.9Å; V134-I138 HydrophobicContact CG1-CG1 4.5Å; V134-I138 WeakPolarHBondContact O-CG1 3.28Å; V134-I138 PolarHBondContact O-N 3.13Å; V135-I138 PolarHBondContact O-N 3.04Å; I138-V140 PolarHBondContact O-N 2.98Å; I138-L141 PolarHBondContact O-N 3.24Å; I138-F142 HydrophobicContact CG2-CD2 3.61Å; I138-F142 HydrophobicContact CG2-CE2 3.92Å; I138-F142 WeakPolarHBondContact O-CB 3.42Å; I138-F142 VanDerWaalsContact O-CD2 3.3Å; I138-F142 WeakPolarHBondContact O-CD2 3.46Å; I138-F142 PolarHBondContact O-N 2.93Å; I138-C216 HydrophobicContact CD1-CB 3.85Å; I138-I219 HydrophobicContact CG2-CG2 4.21Å; I138-A220 HydrophobicContact CG2-CB 4.09Å |
| 139 | Q | 87.9 | Confident | 84.1 | Confident | 16 Ų | 16 | 46 Ų | 46 | 8% | 0.075 | 27% | 0.27 | C | S | . | . | H | α-helix | trans | -60.3 | -45.1 | -179 | -154.4 | -178.2 | 1 | 0 | 0 | 112.1 | V3 V135 G136 V137 T143 I219 A223 | V3-Q139 HydrophobicContact CB-CG 4.38Å; V3-Q139 HydrophobicContact CG1-CB 4.45Å; V3-Q139 HydrophobicContact CG1-CG 3.61Å; V135-Q139 WeakPolarHBondContact O-CB 3.16Å; V135-Q139 PolarHBondContact O-N 3.36Å; G136-Q139 PolarHBondContact O-N 3.3Å; V137-Q139 VanDerWaalsContact C-N 3.28Å; V137-Q139 PolarHBondContact O-N 3.4Å; Q139-T143 WeakPolarHBondContact O-CB 3.38Å; Q139-T143 PolarHBondContact O-N 2.85Å; Q139-T143 PolarHBondContact O-OG1 3.46Å; Q139-I219 HydrophobicContact CB-CG2 4.28Å; Q139-I219 HydrophobicContact CG-CG2 4.42Å; Q139-A223 HydrophobicContact CG-CB 4.08Å |
| 140 | V | 89.9 | Confident | 85.1 | Confident | 33 Ų | 33 | 43.6 Ų | 43.6 | 20% | 0.2 | 25% | 0.252 | C | S | . | . | H | α-helix | trans | -64.1 | -47 | 177.1 | 170.5 | 0 | 0 | 0 | 0 | 111.6 | V3 V4 L7 G136 V137 I138 A144 | V3-V140 HydrophobicContact CB-CG2 4.07Å; V3-V140 HydrophobicContact CG2-CG2 4.28Å; V3-V140 WeakPolarHBondContact O-CG2 3.4Å; V4-V140 HydrophobicContact CG2-CG1 4.29Å; V4-V140 HydrophobicContact CG2-CG2 4.28Å; L7-V140 HydrophobicContact CB-CG2 3.92Å; L7-V140 HydrophobicContact CD2-CB 4.35Å; L7-V140 HydrophobicContact CD2-CG2 3.84Å; G136-V140 WeakPolarHBondContact O-CG2 3.4Å; G136-V140 PolarHBondContact O-N 2.95Å; V137-V140 PolarHBondContact O-N 3.27Å; I138-V140 PolarHBondContact O-N 2.98Å; V140-A144 WeakPolarHBondContact O-CB 3.46Å; V140-A144 PolarHBondContact O-N 3.23Å |
| 141 | L | 91.8 | Very high | 85.6 | Confident | 105 Ų | 105 | 45.8 Ų | 45.8 | 55% | 0.55 | 26% | 0.264 | S | S | . | . | H | α-helix | trans | -61.1 | -51 | -179.7 | -71.8 | 173.2 | 0 | 0 | 0 | 111.4 | V137 I138 A144 V145 | V137-L141 HydrophobicContact CG1-CD1 3.75Å; V137-L141 HydrophobicContact CG1-CG 4.26Å; V137-L141 WeakPolarHBondContact O-CB 3.26Å; V137-L141 VanDerWaalsContact O-CG 3.28Å; V137-L141 WeakPolarHBondContact O-CG 3.44Å; V137-L141 PolarHBondContact O-N 3.38Å; I138-L141 PolarHBondContact O-N 3.24Å; L141-A144 WeakPolarHBondContact O-CB 3.46Å; L141-A144 PolarHBondContact O-N 3.49Å; L141-V145 WeakPolarHBondContact O-CG2 3.17Å; L141-V145 PolarHBondContact O-N 2.9Å |
| 142 | F | 90.1 | Very high | 86.2 | Confident | 83 Ų | 83 | 55.6 Ų | 55.6 | 36% | 0.364 | 30% | 0.301 | S | S | . | . | H | α-helix | trans | -70.7 | -33.5 | -177.8 | -82.1 | -79.5 | 0 | 0 | 0 | 112.7 | I138 V145 A146 A220 A223 V224 | I138-F142 HydrophobicContact CG2-CD2 3.61Å; I138-F142 HydrophobicContact CG2-CE2 3.92Å; I138-F142 WeakPolarHBondContact O-CB 3.42Å; I138-F142 VanDerWaalsContact O-CD2 3.3Å; I138-F142 WeakPolarHBondContact O-CD2 3.46Å; I138-F142 PolarHBondContact O-N 2.93Å; F142-V145 PolarHBondContact O-N 3.09Å; F142-A146 WeakPolarHBondContact O-CB 3.43Å; F142-A146 PolarHBondContact O-N 3.13Å; F142-A220 HydrophobicContact CD1-CB 3.99Å; F142-A220 HydrophobicContact CD2-CB 3.54Å; F142-A220 HydrophobicContact CE1-CB 3.98Å; F142-A220 HydrophobicContact CE2-CB 3.54Å; F142-A220 HydrophobicContact CG-CB 3.77Å; F142-A220 HydrophobicContact CZ-CB 3.76Å; F142-A223 HydrophobicContact CB-CB 3.88Å; F142-V224 HydrophobicContact CB-CG2 4Å; F142-V224 HydrophobicContact CD1-CG2 3.7Å; F142-V224 HydrophobicContact CG-CG2 4.3Å |
| 143 | T | 88.7 | Confident | 86.6 | Confident | 30 Ų | 30 | 56.8 Ų | 56.8 | 18% | 0.184 | 31% | 0.311 | C | S | . | . | H | α-helix | trans | -68.6 | -34 | 171.2 | -63.8 | 0 | 0 | 0 | 0 | 112.2 | V3 Q139 A146 A147 A223 | V3-T143 HydrophobicContact CG2-CG2 3.84Å; Q139-T143 WeakPolarHBondContact O-CB 3.38Å; Q139-T143 PolarHBondContact O-N 2.85Å; Q139-T143 PolarHBondContact O-OG1 3.46Å; T143-A146 VanDerWaalsContact O-CB 3.31Å; T143-A146 WeakPolarHBondContact O-CB 3.29Å; T143-A146 PolarHBondContact O-N 3.34Å; T143-A147 PolarHBondContact O-N 3.45Å; T143-A223 PolarHBondContact OG1-O 2.84Å |
| 144 | A | 89.4 | Confident | 86.8 | Confident | 53 Ų | 53 | 56 Ų | 56 | 44% | 0.438 | 31% | 0.307 | S | S | . | . | H | α-helix | trans | -65.3 | -44.6 | 172.7 | 0 | 0 | 0 | 0 | 0 | 111.3 | V140 L141 A146 A147 L148 | V140-A144 WeakPolarHBondContact O-CB 3.46Å; V140-A144 PolarHBondContact O-N 3.23Å; L141-A144 WeakPolarHBondContact O-CB 3.46Å; L141-A144 PolarHBondContact O-N 3.49Å; A144-A146 VanDerWaalsContact C-N 3.3Å; A144-A146 PolarHBondContact O-N 3.42Å; A144-A147 PolarHBondContact O-N 2.95Å; A144-L148 WeakPolarHBondContact O-CG 3.44Å; A144-L148 PolarHBondContact O-N 2.91Å; A144-L148 VanDerWaalsContact O-N 3.15Å |
| 145 | V | 89.3 | Confident | 87.2 | Confident | 65 Ų | 65 | 54.1 Ų | 54.1 | 39% | 0.394 | 29% | 0.292 | S | S | . | . | H | α-helix | trans | -59 | -42.9 | 172.4 | 171.7 | 0 | 0 | 0 | 0 | 110.9 | L141 F142 A147 L148 I149 | L141-V145 WeakPolarHBondContact O-CG2 3.17Å; L141-V145 PolarHBondContact O-N 2.9Å; F142-V145 PolarHBondContact O-N 3.09Å; V145-A147 VanDerWaalsContact C-N 3.34Å; V145-A147 PolarHBondContact O-N 3.18Å; V145-L148 PolarHBondContact O-N 2.92Å; V145-I149 HydrophobicContact CG1-CD1 3.47Å; V145-I149 VanDerWaalsContact CG1-CD1 3.47Å; V145-I149 HydrophobicContact CG1-CG1 4.27Å; V145-I149 WeakPolarHBondContact O-CB 3.29Å; V145-I149 VanDerWaalsContact O-CG1 3.31Å; V145-I149 WeakPolarHBondContact O-CG1 3.5Å; V145-I149 PolarHBondContact O-N 3.04Å |
| 146 | A | 87.6 | Confident | 87.6 | Confident | 1 Ų | 1 | 58.6 Ų | 58.6 | 1% | 0.008 | 31% | 0.309 | C | S | . | . | H | α-helix | trans | -56 | -48.7 | 175.3 | 0 | 0 | 0 | 0 | 0 | 111.6 | F142 T143 A144 L148 I149 M150 V224 | F142-A146 WeakPolarHBondContact O-CB 3.43Å; F142-A146 PolarHBondContact O-N 3.13Å; T143-A146 VanDerWaalsContact O-CB 3.31Å; T143-A146 WeakPolarHBondContact O-CB 3.29Å; T143-A146 PolarHBondContact O-N 3.34Å; A144-A146 VanDerWaalsContact C-N 3.3Å; A144-A146 PolarHBondContact O-N 3.42Å; A146-L148 VanDerWaalsContact C-N 3.3Å; A146-L148 PolarHBondContact O-N 2.9Å; A146-I149 PolarHBondContact O-N 3.09Å; A146-M150 WeakPolarHBondContact O-CB 3.3Å; A146-M150 PolarHBondContact O-N 3.42Å; A146-V224 WeakPolarHBondContact CB-O 3.33Å |
| 147 | A | 86.8 | Confident | 87.9 | Confident | 59 Ų | 59 | 62.6 Ų | 62.6 | 49% | 0.488 | 33% | 0.33 | S | S | . | . | H | α-helix | trans | -59.3 | -41.3 | 180 | 0 | 0 | 0 | 0 | 0 | 111.8 | T143 A144 V145 | T143-A147 PolarHBondContact O-N 3.45Å; A144-A147 PolarHBondContact O-N 2.95Å; V145-A147 VanDerWaalsContact C-N 3.34Å; V145-A147 PolarHBondContact O-N 3.18Å |
| 148 | L | 88.1 | Confident | 88 | Confident | 136 Ų | 136 | 60 Ų | 60 | 71% | 0.712 | 31% | 0.314 | S | S | * | . | H | α-helix | trans | -69.8 | -33.4 | 178.2 | -63.8 | 175.8 | 0 | 0 | 0 | 113.2 | A144 V145 A146 | A144-L148 WeakPolarHBondContact O-CG 3.44Å; A144-L148 PolarHBondContact O-N 2.91Å; A144-L148 VanDerWaalsContact O-N 3.15Å; V145-L148 PolarHBondContact O-N 2.92Å; A146-L148 VanDerWaalsContact C-N 3.3Å; A146-L148 PolarHBondContact O-N 2.9Å |
| 149 | I | 88.2 | Confident | 88.2 | Confident | 75 Ų | 75 | 58.7 Ų | 58.7 | 39% | 0.385 | 31% | 0.307 | S | S | . | . | H | α-helix | trans | -88.5 | -29.7 | -176 | -65.1 | 176.9 | 0 | 0 | 0 | 111.9 | V145 A146 D151 R152 A153 L158 | V145-I149 HydrophobicContact CG1-CD1 3.47Å; V145-I149 VanDerWaalsContact CG1-CD1 3.47Å; V145-I149 HydrophobicContact CG1-CG1 4.27Å; V145-I149 WeakPolarHBondContact O-CB 3.29Å; V145-I149 VanDerWaalsContact O-CG1 3.31Å; V145-I149 WeakPolarHBondContact O-CG1 3.5Å; V145-I149 PolarHBondContact O-N 3.04Å; A146-I149 PolarHBondContact O-N 3.09Å; I149-D151 VanDerWaalsContact C-N 3.26Å; I149-D151 PolarHBondContact O-N 3.24Å; I149-R152 PolarHBondContact O-N 3.41Å; I149-A153 HydrophobicContact CG2-CB 3.66Å; I149-A153 PolarHBondContact O-N 3.43Å; I149-L158 HydrophobicContact CG2-CD1 4.05Å; I149-L158 HydrophobicContact CG2-CD2 4.47Å |
| 150 | M | 84.8 | Confident | 88.5 | Confident | 13 Ų | 13 | 59 Ų | 59 | 6% | 0.064 | 31% | 0.31 | C | S | . | . | H | α-helix | trans | -57.5 | -38 | -171.5 | -175.5 | 178.8 | -55.5 | 0 | 0 | 112.9 | A146 R152 G154 R155 L158 P228 I229 L232 | A146-M150 WeakPolarHBondContact O-CB 3.3Å; A146-M150 PolarHBondContact O-N 3.42Å; M150-R152 VanDerWaalsContact C-N 3.3Å; M150-R152 PolarHBondContact O-N 3.09Å; M150-G154 PolarHBondContact O-N 3.27Å; M150-R155 PolarHBondContact O-NH1 3.26Å; M150-L158 HydrophobicContact CB-CD2 4.11Å; M150-P228 HydrophobicContact CE-CB 4.17Å; M150-P228 HydrophobicContact CE-CG 3.99Å; M150-I229 HydrophobicContact CE-CD1 4.4Å; M150-I229 HydrophobicContact CE-CG1 3.66Å; M150-I229 HydrophobicContact SD-CG1 4.4Å; M150-L232 HydrophobicContact SD-CD1 3.77Å; M150-L232 HydrophobicContact SD-CD2 4.17Å |
| 151 | D | 81.7 | Confident | 88.7 | Confident | 109 Ų | 109 | 62.1 Ų | 62.1 | 58% | 0.583 | 33% | 0.325 | S | S | * | . | H | α-helix | trans | -71.7 | -25.9 | 177.9 | -69.1 | -27.8 | 0 | 0 | 0 | 112.8 | I149 R155 K300 | I149-D151 VanDerWaalsContact C-N 3.26Å; I149-D151 PolarHBondContact O-N 3.24Å; D151-R155 IonicContact OD1-NH1 2.89Å; D151-K300 WeakPolarHBondContact O-CE 3.31Å |
| 152 | R | 84.8 | Confident | 88.8 | Confident | 209 Ų | 209 | 57.3 Ų | 57.3 | 79% | 0.789 | 30% | 0.3 | S | S | * | . | H | α-helix | trans | -92.3 | -44 | -179.5 | -66.2 | -171.7 | -178.9 | 177.6 | 1.8 | 113.4 | I149 M150 K300 | I149-R152 PolarHBondContact O-N 3.41Å; M150-R152 VanDerWaalsContact C-N 3.3Å; M150-R152 PolarHBondContact O-N 3.09Å; R152-K300 PolarHBondContact O-NZ 2.7Å |
| 153 | A | 84.6 | Confident | 88.9 | Confident | 35 Ų | 35 | 53.3 Ų | 53.3 | 29% | 0.289 | 28% | 0.283 | S | S | . | . | H | α-helix | trans | -91.1 | -18 | -170.7 | 0 | 0 | 0 | 0 | 0 | 114 | I149 L157 L158 | I149-A153 HydrophobicContact CG2-CB 3.66Å; I149-A153 PolarHBondContact O-N 3.43Å; A153-L157 HydrophobicContact CB-CD2 4.39Å; A153-L158 HydrophobicContact CB-CD1 3.24Å |
| 154 | G | 85.9 | Confident | 89.2 | Confident | 1 Ų | 1 | 54.6 Ų | 54.6 | 1% | 0.01 | 29% | 0.291 | C | S | . | . | trans | 88.2 | 158.4 | -179.3 | 0 | 0 | 0 | 0 | 0 | 113.1 | M150 L158 E298 | M150-G154 PolarHBondContact O-N 3.27Å; G154-L158 VanDerWaalsContact O-CD1 3.29Å; G154-L158 WeakPolarHBondContact O-CD1 3.36Å; G154-L158 PolarHBondContact O-N 3.16Å; G154-E298 WeakPolarHBondContact CA-OE1 3.2Å | ||
| 155 | R | 89.3 | Confident | 89.5 | Confident | 24 Ų | 24 | 54.4 Ų | 54.4 | 9% | 0.091 | 28% | 0.284 | C | S | . | . | H | α-helix | trans | -77.4 | -41.3 | -169 | -71.7 | 71.9 | 166.4 | 138.4 | 1.5 | 111.1 | M150 D151 L158 L159 I229 L232 L233 E236 E298 T299 | M150-R155 PolarHBondContact O-NH1 3.26Å; D151-R155 IonicContact OD1-NH1 2.89Å; R155-L158 PolarHBondContact O-N 3.11Å; R155-L159 PolarHBondContact O-N 3.49Å; R155-L159 VanDerWaalsContact O-N 3.11Å; R155-I229 HydrophobicContact CB-CG2 3.89Å; R155-I229 HydrophobicContact CG-CG2 4.18Å; R155-L232 HydrophobicContact CG-CD2 3.8Å; R155-L233 HydrophobicContact CB-CD2 4.22Å; R155-L233 HydrophobicContact CB-CG 4.37Å; R155-L233 HydrophobicContact CG-CD2 4.49Å; R155-E236 IonicContact CZ-OE1 3.36Å; R155-E236 IonicContact NE-OE1 3.4Å; R155-E236 PolarHBondContact NE-OE1 3.41Å; R155-E236 IonicContact NE-OE2 2.68Å; R155-E236 PolarHBondContact NE-OE2 2.91Å; R155-E236 IonicContact NH2-OE1 2.86Å; R155-E236 PolarHBondContact NH2-OE1 2.9Å; R155-E298 PolarHBondContact N-OE1 3.38Å; R155-E298 PolarHBondContact N-OE2 3.42Å; R155-T299 WeakPolarHBondContact CD-OG1 3.42Å |
| 156 | R | 90.8 | Very high | 89.6 | Confident | 95 Ų | 95 | 51.3 Ų | 51.3 | 36% | 0.358 | 27% | 0.265 | S | S | . | . | H | α-helix | trans | -67 | -44.5 | -177.7 | -175.9 | -175.8 | 176 | -162.4 | -6 | 111 | L158 L159 V160 T292 L293 V296 E298 | R156-L158 PolarHBondContact O-N 2.91Å; R156-L159 PolarHBondContact O-N 2.99Å; R156-V160 WeakPolarHBondContact O-CG2 3.33Å; R156-V160 PolarHBondContact O-N 3.2Å; R156-T292 HydrophobicContact CG-CG2 4.34Å; R156-L293 PolarHBondContact NH2-O 3.47Å; R156-V296 VanDerWaalsContact CD-O 3.27Å; R156-V296 WeakPolarHBondContact CD-O 3.49Å; R156-V296 PolarHBondContact NE-O 3.43Å; R156-E298 WeakPolarHBondContact CB-OE2 3.39Å; R156-E298 PolarHBondContact N-OE2 3.3Å; R156-E298 VanDerWaalsContact N-OE2 3.16Å |
| 157 | L | 90.3 | Very high | 89.9 | Confident | 85 Ų | 85 | 52.3 Ų | 52.3 | 45% | 0.445 | 27% | 0.271 | S | S | . | . | H | α-helix | trans | -61.6 | -44.7 | 179.1 | -178.6 | 61.2 | 0 | 0 | 0 | 111.5 | A153 L159 V160 L161 | A153-L157 HydrophobicContact CB-CD2 4.39Å; L157-L159 PolarHBondContact O-N 3.16Å; L157-V160 PolarHBondContact O-N 3.36Å; L157-L161 HydrophobicContact CD1-CD1 4.01Å; L157-L161 HydrophobicContact CD1-CG 4.04Å; L157-L161 HydrophobicContact CG-CD1 3.89Å; L157-L161 HydrophobicContact CG-CG 4.33Å; L157-L161 WeakPolarHBondContact O-CB 3.41Å; L157-L161 WeakPolarHBondContact O-CG 3.19Å; L157-L161 PolarHBondContact O-N 3.5Å |
| 158 | L | 91.2 | Very high | 90.2 | Very high | 5 Ų | 5 | 56.5 Ų | 56.5 | 3% | 0.026 | 28% | 0.278 | C | S | . | . | H | α-helix | trans | -64.3 | -40.4 | 178.4 | -95.6 | 66.8 | 0 | 0 | 0 | 112.3 | I149 M150 A153 G154 R155 R156 S162 I229 | I149-L158 HydrophobicContact CG2-CD1 4.05Å; I149-L158 HydrophobicContact CG2-CD2 4.47Å; M150-L158 HydrophobicContact CB-CD2 4.11Å; A153-L158 HydrophobicContact CB-CD1 3.24Å; G154-L158 VanDerWaalsContact O-CD1 3.29Å; G154-L158 WeakPolarHBondContact O-CD1 3.36Å; G154-L158 PolarHBondContact O-N 3.16Å; R155-L158 PolarHBondContact O-N 3.11Å; R156-L158 PolarHBondContact O-N 2.91Å; L158-S162 VanDerWaalsContact O-CB 3.25Å; L158-S162 WeakPolarHBondContact O-CB 3.31Å; L158-S162 PolarHBondContact O-N 2.93Å; L158-S162 PolarHBondContact O-OG 2.77Å; L158-I229 HydrophobicContact CB-CD1 3.33Å; L158-I229 HydrophobicContact CD2-CD1 4.08Å; L158-I229 HydrophobicContact CG-CD1 4.34Å |
| 159 | L | 92.1 | Very high | 90.4 | Very high | 0 Ų | 0 | 50 Ų | 50 | 0% | 0 | 25% | 0.245 | C | C | . | . | H | α-helix | trans | -62.8 | -40.8 | 175.7 | -80.9 | 172.3 | 0 | 0 | 0 | 112.5 | L100 R155 R156 L157 S162 G163 W226 I229 P230 L233 T292 V296 | L100-L159 HydrophobicContact CD2-CD1 4.28Å; R155-L159 PolarHBondContact O-N 3.49Å; R155-L159 VanDerWaalsContact O-N 3.11Å; R156-L159 PolarHBondContact O-N 2.99Å; L157-L159 PolarHBondContact O-N 3.16Å; L159-S162 WeakPolarHBondContact CA-OG 3.45Å; L159-S162 PolarHBondContact O-OG 3.11Å; L159-G163 PolarHBondContact O-N 3.44Å; L159-W226 HydrophobicContact CD2-CD2 3.83Å; L159-W226 HydrophobicContact CD2-CE3 4.13Å; L159-W226 HydrophobicContact CD2-CG 4.12Å; L159-W226 HydrophobicContact CD2-CZ2 4.36Å; L159-W226 PolarHBondContact O-NE1 3.4Å; L159-I229 HydrophobicContact CD1-CB 4.36Å; L159-I229 HydrophobicContact CD1-CG2 3.62Å; L159-I229 HydrophobicContact CD2-CB 3.91Å; L159-I229 HydrophobicContact CD2-CD1 4.46Å; L159-I229 HydrophobicContact CD2-CG2 4.1Å; L159-I229 HydrophobicContact CG-CB 3.95Å; L159-I229 HydrophobicContact CG-CD1 4.05Å; L159-I229 HydrophobicContact CG-CG2 3.65Å; L159-P230 HydrophobicContact CD2-CG 4.41Å; L159-L233 HydrophobicContact CD1-CD1 3.56Å; L159-T292 HydrophobicContact CB-CG2 3.53Å; L159-T292 HydrophobicContact CD1-CG2 4.1Å; L159-T292 HydrophobicContact CG-CG2 4.48Å; L159-V296 HydrophobicContact CD1-CG1 4.44Å |
| 160 | V | 93.8 | Very high | 90.4 | Very high | 22 Ų | 22 | 46.7 Ų | 46.7 | 13% | 0.133 | 23% | 0.228 | C | C | . | . | H | α-helix | trans | -67.4 | -50.6 | 177.3 | 172.8 | 0 | 0 | 0 | 0 | 110.6 | R156 L157 S162 G163 V164 V289 T292 L293 | R156-V160 WeakPolarHBondContact O-CG2 3.33Å; R156-V160 PolarHBondContact O-N 3.2Å; L157-V160 PolarHBondContact O-N 3.36Å; V160-S162 PolarHBondContact O-N 3.38Å; V160-G163 PolarHBondContact O-N 3.37Å; V160-V164 WeakPolarHBondContact O-CG2 3.29Å; V160-V164 PolarHBondContact O-N 2.78Å; V160-V289 HydrophobicContact CG1-CG1 4.34Å; V160-T292 HydrophobicContact CG2-CG2 3.7Å; V160-L293 HydrophobicContact CB-CD2 4.48Å; V160-L293 HydrophobicContact CG1-CD2 4.01Å; V160-L293 HydrophobicContact CG1-CG 4.4Å; V160-L293 HydrophobicContact CG2-CD2 3.63Å; V160-L293 HydrophobicContact CG2-CG 3.92Å |
| 161 | L | 94.1 | Very high | 90.6 | Very high | 100 Ų | 100 | 48 Ų | 48 | 52% | 0.524 | 24% | 0.239 | S | C | . | . | H | α-helix | trans | -60.8 | -47 | -179.4 | -70.7 | 176 | 0 | 0 | 0 | 111.6 | L157 G163 V164 V165 | L157-L161 HydrophobicContact CD1-CD1 4.01Å; L157-L161 HydrophobicContact CD1-CG 4.04Å; L157-L161 HydrophobicContact CG-CD1 3.89Å; L157-L161 HydrophobicContact CG-CG 4.33Å; L157-L161 WeakPolarHBondContact O-CB 3.41Å; L157-L161 WeakPolarHBondContact O-CG 3.19Å; L157-L161 PolarHBondContact O-N 3.5Å; L161-G163 VanDerWaalsContact C-N 3.34Å; L161-G163 PolarHBondContact O-N 2.92Å; L161-V164 PolarHBondContact O-N 3.47Å; L161-V165 WeakPolarHBondContact O-CG2 3.24Å; L161-V165 PolarHBondContact O-N 2.91Å |
| 162 | S | 93.6 | Very high | 90.9 | Very high | 3 Ų | 3 | 44.3 Ų | 44.3 | 2% | 0.021 | 22% | 0.223 | C | C | . | . | H | α-helix | trans | -61.8 | -41.8 | 175.1 | 54.1 | 0 | 0 | 0 | 0 | 112.1 | L158 L159 V160 V164 V165 M166 G221 G225 W226 | L158-S162 VanDerWaalsContact O-CB 3.25Å; L158-S162 WeakPolarHBondContact O-CB 3.31Å; L158-S162 PolarHBondContact O-N 2.93Å; L158-S162 PolarHBondContact O-OG 2.77Å; L159-S162 WeakPolarHBondContact CA-OG 3.45Å; L159-S162 PolarHBondContact O-OG 3.11Å; V160-S162 PolarHBondContact O-N 3.38Å; S162-V164 PolarHBondContact O-N 2.86Å; S162-V165 PolarHBondContact O-N 3.48Å; S162-M166 VanDerWaalsContact O-CG 3.32Å; S162-M166 WeakPolarHBondContact O-CG 3.37Å; S162-M166 PolarHBondContact O-N 3.45Å; S162-G221 WeakPolarHBondContact CB-O 3.39Å; S162-G225 WeakPolarHBondContact OG-CA 3.47Å; S162-W226 VanDerWaalsContact OG-CD1 3.23Å |
| 163 | G | 92.6 | Very high | 90.9 | Very high | 0 Ų | 0 | 34.7 Ų | 34.7 | 0% | 0 | 19% | 0.187 | C | C | . | . | H | α-helix | trans | -61.2 | -42.6 | 176.9 | 0 | 0 | 0 | 0 | 0 | 112.9 | L159 V160 L161 M166 V167 V289 | L159-G163 PolarHBondContact O-N 3.44Å; V160-G163 PolarHBondContact O-N 3.37Å; L161-G163 VanDerWaalsContact C-N 3.34Å; L161-G163 PolarHBondContact O-N 2.92Å; G163-M166 PolarHBondContact O-N 2.89Å; G163-V167 WeakPolarHBondContact O-CG2 3.34Å; G163-V167 PolarHBondContact O-N 3.39Å; G163-V289 VanDerWaalsContact CA-CG2 3.49Å |
| 164 | V | 95.1 | Very high | 90.8 | Very high | 57 Ų | 57 | 33 Ų | 33 | 35% | 0.345 | 17% | 0.173 | S | C | . | . | H | α-helix | trans | -61.9 | -45.1 | 175.1 | 171.6 | 0 | 0 | 0 | 0 | 111 | V160 L161 S162 M166 V167 F168 V289 | V160-V164 WeakPolarHBondContact O-CG2 3.29Å; V160-V164 PolarHBondContact O-N 2.78Å; L161-V164 PolarHBondContact O-N 3.47Å; S162-V164 PolarHBondContact O-N 2.86Å; V164-M166 VanDerWaalsContact C-N 3.33Å; V164-M166 PolarHBondContact O-N 3.26Å; V164-V167 PolarHBondContact O-N 3.39Å; V164-F168 HydrophobicContact CG1-CD2 3.68Å; V164-F168 HydrophobicContact CG1-CE2 3.46Å; V164-F168 VanDerWaalsContact CG1-CE2 3.46Å; V164-F168 WeakPolarHBondContact O-CD2 3.28Å; V164-F168 PolarHBondContact O-N 2.71Å; V164-F168 VanDerWaalsContact O-N 3.07Å; V164-V289 HydrophobicContact CG2-CG1 4.25Å; V164-V289 HydrophobicContact CG2-CG2 4.48Å |
| 165 | V | 94.6 | Very high | 90.8 | Very high | 49 Ų | 49 | 34.7 Ų | 34.7 | 30% | 0.297 | 19% | 0.187 | S | C | . | . | H | α-helix | trans | -58.5 | -45.8 | 175.1 | 172.7 | 0 | 0 | 0 | 0 | 110.8 | L161 S162 V167 F168 S169 L217 | L161-V165 WeakPolarHBondContact O-CG2 3.24Å; L161-V165 PolarHBondContact O-N 2.91Å; S162-V165 PolarHBondContact O-N 3.48Å; V165-V167 PolarHBondContact O-N 2.89Å; V165-F168 PolarHBondContact O-N 3.49Å; V165-S169 WeakPolarHBondContact O-CB 3.3Å; V165-S169 PolarHBondContact O-N 3.44Å; V165-L217 HydrophobicContact CG1-CD1 3.75Å; V165-L217 HydrophobicContact CG1-CG 3.81Å |
| 166 | M | 92.7 | Very high | 90.5 | Very high | 0 Ų | 0 | 34.3 Ų | 34.3 | 0% | 0 | 19% | 0.185 | C | C | . | . | H | α-helix | trans | -60 | -45.4 | 177.6 | -69.8 | -172.2 | -32.2 | 0 | 0 | 111.9 | S162 G163 V164 F168 S169 T170 F218 F222 W226 | S162-M166 VanDerWaalsContact O-CG 3.32Å; S162-M166 WeakPolarHBondContact O-CG 3.37Å; S162-M166 PolarHBondContact O-N 3.45Å; G163-M166 PolarHBondContact O-N 2.89Å; V164-M166 VanDerWaalsContact C-N 3.33Å; V164-M166 PolarHBondContact O-N 3.26Å; M166-F168 PolarHBondContact O-N 2.79Å; M166-S169 WeakPolarHBondContact O-CB 3.26Å; M166-S169 PolarHBondContact O-N 2.79Å; M166-T170 PolarHBondContact O-N 2.95Å; M166-T170 PolarHBondContact O-OG1 3.31Å; M166-F218 HydrophobicContact CB-CD2 3.98Å; M166-F218 HydrophobicContact CB-CE2 3.92Å; M166-F218 HydrophobicContact CG-CD2 4Å; M166-F218 HydrophobicContact CG-CE2 3.96Å; M166-F218 HydrophobicContact SD-CE2 4.15Å; M166-F218 HydrophobicContact SD-CZ 4.43Å; M166-F222 HydrophobicContact SD-CB 3.86Å; M166-F222 HydrophobicContact SD-CD2 3.82Å; M166-F222 HydrophobicContact SD-CG 4.34Å; M166-W226 HydrophobicContact CE-CB 4.14Å; M166-W226 HydrophobicContact CE-CD2 4.19Å; M166-W226 HydrophobicContact CE-CG 3.59Å; M166-W226 HydrophobicContact SD-CB 4.15Å; M166-W226 HydrophobicContact SD-CG 4.17Å |
| 167 | V | 93.9 | Very high | 89.9 | Confident | 22 Ų | 22 | 30.8 Ų | 30.8 | 13% | 0.133 | 17% | 0.173 | C | C | . | . | H | α-helix | trans | -57.6 | -48.8 | 177.5 | 169.9 | 0 | 0 | 0 | 0 | 111.5 | G163 V164 V165 S169 T170 S171 S282 C285 I286 | G163-V167 WeakPolarHBondContact O-CG2 3.34Å; G163-V167 PolarHBondContact O-N 3.39Å; V164-V167 PolarHBondContact O-N 3.39Å; V165-V167 PolarHBondContact O-N 2.89Å; V167-S169 VanDerWaalsContact C-N 3.29Å; V167-S169 PolarHBondContact O-N 3.11Å; V167-T170 PolarHBondContact O-OG1 3.48Å; V167-S171 WeakPolarHBondContact O-CB 3.39Å; V167-S171 PolarHBondContact O-N 3.48Å; V167-S171 PolarHBondContact O-OG 3.4Å; V167-S282 PolarHBondContact O-OG 3.48Å; V167-C285 HydrophobicContact CG2-CB 3.47Å; V167-C285 VanDerWaalsContact CG2-CB 3.47Å; V167-I286 HydrophobicContact CB-CG1 4.36Å; V167-I286 HydrophobicContact CG1-CD1 4.08Å; V167-I286 HydrophobicContact CG1-CG1 3.63Å; V167-I286 HydrophobicContact CG2-CB 4.47Å; V167-I286 HydrophobicContact CG2-CG1 3.68Å |
| 168 | F | 93.1 | Very high | 89.5 | Confident | 146 Ų | 146 | 32.1 Ų | 32.1 | 64% | 0.64 | 18% | 0.175 | S | C | * | . | H | α-helix | trans | -61.3 | -42.8 | 178.1 | -80.1 | -65.8 | 0 | 0 | 0 | 111.1 | V164 V165 M166 A172 | V164-F168 HydrophobicContact CG1-CD2 3.68Å; V164-F168 HydrophobicContact CG1-CE2 3.46Å; V164-F168 VanDerWaalsContact CG1-CE2 3.46Å; V164-F168 WeakPolarHBondContact O-CD2 3.28Å; V164-F168 PolarHBondContact O-N 2.71Å; V164-F168 VanDerWaalsContact O-N 3.07Å; V165-F168 PolarHBondContact O-N 3.49Å; M166-F168 PolarHBondContact O-N 2.79Å; F168-A172 WeakPolarHBondContact O-CB 3.33Å; F168-A172 PolarHBondContact O-N 3.4Å |
| 169 | S | 90.9 | Very high | 88.9 | Confident | 1 Ų | 1 | 37 Ų | 37 | 1% | 0.007 | 20% | 0.2 | C | C | . | . | H | α-helix | trans | -63.1 | -52.1 | 178.9 | -121.1 | 0 | 0 | 0 | 0 | 113.4 | V165 M166 V167 S171 A172 F173 S214 L217 F218 | V165-S169 WeakPolarHBondContact O-CB 3.3Å; V165-S169 PolarHBondContact O-N 3.44Å; M166-S169 WeakPolarHBondContact O-CB 3.26Å; M166-S169 PolarHBondContact O-N 2.79Å; V167-S169 VanDerWaalsContact C-N 3.29Å; V167-S169 PolarHBondContact O-N 3.11Å; S169-S171 VanDerWaalsContact C-N 3.29Å; S169-S171 PolarHBondContact O-N 3.29Å; S169-A172 PolarHBondContact O-N 3.28Å; S169-F173 WeakPolarHBondContact O-CB 3.21Å; S169-F173 PolarHBondContact O-N 3.12Å; S169-S214 PolarHBondContact OG-O 3.43Å; S169-L217 WeakPolarHBondContact OG-CB 3.43Å; S169-F218 PolarHBondContact OG-N 3.43Å |
| 170 | T | 87.9 | Confident | 87.9 | Confident | 4 Ų | 4 | 38.8 Ų | 38.8 | 3% | 0.025 | 21% | 0.212 | C | C | . | . | H | α-helix | trans | -66.4 | -33.6 | -179.7 | 48.7 | 0 | 0 | 0 | 0 | 111.8 | M166 V167 F173 G174 F218 S282 | M166-T170 PolarHBondContact O-N 2.95Å; M166-T170 PolarHBondContact O-OG1 3.31Å; V167-T170 PolarHBondContact O-OG1 3.48Å; T170-F173 PolarHBondContact O-N 3.45Å; T170-G174 PolarHBondContact O-N 2.87Å; T170-F218 HydrophobicContact CG2-CD2 3.44Å; T170-F218 VanDerWaalsContact CG2-CD2 3.44Å; T170-F218 HydrophobicContact CG2-CE2 3.38Å; T170-F218 HydrophobicContact CG2-CG 4.47Å; T170-F218 HydrophobicContact CG2-CZ 4.39Å; T170-S282 WeakPolarHBondContact OG1-CA 3.35Å; T170-S282 WeakPolarHBondContact OG1-CB 3.23Å; T170-S282 PolarHBondContact OG1-OG 2.97Å |
| 171 | S | 89.9 | Confident | 86.5 | Confident | 42 Ų | 42 | 42.3 Ų | 42.3 | 29% | 0.294 | 23% | 0.226 | S | C | . | . | H | α-helix | trans | -66.8 | -43.8 | 174.3 | -58.2 | 0 | 0 | 0 | 0 | 111.6 | V167 S169 F173 G174 A175 S282 | V167-S171 WeakPolarHBondContact O-CB 3.39Å; V167-S171 PolarHBondContact O-N 3.48Å; V167-S171 PolarHBondContact O-OG 3.4Å; S169-S171 VanDerWaalsContact C-N 3.29Å; S169-S171 PolarHBondContact O-N 3.29Å; S171-F173 VanDerWaalsContact C-N 3.3Å; S171-F173 PolarHBondContact O-N 2.88Å; S171-G174 PolarHBondContact O-N 2.86Å; S171-A175 WeakPolarHBondContact O-CB 3.43Å; S171-A175 PolarHBondContact O-N 3.36Å; S171-S282 PolarHBondContact OG-OG 3.01Å |
| 172 | A | 87.8 | Confident | 84.4 | Confident | 31 Ų | 31 | 40.1 Ų | 40.1 | 26% | 0.256 | 23% | 0.228 | S | C | . | . | H | α-helix | trans | -62.4 | -39.7 | 174.6 | 0 | 0 | 0 | 0 | 0 | 111.4 | F168 S169 A175 Y176 | F168-A172 WeakPolarHBondContact O-CB 3.33Å; F168-A172 PolarHBondContact O-N 3.4Å; S169-A172 PolarHBondContact O-N 3.28Å; A172-A175 PolarHBondContact O-N 3.43Å; A172-Y176 PolarHBondContact O-N 3.03Å |
| 173 | F | 84.1 | Confident | 81.9 | Confident | 7 Ų | 7 | 42.4 Ų | 42.4 | 3% | 0.031 | 25% | 0.252 | C | S | . | . | H | α-helix | trans | -67.7 | -42.7 | 178.3 | -159.5 | -120.7 | 0 | 0 | 0 | 112.7 | I119 S169 T170 S171 A175 Y176 F177 A211 S214 F278 | I119-F173 HydrophobicContact CD1-CE1 3.95Å; I119-F173 HydrophobicContact CD1-CE2 4.03Å; I119-F173 HydrophobicContact CD1-CZ 3.21Å; I119-F173 HydrophobicContact CG1-CZ 3.82Å; I119-F173 HydrophobicContact CG2-CE2 4.39Å; I119-F173 HydrophobicContact CG2-CZ 4.49Å; S169-F173 WeakPolarHBondContact O-CB 3.21Å; S169-F173 PolarHBondContact O-N 3.12Å; T170-F173 PolarHBondContact O-N 3.45Å; S171-F173 VanDerWaalsContact C-N 3.3Å; S171-F173 PolarHBondContact O-N 2.88Å; F173-A175 VanDerWaalsContact C-N 3.34Å; F173-A175 PolarHBondContact O-N 3.33Å; F173-Y176 WeakPolarHBondContact O-CB 3.47Å; F173-Y176 PolarHBondContact O-N 3.41Å; F173-F177 HydrophobicContact CD1-CD2 4.37Å; F173-F177 HydrophobicContact CD1-CE2 4.05Å; F173-F177 HydrophobicContact CE1-CD2 4.15Å; F173-F177 AromaticContact CE1-CE2 3.41Å; F173-F177 HydrophobicContact CE1-CE2 3.41Å; F173-F177 VanDerWaalsContact CE1-CE2 3.41Å; F173-F177 HydrophobicContact CE1-CZ 4.35Å; F173-F177 HydrophobicContact CE2-CE2 4.18Å; F173-F177 HydrophobicContact CZ-CD2 4.3Å; F173-F177 AromaticContact CZ-CE2 3.4Å; F173-F177 HydrophobicContact CZ-CE2 3.4Å; F173-F177 HydrophobicContact CZ-CZ 4.02Å; F173-F177 WeakPolarHBondContact O-CD2 3.38Å; F173-F177 PolarHBondContact O-N 3.32Å; F173-A211 HydrophobicContact CD2-CB 4.42Å; F173-A211 HydrophobicContact CE2-CB 3.88Å; F173-S214 WeakPolarHBondContact CD2-OG 3.31Å; F173-F278 AromaticContact CD1-CD1 3.64Å; F173-F278 HydrophobicContact CD1-CD1 3.64Å; F173-F278 AromaticContact CD1-CD2 3.7Å; F173-F278 HydrophobicContact CD1-CD2 3.7Å; F173-F278 AromaticContact CD1-CE1 3.68Å; F173-F278 HydrophobicContact CD1-CE1 3.68Å; F173-F278 AromaticContact CD1-CE2 3.79Å; F173-F278 HydrophobicContact CD1-CE2 3.79Å; F173-F278 AromaticContact CD1-CG 3.67Å; F173-F278 HydrophobicContact CD1-CG 3.67Å; F173-F278 AromaticContact CD1-CZ 3.79Å; F173-F278 HydrophobicContact CD1-CZ 3.79Å; F173-F278 HydrophobicContact CE1-CD1 4.12Å; F173-F278 AromaticContact CE1-CD2 3.91Å; F173-F278 HydrophobicContact CE1-CD2 3.91Å; F173-F278 AromaticContact CE1-CE1 3.7Å; F173-F278 HydrophobicContact CE1-CE1 3.7Å; F173-F278 AromaticContact CE1-CE2 3.49Å; F173-F278 HydrophobicContact CE1-CE2 3.49Å; F173-F278 VanDerWaalsContact CE1-CE2 3.49Å; F173-F278 HydrophobicContact CE1-CG 4.24Å; F173-F278 AromaticContact CE1-CZ 3.39Å; F173-F278 HydrophobicContact CE1-CZ 3.39Å |
| 174 | G | 83.7 | Confident | 79.6 | Confident | 0 Ų | 0 | 48.3 Ų | 48.3 | 0% | 0 | 29% | 0.29 | C | S | . | . | H | α-helix | trans | -64.2 | -36.9 | 171.5 | 0 | 0 | 0 | 0 | 0 | 112.9 | T170 S171 F177 K178 Y275 | T170-G174 PolarHBondContact O-N 2.87Å; S171-G174 PolarHBondContact O-N 2.86Å; G174-F177 PolarHBondContact O-N 3.5Å; G174-K178 PolarHBondContact O-N 3.17Å; G174-Y275 WeakPolarHBondContact O-CB 3.44Å |
| 175 | A | 85.6 | Confident | 76.9 | Confident | 36 Ų | 36 | 49 Ų | 49 | 30% | 0.298 | 31% | 0.309 | S | S | . | . | H | α-helix | trans | -65.7 | -39.7 | 174.7 | 0 | 0 | 0 | 0 | 0 | 112.2 | S171 A172 F173 K178 L179 | S171-A175 WeakPolarHBondContact O-CB 3.43Å; S171-A175 PolarHBondContact O-N 3.36Å; A172-A175 PolarHBondContact O-N 3.43Å; F173-A175 VanDerWaalsContact C-N 3.34Å; F173-A175 PolarHBondContact O-N 3.33Å; A175-K178 PolarHBondContact O-N 2.92Å; A175-L179 VanDerWaalsContact O-CG 3.31Å; A175-L179 WeakPolarHBondContact O-CG 3.28Å; A175-L179 PolarHBondContact O-N 2.69Å |
| 176 | Y | 82.8 | Confident | 74.5 | Confident | 15 Ų | 15 | 53.9 Ų | 53.9 | 6% | 0.059 | 33% | 0.334 | C | S | . | . | H | α-helix | trans | -54.7 | -56.3 | 172.5 | 167.1 | -98.8 | 0 | 0 | 0 | 110.6 | A172 F173 K178 L179 T180 L207 A211 | A172-Y176 PolarHBondContact O-N 3.03Å; F173-Y176 WeakPolarHBondContact O-CB 3.47Å; F173-Y176 PolarHBondContact O-N 3.41Å; Y176-K178 VanDerWaalsContact C-N 3.26Å; Y176-K178 PolarHBondContact O-N 2.88Å; Y176-L179 PolarHBondContact O-N 3.41Å; Y176-T180 HydrophobicContact CD2-CG2 4.5Å; Y176-T180 HydrophobicContact CE2-CG2 3.84Å; Y176-T180 PolarHBondContact O-N 2.87Å; Y176-T180 PolarHBondContact O-OG1 2.89Å; Y176-L207 HydrophobicContact CD2-CB 3.93Å; Y176-L207 WeakPolarHBondContact CD2-O 3.2Å; Y176-L207 VanDerWaalsContact CE2-C 3.5Å; Y176-L207 HydrophobicContact CE2-CB 3.66Å; Y176-L207 WeakPolarHBondContact CE2-O 3.34Å; Y176-A211 HydrophobicContact CD1-CB 3.71Å; Y176-A211 HydrophobicContact CD2-CB 4.05Å; Y176-A211 HydrophobicContact CE1-CB 3.57Å; Y176-A211 HydrophobicContact CE2-CB 3.93Å; Y176-A211 HydrophobicContact CG-CB 3.94Å |
| 177 | F | 77.9 | Confident | 72 | Confident | 22 Ų | 22 | 58.9 Ų | 58.9 | 10% | 0.096 | 37% | 0.368 | C | S | . | . | H | α-helix | trans | -60.7 | -33.5 | -179.8 | -83 | -64.4 | 0 | 0 | 0 | 113.7 | F173 G174 T180 Q181 P274 F278 | F173-F177 HydrophobicContact CD1-CD2 4.37Å; F173-F177 HydrophobicContact CD1-CE2 4.05Å; F173-F177 HydrophobicContact CE1-CD2 4.15Å; F173-F177 AromaticContact CE1-CE2 3.41Å; F173-F177 HydrophobicContact CE1-CE2 3.41Å; F173-F177 VanDerWaalsContact CE1-CE2 3.41Å; F173-F177 HydrophobicContact CE1-CZ 4.35Å; F173-F177 HydrophobicContact CE2-CE2 4.18Å; F173-F177 HydrophobicContact CZ-CD2 4.3Å; F173-F177 AromaticContact CZ-CE2 3.4Å; F173-F177 HydrophobicContact CZ-CE2 3.4Å; F173-F177 HydrophobicContact CZ-CZ 4.02Å; F173-F177 WeakPolarHBondContact O-CD2 3.38Å; F173-F177 PolarHBondContact O-N 3.32Å; G174-F177 PolarHBondContact O-N 3.5Å; F177-T180 WeakPolarHBondContact CA-OG1 3.43Å; F177-Q181 VanDerWaalsContact O-CB 3.32Å; F177-Q181 WeakPolarHBondContact O-CB 3.34Å; F177-Q181 WeakPolarHBondContact O-CG 3.44Å; F177-Q181 PolarHBondContact O-N 3.43Å; F177-P274 HydrophobicContact CB-CB 4.25Å; F177-P274 HydrophobicContact CD1-CB 3.85Å; F177-P274 HydrophobicContact CD2-CB 4.11Å; F177-P274 HydrophobicContact CE1-CB 4.19Å; F177-P274 HydrophobicContact CE2-CB 4.38Å; F177-P274 HydrophobicContact CG-CB 3.82Å; F177-P274 HydrophobicContact CZ-CB 4.45Å; F177-F278 AromaticContact CD2-CD2 3.77Å; F177-F278 HydrophobicContact CD2-CD2 3.77Å; F177-F278 AromaticContact CD2-CE2 3.89Å; F177-F278 HydrophobicContact CD2-CE2 3.89Å; F177-F278 AromaticContact CE2-CD2 3.89Å; F177-F278 HydrophobicContact CE2-CD2 3.89Å; F177-F278 AromaticContact CE2-CE2 3.51Å; F177-F278 HydrophobicContact CE2-CE2 3.51Å; F177-F278 HydrophobicContact CE2-CZ 4.45Å; F177-F278 HydrophobicContact CZ-CE2 4.46Å |
| 178 | K | 82.1 | Confident | 69.6 | Low | 112 Ų | 112 | 63.3 Ų | 63.3 | 49% | 0.487 | 40% | 0.401 | S | S | . | . | H | α-helix | trans | -65.5 | -40.1 | 174.1 | -171.5 | -172.4 | -179.8 | -172.1 | 0 | 111.5 | G174 A175 Y176 G182 Y275 W279 | G174-K178 PolarHBondContact O-N 3.17Å; A175-K178 PolarHBondContact O-N 2.92Å; Y176-K178 VanDerWaalsContact C-N 3.26Å; Y176-K178 PolarHBondContact O-N 2.88Å; K178-G182 VanDerWaalsContact O-CA 3.23Å; K178-G182 WeakPolarHBondContact O-CA 3.45Å; K178-G182 PolarHBondContact O-N 3.41Å; K178-Y275 HydrophobicContact CB-CG 4.38Å; K178-W279 HydrophobicContact CD-CH2 3.67Å; K178-W279 HydrophobicContact CD-CZ2 3.93Å |
| 179 | L | 79 | Confident | 66.9 | Low | 107 Ų | 107 | 64.9 Ų | 64.9 | 56% | 0.56 | 41% | 0.41 | S | S | * | . | H | α-helix | trans | -73.9 | -38.8 | 179.9 | -68.8 | 169.2 | 0 | 0 | 0 | 112.1 | A175 Y176 | A175-L179 VanDerWaalsContact O-CG 3.31Å; A175-L179 WeakPolarHBondContact O-CG 3.28Å; A175-L179 PolarHBondContact O-N 2.69Å; Y176-L179 PolarHBondContact O-N 3.41Å |
| 180 | T | 70 | Confident | 64.8 | Low | 39 Ų | 39 | 70.9 Ų | 70.9 | 24% | 0.239 | 45% | 0.446 | C | S | . | . | H | α-helix | trans | -73.7 | -33 | 177.3 | 27.1 | 0 | 0 | 0 | 0 | 113.3 | Y176 F177 | Y176-T180 HydrophobicContact CD2-CG2 4.5Å; Y176-T180 HydrophobicContact CE2-CG2 3.84Å; Y176-T180 PolarHBondContact O-N 2.87Å; Y176-T180 PolarHBondContact O-OG1 2.89Å; F177-T180 WeakPolarHBondContact CA-OG1 3.43Å |
| 181 | Q | 65.5 | Low | 62.2 | Low | 95 Ų | 95 | 75 Ų | 75 | 44% | 0.444 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -89.5 | -14.6 | 174.2 | -63.8 | -167.3 | 6.4 | 0 | 0 | 114 | F177 | F177-Q181 VanDerWaalsContact O-CB 3.32Å; F177-Q181 WeakPolarHBondContact O-CB 3.34Å; F177-Q181 WeakPolarHBondContact O-CG 3.44Å; F177-Q181 PolarHBondContact O-N 3.43Å |
| 182 | G | 49.5 | Very low | 60 | Low | 54 Ų | 54 | 80 Ų | 80 | 56% | 0.557 | 50% | 0.502 | S | S | * | . | trans | -98.6 | 14.7 | -174 | 0 | 0 | 0 | 0 | 0 | 115.6 | K178 | K178-G182 VanDerWaalsContact O-CA 3.23Å; K178-G182 WeakPolarHBondContact O-CA 3.45Å; K178-G182 PolarHBondContact O-N 3.41Å | ||
| 183 | G | 40.5 | Very low | 57.8 | Low | 51 Ų | 51 | 84 Ų | 84 | 53% | 0.526 | 53% | 0.528 | S | S | . | . | S | Bend | trans | -54.8 | 142.9 | 172.2 | 0 | 0 | 0 | 0 | 0 | 111.3 | G185 | G183-G185 PolarHBondContact O-N 2.89Š|
| 184 | P | 44 | Very low | 55.3 | Low | 124 Ų | 124 | 87.9 Ų | 87.9 | 81% | 0.805 | 56% | 0.562 | S | S | * | * | trans | -68.1 | 91.5 | -169.2 | 27.1 | -33 | 0 | 0 | 0 | 111.3 | N186 | P184-N186 PolarHBondContact O-N 2.9Š| ||
| 185 | G | 38.7 | Very low | 52.9 | Low | 71 Ų | 71 | 93.5 Ų | 93.5 | 73% | 0.732 | 60% | 0.598 | S | S | * | * | trans | -70.3 | 82.6 | 157.3 | 0 | 0 | 0 | 0 | 0 | 108.6 | G183 S187 | G183-G185 PolarHBondContact O-N 2.89Å; G185-S187 PolarHBondContact O-N 3.27Å | ||
| 186 | N | 45.1 | Very low | 50.7 | Low | 153 Ų | 153 | 99 Ų | 99 | 82% | 0.818 | 63% | 0.628 | S | S | * | * | trans | -63 | 85.9 | 157.2 | -83.6 | -6 | 0 | 0 | 0 | 107.5 | P184 | P184-N186 PolarHBondContact O-N 2.9Š| ||
| 187 | S | 39.9 | Very low | 48.8 | Very low | 104 Ų | 104 | 103.8 Ų | 103.8 | 73% | 0.727 | 66% | 0.663 | S | S | * | * | trans | -174.7 | 101.8 | 156.6 | -76.6 | 0 | 0 | 0 | 0 | 107.8 | G185 H189 | G185-S187 PolarHBondContact O-N 3.27Å; S187-H189 VanDerWaalsContact C-N 3.34Å; S187-H189 PolarHBondContact O-N 3.47Å | ||
| 188 | S | 43.3 | Very low | 46.8 | Very low | 116 Ų | 116 | 107.5 Ų | 107.5 | 81% | 0.811 | 70% | 0.698 | S | S | * | * | trans | -45.5 | 97.7 | 151.8 | 43.8 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 189 | H | 36.1 | Very low | 44.8 | Very low | 179 Ų | 179 | 109.9 Ų | 109.9 | 83% | 0.829 | 71% | 0.711 | S | S | * | * | trans | -172.4 | 124.1 | 144.6 | -109.6 | -86.5 | 0 | 0 | 0 | 109.2 | S187 A191 | S187-H189 VanDerWaalsContact C-N 3.34Å; S187-H189 PolarHBondContact O-N 3.47Å; H189-A191 PolarHBondContact O-N 3.29Å | ||
| 190 | V | 46.7 | Very low | 43 | Very low | 127 Ų | 127 | 108.5 Ų | 108.5 | 77% | 0.77 | 71% | 0.708 | S | S | * | * | trans | -53 | 117.9 | 167.9 | 171.9 | 0 | 0 | 0 | 0 | 108.9 | I192 | V190-I192 HydrophobicContact CG1-CD1 4.41Å; V190-I192 HydrophobicContact CG1-CG1 4.09Å | ||
| 191 | A | 32.9 | Very low | 41.6 | Very low | 90 Ų | 90 | 110 Ų | 110 | 74% | 0.744 | 72% | 0.718 | S | S | * | * | trans | -118.4 | 92.2 | 164.4 | 0 | 0 | 0 | 0 | 0 | 108.4 | H189 | H189-A191 PolarHBondContact O-N 3.29Š| ||
| 192 | I | 45.7 | Very low | 40.4 | Very low | 146 Ų | 146 | 112.7 Ų | 112.7 | 75% | 0.749 | 74% | 0.735 | S | S | * | * | trans | -56.1 | 137.9 | 153.8 | -66 | 166 | 0 | 0 | 0 | 106.2 | V190 | V190-I192 HydrophobicContact CG1-CD1 4.41Å; V190-I192 HydrophobicContact CG1-CG1 4.09Å | ||
| 193 | S | 41.3 | Very low | 40.1 | Very low | 116 Ų | 116 | 113.7 Ų | 113.7 | 81% | 0.811 | 74% | 0.738 | S | S | * | * | trans | 70.4 | 93.6 | -179.6 | 65.8 | 0 | 0 | 0 | 0 | 116.6 | ||||
| 194 | A | 30.4 | Very low | 40.6 | Very low | 89 Ų | 89 | 112.8 Ų | 112.8 | 74% | 0.736 | 72% | 0.723 | S | S | * | * | trans | -133.6 | 128.5 | 148.6 | 0 | 0 | 0 | 0 | 0 | 108.1 | ||||
| 195 | P | 33.3 | Very low | 41 | Very low | 117 Ų | 117 | 111.4 Ų | 111.4 | 76% | 0.76 | 71% | 0.713 | S | S | * | * | trans | -66.3 | 154.3 | 178.8 | 29.4 | -32.4 | 0 | 0 | 0 | 109.9 | S197 | P195-S197 VanDerWaalsContact C-N 3.26Å; P195-S197 PolarHBondContact O-N 3.46Å | ||
| 196 | V | 39.9 | Very low | 41.9 | Very low | 152 Ų | 152 | 110.5 Ų | 110.5 | 92% | 0.921 | 70% | 0.703 | S | S | * | * | S | Bend | trans | -54.4 | 85.5 | 172.1 | 179.3 | 0 | 0 | 0 | 0 | 109.7 | ||
| 197 | S | 42.6 | Very low | 43.1 | Very low | 115 Ų | 115 | 105.7 Ų | 105.7 | 80% | 0.804 | 68% | 0.677 | S | S | * | * | trans | -176.9 | 89.5 | 165.2 | -123.7 | 0 | 0 | 0 | 0 | 109.6 | P195 | P195-S197 VanDerWaalsContact C-N 3.26Å; P195-S197 PolarHBondContact O-N 3.46Å | ||
| 198 | A | 35.2 | Very low | 44.6 | Very low | 100 Ų | 100 | 101.3 Ų | 101.3 | 83% | 0.826 | 65% | 0.647 | S | S | * | * | trans | -154.3 | 106.3 | 162 | 0 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 199 | Q | 42.1 | Very low | 46.1 | Very low | 162 Ų | 162 | 104.4 Ų | 104.4 | 76% | 0.757 | 64% | 0.641 | S | S | * | * | trans | -58.2 | 147.7 | 169.9 | -63.4 | 170.8 | -73.7 | 0 | 0 | 111.7 | V201 | Q199-V201 HydrophobicContact CB-CG2 3.62Å; Q199-V201 HydrophobicContact CG-CG2 4.26Å | ||
| 200 | P | 39.6 | Very low | 48.3 | Very low | 78 Ų | 78 | 98.1 Ų | 98.1 | 51% | 0.506 | 61% | 0.614 | S | S | . | * | trans | -109 | 109.7 | 147.2 | 26.9 | -12.3 | 0 | 0 | 0 | 109.1 | S204 | P200-S204 WeakPolarHBondContact O-CB 3.49Å; P200-S204 PolarHBondContact O-OG 3.44Å | ||
| 201 | V | 41.3 | Very low | 49.9 | Very low | 72 Ų | 72 | 92.1 Ų | 92.1 | 44% | 0.436 | 58% | 0.577 | S | S | . | * | trans | -82.6 | -21.1 | -161.4 | 175.8 | 0 | 0 | 0 | 0 | 115.9 | Q199 | Q199-V201 HydrophobicContact CB-CG2 3.62Å; Q199-V201 HydrophobicContact CG-CG2 4.26Å | ||
| 202 | D | 40.7 | Very low | 52.2 | Low | 151 Ų | 151 | 88.8 Ų | 88.8 | 81% | 0.807 | 55% | 0.548 | S | S | * | . | S | Bend | trans | -123.9 | -21.8 | -171.7 | -63.5 | -48.3 | 0 | 0 | 0 | 116.8 | ||
| 203 | A | 42.6 | Very low | 54.1 | Low | 75 Ų | 75 | 83.6 Ų | 83.6 | 62% | 0.62 | 53% | 0.53 | S | S | * | . | S | Bend | trans | -90.3 | -13.4 | 175.5 | 0 | 0 | 0 | 0 | 0 | 113.8 | ||
| 204 | S | 50.7 | Low | 56.3 | Low | 31 Ų | 31 | 78.5 Ų | 78.5 | 22% | 0.217 | 49% | 0.494 | C | S | . | . | S | Bend | trans | -76.4 | -34.9 | -172.3 | 50.1 | 0 | 0 | 0 | 0 | 113.7 | P200 G206 L207 A208 | P200-S204 WeakPolarHBondContact O-CB 3.49Å; P200-S204 PolarHBondContact O-OG 3.44Å; S204-G206 VanDerWaalsContact C-N 3.34Å; S204-G206 PolarHBondContact O-N 3.03Å; S204-L207 PolarHBondContact O-N 3.48Å; S204-A208 PolarHBondContact O-N 3.32Å |
| 205 | V | 52.9 | Low | 59 | Low | 96 Ų | 96 | 74.3 Ų | 74.3 | 58% | 0.582 | 46% | 0.46 | S | S | * | . | H | α-helix | trans | -67 | -36.8 | -177.4 | -174.6 | 0 | 0 | 0 | 0 | 111.7 | L207 | V205-L207 VanDerWaalsContact C-N 3.28Å; V205-L207 PolarHBondContact O-N 2.65Å |
| 206 | G | 58.5 | Low | 61.6 | Low | 52 Ų | 52 | 70 Ų | 70 | 54% | 0.536 | 43% | 0.432 | S | S | . | . | H | α-helix | trans | -74.8 | -10.7 | -180 | 0 | 0 | 0 | 0 | 0 | 114.9 | S204 W209 | S204-G206 VanDerWaalsContact C-N 3.34Å; S204-G206 PolarHBondContact O-N 3.03Å; G206-W209 PolarHBondContact O-NE1 2.91Å |
| 207 | L | 69 | Low | 64 | Low | 52 Ų | 52 | 67 Ų | 67 | 27% | 0.272 | 41% | 0.41 | S | S | . | . | H | α-helix | trans | -115 | -15.1 | 179.1 | -80.2 | 146.4 | 0 | 0 | 0 | 112.4 | Y176 S204 V205 W209 L210 A211 | Y176-L207 HydrophobicContact CD2-CB 3.93Å; Y176-L207 WeakPolarHBondContact CD2-O 3.2Å; Y176-L207 VanDerWaalsContact CE2-C 3.5Å; Y176-L207 HydrophobicContact CE2-CB 3.66Å; Y176-L207 WeakPolarHBondContact CE2-O 3.34Å; S204-L207 PolarHBondContact O-N 3.48Å; V205-L207 VanDerWaalsContact C-N 3.28Å; V205-L207 PolarHBondContact O-N 2.65Å; L207-W209 VanDerWaalsContact C-N 3.25Å; L207-W209 PolarHBondContact O-N 3.35Å; L207-L210 HydrophobicContact CD2-CD2 4.16Å; L207-L210 VanDerWaalsContact O-CB 3.23Å; L207-L210 WeakPolarHBondContact O-CB 3.42Å; L207-L210 PolarHBondContact O-N 3.48Å; L207-A211 PolarHBondContact O-N 2.92Å |
| 208 | A | 71.1 | Confident | 66.3 | Low | 12 Ų | 12 | 61.7 Ų | 61.7 | 10% | 0.099 | 37% | 0.373 | C | S | . | . | H | α-helix | trans | -58.4 | -34.4 | 177.9 | 0 | 0 | 0 | 0 | 0 | 113.1 | A123 S204 L210 A211 V212 | A123-A208 HydrophobicContact CB-CB 3.92Å; S204-A208 PolarHBondContact O-N 3.32Å; A208-L210 PolarHBondContact O-N 3.46Å; A208-A211 WeakPolarHBondContact O-CB 3.29Å; A208-A211 PolarHBondContact O-N 3.04Å; A208-V212 WeakPolarHBondContact O-CG2 3.42Å; A208-V212 PolarHBondContact O-N 3.49Å |
| 209 | W | 75.9 | Confident | 68.9 | Low | 180 Ų | 180 | 57.2 Ų | 57.2 | 68% | 0.682 | 34% | 0.335 | S | S | * | . | H | α-helix | trans | -62.6 | -30.4 | 174.4 | 72.1 | -91.8 | 0 | 0 | 0 | 112.5 | G206 L207 G213 | G206-W209 PolarHBondContact O-NE1 2.91Å; L207-W209 VanDerWaalsContact C-N 3.25Å; L207-W209 PolarHBondContact O-N 3.35Å; W209-G213 WeakPolarHBondContact O-CA 3.33Å; W209-G213 PolarHBondContact O-N 2.91Å |
| 210 | L | 81.9 | Confident | 71.3 | Confident | 48 Ų | 48 | 49.8 Ų | 49.8 | 25% | 0.251 | 30% | 0.301 | S | S | . | . | H | α-helix | trans | -71.1 | -40.5 | 176.7 | -177.5 | 66.6 | 0 | 0 | 0 | 110.4 | L207 A208 S214 | L207-L210 HydrophobicContact CD2-CD2 4.16Å; L207-L210 VanDerWaalsContact O-CB 3.23Å; L207-L210 WeakPolarHBondContact O-CB 3.42Å; L207-L210 PolarHBondContact O-N 3.48Å; A208-L210 PolarHBondContact O-N 3.46Å; L210-S214 VanDerWaalsContact O-CB 3.25Å; L210-S214 WeakPolarHBondContact O-CB 3.3Å; L210-S214 PolarHBondContact O-N 2.72Å; L210-S214 PolarHBondContact O-OG 3.04Å |
| 211 | A | 79.9 | Confident | 73.8 | Confident | 1 Ų | 1 | 46.3 Ų | 46.3 | 1% | 0.008 | 28% | 0.28 | C | S | . | . | H | α-helix | trans | -62.3 | -52.6 | 175.1 | 0 | 0 | 0 | 0 | 0 | 111.5 | I119 F173 Y176 L207 A208 S214 M215 | I119-A211 HydrophobicContact CG2-CB 4.06Å; F173-A211 HydrophobicContact CD2-CB 4.42Å; F173-A211 HydrophobicContact CE2-CB 3.88Å; Y176-A211 HydrophobicContact CD1-CB 3.71Å; Y176-A211 HydrophobicContact CD2-CB 4.05Å; Y176-A211 HydrophobicContact CE1-CB 3.57Å; Y176-A211 HydrophobicContact CE2-CB 3.93Å; Y176-A211 HydrophobicContact CG-CB 3.94Å; L207-A211 PolarHBondContact O-N 2.92Å; A208-A211 WeakPolarHBondContact O-CB 3.29Å; A208-A211 PolarHBondContact O-N 3.04Å; A211-S214 PolarHBondContact O-OG 3.18Å; A211-S214 VanDerWaalsContact O-OG 3.08Å; A211-M215 WeakPolarHBondContact O-CB 3.48Å; A211-M215 PolarHBondContact O-N 2.98Å |
| 212 | V | 81.6 | Confident | 76.1 | Confident | 20 Ų | 20 | 43.8 Ų | 43.8 | 12% | 0.121 | 26% | 0.263 | C | S | . | . | H | α-helix | trans | -64 | -44.1 | 178.5 | 175.6 | 0 | 0 | 0 | 0 | 111.3 | F120 A123 A208 M215 C216 | F120-V212 HydrophobicContact CD1-CG2 4.42Å; F120-V212 HydrophobicContact CE1-CG1 3.74Å; F120-V212 HydrophobicContact CE1-CG2 4.37Å; F120-V212 HydrophobicContact CE2-CG1 4.23Å; F120-V212 HydrophobicContact CZ-CG1 3.56Å; A123-V212 HydrophobicContact CB-CG2 4.19Å; A208-V212 WeakPolarHBondContact O-CG2 3.42Å; A208-V212 PolarHBondContact O-N 3.49Å; V212-M215 PolarHBondContact O-N 2.87Å; V212-C216 WeakPolarHBondContact O-CB 3.33Å; V212-C216 PolarHBondContact O-N 3.02Å; V212-C216 PolarHBondContact O-SG 3.44Å |
| 213 | G | 85.1 | Confident | 78.5 | Confident | 37 Ų | 37 | 36.7 Ų | 36.7 | 38% | 0.381 | 23% | 0.225 | S | C | . | . | H | α-helix | trans | -63.9 | -45 | 179.9 | 0 | 0 | 0 | 0 | 0 | 112.8 | W209 M215 C216 L217 | W209-G213 WeakPolarHBondContact O-CA 3.33Å; W209-G213 PolarHBondContact O-N 2.91Å; G213-M215 VanDerWaalsContact C-N 3.34Å; G213-C216 PolarHBondContact O-N 3.17Å; G213-L217 VanDerWaalsContact O-CB 3.29Å; G213-L217 WeakPolarHBondContact O-CB 3.25Å; G213-L217 PolarHBondContact O-N 3.33Å |
| 214 | S | 87.3 | Confident | 80.8 | Confident | 8 Ų | 8 | 34.7 Ų | 34.7 | 6% | 0.056 | 21% | 0.205 | C | C | . | . | H | α-helix | trans | -68.6 | -32 | 175.7 | 57.1 | 0 | 0 | 0 | 0 | 112.4 | S169 F173 L210 A211 F218 | S169-S214 PolarHBondContact OG-O 3.43Å; F173-S214 WeakPolarHBondContact CD2-OG 3.31Å; L210-S214 VanDerWaalsContact O-CB 3.25Å; L210-S214 WeakPolarHBondContact O-CB 3.3Å; L210-S214 PolarHBondContact O-N 2.72Å; L210-S214 PolarHBondContact O-OG 3.04Å; A211-S214 PolarHBondContact O-OG 3.18Å; A211-S214 VanDerWaalsContact O-OG 3.08Å; S214-F218 WeakPolarHBondContact O-CB 3.34Å; S214-F218 PolarHBondContact O-N 3.01Å |
| 215 | M | 86.8 | Confident | 82.6 | Confident | 2 Ų | 2 | 33.2 Ų | 33.2 | 1% | 0.01 | 19% | 0.194 | C | C | . | . | H | α-helix | trans | -67.7 | -46.7 | 172 | -169.2 | 178.6 | 74.8 | 0 | 0 | 112.1 | V112 A116 I119 F120 V135 A211 V212 G213 L217 F218 I219 | V112-M215 HydrophobicContact CG1-CG 3.64Å; V112-M215 HydrophobicContact CG1-SD 4.2Å; A116-M215 VanDerWaalsContact CA-SD 3.5Å; A116-M215 HydrophobicContact CB-CE 3.65Å; A116-M215 HydrophobicContact CB-SD 3.59Å; A116-M215 VanDerWaalsContact CB-SD 3.59Å; I119-M215 HydrophobicContact CD1-SD 3.71Å; F120-M215 HydrophobicContact CD2-CE 3.55Å; F120-M215 HydrophobicContact CE2-CE 3.19Å; F120-M215 HydrophobicContact CZ-CE 4.35Å; V135-M215 HydrophobicContact CG2-CE 4.19Å; A211-M215 WeakPolarHBondContact O-CB 3.48Å; A211-M215 PolarHBondContact O-N 2.98Å; V212-M215 PolarHBondContact O-N 2.87Å; G213-M215 VanDerWaalsContact C-N 3.34Å; M215-L217 VanDerWaalsContact C-N 3.3Å; M215-L217 PolarHBondContact O-N 3.36Å; M215-F218 WeakPolarHBondContact O-CB 3.36Å; M215-F218 PolarHBondContact O-N 3.02Å; M215-F218 VanDerWaalsContact O-N 3.13Å; M215-I219 HydrophobicContact CE-CD1 4.47Å; M215-I219 HydrophobicContact CG-CD1 3.97Å; M215-I219 WeakPolarHBondContact O-CD1 3.25Å; M215-I219 WeakPolarHBondContact O-CG1 3.05Å; M215-I219 PolarHBondContact O-N 2.64Å |
| 216 | C | 88 | Confident | 84.4 | Confident | 26 Ų | 26 | 28.7 Ų | 28.7 | 18% | 0.176 | 17% | 0.167 | C | C | . | . | H | α-helix | trans | -59.8 | -42.2 | 177.3 | -69.6 | 0 | 0 | 0 | 0 | 111.6 | I138 V212 G213 F218 I219 A220 | I138-C216 HydrophobicContact CD1-CB 3.85Å; V212-C216 WeakPolarHBondContact O-CB 3.33Å; V212-C216 PolarHBondContact O-N 3.02Å; V212-C216 PolarHBondContact O-SG 3.44Å; G213-C216 PolarHBondContact O-N 3.17Å; C216-F218 VanDerWaalsContact C-N 3.33Å; C216-I219 PolarHBondContact O-N 3.48Å; C216-A220 VanDerWaalsContact O-CB 3.32Å; C216-A220 WeakPolarHBondContact O-CB 3.32Å; C216-A220 PolarHBondContact O-N 2.93Å |
| 217 | L | 91.2 | Very high | 85.8 | Confident | 88 Ų | 88 | 27 Ų | 27 | 46% | 0.461 | 15% | 0.149 | S | C | . | . | H | α-helix | trans | -66.3 | -35.3 | 176.7 | -177.9 | 65.4 | 0 | 0 | 0 | 112 | V165 S169 G213 M215 G221 | V165-L217 HydrophobicContact CG1-CD1 3.75Å; V165-L217 HydrophobicContact CG1-CG 3.81Å; S169-L217 WeakPolarHBondContact OG-CB 3.43Å; G213-L217 VanDerWaalsContact O-CB 3.29Å; G213-L217 WeakPolarHBondContact O-CB 3.25Å; G213-L217 PolarHBondContact O-N 3.33Å; M215-L217 VanDerWaalsContact C-N 3.3Å; M215-L217 PolarHBondContact O-N 3.36Å; L217-G221 PolarHBondContact O-N 2.93Å |
| 218 | F | 91.6 | Very high | 86.7 | Confident | 5 Ų | 5 | 26.1 Ų | 26.1 | 2% | 0.022 | 15% | 0.147 | C | C | . | . | H | α-helix | trans | -63.8 | -49.3 | 174.7 | 178.4 | -96.3 | 0 | 0 | 0 | 110.8 | V109 V112 M166 S169 T170 S214 M215 C216 A220 G221 F222 | V109-F218 HydrophobicContact CB-CE1 4.25Å; V109-F218 HydrophobicContact CG2-CE1 4.28Å; V112-F218 HydrophobicContact CB-CD1 4.14Å; V112-F218 HydrophobicContact CB-CE1 4.01Å; V112-F218 HydrophobicContact CG1-CD1 3.82Å; V112-F218 HydrophobicContact CG1-CE1 4.2Å; V112-F218 HydrophobicContact CG2-CD1 4.04Å; V112-F218 HydrophobicContact CG2-CE1 3.83Å; V112-F218 HydrophobicContact CG2-CZ 4.3Å; M166-F218 HydrophobicContact CB-CD2 3.98Å; M166-F218 HydrophobicContact CB-CE2 3.92Å; M166-F218 HydrophobicContact CG-CD2 4Å; M166-F218 HydrophobicContact CG-CE2 3.96Å; M166-F218 HydrophobicContact SD-CE2 4.15Å; M166-F218 HydrophobicContact SD-CZ 4.43Å; S169-F218 PolarHBondContact OG-N 3.43Å; T170-F218 HydrophobicContact CG2-CD2 3.44Å; T170-F218 VanDerWaalsContact CG2-CD2 3.44Å; T170-F218 HydrophobicContact CG2-CE2 3.38Å; T170-F218 HydrophobicContact CG2-CG 4.47Å; T170-F218 HydrophobicContact CG2-CZ 4.39Å; S214-F218 WeakPolarHBondContact O-CB 3.34Å; S214-F218 PolarHBondContact O-N 3.01Å; M215-F218 WeakPolarHBondContact O-CB 3.36Å; M215-F218 PolarHBondContact O-N 3.02Å; M215-F218 VanDerWaalsContact O-N 3.13Å; C216-F218 VanDerWaalsContact C-N 3.33Å; F218-A220 VanDerWaalsContact C-N 3.33Å; F218-A220 PolarHBondContact O-N 2.93Å; F218-G221 PolarHBondContact O-N 3.33Å; F218-F222 WeakPolarHBondContact O-CB 3.46Å; F218-F222 PolarHBondContact O-N 3.44Å |
| 219 | I | 89.5 | Confident | 87.6 | Confident | 6 Ų | 6 | 25.6 Ų | 25.6 | 3% | 0.031 | 14% | 0.142 | C | C | . | . | H | α-helix | trans | -61.7 | -43.4 | 178.9 | -66.5 | 156.4 | 0 | 0 | 0 | 110.5 | V135 I138 Q139 M215 C216 F222 A223 | V135-I219 HydrophobicContact CB-CD1 4.23Å; V135-I219 HydrophobicContact CG1-CD1 3.74Å; V135-I219 HydrophobicContact CG1-CG2 4.38Å; V135-I219 HydrophobicContact CG2-CD1 3.72Å; I138-I219 HydrophobicContact CG2-CG2 4.21Å; Q139-I219 HydrophobicContact CB-CG2 4.28Å; Q139-I219 HydrophobicContact CG-CG2 4.42Å; M215-I219 HydrophobicContact CE-CD1 4.47Å; M215-I219 HydrophobicContact CG-CD1 3.97Å; M215-I219 WeakPolarHBondContact O-CD1 3.25Å; M215-I219 WeakPolarHBondContact O-CG1 3.05Å; M215-I219 PolarHBondContact O-N 2.64Å; C216-I219 PolarHBondContact O-N 3.48Å; I219-F222 PolarHBondContact O-N 3.25Å; I219-A223 WeakPolarHBondContact O-CB 3.34Å; I219-A223 PolarHBondContact O-N 3.49Å |
| 220 | A | 91.3 | Very high | 88.4 | Confident | 6 Ų | 6 | 17.1 Ų | 17.1 | 5% | 0.05 | 11% | 0.11 | C | C | . | . | H | α-helix | trans | -60.2 | -49.3 | 175.5 | 0 | 0 | 0 | 0 | 0 | 111.6 | I138 F142 C216 F218 F222 A223 V224 | I138-A220 HydrophobicContact CG2-CB 4.09Å; F142-A220 HydrophobicContact CD1-CB 3.99Å; F142-A220 HydrophobicContact CD2-CB 3.54Å; F142-A220 HydrophobicContact CE1-CB 3.98Å; F142-A220 HydrophobicContact CE2-CB 3.54Å; F142-A220 HydrophobicContact CG-CB 3.77Å; F142-A220 HydrophobicContact CZ-CB 3.76Å; C216-A220 VanDerWaalsContact O-CB 3.32Å; C216-A220 WeakPolarHBondContact O-CB 3.32Å; C216-A220 PolarHBondContact O-N 2.93Å; F218-A220 VanDerWaalsContact C-N 3.33Å; F218-A220 PolarHBondContact O-N 2.93Å; A220-F222 PolarHBondContact O-N 3.35Å; A220-A223 PolarHBondContact O-N 3.28Å; A220-V224 WeakPolarHBondContact O-CG2 3.32Å; A220-V224 PolarHBondContact O-N 3.28Å; A220-V224 VanDerWaalsContact O-N 3.09Å |
| 221 | G | 91.8 | Very high | 88.7 | Confident | 5 Ų | 5 | 19.7 Ų | 19.7 | 5% | 0.052 | 12% | 0.117 | C | C | . | . | H | α-helix | trans | -57.3 | -49.8 | 176.5 | 0 | 0 | 0 | 0 | 0 | 111.9 | S162 L217 F218 A223 V224 G225 | S162-G221 WeakPolarHBondContact CB-O 3.39Å; L217-G221 PolarHBondContact O-N 2.93Å; F218-G221 PolarHBondContact O-N 3.33Å; G221-A223 PolarHBondContact O-N 2.89Å; G221-V224 PolarHBondContact O-N 3.04Å; G221-G225 PolarHBondContact O-N 3.05Å |
| 222 | F | 91.4 | Very high | 89.2 | Confident | 19 Ų | 19 | 22 Ų | 22 | 8% | 0.083 | 13% | 0.129 | C | C | . | . | H | α-helix | trans | -58.4 | -47.5 | 176.9 | -175.9 | -91.5 | 0 | 0 | 0 | 111.7 | Q104 V109 M166 F218 I219 A220 V224 G225 W226 G227 | Q104-F222 HydrophobicContact CG-CE2 3.82Å; Q104-F222 HydrophobicContact CG-CZ 3.85Å; V109-F222 HydrophobicContact CB-CD2 4.15Å; V109-F222 HydrophobicContact CB-CE2 3.89Å; V109-F222 HydrophobicContact CB-CZ 4.16Å; V109-F222 HydrophobicContact CG1-CE2 3.92Å; V109-F222 HydrophobicContact CG1-CZ 3.93Å; V109-F222 HydrophobicContact CG2-CD1 3.97Å; V109-F222 HydrophobicContact CG2-CD2 4.03Å; V109-F222 HydrophobicContact CG2-CE1 3.89Å; V109-F222 HydrophobicContact CG2-CE2 3.95Å; V109-F222 HydrophobicContact CG2-CG 4.04Å; V109-F222 HydrophobicContact CG2-CZ 3.88Å; M166-F222 HydrophobicContact SD-CB 3.86Å; M166-F222 HydrophobicContact SD-CD2 3.82Å; M166-F222 HydrophobicContact SD-CG 4.34Å; F218-F222 WeakPolarHBondContact O-CB 3.46Å; F218-F222 PolarHBondContact O-N 3.44Å; I219-F222 PolarHBondContact O-N 3.25Å; A220-F222 PolarHBondContact O-N 3.35Å; F222-V224 PolarHBondContact O-N 2.64Å; F222-G225 PolarHBondContact O-N 3.2Å; F222-W226 HydrophobicContact CD2-CB 3.78Å; F222-W226 HydrophobicContact CE2-CB 3.97Å; F222-W226 PolarHBondContact O-N 3.5Å; F222-G227 PolarHBondContact O-N 3.49Å |
| 223 | A | 89.4 | Confident | 89.4 | Confident | 1 Ų | 1 | 21.1 Ų | 21.1 | 1% | 0.008 | 12% | 0.124 | C | C | . | . | H | α-helix | trans | -62.5 | -27.2 | -179 | 0 | 0 | 0 | 0 | 0 | 113.8 | Q139 F142 T143 I219 A220 G221 P228 | Q139-A223 HydrophobicContact CG-CB 4.08Å; F142-A223 HydrophobicContact CB-CB 3.88Å; T143-A223 PolarHBondContact OG1-O 2.84Å; I219-A223 WeakPolarHBondContact O-CB 3.34Å; I219-A223 PolarHBondContact O-N 3.49Å; A220-A223 PolarHBondContact O-N 3.28Å; G221-A223 PolarHBondContact O-N 2.89Å; A223-P228 WeakPolarHBondContact O-CD 3.27Å |
| 224 | V | 91.3 | Very high | 89.5 | Confident | 33 Ų | 33 | 19.7 Ų | 19.7 | 20% | 0.2 | 11% | 0.107 | C | C | . | . | H | α-helix | trans | -76.9 | -34.2 | 178.6 | 172.3 | 0 | 0 | 0 | 0 | 113.1 | F142 A146 A220 G221 F222 | F142-V224 HydrophobicContact CB-CG2 4Å; F142-V224 HydrophobicContact CD1-CG2 3.7Å; F142-V224 HydrophobicContact CG-CG2 4.3Å; A146-V224 WeakPolarHBondContact CB-O 3.33Å; A220-V224 WeakPolarHBondContact O-CG2 3.32Å; A220-V224 PolarHBondContact O-N 3.28Å; A220-V224 VanDerWaalsContact O-N 3.09Å; G221-V224 PolarHBondContact O-N 3.04Å; F222-V224 PolarHBondContact O-N 2.64Å |
| 225 | G | 89.3 | Confident | 89.3 | Confident | 0 Ų | 0 | 21.8 Ų | 21.8 | 0% | 0 | 12% | 0.122 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -134.8 | -70.5 | -172.5 | 0 | 0 | 0 | 0 | 0 | 114.3 | S162 G221 F222 G227 P228 I229 | S162-G225 WeakPolarHBondContact OG-CA 3.47Å; G221-G225 PolarHBondContact O-N 3.05Å; F222-G225 PolarHBondContact O-N 3.2Å; G225-G227 PolarHBondContact O-N 2.91Å; G225-G227 VanDerWaalsContact O-N 3.11Å; G225-P228 WeakPolarHBondContact O-CD 3.48Å; G225-I229 VanDerWaalsContact O-CB 3.24Å; G225-I229 WeakPolarHBondContact O-CB 3.38Å; G225-I229 VanDerWaalsContact O-CG1 3.3Å; G225-I229 WeakPolarHBondContact O-CG1 3.26Å; G225-I229 PolarHBondContact O-N 3.46Å |
| 226 | W | 90.3 | Very high | 89.2 | Confident | 1 Ų | 1 | 23.8 Ų | 23.8 | 0% | 0.004 | 13% | 0.131 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -62.7 | -19 | -173.9 | -75.6 | 92.4 | 0 | 0 | 0 | 114.7 | L100 F103 Q104 L159 S162 M166 F222 P230 S288 T292 | L100-W226 HydrophobicContact CD2-CH2 3.92Å; L100-W226 HydrophobicContact CD2-CZ3 3.78Å; F103-W226 HydrophobicContact CB-CH2 4.25Å; F103-W226 HydrophobicContact CB-CZ3 3.93Å; Q104-W226 VanDerWaalsContact CD-O 3.28Å; Q104-W226 WeakPolarHBondContact CG-O 3.39Å; Q104-W226 PolarHBondContact NE2-O 3.38Å; L159-W226 HydrophobicContact CD2-CD2 3.83Å; L159-W226 HydrophobicContact CD2-CE3 4.13Å; L159-W226 HydrophobicContact CD2-CG 4.12Å; L159-W226 HydrophobicContact CD2-CZ2 4.36Å; L159-W226 PolarHBondContact O-NE1 3.4Å; S162-W226 VanDerWaalsContact OG-CD1 3.23Å; M166-W226 HydrophobicContact CE-CB 4.14Å; M166-W226 HydrophobicContact CE-CD2 4.19Å; M166-W226 HydrophobicContact CE-CG 3.59Å; M166-W226 HydrophobicContact SD-CB 4.15Å; M166-W226 HydrophobicContact SD-CG 4.17Å; F222-W226 HydrophobicContact CD2-CB 3.78Å; F222-W226 HydrophobicContact CE2-CB 3.97Å; F222-W226 PolarHBondContact O-N 3.5Å; W226-P230 HydrophobicContact CE3-CG 4.23Å; W226-P230 VanDerWaalsContact O-CD 3.29Å; W226-P230 WeakPolarHBondContact O-CD 3.42Å; W226-P230 WeakPolarHBondContact O-CG 3.38Å; W226-S288 VanDerWaalsContact CH2-CB 3.5Å; W226-S288 WeakPolarHBondContact CZ2-OG 3.35Å; W226-T292 WeakPolarHBondContact CH2-OG1 3.38Å; W226-T292 WeakPolarHBondContact CZ2-OG1 3.36Å |
| 227 | G | 88.3 | Confident | 89.1 | Confident | 16 Ų | 16 | 22.6 Ų | 22.6 | 17% | 0.165 | 12% | 0.123 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -69.2 | -70.4 | 170.8 | 0 | 0 | 0 | 0 | 0 | 112.2 | Q104 F222 G225 W231 | Q104-G227 PolarHBondContact NE2-O 3.18Å; F222-G227 PolarHBondContact O-N 3.49Å; G225-G227 PolarHBondContact O-N 2.91Å; G225-G227 VanDerWaalsContact O-N 3.11Å; G227-W231 VanDerWaalsContact O-CD1 3.31Å |
| 228 | P | 88.4 | Confident | 88.7 | Confident | 35 Ų | 35 | 18.5 Ų | 18.5 | 23% | 0.227 | 10% | 0.101 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -84.1 | -31.2 | -171.8 | 29.7 | -34.8 | 0 | 0 | 0 | 115 | M150 A223 G225 W231 L232 | M150-P228 HydrophobicContact CE-CB 4.17Å; M150-P228 HydrophobicContact CE-CG 3.99Å; A223-P228 WeakPolarHBondContact O-CD 3.27Å; G225-P228 WeakPolarHBondContact O-CD 3.48Å; P228-W231 PolarHBondContact O-N 2.85Å; P228-L232 PolarHBondContact O-N 3.34Å |
| 229 | I | 90.2 | Very high | 87.9 | Confident | 0 Ų | 0 | 18.5 Ų | 18.5 | 0% | 0 | 10% | 0.102 | C | C | . | . | H | α-helix | trans | -70.7 | -41.1 | -167.6 | -60 | 176.2 | 0 | 0 | 0 | 113.2 | M150 R155 L158 L159 G225 W231 L232 L233 | M150-I229 HydrophobicContact CE-CD1 4.4Å; M150-I229 HydrophobicContact CE-CG1 3.66Å; M150-I229 HydrophobicContact SD-CG1 4.4Å; R155-I229 HydrophobicContact CB-CG2 3.89Å; R155-I229 HydrophobicContact CG-CG2 4.18Å; L158-I229 HydrophobicContact CB-CD1 3.33Å; L158-I229 HydrophobicContact CD2-CD1 4.08Å; L158-I229 HydrophobicContact CG-CD1 4.34Å; L159-I229 HydrophobicContact CD1-CB 4.36Å; L159-I229 HydrophobicContact CD1-CG2 3.62Å; L159-I229 HydrophobicContact CD2-CB 3.91Å; L159-I229 HydrophobicContact CD2-CD1 4.46Å; L159-I229 HydrophobicContact CD2-CG2 4.1Å; L159-I229 HydrophobicContact CG-CB 3.95Å; L159-I229 HydrophobicContact CG-CD1 4.05Å; L159-I229 HydrophobicContact CG-CG2 3.65Å; G225-I229 VanDerWaalsContact O-CB 3.24Å; G225-I229 WeakPolarHBondContact O-CB 3.38Å; G225-I229 VanDerWaalsContact O-CG1 3.3Å; G225-I229 WeakPolarHBondContact O-CG1 3.26Å; G225-I229 PolarHBondContact O-N 3.46Å; I229-W231 VanDerWaalsContact C-N 3.29Å; I229-W231 PolarHBondContact O-N 3.35Å; I229-L232 PolarHBondContact O-N 2.92Å; I229-L232 VanDerWaalsContact O-N 3.12Å; I229-L233 HydrophobicContact CG2-CD1 3.6Å; I229-L233 HydrophobicContact CG2-CG 3.85Å; I229-L233 WeakPolarHBondContact O-CB 2.98Å; I229-L233 PolarHBondContact O-N 2.87Å |
| 230 | P | 91.2 | Very high | 87.1 | Confident | 2 Ų | 2 | 23.6 Ų | 23.6 | 1% | 0.013 | 13% | 0.128 | C | C | . | . | H | α-helix | trans | -56 | -42.6 | 176.7 | -30.1 | 39.1 | 0 | 0 | 0 | 113.1 | L100 M101 L159 W226 L232 M234 | L100-P230 HydrophobicContact CB-CB 4.25Å; M101-P230 HydrophobicContact CE-CB 4.22Å; M101-P230 HydrophobicContact SD-CB 4.23Å; L159-P230 HydrophobicContact CD2-CG 4.41Å; W226-P230 HydrophobicContact CE3-CG 4.23Å; W226-P230 VanDerWaalsContact O-CD 3.29Å; W226-P230 WeakPolarHBondContact O-CD 3.42Å; W226-P230 WeakPolarHBondContact O-CG 3.38Å; P230-L232 VanDerWaalsContact C-N 3.35Å; P230-L232 PolarHBondContact O-N 2.84Å; P230-M234 WeakPolarHBondContact O-CB 3.43Å; P230-M234 PolarHBondContact O-N 3.44Å; P230-M234 VanDerWaalsContact O-N 3.07Å |
| 231 | W | 89.9 | Confident | 86.2 | Confident | 103 Ų | 103 | 28 Ų | 28 | 39% | 0.39 | 15% | 0.148 | S | C | . | . | H | α-helix | trans | -65.2 | -37.9 | 176.7 | -67.6 | 92.9 | 0 | 0 | 0 | 112.6 | M101 G227 P228 I229 V251 | M101-W231 HydrophobicContact CE-CD2 3.72Å; M101-W231 HydrophobicContact CE-CE3 3.93Å; M101-W231 HydrophobicContact CE-CG 4.04Å; M101-W231 HydrophobicContact CE-CZ2 4.39Å; M101-W231 HydrophobicContact CE-CZ3 4.37Å; M101-W231 HydrophobicContact SD-CZ2 4.38Å; G227-W231 VanDerWaalsContact O-CD1 3.31Å; P228-W231 PolarHBondContact O-N 2.85Å; I229-W231 VanDerWaalsContact C-N 3.29Å; I229-W231 PolarHBondContact O-N 3.35Å; W231-V251 HydrophobicContact CH2-CG2 4.05Å; W231-V251 HydrophobicContact CZ3-CG2 3.7Å |
| 232 | L | 88.8 | Confident | 85.5 | Confident | 50 Ų | 50 | 28 Ų | 28 | 26% | 0.262 | 15% | 0.147 | S | C | . | . | H | α-helix | trans | -72.5 | -49.9 | 178.2 | -178.8 | 135 | 0 | 0 | 0 | 111.8 | M150 R155 P228 I229 P230 M234 S235 E236 | M150-L232 HydrophobicContact SD-CD1 3.77Å; M150-L232 HydrophobicContact SD-CD2 4.17Å; R155-L232 HydrophobicContact CG-CD2 3.8Å; P228-L232 PolarHBondContact O-N 3.34Å; I229-L232 PolarHBondContact O-N 2.92Å; I229-L232 VanDerWaalsContact O-N 3.12Å; P230-L232 VanDerWaalsContact C-N 3.35Å; P230-L232 PolarHBondContact O-N 2.84Å; L232-M234 VanDerWaalsContact C-N 3.27Å; L232-M234 PolarHBondContact O-N 2.87Å; L232-S235 WeakPolarHBondContact O-CA 3.38Å; L232-S235 WeakPolarHBondContact O-CB 3.49Å; L232-S235 PolarHBondContact O-N 3.34Å; L232-S235 PolarHBondContact O-OG 2.88Å; L232-E236 VanDerWaalsContact CD2-CD 3.45Å; L232-E236 HydrophobicContact CD2-CG 4.33Å; L232-E236 VanDerWaalsContact CD2-OE1 3.3Å; L232-E236 WeakPolarHBondContact CD2-OE1 3.3Å; L232-E236 PolarHBondContact O-N 2.92Å; L232-E236 VanDerWaalsContact O-N 3.16Å |
| 233 | L | 87.3 | Confident | 85 | Confident | 1 Ų | 1 | 30.2 Ų | 30.2 | 1% | 0.005 | 16% | 0.156 | C | C | . | . | H | α-helix | trans | -56 | -44.2 | 178.2 | -87.8 | 171.7 | 0 | 0 | 0 | 111.5 | L100 R155 L159 I229 S235 E236 I237 V296 T299 | L100-L233 HydrophobicContact CD1-CB 4.38Å; L100-L233 HydrophobicContact CD1-CD1 3.79Å; R155-L233 HydrophobicContact CB-CD2 4.22Å; R155-L233 HydrophobicContact CB-CG 4.37Å; R155-L233 HydrophobicContact CG-CD2 4.49Å; L159-L233 HydrophobicContact CD1-CD1 3.56Å; I229-L233 HydrophobicContact CG2-CD1 3.6Å; I229-L233 HydrophobicContact CG2-CG 3.85Å; I229-L233 WeakPolarHBondContact O-CB 2.98Å; I229-L233 PolarHBondContact O-N 2.87Å; L233-S235 PolarHBondContact O-N 3.32Å; L233-E236 CarbonylContact O-C 3.53Å; L233-E236 WeakPolarHBondContact O-CA 3.45Å; L233-E236 PolarHBondContact O-N 3.39Å; L233-I237 HydrophobicContact CD2-CG2 4.33Å; L233-I237 VanDerWaalsContact O-CG1 3.28Å; L233-I237 WeakPolarHBondContact O-CG1 3.49Å; L233-I237 WeakPolarHBondContact O-CG2 3.4Å; L233-I237 PolarHBondContact O-N 2.82Å; L233-V296 HydrophobicContact CD1-CG1 3.9Å; L233-T299 HydrophobicContact CD2-CG2 3.49Å; L233-T299 VanDerWaalsContact CD2-CG2 3.49Å; L233-T299 WeakPolarHBondContact CD2-OG1 3.34Å |
| 234 | M | 85.8 | Confident | 84.6 | Confident | 7 Ų | 7 | 33 Ų | 33 | 3% | 0.034 | 19% | 0.185 | C | C | . | . | H | α-helix | trans | -54.4 | -34.9 | 175.5 | -177.5 | -170.9 | 170.9 | 0 | 0 | 112.9 | M101 P230 L232 F238 T247 C250 V251 | M101-M234 HydrophobicContact CE-CB 4.42Å; M101-M234 HydrophobicContact CE-SD 3.37Å; M101-M234 WeakPolarHBondContact CE-SD 3.31Å; P230-M234 WeakPolarHBondContact O-CB 3.43Å; P230-M234 PolarHBondContact O-N 3.44Å; P230-M234 VanDerWaalsContact O-N 3.07Å; L232-M234 VanDerWaalsContact C-N 3.27Å; L232-M234 PolarHBondContact O-N 2.87Å; M234-F238 HydrophobicContact CB-CE2 4.47Å; M234-F238 HydrophobicContact CE-CE2 4.15Å; M234-F238 HydrophobicContact CG-CD2 3.98Å; M234-F238 HydrophobicContact CG-CE2 3.46Å; M234-F238 VanDerWaalsContact CG-CE2 3.46Å; M234-F238 HydrophobicContact CG-CZ 4.37Å; M234-F238 WeakPolarHBondContact O-CD2 3.09Å; M234-T247 VanDerWaalsContact CE-CB 3.49Å; M234-T247 HydrophobicContact CE-CG2 3.41Å; M234-T247 VanDerWaalsContact CE-CG2 3.41Å; M234-T247 WeakPolarHBondContact CE-O 3.32Å; M234-C250 HydrophobicContact CE-CB 3.48Å; M234-C250 VanDerWaalsContact CE-CB 3.48Å; M234-C250 HydrophobicContact SD-CB 3.97Å; M234-V251 HydrophobicContact CE-CG2 4.2Å |
| 235 | S | 83.9 | Confident | 84.3 | Confident | 52 Ų | 52 | 34.4 Ų | 34.4 | 36% | 0.364 | 19% | 0.194 | S | C | . | . | H | α-helix | trans | -79.7 | -22.5 | 175.8 | 82.1 | 0 | 0 | 0 | 0 | 113.9 | L232 L233 K243 | L232-S235 WeakPolarHBondContact O-CA 3.38Å; L232-S235 WeakPolarHBondContact O-CB 3.49Å; L232-S235 PolarHBondContact O-N 3.34Å; L232-S235 PolarHBondContact O-OG 2.88Å; L233-S235 PolarHBondContact O-N 3.32Å; S235-K243 PolarHBondContact O-NZ 3.47Å |
| 236 | E | 85.3 | Confident | 84.1 | Confident | 44 Ų | 44 | 34.7 Ų | 34.7 | 21% | 0.206 | 20% | 0.196 | C | C | . | . | H | α-helix | trans | -92.9 | -26.3 | -177.7 | -69.3 | -178.2 | 165.7 | 0 | 0 | 113.4 | R155 L232 L233 T299 L304 | R155-E236 IonicContact CZ-OE1 3.36Å; R155-E236 IonicContact NE-OE1 3.4Å; R155-E236 PolarHBondContact NE-OE1 3.41Å; R155-E236 IonicContact NE-OE2 2.68Å; R155-E236 PolarHBondContact NE-OE2 2.91Å; R155-E236 IonicContact NH2-OE1 2.86Å; R155-E236 PolarHBondContact NH2-OE1 2.9Å; L232-E236 VanDerWaalsContact CD2-CD 3.45Å; L232-E236 HydrophobicContact CD2-CG 4.33Å; L232-E236 VanDerWaalsContact CD2-OE1 3.3Å; L232-E236 WeakPolarHBondContact CD2-OE1 3.3Å; L232-E236 PolarHBondContact O-N 2.92Å; L232-E236 VanDerWaalsContact O-N 3.16Å; L233-E236 CarbonylContact O-C 3.53Å; L233-E236 WeakPolarHBondContact O-CA 3.45Å; L233-E236 PolarHBondContact O-N 3.39Å; E236-T299 VanDerWaalsContact OE2-CB 3.24Å; E236-T299 WeakPolarHBondContact OE2-CB 3.49Å; E236-T299 PolarHBondContact OE2-OG1 2.99Å; E236-L304 WeakPolarHBondContact O-CD1 3.41Å |
| 237 | I | 84.6 | Confident | 84 | Confident | 1 Ų | 1 | 36.8 Ų | 36.8 | 1% | 0.005 | 21% | 0.209 | C | C | . | . | H | α-helix | trans | -95.4 | -19 | -175.2 | 69.2 | -174.9 | 0 | 0 | 0 | 114.1 | P93 I96 L233 T299 F311 | P93-I237 HydrophobicContact CB-CB 4.17Å; P93-I237 HydrophobicContact CB-CD1 4.25Å; P93-I237 HydrophobicContact CB-CG1 4.04Å; P93-I237 WeakPolarHBondContact O-CD1 2.98Å; I96-I237 HydrophobicContact CB-CD1 4.41Å; I96-I237 HydrophobicContact CG2-CD1 4.2Å; L233-I237 HydrophobicContact CD2-CG2 4.33Å; L233-I237 VanDerWaalsContact O-CG1 3.28Å; L233-I237 WeakPolarHBondContact O-CG1 3.49Å; L233-I237 WeakPolarHBondContact O-CG2 3.4Å; L233-I237 PolarHBondContact O-N 2.82Å; I237-T299 HydrophobicContact CG2-CG2 4Å; I237-F311 HydrophobicContact CB-CE2 4.38Å |
| 238 | F | 83.6 | Confident | 84 | Confident | 2 Ų | 2 | 38 Ų | 38 | 1% | 0.009 | 22% | 0.222 | C | C | . | . | S | Bend | trans | -87.5 | 128.8 | -174.7 | -71.5 | -35.8 | 0 | 0 | 0 | 113.4 | P93 F94 M234 K243 A246 | P93-F238 HydrophobicContact CB-CD1 4Å; P93-F238 HydrophobicContact CB-CE1 4.07Å; F94-F238 HydrophobicContact CB-CE1 4.43Å; M234-F238 HydrophobicContact CB-CE2 4.47Å; M234-F238 HydrophobicContact CE-CE2 4.15Å; M234-F238 HydrophobicContact CG-CD2 3.98Å; M234-F238 HydrophobicContact CG-CE2 3.46Å; M234-F238 VanDerWaalsContact CG-CE2 3.46Å; M234-F238 HydrophobicContact CG-CZ 4.37Å; M234-F238 WeakPolarHBondContact O-CD2 3.09Å; F238-K243 HydrophobicContact CB-CB 4.13Å; F238-K243 HydrophobicContact CB-CG 4.11Å; F238-A246 HydrophobicContact CD1-CB 4.01Å; F238-A246 HydrophobicContact CD2-CB 3.92Å; F238-A246 HydrophobicContact CE1-CB 4.01Å; F238-A246 HydrophobicContact CE2-CB 3.85Å; F238-A246 HydrophobicContact CG-CB 4.02Å; F238-A246 HydrophobicContact CZ-CB 3.94Å |
| 239 | P | 74.8 | Confident | 84.1 | Confident | 5 Ų | 5 | 38.9 Ų | 38.9 | 3% | 0.032 | 22% | 0.224 | C | C | . | . | trans | -58.7 | 142 | 172.8 | -12.1 | 19.7 | 0 | 0 | 0 | 111.2 | I90 H241 V242 K243 | I90-P239 HydrophobicContact CG1-CG 4.31Å; P239-H241 WeakPolarHBondContact CB-CE1 3.43Å; P239-H241 PolarHBondContact O-N 2.98Å; P239-H241 VanDerWaalsContact O-N 3.08Å; P239-V242 HydrophobicContact CB-CG2 3.98Å; P239-V242 HydrophobicContact CG-CG2 3.74Å; P239-V242 PolarHBondContact O-N 3.13Å; P239-V242 VanDerWaalsContact O-N 3.11Å; P239-K243 WeakPolarHBondContact O-CB 3.25Å; P239-K243 PolarHBondContact O-N 3.36Å | ||
| 240 | L | 72.8 | Confident | 84.2 | Confident | 112 Ų | 112 | 38.9 Ų | 38.9 | 59% | 0.586 | 22% | 0.224 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -54 | -35.6 | -175.5 | -65.6 | 175.2 | 0 | 0 | 0 | 113.6 | L304 | L240-L304 HydrophobicContact CD1-CD2 4.34Å; L240-L304 HydrophobicContact CD2-CD2 3.85Å; L240-L304 HydrophobicContact CG-CD2 3.64Å |
| 241 | H | 72.6 | Confident | 84.2 | Confident | 99 Ų | 99 | 40.7 Ų | 40.7 | 46% | 0.458 | 24% | 0.235 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -74.6 | -23.3 | -176 | 61.4 | -88.9 | 0 | 0 | 0 | 114.1 | P239 | P239-H241 WeakPolarHBondContact CB-CE1 3.43Å; P239-H241 PolarHBondContact O-N 2.98Å; P239-H241 VanDerWaalsContact O-N 3.08Å |
| 242 | V | 76.5 | Confident | 84.5 | Confident | 4 Ų | 4 | 41.3 Ų | 41.3 | 2% | 0.024 | 25% | 0.245 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -112.1 | -5.8 | 175.7 | -69.7 | 0 | 0 | 0 | 0 | 113.7 | F80 I90 P239 G244 V245 A246 | F80-V242 HydrophobicContact CE2-CG1 4.48Å; I90-V242 HydrophobicContact CD1-CG1 4.07Å; I90-V242 HydrophobicContact CD1-CG2 4.5Å; I90-V242 HydrophobicContact CG2-CG1 4.48Å; I90-V242 HydrophobicContact CG2-CG2 4.13Å; P239-V242 HydrophobicContact CB-CG2 3.98Å; P239-V242 HydrophobicContact CG-CG2 3.74Å; P239-V242 PolarHBondContact O-N 3.13Å; P239-V242 VanDerWaalsContact O-N 3.11Å; V242-G244 VanDerWaalsContact C-N 3.26Å; V242-G244 PolarHBondContact O-N 3.26Å; V242-G244 VanDerWaalsContact O-N 3.16Å; V242-V245 PolarHBondContact O-N 2.55Å; V242-A246 WeakPolarHBondContact O-CB 3.44Å; V242-A246 PolarHBondContact O-N 2.97Å |
| 243 | K | 81.2 | Confident | 84.7 | Confident | 66 Ų | 66 | 40.1 Ų | 40.1 | 29% | 0.287 | 24% | 0.24 | S | C | . | . | H | α-helix | trans | -53.4 | -41.1 | -171.8 | -177 | 166.7 | 176.6 | 168.4 | 0 | 112.7 | S235 F238 P239 T247 | S235-K243 PolarHBondContact O-NZ 3.47Å; F238-K243 HydrophobicContact CB-CB 4.13Å; F238-K243 HydrophobicContact CB-CG 4.11Å; P239-K243 WeakPolarHBondContact O-CB 3.25Å; P239-K243 PolarHBondContact O-N 3.36Å; K243-T247 WeakPolarHBondContact O-CA 3.18Å; K243-T247 WeakPolarHBondContact O-CB 3.35Å; K243-T247 PolarHBondContact O-N 3.48Å; K243-T247 PolarHBondContact O-OG1 3.02Å |
| 244 | G | 81.3 | Confident | 85 | Confident | 60 Ų | 60 | 40.3 Ų | 40.3 | 62% | 0.619 | 24% | 0.241 | S | C | * | . | H | α-helix | trans | -60.2 | -55.6 | 179.7 | 0 | 0 | 0 | 0 | 0 | 113.3 | V242 T247 G248 | V242-G244 VanDerWaalsContact C-N 3.26Å; V242-G244 PolarHBondContact O-N 3.26Å; V242-G244 VanDerWaalsContact O-N 3.16Å; G244-T247 PolarHBondContact O-N 3.35Å; G244-G248 PolarHBondContact O-N 3.18Å |
| 245 | V | 83.8 | Confident | 85.3 | Confident | 63 Ų | 63 | 48 Ų | 48 | 38% | 0.382 | 27% | 0.27 | S | S | . | . | H | α-helix | trans | -70.1 | -45 | -177.4 | -178.3 | 0 | 0 | 0 | 0 | 111.7 | F80 V242 T247 G248 I249 | F80-V245 HydrophobicContact CB-CG2 4.21Å; F80-V245 HydrophobicContact CD1-CG1 4.15Å; F80-V245 HydrophobicContact CD1-CG2 4.5Å; F80-V245 HydrophobicContact CD2-CB 3.79Å; F80-V245 HydrophobicContact CD2-CG1 3.97Å; F80-V245 HydrophobicContact CD2-CG2 3.71Å; F80-V245 HydrophobicContact CE1-CG1 3.79Å; F80-V245 HydrophobicContact CE2-CB 3.69Å; F80-V245 HydrophobicContact CE2-CG1 3.59Å; F80-V245 HydrophobicContact CE2-CG2 4.15Å; F80-V245 HydrophobicContact CG-CB 4.31Å; F80-V245 HydrophobicContact CG-CG1 4.22Å; F80-V245 HydrophobicContact CG-CG2 3.89Å; F80-V245 HydrophobicContact CZ-CB 4.14Å; F80-V245 HydrophobicContact CZ-CG1 3.48Å; F80-V245 VanDerWaalsContact CZ-CG1 3.48Å; V242-V245 PolarHBondContact O-N 2.55Å; V245-T247 PolarHBondContact O-N 2.91Å; V245-G248 PolarHBondContact O-N 3.26Å; V245-I249 HydrophobicContact CG1-CD1 4.05Å; V245-I249 WeakPolarHBondContact O-CG1 3.3Å; V245-I249 PolarHBondContact O-N 3.05Å |
| 246 | A | 85.4 | Confident | 85.9 | Confident | 5 Ų | 5 | 49.7 Ų | 49.7 | 4% | 0.041 | 27% | 0.274 | C | S | . | . | H | α-helix | trans | -58.3 | -37.2 | 175.5 | 0 | 0 | 0 | 0 | 0 | 110.9 | F94 F238 V242 I249 C250 | F94-A246 HydrophobicContact CD2-CB 4.17Å; F238-A246 HydrophobicContact CD1-CB 4.01Å; F238-A246 HydrophobicContact CD2-CB 3.92Å; F238-A246 HydrophobicContact CE1-CB 4.01Å; F238-A246 HydrophobicContact CE2-CB 3.85Å; F238-A246 HydrophobicContact CG-CB 4.02Å; F238-A246 HydrophobicContact CZ-CB 3.94Å; V242-A246 WeakPolarHBondContact O-CB 3.44Å; V242-A246 PolarHBondContact O-N 2.97Å; A246-I249 PolarHBondContact O-N 2.89Å; A246-C250 PolarHBondContact O-N 3.47Å; A246-C250 VanDerWaalsContact O-N 3.14Å; A246-C250 PolarHBondContact O-SG 3.29Å |
| 247 | T | 88.3 | Confident | 86.2 | Confident | 46 Ų | 46 | 49.9 Ų | 49.9 | 28% | 0.282 | 28% | 0.276 | S | S | . | . | H | α-helix | trans | -65.5 | -49.3 | 176.8 | -67.7 | 0 | 0 | 0 | 0 | 112 | M234 K243 G244 V245 I249 C250 V251 | M234-T247 VanDerWaalsContact CE-CB 3.49Å; M234-T247 HydrophobicContact CE-CG2 3.41Å; M234-T247 VanDerWaalsContact CE-CG2 3.41Å; M234-T247 WeakPolarHBondContact CE-O 3.32Å; K243-T247 WeakPolarHBondContact O-CA 3.18Å; K243-T247 WeakPolarHBondContact O-CB 3.35Å; K243-T247 PolarHBondContact O-N 3.48Å; K243-T247 PolarHBondContact O-OG1 3.02Å; G244-T247 PolarHBondContact O-N 3.35Å; V245-T247 PolarHBondContact O-N 2.91Å; T247-I249 VanDerWaalsContact C-N 3.28Å; T247-I249 PolarHBondContact O-N 3.21Å; T247-C250 PolarHBondContact O-N 2.65Å; T247-V251 HydrophobicContact CG2-CG2 4.42Å; T247-V251 WeakPolarHBondContact O-CG2 3.32Å; T247-V251 PolarHBondContact O-N 3.26Å |
| 248 | G | 89.1 | Confident | 86.5 | Confident | 42 Ų | 42 | 50.2 Ų | 50.2 | 43% | 0.433 | 28% | 0.279 | S | S | . | . | H | α-helix | trans | -54.9 | -42.7 | 176.5 | 0 | 0 | 0 | 0 | 0 | 112.8 | G244 V245 V251 L252 | G244-G248 PolarHBondContact O-N 3.18Å; V245-G248 PolarHBondContact O-N 3.26Å; G248-V251 PolarHBondContact O-N 3.07Å; G248-L252 WeakPolarHBondContact O-CB 3.28Å; G248-L252 PolarHBondContact O-N 2.84Å |
| 249 | I | 90.8 | Very high | 86.9 | Confident | 53 Ų | 53 | 56 Ų | 56 | 27% | 0.272 | 30% | 0.304 | S | S | . | . | H | α-helix | trans | -66.4 | -44.9 | 179.6 | -63.1 | 164.8 | 0 | 0 | 0 | 111.7 | F94 V98 V245 A246 T247 V251 L252 T253 | F94-I249 HydrophobicContact CE2-CB 4.03Å; F94-I249 HydrophobicContact CE2-CD1 3.84Å; F94-I249 HydrophobicContact CE2-CG2 3.95Å; F94-I249 HydrophobicContact CZ-CB 4.31Å; F94-I249 HydrophobicContact CZ-CD1 4Å; F94-I249 HydrophobicContact CZ-CG2 3.75Å; V98-I249 HydrophobicContact CG2-CG2 4.44Å; V245-I249 HydrophobicContact CG1-CD1 4.05Å; V245-I249 WeakPolarHBondContact O-CG1 3.3Å; V245-I249 PolarHBondContact O-N 3.05Å; A246-I249 PolarHBondContact O-N 2.89Å; T247-I249 VanDerWaalsContact C-N 3.28Å; T247-I249 PolarHBondContact O-N 3.21Å; I249-V251 VanDerWaalsContact C-N 3.32Å; I249-V251 PolarHBondContact O-N 3.08Å; I249-L252 WeakPolarHBondContact O-CB 3.26Å; I249-L252 PolarHBondContact O-N 3.19Å; I249-T253 PolarHBondContact O-N 3.25Å; I249-T253 PolarHBondContact O-OG1 3.36Å; I249-T253 VanDerWaalsContact O-OG1 3.09Å |
| 250 | C | 91.1 | Very high | 87.7 | Confident | 0 Ų | 0 | 59.1 Ų | 59.1 | 0% | 0 | 32% | 0.32 | C | S | . | . | H | α-helix | trans | -64.6 | -38.7 | 178.8 | -59.8 | 0 | 0 | 0 | 0 | 111.7 | M101 M234 A246 T247 L252 T253 N254 | M101-C250 HydrophobicContact CG-CB 4.01Å; M234-C250 HydrophobicContact CE-CB 3.48Å; M234-C250 VanDerWaalsContact CE-CB 3.48Å; M234-C250 HydrophobicContact SD-CB 3.97Å; A246-C250 PolarHBondContact O-N 3.47Å; A246-C250 VanDerWaalsContact O-N 3.14Å; A246-C250 PolarHBondContact O-SG 3.29Å; T247-C250 PolarHBondContact O-N 2.65Å; C250-L252 VanDerWaalsContact C-N 3.35Å; C250-T253 PolarHBondContact O-N 3.13Å; C250-N254 WeakPolarHBondContact O-CB 3.38Å; C250-N254 PolarHBondContact O-N 3.5Å |
| 251 | V | 92.6 | Very high | 88.4 | Confident | 39 Ų | 39 | 55 Ų | 55 | 24% | 0.236 | 30% | 0.299 | C | S | . | . | H | α-helix | trans | -63.4 | -43.4 | 174.8 | 173.9 | 0 | 0 | 0 | 0 | 110.5 | W231 M234 T247 G248 I249 T253 N254 W255 | W231-V251 HydrophobicContact CH2-CG2 4.05Å; W231-V251 HydrophobicContact CZ3-CG2 3.7Å; M234-V251 HydrophobicContact CE-CG2 4.2Å; T247-V251 HydrophobicContact CG2-CG2 4.42Å; T247-V251 WeakPolarHBondContact O-CG2 3.32Å; T247-V251 PolarHBondContact O-N 3.26Å; G248-V251 PolarHBondContact O-N 3.07Å; I249-V251 VanDerWaalsContact C-N 3.32Å; I249-V251 PolarHBondContact O-N 3.08Å; V251-T253 PolarHBondContact O-N 2.96Å; V251-N254 WeakPolarHBondContact O-CB 3.39Å; V251-N254 PolarHBondContact O-N 2.95Å; V251-W255 PolarHBondContact O-N 3.23Å |
| 252 | L | 94.5 | Very high | 89.1 | Confident | 117 Ų | 117 | 52.7 Ų | 52.7 | 61% | 0.613 | 29% | 0.293 | S | S | * | . | H | α-helix | trans | -59.3 | -45.9 | 174 | 179.8 | 65.7 | 0 | 0 | 0 | 111.2 | G248 I249 C250 N254 W255 L256 | G248-L252 WeakPolarHBondContact O-CB 3.28Å; G248-L252 PolarHBondContact O-N 2.84Å; I249-L252 WeakPolarHBondContact O-CB 3.26Å; I249-L252 PolarHBondContact O-N 3.19Å; C250-L252 VanDerWaalsContact C-N 3.35Å; L252-N254 VanDerWaalsContact C-N 3.34Å; L252-N254 PolarHBondContact O-N 3.46Å; L252-W255 PolarHBondContact O-N 2.87Å; L252-L256 WeakPolarHBondContact O-CB 3.29Å; L252-L256 PolarHBondContact O-N 2.93Å |
| 253 | T | 93.6 | Very high | 89.7 | Confident | 24 Ų | 24 | 58.5 Ų | 58.5 | 15% | 0.147 | 32% | 0.317 | C | S | . | . | H | α-helix | trans | -60 | -44 | 175.4 | -57.2 | 0 | 0 | 0 | 0 | 111.5 | V98 A102 I249 C250 V251 L256 M257 | V98-T253 HydrophobicContact CG1-CG2 3.98Å; A102-T253 HydrophobicContact CB-CG2 4.25Å; I249-T253 PolarHBondContact O-N 3.25Å; I249-T253 PolarHBondContact O-OG1 3.36Å; I249-T253 VanDerWaalsContact O-OG1 3.09Å; C250-T253 PolarHBondContact O-N 3.13Å; V251-T253 PolarHBondContact O-N 2.96Å; T253-L256 PolarHBondContact O-N 3.39Å; T253-M257 HydrophobicContact CG2-CG 4.15Å; T253-M257 WeakPolarHBondContact O-CB 3.42Å; T253-M257 VanDerWaalsContact O-CG 3.25Å; T253-M257 WeakPolarHBondContact O-CG 3.34Å; T253-M257 PolarHBondContact O-N 3.43Å |
| 254 | N | 93.3 | Very high | 89.9 | Confident | 5 Ų | 5 | 59.8 Ų | 59.8 | 3% | 0.027 | 32% | 0.324 | C | S | . | . | H | α-helix | trans | -57 | -53.3 | 177.1 | -179.1 | 71.4 | 0 | 0 | 0 | 111 | M101 Q105 C250 V251 L252 L256 M257 A258 | M101-N254 HydrophobicContact CB-CB 4.01Å; M101-N254 HydrophobicContact CG-CB 4.26Å; M101-N254 HydrophobicContact SD-CB 4.11Å; Q105-N254 WeakPolarHBondContact CG-O 3.21Å; Q105-N254 WeakPolarHBondContact CG-OD1 3.32Å; Q105-N254 PolarHBondContact NE2-OD1 3.04Å; C250-N254 WeakPolarHBondContact O-CB 3.38Å; C250-N254 PolarHBondContact O-N 3.5Å; V251-N254 WeakPolarHBondContact O-CB 3.39Å; V251-N254 PolarHBondContact O-N 2.95Å; L252-N254 VanDerWaalsContact C-N 3.34Å; L252-N254 PolarHBondContact O-N 3.46Å; N254-L256 PolarHBondContact O-N 3.14Å; N254-M257 PolarHBondContact O-N 3.4Å; N254-A258 WeakPolarHBondContact O-CB 3.38Å; N254-A258 PolarHBondContact O-N 3.19Å |
| 255 | W | 93.4 | Very high | 90 | Very high | 168 Ų | 168 | 57.9 Ų | 57.9 | 64% | 0.636 | 30% | 0.299 | S | S | * | . | H | α-helix | trans | -70.1 | -34.2 | -178.4 | -69.8 | 111.8 | 0 | 0 | 0 | 113.3 | V251 L252 A258 F259 | V251-W255 PolarHBondContact O-N 3.23Å; L252-W255 PolarHBondContact O-N 2.87Å; W255-A258 PolarHBondContact O-N 2.91Å; W255-F259 WeakPolarHBondContact O-CB 3.34Å; W255-F259 PolarHBondContact O-N 2.96Å |
| 256 | L | 94.7 | Very high | 89.8 | Confident | 89 Ų | 89 | 58.1 Ų | 58.1 | 47% | 0.466 | 30% | 0.303 | S | S | . | . | H | α-helix | trans | -63.6 | -45.7 | 174.3 | -178.7 | 65.2 | 0 | 0 | 0 | 111.2 | L252 T253 N254 F259 L260 | L252-L256 WeakPolarHBondContact O-CB 3.29Å; L252-L256 PolarHBondContact O-N 2.93Å; T253-L256 PolarHBondContact O-N 3.39Å; N254-L256 PolarHBondContact O-N 3.14Å; L256-F259 PolarHBondContact O-N 3.46Å; L256-L260 HydrophobicContact CG-CD1 4.2Å; L256-L260 WeakPolarHBondContact O-CB 3.35Å; L256-L260 WeakPolarHBondContact O-CG 3.44Å; L256-L260 PolarHBondContact O-N 2.9Å |
| 257 | M | 93.1 | Very high | 89.7 | Confident | 47 Ų | 47 | 60.6 Ų | 60.6 | 23% | 0.232 | 32% | 0.32 | C | S | . | . | H | α-helix | trans | -67.8 | -38.4 | 176.8 | -69.1 | -64.4 | 141.8 | 0 | 0 | 111.5 | A102 Q105 T253 N254 F259 L260 V261 | A102-M257 HydrophobicContact CB-CG 4.23Å; Q105-M257 HydrophobicContact CB-CB 3.69Å; Q105-M257 HydrophobicContact CG-CB 4.06Å; T253-M257 HydrophobicContact CG2-CG 4.15Å; T253-M257 WeakPolarHBondContact O-CB 3.42Å; T253-M257 VanDerWaalsContact O-CG 3.25Å; T253-M257 WeakPolarHBondContact O-CG 3.34Å; T253-M257 PolarHBondContact O-N 3.43Å; N254-M257 PolarHBondContact O-N 3.4Å; M257-F259 VanDerWaalsContact C-N 3.31Å; M257-F259 PolarHBondContact O-N 3.36Å; M257-L260 HydrophobicContact CE-CD1 3.91Å; M257-L260 PolarHBondContact O-N 2.98Å; M257-L260 HydrophobicContact SD-CD1 4.14Å; M257-V261 WeakPolarHBondContact O-CB 3.44Å; M257-V261 VanDerWaalsContact O-CG2 3.26Å; M257-V261 WeakPolarHBondContact O-CG2 3.17Å; M257-V261 PolarHBondContact O-N 2.91Å |
| 258 | A | 91 | Very high | 89.4 | Confident | 8 Ų | 8 | 60.6 Ų | 60.6 | 7% | 0.066 | 32% | 0.319 | C | S | . | . | H | α-helix | trans | -57.9 | -44.9 | 173 | 0 | 0 | 0 | 0 | 0 | 111.5 | Q105 N110 N254 W255 T262 | Q105-A258 HydrophobicContact CG-CB 4.19Å; N110-A258 WeakPolarHBondContact ND2-CB 3.39Å; N254-A258 WeakPolarHBondContact O-CB 3.38Å; N254-A258 PolarHBondContact O-N 3.19Å; W255-A258 PolarHBondContact O-N 2.91Å; A258-T262 VanDerWaalsContact O-CB 3.3Å; A258-T262 WeakPolarHBondContact O-CB 3.41Å; A258-T262 PolarHBondContact O-N 2.99Å; A258-T262 PolarHBondContact O-OG1 3.4Å |
| 259 | F | 91.2 | Very high | 88.8 | Confident | 125 Ų | 125 | 59.8 Ų | 59.8 | 55% | 0.548 | 30% | 0.304 | S | S | . | . | H | α-helix | trans | -63.7 | -49.5 | 175.9 | 174.8 | -98.2 | 0 | 0 | 0 | 112 | W255 L256 M257 T262 K263 | W255-F259 WeakPolarHBondContact O-CB 3.34Å; W255-F259 PolarHBondContact O-N 2.96Å; L256-F259 PolarHBondContact O-N 3.46Å; M257-F259 VanDerWaalsContact C-N 3.31Å; M257-F259 PolarHBondContact O-N 3.36Å; F259-T262 PolarHBondContact O-N 3.04Å; F259-K263 HydrophobicContact CE1-CD 4.02Å; F259-K263 HydrophobicContact CZ-CD 4Å; F259-K263 VanDerWaalsContact O-CB 3.28Å; F259-K263 WeakPolarHBondContact O-CB 3.35Å; F259-K263 PolarHBondContact O-N 3.13Å |
| 260 | L | 90.7 | Very high | 88.3 | Confident | 69 Ų | 69 | 65.1 Ų | 65.1 | 36% | 0.361 | 33% | 0.328 | S | S | . | . | H | α-helix | trans | -60.4 | -49.4 | 179.8 | -74.5 | 172 | 0 | 0 | 0 | 111.6 | L256 M257 T262 K263 E264 | L256-L260 HydrophobicContact CG-CD1 4.2Å; L256-L260 WeakPolarHBondContact O-CB 3.35Å; L256-L260 WeakPolarHBondContact O-CG 3.44Å; L256-L260 PolarHBondContact O-N 2.9Å; M257-L260 HydrophobicContact CE-CD1 3.91Å; M257-L260 PolarHBondContact O-N 2.98Å; M257-L260 HydrophobicContact SD-CD1 4.14Å; L260-T262 VanDerWaalsContact C-N 3.34Å; L260-T262 PolarHBondContact O-N 3.22Å; L260-K263 PolarHBondContact O-N 2.93Å; L260-E264 WeakPolarHBondContact O-CB 3.39Å; L260-E264 WeakPolarHBondContact O-CG 3.1Å; L260-E264 PolarHBondContact O-N 3.36Å |
| 261 | V | 88.5 | Confident | 87.9 | Confident | 25 Ų | 25 | 70.7 Ų | 70.7 | 15% | 0.152 | 36% | 0.361 | C | S | . | . | H | α-helix | trans | -59.2 | -47.6 | 178.1 | 170.8 | 0 | 0 | 0 | 0 | 110 | L106 M257 K263 F265 | L106-V261 HydrophobicContact CD2-CG2 4.03Å; M257-V261 WeakPolarHBondContact O-CB 3.44Å; M257-V261 VanDerWaalsContact O-CG2 3.26Å; M257-V261 WeakPolarHBondContact O-CG2 3.17Å; M257-V261 PolarHBondContact O-N 2.91Å; V261-K263 PolarHBondContact O-N 3.44Å; V261-F265 WeakPolarHBondContact O-CB 3.18Å; V261-F265 PolarHBondContact O-N 3.07Å |
| 262 | T | 87.2 | Confident | 87.1 | Confident | 52 Ų | 52 | 72 Ų | 72 | 32% | 0.319 | 37% | 0.367 | S | S | . | . | H | α-helix | trans | -64 | -41.9 | -178.9 | -55.2 | 0 | 0 | 0 | 0 | 112.3 | F114 A258 F259 L260 | F114-T262 HydrophobicContact CD2-CG2 4.2Å; F114-T262 HydrophobicContact CE2-CG2 3.49Å; F114-T262 VanDerWaalsContact CE2-CG2 3.49Å; F114-T262 HydrophobicContact CZ-CG2 4.18Å; A258-T262 VanDerWaalsContact O-CB 3.3Å; A258-T262 WeakPolarHBondContact O-CB 3.41Å; A258-T262 PolarHBondContact O-N 2.99Å; A258-T262 PolarHBondContact O-OG1 3.4Å; F259-T262 PolarHBondContact O-N 3.04Å; L260-T262 VanDerWaalsContact C-N 3.34Å; L260-T262 PolarHBondContact O-N 3.22Å |
| 263 | K | 88.1 | Confident | 86.4 | Confident | 125 Ų | 125 | 73 Ų | 73 | 54% | 0.543 | 36% | 0.363 | S | S | . | . | H | α-helix | trans | -68.8 | -47.4 | 179.9 | -180 | -177.7 | 172.5 | -173.4 | 0 | 112.1 | F259 L260 V261 F265 | F259-K263 HydrophobicContact CE1-CD 4.02Å; F259-K263 HydrophobicContact CZ-CD 4Å; F259-K263 VanDerWaalsContact O-CB 3.28Å; F259-K263 WeakPolarHBondContact O-CB 3.35Å; F259-K263 PolarHBondContact O-N 3.13Å; L260-K263 PolarHBondContact O-N 2.93Å; V261-K263 PolarHBondContact O-N 3.44Å; K263-F265 VanDerWaalsContact C-N 3.29Å |
| 264 | E | 87.1 | Confident | 85.6 | Confident | 94 Ų | 94 | 72.9 Ų | 72.9 | 44% | 0.439 | 36% | 0.362 | S | S | . | . | H | α-helix | trans | -79.1 | -14.2 | -176.8 | -61.4 | -56.9 | 146.5 | 0 | 0 | 112.4 | L260 S266 S267 L268 | L260-E264 WeakPolarHBondContact O-CB 3.39Å; L260-E264 WeakPolarHBondContact O-CG 3.1Å; L260-E264 PolarHBondContact O-N 3.36Å; E264-S266 PolarHBondContact O-N 2.83Å; E264-S267 PolarHBondContact O-N 2.88Å; E264-L268 WeakPolarHBondContact O-CB 3.45Å; E264-L268 PolarHBondContact O-N 3.37Å |
| 265 | F | 81.6 | Confident | 85 | Confident | 19 Ų | 19 | 75.7 Ų | 75.7 | 8% | 0.083 | 37% | 0.372 | C | S | . | . | H | α-helix | trans | -59.3 | -43.7 | -177.2 | -167.6 | -100.1 | 0 | 0 | 0 | 112.6 | A111 Y115 V261 K263 L268 M269 A277 F278 | A111-F265 HydrophobicContact CB-CD1 3.96Å; A111-F265 HydrophobicContact CB-CD2 3.3Å; A111-F265 HydrophobicContact CB-CE1 3.92Å; A111-F265 HydrophobicContact CB-CE2 3.26Å; A111-F265 HydrophobicContact CB-CG 3.66Å; A111-F265 HydrophobicContact CB-CZ 3.58Å; Y115-F265 HydrophobicContact CD2-CD1 4.15Å; Y115-F265 AromaticContact CD2-CE1 3.56Å; Y115-F265 HydrophobicContact CD2-CE1 3.56Å; Y115-F265 HydrophobicContact CD2-CZ 4.38Å; Y115-F265 HydrophobicContact CE1-CE1 4.43Å; Y115-F265 AromaticContact CE2-CD1 3.37Å; Y115-F265 HydrophobicContact CE2-CD1 3.37Å; Y115-F265 AromaticContact CE2-CE1 3.08Å; Y115-F265 HydrophobicContact CE2-CE1 3.08Å; Y115-F265 HydrophobicContact CE2-CZ 4.25Å; Y115-F265 HydrophobicContact CG-CE1 4.42Å; Y115-F265 AromaticContact CZ-CD1 3.93Å; Y115-F265 AromaticContact CZ-CE1 3.55Å; V261-F265 WeakPolarHBondContact O-CB 3.18Å; V261-F265 PolarHBondContact O-N 3.07Å; K263-F265 VanDerWaalsContact C-N 3.29Å; F265-L268 WeakPolarHBondContact O-CB 3.45Å; F265-L268 PolarHBondContact O-N 3.36Å; F265-M269 HydrophobicContact CE1-CE 3.43Å; F265-M269 VanDerWaalsContact CE1-CE 3.43Å; F265-M269 HydrophobicContact CE1-SD 3.6Å; F265-M269 HydrophobicContact CZ-CE 3.77Å; F265-M269 HydrophobicContact CZ-SD 3.65Å; F265-M269 WeakPolarHBondContact O-CB 3.24Å; F265-M269 PolarHBondContact O-N 2.82Å; F265-A277 HydrophobicContact CE2-CB 4.27Å; F265-F278 HydrophobicContact CZ-CE1 4.37Å; F265-F278 HydrophobicContact CZ-CZ 4Å |
| 266 | S | 80.2 | Confident | 84.4 | Confident | 68 Ų | 68 | 68.1 Ų | 68.1 | 48% | 0.476 | 35% | 0.347 | S | S | . | . | H | α-helix | trans | -63 | -45.7 | 178.3 | -58.5 | 0 | 0 | 0 | 0 | 111.6 | E264 L268 M269 E270 | E264-S266 PolarHBondContact O-N 2.83Å; S266-L268 VanDerWaalsContact C-N 3.31Å; S266-L268 PolarHBondContact O-N 3.37Å; S266-M269 WeakPolarHBondContact O-CB 3.46Å; S266-M269 PolarHBondContact O-N 2.83Å; S266-E270 PolarHBondContact O-N 3.06Å; S266-E270 VanDerWaalsContact O-N 3.1Å |
| 267 | S | 84.3 | Confident | 84 | Confident | 57 Ų | 57 | 64 Ų | 64 | 40% | 0.399 | 33% | 0.326 | S | S | . | . | H | α-helix | trans | -60.3 | -41.3 | 174.5 | -52.3 | 0 | 0 | 0 | 0 | 111.9 | E264 M269 E270 V271 | E264-S267 PolarHBondContact O-N 2.88Å; S267-M269 VanDerWaalsContact C-N 3.32Å; S267-M269 PolarHBondContact O-N 3.26Å; S267-E270 PolarHBondContact O-N 3.36Å; S267-V271 WeakPolarHBondContact O-CG2 3.27Å; S267-V271 PolarHBondContact O-N 2.95Å; S267-V271 VanDerWaalsContact O-N 3.07Å |
| 268 | L | 81.4 | Confident | 83.5 | Confident | 46 Ų | 46 | 62 Ų | 62 | 24% | 0.241 | 32% | 0.315 | C | S | . | . | H | α-helix | trans | -63.5 | -40 | 177.1 | -168.8 | 76 | 0 | 0 | 0 | 111.1 | E264 F265 S266 E270 V271 L272 A277 L280 | E264-L268 WeakPolarHBondContact O-CB 3.45Å; E264-L268 PolarHBondContact O-N 3.37Å; F265-L268 WeakPolarHBondContact O-CB 3.45Å; F265-L268 PolarHBondContact O-N 3.36Å; S266-L268 VanDerWaalsContact C-N 3.31Å; S266-L268 PolarHBondContact O-N 3.37Å; L268-E270 VanDerWaalsContact C-N 3.32Å; L268-E270 PolarHBondContact O-N 3.31Å; L268-V271 PolarHBondContact O-N 2.88Å; L268-L272 HydrophobicContact CD1-CD1 3.85Å; L268-L272 HydrophobicContact CD1-CD2 4.07Å; L268-L272 HydrophobicContact CD1-CG 4.39Å; L268-L272 WeakPolarHBondContact O-CB 3.46Å; L268-L272 PolarHBondContact O-N 3.27Å; L268-A277 HydrophobicContact CD2-CB 3.76Å; L268-A277 HydrophobicContact CG-CB 4.09Å; L268-L280 HydrophobicContact CD1-CD2 3.86Å; L268-L280 HydrophobicContact CD2-CD2 4Å |
| 269 | M | 77.3 | Confident | 83.4 | Confident | 26 Ų | 26 | 66.8 Ų | 66.8 | 13% | 0.128 | 33% | 0.332 | C | S | . | . | H | α-helix | trans | -64.4 | -36.2 | 177.4 | -145.9 | 82.4 | 129.3 | 0 | 0 | 112.1 | Y115 F265 S266 S267 R273 P274 A277 F278 | Y115-M269 HydrophobicContact CD1-CE 3.78Å; Y115-M269 HydrophobicContact CE1-CE 3.29Å; Y115-M269 HydrophobicContact CE2-CE 4.16Å; Y115-M269 HydrophobicContact CG-CE 4.34Å; Y115-M269 VanDerWaalsContact CZ-CE 3.49Å; F265-M269 HydrophobicContact CE1-CE 3.43Å; F265-M269 VanDerWaalsContact CE1-CE 3.43Å; F265-M269 HydrophobicContact CE1-SD 3.6Å; F265-M269 HydrophobicContact CZ-CE 3.77Å; F265-M269 HydrophobicContact CZ-SD 3.65Å; F265-M269 WeakPolarHBondContact O-CB 3.24Å; F265-M269 PolarHBondContact O-N 2.82Å; S266-M269 WeakPolarHBondContact O-CB 3.46Å; S266-M269 PolarHBondContact O-N 2.83Å; S267-M269 VanDerWaalsContact C-N 3.32Å; S267-M269 PolarHBondContact O-N 3.26Å; M269-R273 CarbonylContact O-C 3.59Å; M269-R273 WeakPolarHBondContact O-CA 3.23Å; M269-R273 PolarHBondContact O-N 3.26Å; M269-R273 VanDerWaalsContact O-N 3.15Å; M269-P274 HydrophobicContact CE-CB 4.28Å; M269-P274 HydrophobicContact CE-CG 4.35Å; M269-P274 HydrophobicContact CG-CG 4.02Å; M269-P274 HydrophobicContact SD-CB 4.07Å; M269-P274 HydrophobicContact SD-CG 4.16Å; M269-A277 HydrophobicContact SD-CB 4.02Å; M269-F278 HydrophobicContact CE-CE2 4.39Å |
| 270 | E | 79.5 | Confident | 83.4 | Confident | 164 Ų | 164 | 63.9 Ų | 63.9 | 77% | 0.766 | 32% | 0.322 | S | S | * | . | H | α-helix | trans | -71 | -43.5 | 176.6 | -71.2 | -179.4 | 179.9 | 0 | 0 | 112.3 | S266 S267 L268 | S266-E270 PolarHBondContact O-N 3.06Å; S266-E270 VanDerWaalsContact O-N 3.1Å; S267-E270 PolarHBondContact O-N 3.36Å; L268-E270 VanDerWaalsContact C-N 3.32Å; L268-E270 PolarHBondContact O-N 3.31Å |
| 271 | V | 83.1 | Confident | 83.3 | Confident | 117 Ų | 117 | 61.1 Ų | 61.1 | 71% | 0.709 | 31% | 0.309 | S | S | * | . | H | α-helix | trans | -81.4 | -47.8 | -175.2 | -177.6 | 0 | 0 | 0 | 0 | 112.1 | S267 L268 | S267-V271 WeakPolarHBondContact O-CG2 3.27Å; S267-V271 PolarHBondContact O-N 2.95Å; S267-V271 VanDerWaalsContact O-N 3.07Å; L268-V271 PolarHBondContact O-N 2.88Å |
| 272 | L | 75.6 | Confident | 83.4 | Confident | 67 Ų | 67 | 60.1 Ų | 60.1 | 35% | 0.351 | 30% | 0.303 | S | S | . | . | H | α-helix | trans | -93.2 | -6.2 | -174.8 | -87.9 | 75.7 | 0 | 0 | 0 | 113.4 | L268 G276 L280 | L268-L272 HydrophobicContact CD1-CD1 3.85Å; L268-L272 HydrophobicContact CD1-CD2 4.07Å; L268-L272 HydrophobicContact CD1-CG 4.39Å; L268-L272 WeakPolarHBondContact O-CB 3.46Å; L268-L272 PolarHBondContact O-N 3.27Å; L272-G276 WeakPolarHBondContact O-CA 3.33Å; L272-G276 PolarHBondContact O-N 3.07Å; L272-L280 HydrophobicContact CD2-CD2 4.46Å |
| 273 | R | 80.5 | Confident | 83.7 | Confident | 139 Ų | 139 | 59.3 Ų | 59.3 | 53% | 0.525 | 30% | 0.302 | S | S | . | . | H | α-helix | trans | 60.6 | 164.5 | -166.9 | -58.2 | -177.3 | 179.2 | -177.8 | -1.1 | 111.8 | M269 Y275 G276 A277 | M269-R273 CarbonylContact O-C 3.59Å; M269-R273 WeakPolarHBondContact O-CA 3.23Å; M269-R273 PolarHBondContact O-N 3.26Å; M269-R273 VanDerWaalsContact O-N 3.15Å; R273-Y275 VanDerWaalsContact C-N 3.31Å; R273-Y275 HydrophobicContact CB-CD1 3.88Å; R273-Y275 HydrophobicContact CB-CE1 3.48Å; R273-Y275 VanDerWaalsContact CB-CE1 3.48Å; R273-Y275 HydrophobicContact CG-CE1 4.11Å; R273-Y275 PolarHBondContact O-N 2.66Å; R273-G276 PolarHBondContact O-N 3.28Å; R273-G276 VanDerWaalsContact O-N 3.09Å; R273-A277 PolarHBondContact O-N 3.44Å; R273-A277 VanDerWaalsContact O-N 3.14Å |
| 274 | P | 76.1 | Confident | 83.9 | Confident | 20 Ų | 20 | 56.4 Ų | 56.4 | 13% | 0.13 | 29% | 0.289 | C | S | . | . | H | α-helix | trans | -55 | -42.2 | -178.1 | -29.9 | 37.2 | 0 | 0 | 0 | 114.1 | F177 M269 G276 A277 F278 | F177-P274 HydrophobicContact CB-CB 4.25Å; F177-P274 HydrophobicContact CD1-CB 3.85Å; F177-P274 HydrophobicContact CD2-CB 4.11Å; F177-P274 HydrophobicContact CE1-CB 4.19Å; F177-P274 HydrophobicContact CE2-CB 4.38Å; F177-P274 HydrophobicContact CG-CB 3.82Å; F177-P274 HydrophobicContact CZ-CB 4.45Å; M269-P274 HydrophobicContact CE-CB 4.28Å; M269-P274 HydrophobicContact CE-CG 4.35Å; M269-P274 HydrophobicContact CG-CG 4.02Å; M269-P274 HydrophobicContact SD-CB 4.07Å; M269-P274 HydrophobicContact SD-CG 4.16Å; P274-G276 VanDerWaalsContact C-N 3.32Å; P274-G276 PolarHBondContact O-N 3.2Å; P274-A277 PolarHBondContact O-N 2.98Å; P274-F278 WeakPolarHBondContact O-CD2 3.2Å; P274-F278 PolarHBondContact O-N 3.34Å |
| 275 | Y | 79.9 | Confident | 84.2 | Confident | 64 Ų | 64 | 52 Ų | 52 | 25% | 0.251 | 27% | 0.269 | S | S | . | . | H | α-helix | trans | -62.9 | -36.9 | 179.2 | 63.8 | -98 | 0 | 0 | 0 | 112.9 | G174 K178 R273 W279 | G174-Y275 WeakPolarHBondContact O-CB 3.44Å; K178-Y275 HydrophobicContact CB-CG 4.38Å; R273-Y275 VanDerWaalsContact C-N 3.31Å; R273-Y275 HydrophobicContact CB-CD1 3.88Å; R273-Y275 HydrophobicContact CB-CE1 3.48Å; R273-Y275 VanDerWaalsContact CB-CE1 3.48Å; R273-Y275 HydrophobicContact CG-CE1 4.11Å; R273-Y275 PolarHBondContact O-N 2.66Å; Y275-W279 WeakPolarHBondContact O-CB 3.4Å; Y275-W279 PolarHBondContact O-N 2.89Å; Y275-W279 VanDerWaalsContact O-N 3.11Å |
| 276 | G | 81.9 | Confident | 84.8 | Confident | 10 Ų | 10 | 54.7 Ų | 54.7 | 10% | 0.103 | 28% | 0.283 | C | S | . | . | H | α-helix | trans | -73.5 | -36.9 | -179.3 | 0 | 0 | 0 | 0 | 0 | 112.2 | L272 R273 P274 W279 L280 | L272-G276 WeakPolarHBondContact O-CA 3.33Å; L272-G276 PolarHBondContact O-N 3.07Å; R273-G276 PolarHBondContact O-N 3.28Å; R273-G276 VanDerWaalsContact O-N 3.09Å; P274-G276 VanDerWaalsContact C-N 3.32Å; P274-G276 PolarHBondContact O-N 3.2Å; G276-W279 PolarHBondContact O-N 3.26Å; G276-L280 WeakPolarHBondContact O-CB 3.25Å; G276-L280 PolarHBondContact O-N 2.94Å |
| 277 | A | 84.9 | Confident | 85.5 | Confident | 2 Ų | 2 | 57.2 Ų | 57.2 | 2% | 0.017 | 29% | 0.286 | C | S | . | . | H | α-helix | trans | -61.2 | -46.1 | 175.1 | 0 | 0 | 0 | 0 | 0 | 112 | F265 L268 M269 R273 P274 L280 A281 | F265-A277 HydrophobicContact CE2-CB 4.27Å; L268-A277 HydrophobicContact CD2-CB 3.76Å; L268-A277 HydrophobicContact CG-CB 4.09Å; M269-A277 HydrophobicContact SD-CB 4.02Å; R273-A277 PolarHBondContact O-N 3.44Å; R273-A277 VanDerWaalsContact O-N 3.14Å; P274-A277 PolarHBondContact O-N 2.98Å; A277-L280 PolarHBondContact O-N 3.41Å; A277-A281 PolarHBondContact O-N 2.98Å |
| 278 | F | 84.4 | Confident | 85.9 | Confident | 4 Ų | 4 | 54.5 Ų | 54.5 | 2% | 0.018 | 27% | 0.267 | C | S | . | . | H | α-helix | trans | -72.8 | -30.7 | 179 | -69.2 | -65.2 | 0 | 0 | 0 | 113.7 | V112 F173 F177 F265 M269 P274 A281 S282 | V112-F278 HydrophobicContact CG2-CE1 4.05Å; F173-F278 AromaticContact CD1-CD1 3.64Å; F173-F278 HydrophobicContact CD1-CD1 3.64Å; F173-F278 AromaticContact CD1-CD2 3.7Å; F173-F278 HydrophobicContact CD1-CD2 3.7Å; F173-F278 AromaticContact CD1-CE1 3.68Å; F173-F278 HydrophobicContact CD1-CE1 3.68Å; F173-F278 AromaticContact CD1-CE2 3.79Å; F173-F278 HydrophobicContact CD1-CE2 3.79Å; F173-F278 AromaticContact CD1-CG 3.67Å; F173-F278 HydrophobicContact CD1-CG 3.67Å; F173-F278 AromaticContact CD1-CZ 3.79Å; F173-F278 HydrophobicContact CD1-CZ 3.79Å; F173-F278 HydrophobicContact CE1-CD1 4.12Å; F173-F278 AromaticContact CE1-CD2 3.91Å; F173-F278 HydrophobicContact CE1-CD2 3.91Å; F173-F278 AromaticContact CE1-CE1 3.7Å; F173-F278 HydrophobicContact CE1-CE1 3.7Å; F173-F278 AromaticContact CE1-CE2 3.49Å; F173-F278 HydrophobicContact CE1-CE2 3.49Å; F173-F278 VanDerWaalsContact CE1-CE2 3.49Å; F173-F278 HydrophobicContact CE1-CG 4.24Å; F173-F278 AromaticContact CE1-CZ 3.39Å; F173-F278 HydrophobicContact CE1-CZ 3.39Å; F177-F278 AromaticContact CD2-CD2 3.77Å; F177-F278 HydrophobicContact CD2-CD2 3.77Å; F177-F278 AromaticContact CD2-CE2 3.89Å; F177-F278 HydrophobicContact CD2-CE2 3.89Å; F177-F278 AromaticContact CE2-CD2 3.89Å; F177-F278 HydrophobicContact CE2-CD2 3.89Å; F177-F278 AromaticContact CE2-CE2 3.51Å; F177-F278 HydrophobicContact CE2-CE2 3.51Å; F177-F278 HydrophobicContact CE2-CZ 4.45Å; F177-F278 HydrophobicContact CZ-CE2 4.46Å; F265-F278 HydrophobicContact CZ-CE1 4.37Å; F265-F278 HydrophobicContact CZ-CZ 4Å; M269-F278 HydrophobicContact CE-CE2 4.39Å; P274-F278 WeakPolarHBondContact O-CD2 3.2Å; P274-F278 PolarHBondContact O-N 3.34Å; F278-A281 PolarHBondContact O-N 3.49Å; F278-S282 WeakPolarHBondContact O-CB 3.47Å; F278-S282 PolarHBondContact O-N 3.42Å |
| 279 | W | 88.4 | Confident | 86.5 | Confident | 109 Ų | 109 | 53 Ų | 53 | 41% | 0.413 | 26% | 0.26 | S | S | . | . | H | α-helix | trans | -68.5 | -36.8 | 170.5 | -77.6 | -6 | 0 | 0 | 0 | 112.7 | K178 Y275 G276 S282 A283 | K178-W279 HydrophobicContact CD-CH2 3.67Å; K178-W279 HydrophobicContact CD-CZ2 3.93Å; Y275-W279 WeakPolarHBondContact O-CB 3.4Å; Y275-W279 PolarHBondContact O-N 2.89Å; Y275-W279 VanDerWaalsContact O-N 3.11Å; G276-W279 PolarHBondContact O-N 3.26Å; W279-S282 WeakPolarHBondContact O-CB 3.19Å; W279-S282 PolarHBondContact O-N 3.33Å; W279-A283 PolarHBondContact O-N 3.44Å |
| 280 | L | 89.9 | Confident | 87.3 | Confident | 64 Ų | 64 | 55.4 Ų | 55.4 | 34% | 0.335 | 27% | 0.273 | S | S | . | . | H | α-helix | trans | -63.1 | -44.2 | 171.9 | -177.2 | 64.6 | 0 | 0 | 0 | 111 | L268 L272 G276 A277 S282 A283 F284 | L268-L280 HydrophobicContact CD1-CD2 3.86Å; L268-L280 HydrophobicContact CD2-CD2 4Å; L272-L280 HydrophobicContact CD2-CD2 4.46Å; G276-L280 WeakPolarHBondContact O-CB 3.25Å; G276-L280 PolarHBondContact O-N 2.94Å; A277-L280 PolarHBondContact O-N 3.41Å; L280-S282 VanDerWaalsContact C-N 3.29Å; L280-S282 PolarHBondContact O-N 3.24Å; L280-A283 WeakPolarHBondContact O-CB 3.32Å; L280-A283 PolarHBondContact O-N 3.38Å; L280-A283 VanDerWaalsContact O-N 3.16Å; L280-F284 HydrophobicContact CD1-CD2 4.4Å; L280-F284 HydrophobicContact CD1-CE2 3.88Å; L280-F284 HydrophobicContact CD1-CZ 4.5Å; L280-F284 HydrophobicContact CD2-CE2 4.17Å; L280-F284 HydrophobicContact CG-CD2 4.1Å; L280-F284 HydrophobicContact CG-CE2 3.71Å; L280-F284 VanDerWaalsContact O-CD2 3.27Å; L280-F284 WeakPolarHBondContact O-CD2 3.33Å; L280-F284 PolarHBondContact O-N 2.68Å |
| 281 | A | 88.6 | Confident | 88 | Confident | 11 Ų | 11 | 49.1 Ų | 49.1 | 9% | 0.091 | 24% | 0.243 | C | C | . | . | H | α-helix | trans | -59.4 | -39.8 | 173.3 | 0 | 0 | 0 | 0 | 0 | 112.1 | A277 F278 F284 C285 | A277-A281 PolarHBondContact O-N 2.98Å; F278-A281 PolarHBondContact O-N 3.49Å; A281-F284 PolarHBondContact O-N 3.2Å; A281-C285 PolarHBondContact O-N 3.43Å; A281-C285 PolarHBondContact O-SG 2.93Å |
| 282 | S | 91 | Very high | 88.3 | Confident | 5 Ų | 5 | 43.6 Ų | 43.6 | 4% | 0.035 | 21% | 0.209 | C | C | . | . | H | α-helix | trans | -61.7 | -42.6 | 173.9 | -167.4 | 0 | 0 | 0 | 0 | 112.2 | V167 T170 S171 F278 W279 L280 F284 C285 I286 | V167-S282 PolarHBondContact O-OG 3.48Å; T170-S282 WeakPolarHBondContact OG1-CA 3.35Å; T170-S282 WeakPolarHBondContact OG1-CB 3.23Å; T170-S282 PolarHBondContact OG1-OG 2.97Å; S171-S282 PolarHBondContact OG-OG 3.01Å; F278-S282 WeakPolarHBondContact O-CB 3.47Å; F278-S282 PolarHBondContact O-N 3.42Å; W279-S282 WeakPolarHBondContact O-CB 3.19Å; W279-S282 PolarHBondContact O-N 3.33Å; L280-S282 VanDerWaalsContact C-N 3.29Å; L280-S282 PolarHBondContact O-N 3.24Å; S282-F284 VanDerWaalsContact C-N 3.35Å; S282-F284 PolarHBondContact O-N 3.11Å; S282-C285 WeakPolarHBondContact O-CB 3.33Å; S282-C285 PolarHBondContact O-N 2.9Å; S282-C285 VanDerWaalsContact O-N 3.13Å; S282-I286 WeakPolarHBondContact O-CG1 3.2Å; S282-I286 PolarHBondContact O-N 2.91Å |
| 283 | A | 93.6 | Very high | 89 | Confident | 35 Ų | 35 | 43.6 Ų | 43.6 | 29% | 0.289 | 21% | 0.209 | S | C | . | . | H | α-helix | trans | -60.4 | -43.6 | 174.8 | 0 | 0 | 0 | 0 | 0 | 111.7 | W279 L280 C285 I286 F287 | W279-A283 PolarHBondContact O-N 3.44Å; L280-A283 WeakPolarHBondContact O-CB 3.32Å; L280-A283 PolarHBondContact O-N 3.38Å; L280-A283 VanDerWaalsContact O-N 3.16Å; A283-C285 VanDerWaalsContact C-N 3.32Å; A283-C285 PolarHBondContact O-N 3.45Å; A283-I286 WeakPolarHBondContact O-CB 3.39Å; A283-I286 PolarHBondContact O-N 3.16Å; A283-F287 HydrophobicContact CB-CE2 4.48Å; A283-F287 WeakPolarHBondContact O-CD2 3.39Å; A283-F287 PolarHBondContact O-N 2.89Å |
| 284 | F | 93.3 | Very high | 89.4 | Confident | 64 Ų | 64 | 45.1 Ų | 45.1 | 28% | 0.281 | 22% | 0.22 | S | C | . | . | H | α-helix | trans | -62.2 | -37.2 | 173.3 | -75.4 | -61.1 | 0 | 0 | 0 | 112.9 | L106 L280 A281 S282 F287 S288 | L106-F284 HydrophobicContact CB-CB 4.26Å; L106-F284 HydrophobicContact CB-CD1 4.33Å; L106-F284 HydrophobicContact CB-CG 4.14Å; L106-F284 HydrophobicContact CD1-CD1 4.23Å; L106-F284 HydrophobicContact CD1-CE1 4.26Å; L280-F284 HydrophobicContact CD1-CD2 4.4Å; L280-F284 HydrophobicContact CD1-CE2 3.88Å; L280-F284 HydrophobicContact CD1-CZ 4.5Å; L280-F284 HydrophobicContact CD2-CE2 4.17Å; L280-F284 HydrophobicContact CG-CD2 4.1Å; L280-F284 HydrophobicContact CG-CE2 3.71Å; L280-F284 VanDerWaalsContact O-CD2 3.27Å; L280-F284 WeakPolarHBondContact O-CD2 3.33Å; L280-F284 PolarHBondContact O-N 2.68Å; A281-F284 PolarHBondContact O-N 3.2Å; S282-F284 VanDerWaalsContact C-N 3.35Å; S282-F284 PolarHBondContact O-N 3.11Å; F284-F287 PolarHBondContact O-N 3.44Å; F284-S288 WeakPolarHBondContact O-CB 3.41Å; F284-S288 PolarHBondContact O-N 3.25Å |
| 285 | C | 92.1 | Very high | 90 | Very high | 0 Ų | 0 | 47 Ų | 47 | 0% | 0 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -66.5 | -35.4 | 173.7 | -65.7 | 0 | 0 | 0 | 0 | 112.4 | V167 A281 S282 A283 S288 V289 | V167-C285 HydrophobicContact CG2-CB 3.47Å; V167-C285 VanDerWaalsContact CG2-CB 3.47Å; A281-C285 PolarHBondContact O-N 3.43Å; A281-C285 PolarHBondContact O-SG 2.93Å; S282-C285 WeakPolarHBondContact O-CB 3.33Å; S282-C285 PolarHBondContact O-N 2.9Å; S282-C285 VanDerWaalsContact O-N 3.13Å; A283-C285 VanDerWaalsContact C-N 3.32Å; A283-C285 PolarHBondContact O-N 3.45Å; C285-S288 PolarHBondContact O-N 3.28Å; C285-S288 PolarHBondContact O-OG 3.03Å; C285-V289 WeakPolarHBondContact O-CG2 3.38Å; C285-V289 PolarHBondContact O-N 2.97Å |
| 286 | I | 94.6 | Very high | 90.3 | Very high | 77 Ų | 77 | 44.1 Ų | 44.1 | 40% | 0.395 | 22% | 0.222 | S | C | . | . | H | α-helix | trans | -64.8 | -46.9 | 173.2 | -67.6 | 167.7 | 0 | 0 | 0 | 109.8 | V167 S282 A283 S288 V289 L290 | V167-I286 HydrophobicContact CB-CG1 4.36Å; V167-I286 HydrophobicContact CG1-CD1 4.08Å; V167-I286 HydrophobicContact CG1-CG1 3.63Å; V167-I286 HydrophobicContact CG2-CB 4.47Å; V167-I286 HydrophobicContact CG2-CG1 3.68Å; S282-I286 WeakPolarHBondContact O-CG1 3.2Å; S282-I286 PolarHBondContact O-N 2.91Å; A283-I286 WeakPolarHBondContact O-CB 3.39Å; A283-I286 PolarHBondContact O-N 3.16Å; I286-S288 VanDerWaalsContact C-N 3.28Å; I286-S288 PolarHBondContact O-N 3.4Å; I286-V289 PolarHBondContact O-N 3.18Å; I286-L290 HydrophobicContact CG2-CD1 4.1Å; I286-L290 HydrophobicContact CG2-CG 4.45Å; I286-L290 WeakPolarHBondContact O-CG 3.07Å; I286-L290 PolarHBondContact O-N 3.23Å |
| 287 | F | 94.5 | Very high | 90.4 | Very high | 120 Ų | 120 | 44.4 Ų | 44.4 | 53% | 0.526 | 22% | 0.222 | S | C | . | . | H | α-helix | trans | -61.2 | -37.3 | 176.7 | -69.5 | -54.6 | 0 | 0 | 0 | 112.3 | F103 A283 F284 L290 F291 | F103-F287 HydrophobicContact CE1-CB 4.25Å; A283-F287 HydrophobicContact CB-CE2 4.48Å; A283-F287 WeakPolarHBondContact O-CD2 3.39Å; A283-F287 PolarHBondContact O-N 2.89Å; F284-F287 PolarHBondContact O-N 3.44Å; F287-L290 PolarHBondContact O-N 3.37Å; F287-F291 VanDerWaalsContact O-CB 3.24Å; F287-F291 WeakPolarHBondContact O-CB 3.48Å; F287-F291 PolarHBondContact O-N 3.34Å |
| 288 | S | 93 | Very high | 90.4 | Very high | 1 Ų | 1 | 46.7 Ų | 46.7 | 1% | 0.007 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -67.6 | -37.2 | 177.3 | 80.4 | 0 | 0 | 0 | 0 | 112.4 | W226 F284 C285 I286 T292 | W226-S288 VanDerWaalsContact CH2-CB 3.5Å; W226-S288 WeakPolarHBondContact CZ2-OG 3.35Å; F284-S288 WeakPolarHBondContact O-CB 3.41Å; F284-S288 PolarHBondContact O-N 3.25Å; C285-S288 PolarHBondContact O-N 3.28Å; C285-S288 PolarHBondContact O-OG 3.03Å; I286-S288 VanDerWaalsContact C-N 3.28Å; I286-S288 PolarHBondContact O-N 3.4Å; S288-T292 WeakPolarHBondContact O-CB 3.42Å; S288-T292 PolarHBondContact O-N 3.14Å; S288-T292 PolarHBondContact O-OG1 3.3Å |
| 289 | V | 93.8 | Very high | 90.2 | Very high | 14 Ų | 14 | 46.7 Ų | 46.7 | 9% | 0.085 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -64.2 | -48.5 | 172.3 | 171.2 | 0 | 0 | 0 | 0 | 110.9 | V160 G163 V164 C285 I286 F291 T292 L293 | V160-V289 HydrophobicContact CG1-CG1 4.34Å; G163-V289 VanDerWaalsContact CA-CG2 3.49Å; V164-V289 HydrophobicContact CG2-CG1 4.25Å; V164-V289 HydrophobicContact CG2-CG2 4.48Å; C285-V289 WeakPolarHBondContact O-CG2 3.38Å; C285-V289 PolarHBondContact O-N 2.97Å; I286-V289 PolarHBondContact O-N 3.18Å; V289-F291 VanDerWaalsContact C-N 3.34Å; V289-F291 PolarHBondContact O-N 3.36Å; V289-T292 PolarHBondContact O-N 3.48Å; V289-L293 HydrophobicContact CG1-CD1 4.09Å; V289-L293 WeakPolarHBondContact O-CG 3.5Å; V289-L293 PolarHBondContact O-N 3.15Å |
| 290 | L | 94.4 | Very high | 89.8 | Confident | 77 Ų | 77 | 46 Ų | 46 | 40% | 0.403 | 23% | 0.233 | S | C | . | . | H | α-helix | trans | -60.3 | -45.6 | 177.6 | -67.6 | 174.5 | 0 | 0 | 0 | 111 | I286 F287 T292 L293 F294 | I286-L290 HydrophobicContact CG2-CD1 4.1Å; I286-L290 HydrophobicContact CG2-CG 4.45Å; I286-L290 WeakPolarHBondContact O-CG 3.07Å; I286-L290 PolarHBondContact O-N 3.23Å; F287-L290 PolarHBondContact O-N 3.37Å; L290-T292 VanDerWaalsContact C-N 3.31Å; L290-T292 PolarHBondContact O-N 3.1Å; L290-L293 PolarHBondContact O-N 3.18Å; L290-L293 VanDerWaalsContact O-N 3.14Å; L290-F294 HydrophobicContact CD2-CE2 4.24Å; L290-F294 WeakPolarHBondContact O-CD2 3.5Å; L290-F294 PolarHBondContact O-N 3Å |
| 291 | F | 93.4 | Very high | 88.8 | Confident | 32 Ų | 32 | 46.8 Ų | 46.8 | 14% | 0.14 | 26% | 0.257 | C | S | . | . | H | α-helix | trans | -58.4 | -43.4 | 175.1 | 178.9 | -98.9 | 0 | 0 | 0 | 111.9 | I96 L100 F103 F287 V289 L293 F294 C295 V296 | I96-F291 HydrophobicContact CG1-CZ 4.45Å; L100-F291 HydrophobicContact CD2-CE1 4.48Å; L100-F291 HydrophobicContact CG-CE1 4.37Å; F103-F291 HydrophobicContact CD2-CB 4.38Å; F103-F291 AromaticContact CD2-CD1 3.96Å; F103-F291 HydrophobicContact CD2-CD1 3.96Å; F103-F291 HydrophobicContact CD2-CG 4.17Å; F103-F291 HydrophobicContact CE2-CB 3.77Å; F103-F291 AromaticContact CE2-CD1 3.84Å; F103-F291 HydrophobicContact CE2-CD1 3.84Å; F103-F291 HydrophobicContact CE2-CD2 4.04Å; F103-F291 HydrophobicContact CE2-CE1 4.46Å; F103-F291 AromaticContact CE2-CG 3.59Å; F103-F291 HydrophobicContact CE2-CG 3.59Å; F103-F291 HydrophobicContact CZ-CB 4.4Å; F287-F291 VanDerWaalsContact O-CB 3.24Å; F287-F291 WeakPolarHBondContact O-CB 3.48Å; F287-F291 PolarHBondContact O-N 3.34Å; V289-F291 VanDerWaalsContact C-N 3.34Å; V289-F291 PolarHBondContact O-N 3.36Å; F291-L293 VanDerWaalsContact C-N 3.31Å; F291-L293 PolarHBondContact O-N 3.48Å; F291-F294 PolarHBondContact O-N 2.84Å; F291-C295 HydrophobicContact CD2-CB 3.86Å; F291-C295 HydrophobicContact CE1-CB 4.33Å; F291-C295 HydrophobicContact CE2-CB 3.57Å; F291-C295 HydrophobicContact CG-CB 4.37Å; F291-C295 HydrophobicContact CZ-CB 3.82Å; F291-C295 WeakPolarHBondContact O-CA 3.05Å; F291-C295 VanDerWaalsContact O-CB 3.3Å; F291-C295 WeakPolarHBondContact O-CB 3.44Å; F291-C295 PolarHBondContact O-N 2.95Å; F291-V296 HydrophobicContact CD1-CG2 4.31Å; F291-V296 HydrophobicContact CE1-CG2 4.1Å |
| 292 | T | 91.3 | Very high | 88.2 | Confident | 0 Ų | 0 | 50.5 Ų | 50.5 | 0% | 0 | 27% | 0.271 | C | S | . | . | H | α-helix | trans | -64 | -37.8 | 176.7 | -56.4 | 0 | 0 | 0 | 0 | 111.7 | R156 L159 V160 W226 S288 V289 L290 V296 | R156-T292 HydrophobicContact CG-CG2 4.34Å; L159-T292 HydrophobicContact CB-CG2 3.53Å; L159-T292 HydrophobicContact CD1-CG2 4.1Å; L159-T292 HydrophobicContact CG-CG2 4.48Å; V160-T292 HydrophobicContact CG2-CG2 3.7Å; W226-T292 WeakPolarHBondContact CH2-OG1 3.38Å; W226-T292 WeakPolarHBondContact CZ2-OG1 3.36Å; S288-T292 WeakPolarHBondContact O-CB 3.42Å; S288-T292 PolarHBondContact O-N 3.14Å; S288-T292 PolarHBondContact O-OG1 3.3Å; V289-T292 PolarHBondContact O-N 3.48Å; L290-T292 VanDerWaalsContact C-N 3.31Å; L290-T292 PolarHBondContact O-N 3.1Å; T292-V296 HydrophobicContact CG2-CB 4.19Å; T292-V296 HydrophobicContact CG2-CG2 4.27Å |
| 293 | L | 90.3 | Very high | 87.5 | Confident | 67 Ų | 67 | 53.8 Ų | 53.8 | 35% | 0.351 | 29% | 0.29 | S | S | . | . | H | α-helix | trans | -68 | -38.9 | 177.4 | -74.3 | 171.1 | 0 | 0 | 0 | 112.5 | R156 V160 V289 L290 F291 | R156-L293 PolarHBondContact NH2-O 3.47Å; V160-L293 HydrophobicContact CB-CD2 4.48Å; V160-L293 HydrophobicContact CG1-CD2 4.01Å; V160-L293 HydrophobicContact CG1-CG 4.4Å; V160-L293 HydrophobicContact CG2-CD2 3.63Å; V160-L293 HydrophobicContact CG2-CG 3.92Å; V289-L293 HydrophobicContact CG1-CD1 4.09Å; V289-L293 WeakPolarHBondContact O-CG 3.5Å; V289-L293 PolarHBondContact O-N 3.15Å; L290-L293 PolarHBondContact O-N 3.18Å; L290-L293 VanDerWaalsContact O-N 3.14Å; F291-L293 VanDerWaalsContact C-N 3.31Å; F291-L293 PolarHBondContact O-N 3.48Å |
| 294 | F | 88.4 | Confident | 86.3 | Confident | 171 Ų | 171 | 54.5 Ų | 54.5 | 75% | 0.75 | 29% | 0.289 | S | S | * | . | H | α-helix | trans | -96.4 | -32 | -174.3 | -65.4 | -65.8 | 0 | 0 | 0 | 114.5 | L290 F291 | L290-F294 HydrophobicContact CD2-CE2 4.24Å; L290-F294 WeakPolarHBondContact O-CD2 3.5Å; L290-F294 PolarHBondContact O-N 3Å; F291-F294 PolarHBondContact O-N 2.84Å |
| 295 | C | 87.3 | Confident | 85.1 | Confident | 59 Ų | 59 | 59 Ų | 59 | 40% | 0.399 | 31% | 0.311 | S | S | . | . | H | α-helix | trans | -110.8 | -26 | -167.7 | -59 | 0 | 0 | 0 | 0 | 114.2 | I96 F291 P297 | I96-C295 WeakPolarHBondContact CD1-O 3.43Å; F291-C295 HydrophobicContact CD2-CB 3.86Å; F291-C295 HydrophobicContact CE1-CB 4.33Å; F291-C295 HydrophobicContact CE2-CB 3.57Å; F291-C295 HydrophobicContact CG-CB 4.37Å; F291-C295 HydrophobicContact CZ-CB 3.82Å; F291-C295 WeakPolarHBondContact O-CA 3.05Å; F291-C295 VanDerWaalsContact O-CB 3.3Å; F291-C295 WeakPolarHBondContact O-CB 3.44Å; F291-C295 PolarHBondContact O-N 2.95Å; C295-P297 WeakPolarHBondContact O-CD 3.39Å |
| 296 | V | 87.4 | Confident | 84.2 | Confident | 4 Ų | 4 | 64.2 Ų | 64.2 | 2% | 0.024 | 34% | 0.336 | C | S | . | . | P | Polyproline II helix | trans | -88.9 | 117.3 | -175 | 179.5 | 0 | 0 | 0 | 0 | 110.2 | I96 L100 R156 L159 L233 F291 T292 | I96-V296 HydrophobicContact CG2-CG2 4.1Å; L100-V296 HydrophobicContact CD1-CG2 4.38Å; L100-V296 HydrophobicContact CD2-CG2 4.08Å; L100-V296 HydrophobicContact CG-CG2 4.43Å; R156-V296 VanDerWaalsContact CD-O 3.27Å; R156-V296 WeakPolarHBondContact CD-O 3.49Å; R156-V296 PolarHBondContact NE-O 3.43Å; L159-V296 HydrophobicContact CD1-CG1 4.44Å; L233-V296 HydrophobicContact CD1-CG1 3.9Å; F291-V296 HydrophobicContact CD1-CG2 4.31Å; F291-V296 HydrophobicContact CE1-CG2 4.1Å; T292-V296 HydrophobicContact CG2-CB 4.19Å; T292-V296 HydrophobicContact CG2-CG2 4.27Å |
| 297 | P | 83.5 | Confident | 83.3 | Confident | 17 Ų | 17 | 60.9 Ų | 60.9 | 11% | 0.11 | 32% | 0.318 | C | S | . | . | P | Polyproline II helix | trans | -75.5 | 156.1 | 175.2 | 32.3 | -35.4 | 0 | 0 | 0 | 111.4 | C295 T299 F311 | C295-P297 WeakPolarHBondContact O-CD 3.39Å; P297-T299 PolarHBondContact O-N 2.69Å; P297-F311 HydrophobicContact CG-CE1 4.19Å; P297-F311 HydrophobicContact CG-CE2 4.26Å; P297-F311 HydrophobicContact CG-CZ 3.56Å |
| 298 | E | 84.9 | Confident | 82 | Confident | 50 Ų | 50 | 56.4 Ų | 56.4 | 23% | 0.234 | 30% | 0.301 | C | S | . | . | P | Polyproline II helix | trans | -77 | 122.1 | 168.2 | -175.7 | 56.9 | -109.1 | 0 | 0 | 109.6 | G154 R155 R156 K300 K302 | G154-E298 WeakPolarHBondContact CA-OE1 3.2Å; R155-E298 PolarHBondContact N-OE1 3.38Å; R155-E298 PolarHBondContact N-OE2 3.42Å; R156-E298 WeakPolarHBondContact CB-OE2 3.39Å; R156-E298 PolarHBondContact N-OE2 3.3Å; R156-E298 VanDerWaalsContact N-OE2 3.16Å; E298-K300 HydrophobicContact CG-CB 4.1Å; E298-K300 WeakPolarHBondContact OE1-CB 3.44Å; E298-K300 PolarHBondContact OE1-N 3.42Å; E298-K302 WeakPolarHBondContact O-CD 3.36Å; E298-K302 WeakPolarHBondContact O-CE 3.38Å; E298-K302 PolarHBondContact O-NZ 3.45Å |
| 299 | T | 81.5 | Confident | 80.9 | Confident | 4 Ų | 4 | 57.8 Ų | 57.8 | 3% | 0.025 | 31% | 0.313 | C | S | . | . | trans | -98.9 | -11 | -179.3 | 57.4 | 0 | 0 | 0 | 0 | 113.1 | R155 L233 E236 I237 P297 G301 K302 I307 | R155-T299 WeakPolarHBondContact CD-OG1 3.42Å; L233-T299 HydrophobicContact CD2-CG2 3.49Å; L233-T299 VanDerWaalsContact CD2-CG2 3.49Å; L233-T299 WeakPolarHBondContact CD2-OG1 3.34Å; E236-T299 VanDerWaalsContact OE2-CB 3.24Å; E236-T299 WeakPolarHBondContact OE2-CB 3.49Å; E236-T299 PolarHBondContact OE2-OG1 2.99Å; I237-T299 HydrophobicContact CG2-CG2 4Å; P297-T299 PolarHBondContact O-N 2.69Å; T299-G301 PolarHBondContact O-N 2.91Å; T299-K302 PolarHBondContact O-N 2.98Å; T299-I307 HydrophobicContact CG2-CD1 3.94Å | ||
| 300 | K | 78.2 | Confident | 80.1 | Confident | 94 Ų | 94 | 62.2 Ų | 62.2 | 41% | 0.409 | 33% | 0.332 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -53.8 | 122.6 | 179.9 | -178.9 | -173.2 | 169.5 | -170.6 | 0 | 112 | D151 R152 E298 K302 | D151-K300 WeakPolarHBondContact O-CE 3.31Å; R152-K300 PolarHBondContact O-NZ 2.7Å; E298-K300 HydrophobicContact CG-CB 4.1Å; E298-K300 WeakPolarHBondContact OE1-CB 3.44Å; E298-K300 PolarHBondContact OE1-N 3.42Å; K300-K302 PolarHBondContact O-N 2.8Å |
| 301 | G | 69.3 | Low | 79.2 | Confident | 81 Ų | 81 | 59.1 Ų | 59.1 | 84% | 0.835 | 32% | 0.315 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 70.7 | 12.4 | 172.5 | 0 | 0 | 0 | 0 | 0 | 114.9 | T299 | T299-G301 PolarHBondContact O-N 2.91Š|
| 302 | K | 76.6 | Confident | 78.1 | Confident | 89 Ų | 89 | 61.2 Ų | 61.2 | 39% | 0.387 | 33% | 0.326 | S | S | . | . | trans | -101.3 | 142.6 | 177.1 | -65.5 | -177.6 | -178.1 | 165.4 | 0 | 111 | E298 T299 K300 Q306 I307 | E298-K302 WeakPolarHBondContact O-CD 3.36Å; E298-K302 WeakPolarHBondContact O-CE 3.38Å; E298-K302 PolarHBondContact O-NZ 3.45Å; T299-K302 PolarHBondContact O-N 2.98Å; K300-K302 PolarHBondContact O-N 2.8Å; K302-Q306 HydrophobicContact CB-CB 4.45Å; K302-I307 HydrophobicContact CB-CD1 4.15Å; K302-I307 HydrophobicContact CB-CG1 3.84Å; K302-I307 HydrophobicContact CD-CG1 4.35Å | ||
| 303 | T | 76.1 | Confident | 76.8 | Confident | 73 Ų | 73 | 64.5 Ų | 64.5 | 45% | 0.448 | 36% | 0.359 | S | S | . | . | trans | -74.1 | 157.1 | 171.4 | 68.3 | 0 | 0 | 0 | 0 | 110.5 | E305 Q306 I307 | T303-E305 PolarHBondContact O-N 3.31Å; T303-Q306 PolarHBondContact O-N 3.45Å; T303-Q306 VanDerWaalsContact O-N 3.12Å; T303-Q306 VanDerWaalsContact OG1-CG 3.26Å; T303-Q306 WeakPolarHBondContact OG1-CG 3.32Å; T303-Q306 PolarHBondContact OG1-N 2.89Å; T303-I307 WeakPolarHBondContact O-CG1 3.41Å; T303-I307 PolarHBondContact O-N 3.24Å | ||
| 304 | L | 67.9 | Low | 74.9 | Confident | 51 Ų | 51 | 73 Ų | 73 | 27% | 0.267 | 39% | 0.387 | S | S | . | . | H | α-helix | trans | -56.9 | -36.3 | 176.4 | -174.3 | 65.9 | 0 | 0 | 0 | 111.9 | E236 L240 I307 T308 | E236-L304 WeakPolarHBondContact O-CD1 3.41Å; L240-L304 HydrophobicContact CD1-CD2 4.34Å; L240-L304 HydrophobicContact CD2-CD2 3.85Å; L240-L304 HydrophobicContact CG-CD2 3.64Å; L304-I307 PolarHBondContact O-N 3.32Å; L304-T308 WeakPolarHBondContact O-CB 3.42Å; L304-T308 PolarHBondContact O-N 3.3Å; L304-T308 PolarHBondContact O-OG1 3Å |
| 305 | E | 68.5 | Low | 74.2 | Confident | 159 Ų | 159 | 68.2 Ų | 68.2 | 74% | 0.743 | 37% | 0.369 | S | S | * | . | H | α-helix | trans | -65.9 | -42.9 | 176.6 | -65.3 | 178.3 | 175.9 | 0 | 0 | 112.1 | T303 I307 T308 A309 | T303-E305 PolarHBondContact O-N 3.31Å; E305-I307 VanDerWaalsContact C-N 3.32Å; E305-I307 PolarHBondContact O-N 3.48Å; E305-T308 PolarHBondContact O-N 2.92Å; E305-A309 WeakPolarHBondContact O-CB 3.4Å; E305-A309 PolarHBondContact O-N 2.72Å |
| 306 | Q | 72.6 | Confident | 73.5 | Confident | 109 Ų | 109 | 68.6 Ų | 68.6 | 51% | 0.509 | 37% | 0.367 | S | S | . | . | H | α-helix | trans | -64.2 | -37.6 | 175.7 | -73.2 | 169.3 | -14 | 0 | 0 | 112 | K302 T303 H310 | K302-Q306 HydrophobicContact CB-CB 4.45Å; T303-Q306 PolarHBondContact O-N 3.45Å; T303-Q306 VanDerWaalsContact O-N 3.12Å; T303-Q306 VanDerWaalsContact OG1-CG 3.26Å; T303-Q306 WeakPolarHBondContact OG1-CG 3.32Å; T303-Q306 PolarHBondContact OG1-N 2.89Å; Q306-H310 WeakPolarHBondContact O-CB 3.47Å; Q306-H310 PolarHBondContact O-N 2.99Å |
| 307 | I | 75.6 | Confident | 72.7 | Confident | 7 Ų | 7 | 72.2 Ų | 72.2 | 4% | 0.036 | 39% | 0.386 | C | S | . | . | H | α-helix | trans | -67.2 | -43.5 | 175.8 | -65.8 | 168.3 | 0 | 0 | 0 | 110 | T299 K302 T303 L304 E305 H310 F311 | T299-I307 HydrophobicContact CG2-CD1 3.94Å; K302-I307 HydrophobicContact CB-CD1 4.15Å; K302-I307 HydrophobicContact CB-CG1 3.84Å; K302-I307 HydrophobicContact CD-CG1 4.35Å; T303-I307 WeakPolarHBondContact O-CG1 3.41Å; T303-I307 PolarHBondContact O-N 3.24Å; L304-I307 PolarHBondContact O-N 3.32Å; E305-I307 VanDerWaalsContact C-N 3.32Å; E305-I307 PolarHBondContact O-N 3.48Å; I307-H310 WeakPolarHBondContact O-CB 3.1Å; I307-H310 PolarHBondContact O-N 3.46Å; I307-F311 HydrophobicContact CG2-CD2 3.77Å; I307-F311 HydrophobicContact CG2-CE2 3.46Å; I307-F311 VanDerWaalsContact CG2-CE2 3.46Å; I307-F311 WeakPolarHBondContact O-CD2 3.4Å; I307-F311 PolarHBondContact O-N 3.06Å; I307-F311 VanDerWaalsContact O-N 3.11Å |
| 308 | T | 68.8 | Low | 72.1 | Confident | 25 Ų | 25 | 75.5 Ų | 75.5 | 15% | 0.153 | 40% | 0.402 | C | S | . | . | H | α-helix | trans | -63.3 | -46.1 | 177.9 | -52.3 | 0 | 0 | 0 | 0 | 110.9 | L304 E305 H310 F311 E312 | L304-T308 WeakPolarHBondContact O-CB 3.42Å; L304-T308 PolarHBondContact O-N 3.3Å; L304-T308 PolarHBondContact O-OG1 3Å; E305-T308 PolarHBondContact O-N 2.92Å; T308-H310 VanDerWaalsContact C-N 3.33Å; T308-H310 PolarHBondContact O-N 2.8Å; T308-F311 PolarHBondContact O-N 3.09Å; T308-F311 VanDerWaalsContact O-N 3.13Å; T308-E312 WeakPolarHBondContact O-CG 3.23Å; T308-E312 PolarHBondContact O-N 3.41Å |
| 309 | A | 68.6 | Low | 71.3 | Confident | 31 Ų | 31 | 77.1 Ų | 77.1 | 26% | 0.256 | 41% | 0.413 | S | S | . | . | H | α-helix | trans | -58.8 | -43.1 | 175.4 | 0 | 0 | 0 | 0 | 0 | 112.1 | E305 F311 E312 G313 R314 | E305-A309 WeakPolarHBondContact O-CB 3.4Å; E305-A309 PolarHBondContact O-N 2.72Å; A309-F311 VanDerWaalsContact C-N 3.3Å; A309-F311 PolarHBondContact O-N 3.23Å; A309-E312 CarbonylContact O-C 3.58Å; A309-E312 PolarHBondContact O-N 2.75Å; A309-E312 VanDerWaalsContact O-N 3.13Å; A309-G313 PolarHBondContact O-N 3.07Å; A309-R314 CarbonylContact C-O 3.56Å; A309-R314 HydrophobicContact CB-CB 4.38Å; A309-R314 PolarHBondContact O-N 2.89Å |
| 310 | H | 76.6 | Confident | 70.6 | Confident | 107 Ų | 107 | 81.9 Ų | 81.9 | 50% | 0.495 | 44% | 0.439 | S | S | . | . | H | α-helix | trans | -58.4 | -40.5 | 175.4 | -179.5 | 68.2 | 0 | 0 | 0 | 112.6 | Q306 I307 T308 G313 | Q306-H310 WeakPolarHBondContact O-CB 3.47Å; Q306-H310 PolarHBondContact O-N 2.99Å; I307-H310 WeakPolarHBondContact O-CB 3.1Å; I307-H310 PolarHBondContact O-N 3.46Å; T308-H310 VanDerWaalsContact C-N 3.33Å; T308-H310 PolarHBondContact O-N 2.8Å; H310-G313 PolarHBondContact O-N 2.98Å |
| 311 | F | 75.9 | Confident | 70.1 | Confident | 12 Ų | 12 | 81.1 Ų | 81.1 | 5% | 0.053 | 44% | 0.441 | C | S | . | . | H | α-helix | trans | -73.2 | -32.8 | 176.5 | -74.3 | -63.5 | 0 | 0 | 0 | 113.2 | K92 P93 I96 I237 P297 I307 T308 A309 G313 | K92-F311 HydrophobicContact CB-CD1 3.69Å; K92-F311 HydrophobicContact CB-CE1 4.16Å; K92-F311 HydrophobicContact CB-CG 4.47Å; K92-F311 HydrophobicContact CD-CD1 4.13Å; K92-F311 PolarHBondContact NZ-O 2.84Å; P93-F311 HydrophobicContact CB-CE2 4.3Å; P93-F311 HydrophobicContact CG-CB 4.39Å; P93-F311 HydrophobicContact CG-CD1 4.29Å; P93-F311 HydrophobicContact CG-CD2 3.56Å; P93-F311 HydrophobicContact CG-CE1 4.43Å; P93-F311 HydrophobicContact CG-CE2 3.71Å; P93-F311 HydrophobicContact CG-CG 3.85Å; P93-F311 HydrophobicContact CG-CZ 4.13Å; I96-F311 HydrophobicContact CD1-CE1 3.56Å; I96-F311 HydrophobicContact CD1-CZ 3.77Å; I237-F311 HydrophobicContact CB-CE2 4.38Å; P297-F311 HydrophobicContact CG-CE1 4.19Å; P297-F311 HydrophobicContact CG-CE2 4.26Å; P297-F311 HydrophobicContact CG-CZ 3.56Å; I307-F311 HydrophobicContact CG2-CD2 3.77Å; I307-F311 HydrophobicContact CG2-CE2 3.46Å; I307-F311 VanDerWaalsContact CG2-CE2 3.46Å; I307-F311 WeakPolarHBondContact O-CD2 3.4Å; I307-F311 PolarHBondContact O-N 3.06Å; I307-F311 VanDerWaalsContact O-N 3.11Å; T308-F311 PolarHBondContact O-N 3.09Å; T308-F311 VanDerWaalsContact O-N 3.13Å; A309-F311 VanDerWaalsContact C-N 3.3Å; A309-F311 PolarHBondContact O-N 3.23Å; F311-G313 PolarHBondContact O-N 3.24Å |
| 312 | E | 70.1 | Confident | 70.2 | Confident | 76 Ų | 76 | 81.1 Ų | 81.1 | 36% | 0.355 | 41% | 0.41 | S | S | . | . | H | α-helix | trans | -71.2 | -14.9 | 173 | -71.3 | -176.7 | -179.7 | 0 | 0 | 113.5 | T308 A309 R314 | T308-E312 WeakPolarHBondContact O-CG 3.23Å; T308-E312 PolarHBondContact O-N 3.41Å; A309-E312 CarbonylContact O-C 3.58Å; A309-E312 PolarHBondContact O-N 2.75Å; A309-E312 VanDerWaalsContact O-N 3.13Å; E312-R314 HydrophobicContact CB-CG 4.44Å; E312-R314 IonicContact OE2-CZ 3.67Å; E312-R314 IonicContact OE2-NE 3.95Å; E312-R314 IonicContact OE2-NH1 2.93Å; E312-R314 PolarHBondContact OE2-NH1 2.92Å |
| 313 | G | 64.3 | Low | 69.6 | Low | 68 Ų | 68 | 80.4 Ų | 80.4 | 70% | 0.701 | 41% | 0.412 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 78.5 | 27.1 | -177.6 | 0 | 0 | 0 | 0 | 0 | 113.4 | A309 H310 F311 | A309-G313 PolarHBondContact O-N 3.07Å; H310-G313 PolarHBondContact O-N 2.98Å; F311-G313 PolarHBondContact O-N 3.24Å |
| 314 | R | 50.5 | Low | 69 | Low | 247 Ų | 247 | 81.1 Ų | 81.1 | 93% | 0.932 | 41% | 0.409 | S | S | * | . | trans | -104.9 | 0 | 176.3 | -69.1 | 178.4 | 173.4 | 161 | -11.4 | 111.4 | A309 E312 | A309-R314 CarbonylContact C-O 3.56Å; A309-R314 HydrophobicContact CB-CB 4.38Å; A309-R314 PolarHBondContact O-N 2.89Å; E312-R314 HydrophobicContact CB-CG 4.44Å; E312-R314 IonicContact OE2-CZ 3.67Å; E312-R314 IonicContact OE2-NE 3.95Å; E312-R314 IonicContact OE2-NH1 2.93Å; E312-R314 PolarHBondContact OE2-NH1 2.92Å |
Retrieved 314 of 314 residues in 175.4 ms
(Link to these results)