| 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 | 54.2 | Low | 64.1 | Low | 203 Ų | 203 | 127.3 Ų | 127.3 | 100% | 1 | 60% | 0.604 | S | S | * | * | 0 | -50.1 | 0 | -78 | -175.4 | -177.4 | 0 | 0 | 113.2 | H3 F4 Q5 | M1-H3 PolarHBondContact O-N 3.38Å; M1-F4 PolarHBondContact O-N 3.18Å; M1-F4 VanDerWaalsContact O-N 3.09Å; M1-Q5 PolarHBondContact O-N 2.89Å; M1-Q5 VanDerWaalsContact O-N 3.09Å | |||
| 2 | L | 64.3 | Low | 64.3 | Low | 128 Ų | 128 | 119.9 Ų | 119.9 | 67% | 0.67 | 58% | 0.576 | S | S | * | * | H | α-helix | trans | -54.2 | -48.1 | -179.5 | -159.2 | 85.9 | 0 | 0 | 0 | 113.3 | F4 Q5 V6 | L2-F4 VanDerWaalsContact C-N 3.29Å; L2-F4 PolarHBondContact O-N 2.98Å; L2-Q5 PolarHBondContact O-N 3.45Å; L2-V6 HydrophobicContact CG-CG2 4.44Å; L2-V6 WeakPolarHBondContact O-CB 3.37Å; L2-V6 VanDerWaalsContact O-CG2 3.25Å; L2-V6 WeakPolarHBondContact O-CG2 3.29Å; L2-V6 PolarHBondContact O-N 3.35Å |
| 3 | H | 64.8 | Low | 65.1 | Low | 169 Ų | 169 | 114 Ų | 114 | 78% | 0.782 | 55% | 0.55 | S | S | * | . | H | α-helix | trans | -57.9 | -37.2 | 176.9 | -80.8 | -82.8 | 0 | 0 | 0 | 113.7 | M1 A7 | M1-H3 PolarHBondContact O-N 3.38Å; H3-A7 VanDerWaalsContact O-CB 3.26Å; H3-A7 WeakPolarHBondContact O-CB 3.35Å; H3-A7 PolarHBondContact O-N 3.24Å |
| 4 | F | 66.2 | Low | 66.3 | Low | 148 Ų | 148 | 108.1 Ų | 108.1 | 65% | 0.649 | 53% | 0.533 | S | S | * | . | H | α-helix | trans | -71 | -43.6 | 178.7 | -175.1 | -94.2 | 0 | 0 | 0 | 111.3 | M1 L2 V6 A7 Q8 | M1-F4 PolarHBondContact O-N 3.18Å; M1-F4 VanDerWaalsContact O-N 3.09Å; L2-F4 VanDerWaalsContact C-N 3.29Å; L2-F4 PolarHBondContact O-N 2.98Å; F4-V6 VanDerWaalsContact C-N 3.35Å; F4-V6 PolarHBondContact O-N 3.01Å; F4-A7 PolarHBondContact O-N 3.16Å; F4-Q8 WeakPolarHBondContact O-CB 3.32Å; F4-Q8 PolarHBondContact O-N 3.34Å |
| 5 | Q | 67.7 | Low | 67.5 | Low | 123 Ų | 123 | 103 Ų | 103 | 58% | 0.575 | 51% | 0.509 | S | S | * | . | H | α-helix | trans | -62.6 | -41.9 | 175.4 | -71.6 | 176.7 | -23.1 | 0 | 0 | 111.7 | M1 L2 Q8 W9 | M1-Q5 PolarHBondContact O-N 2.89Å; M1-Q5 VanDerWaalsContact O-N 3.09Å; L2-Q5 PolarHBondContact O-N 3.45Å; Q5-Q8 PolarHBondContact O-N 3.34Å; Q5-W9 WeakPolarHBondContact O-CB 3.25Å; Q5-W9 PolarHBondContact O-N 2.98Å |
| 6 | V | 67.7 | Low | 68.3 | Low | 71 Ų | 71 | 98.3 Ų | 98.3 | 43% | 0.43 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -65.1 | -45.3 | 176.6 | 172.3 | 0 | 0 | 0 | 0 | 111 | L2 F4 Q8 W9 L10 | L2-V6 HydrophobicContact CG-CG2 4.44Å; L2-V6 WeakPolarHBondContact O-CB 3.37Å; L2-V6 VanDerWaalsContact O-CG2 3.25Å; L2-V6 WeakPolarHBondContact O-CG2 3.29Å; L2-V6 PolarHBondContact O-N 3.35Å; F4-V6 VanDerWaalsContact C-N 3.35Å; F4-V6 PolarHBondContact O-N 3.01Å; V6-Q8 PolarHBondContact O-N 2.92Å; V6-W9 PolarHBondContact O-N 2.87Å; V6-L10 HydrophobicContact CG1-CD1 3.79Å; V6-L10 WeakPolarHBondContact O-CB 3.35Å; V6-L10 WeakPolarHBondContact O-CG 3.45Å; V6-L10 PolarHBondContact O-N 3.48Å |
| 7 | A | 62.6 | Low | 69.2 | Low | 49 Ų | 49 | 93.3 Ų | 93.3 | 41% | 0.405 | 46% | 0.464 | S | S | . | . | H | α-helix | trans | -64 | -40 | 177.8 | 0 | 0 | 0 | 0 | 0 | 112.6 | H3 F4 L10 R11 | H3-A7 VanDerWaalsContact O-CB 3.26Å; H3-A7 WeakPolarHBondContact O-CB 3.35Å; H3-A7 PolarHBondContact O-N 3.24Å; F4-A7 PolarHBondContact O-N 3.16Å; A7-L10 PolarHBondContact O-N 3.49Å; A7-R11 PolarHBondContact O-N 3.24Å |
| 8 | Q | 63.5 | Low | 70.2 | Confident | 102 Ų | 102 | 90.3 Ų | 90.3 | 48% | 0.477 | 46% | 0.456 | S | S | . | . | H | α-helix | trans | -66.2 | -42.7 | 175.6 | -172.4 | 174.8 | 2.9 | 0 | 0 | 111.3 | F4 Q5 V6 R11 S12 | F4-Q8 WeakPolarHBondContact O-CB 3.32Å; F4-Q8 PolarHBondContact O-N 3.34Å; Q5-Q8 PolarHBondContact O-N 3.34Å; V6-Q8 PolarHBondContact O-N 2.92Å; Q8-R11 PolarHBondContact O-N 3.4Å; Q8-S12 PolarHBondContact O-N 2.77Å; Q8-S12 VanDerWaalsContact O-N 3.12Å; Q8-S12 PolarHBondContact O-OG 3.09Å |
| 9 | W | 68.4 | Low | 71 | Confident | 110 Ų | 110 | 85.5 Ų | 85.5 | 42% | 0.417 | 43% | 0.432 | S | S | . | . | H | α-helix | trans | -64.6 | -40.1 | 176 | -176 | 90.2 | 0 | 0 | 0 | 112.3 | Q5 V6 R11 S12 N13 L16 A17 | Q5-W9 WeakPolarHBondContact O-CB 3.25Å; Q5-W9 PolarHBondContact O-N 2.98Å; V6-W9 PolarHBondContact O-N 2.87Å; W9-R11 VanDerWaalsContact C-N 3.35Å; W9-S12 PolarHBondContact O-N 3.37Å; W9-S12 PolarHBondContact O-OG 3.24Å; W9-N13 VanDerWaalsContact CD1-ND2 3.31Å; W9-N13 HydrophobicContact CD2-CB 4.18Å; W9-N13 HydrophobicContact CE3-CB 4.39Å; W9-N13 HydrophobicContact CH2-CB 4.09Å; W9-N13 HydrophobicContact CZ2-CB 3.86Å; W9-N13 HydrophobicContact CZ3-CB 4.35Å; W9-N13 PolarHBondContact NE1-ND2 3.02Å; W9-N13 VanDerWaalsContact NE1-ND2 3.16Å; W9-N13 WeakPolarHBondContact O-CB 3.44Å; W9-N13 PolarHBondContact O-N 3.09Å; W9-N13 PolarHBondContact O-ND2 3.49Å; W9-N13 VanDerWaalsContact O-ND2 3.08Å; W9-L16 HydrophobicContact CZ2-CD2 4.34Å; W9-A17 HydrophobicContact CH2-CB 4.49Å; W9-A17 HydrophobicContact CZ3-CB 4.02Å |
| 10 | L | 65.1 | Low | 71.8 | Confident | 79 Ų | 79 | 85 Ų | 85 | 41% | 0.414 | 43% | 0.43 | S | S | . | . | H | α-helix | trans | -62.4 | -39.5 | 173.9 | -86.4 | 158.6 | 0 | 0 | 0 | 111.8 | V6 A7 S12 G14 A17 | V6-L10 HydrophobicContact CG1-CD1 3.79Å; V6-L10 WeakPolarHBondContact O-CB 3.35Å; V6-L10 WeakPolarHBondContact O-CG 3.45Å; V6-L10 PolarHBondContact O-N 3.48Å; A7-L10 PolarHBondContact O-N 3.49Å; L10-S12 VanDerWaalsContact C-N 3.33Å; L10-S12 PolarHBondContact O-N 3.33Å; L10-G14 WeakPolarHBondContact O-CA 3.37Å; L10-G14 PolarHBondContact O-N 3.39Å; L10-A17 HydrophobicContact CD2-CB 3.69Å |
| 11 | R | 60.6 | Low | 72.7 | Confident | 218 Ų | 218 | 84.5 Ų | 84.5 | 82% | 0.823 | 44% | 0.435 | S | S | * | . | H | α-helix | trans | -64.6 | -36.9 | 174.1 | -81.1 | -176.6 | 177.6 | 167.8 | -0.2 | 112.4 | A7 Q8 W9 | A7-R11 PolarHBondContact O-N 3.24Å; Q8-R11 PolarHBondContact O-N 3.4Å; W9-R11 VanDerWaalsContact C-N 3.35Å |
| 12 | S | 65.9 | Low | 74.5 | Confident | 39 Ų | 39 | 75 Ų | 75 | 27% | 0.273 | 39% | 0.389 | S | S | . | . | H | α-helix | trans | -82.4 | -24.6 | 179.4 | 60.4 | 0 | 0 | 0 | 0 | 114.3 | Q8 W9 L10 | Q8-S12 PolarHBondContact O-N 2.77Å; Q8-S12 VanDerWaalsContact O-N 3.12Å; Q8-S12 PolarHBondContact O-OG 3.09Å; W9-S12 PolarHBondContact O-N 3.37Å; W9-S12 PolarHBondContact O-OG 3.24Å; L10-S12 VanDerWaalsContact C-N 3.33Å; L10-S12 PolarHBondContact O-N 3.33Å |
| 13 | N | 75.6 | Confident | 75.6 | Confident | 43 Ų | 43 | 69.7 Ų | 69.7 | 23% | 0.23 | 36% | 0.361 | C | S | . | . | H | α-helix | trans | -126.1 | 25.8 | -174.3 | -58.8 | -80.8 | 0 | 0 | 0 | 112.6 | W9 L15 L16 A17 | W9-N13 VanDerWaalsContact CD1-ND2 3.31Å; W9-N13 HydrophobicContact CD2-CB 4.18Å; W9-N13 HydrophobicContact CE3-CB 4.39Å; W9-N13 HydrophobicContact CH2-CB 4.09Å; W9-N13 HydrophobicContact CZ2-CB 3.86Å; W9-N13 HydrophobicContact CZ3-CB 4.35Å; W9-N13 PolarHBondContact NE1-ND2 3.02Å; W9-N13 VanDerWaalsContact NE1-ND2 3.16Å; W9-N13 WeakPolarHBondContact O-CB 3.44Å; W9-N13 PolarHBondContact O-N 3.09Å; W9-N13 PolarHBondContact O-ND2 3.49Å; W9-N13 VanDerWaalsContact O-ND2 3.08Å; N13-L15 VanDerWaalsContact C-N 3.27Å; N13-L15 PolarHBondContact O-N 3.36Å; N13-L16 HydrophobicContact CB-CB 4.33Å; N13-L16 WeakPolarHBondContact O-CB 3.46Å; N13-L16 PolarHBondContact O-N 2.92Å; N13-A17 PolarHBondContact O-N 3.37Å |
| 14 | G | 81.9 | Confident | 76.8 | Confident | 31 Ų | 31 | 66.1 Ų | 66.1 | 32% | 0.32 | 35% | 0.351 | S | S | . | . | H | α-helix | trans | -56.5 | -40.6 | -171 | 0 | 0 | 0 | 0 | 0 | 113.2 | L10 A17 A18 | L10-G14 WeakPolarHBondContact O-CA 3.37Å; L10-G14 PolarHBondContact O-N 3.39Å; G14-A17 PolarHBondContact O-N 3.44Å; G14-A18 VanDerWaalsContact O-CB 3.29Å; G14-A18 WeakPolarHBondContact O-CB 3.12Å; G14-A18 PolarHBondContact O-N 3.11Å |
| 15 | L | 83.2 | Confident | 78.1 | Confident | 32 Ų | 32 | 63.1 Ų | 63.1 | 17% | 0.168 | 34% | 0.342 | C | S | . | . | H | α-helix | trans | -61.9 | -43.8 | 175.4 | 177.4 | 66.1 | 0 | 0 | 0 | 112.4 | N13 A18 T19 I233 W234 P237 | N13-L15 VanDerWaalsContact C-N 3.27Å; N13-L15 PolarHBondContact O-N 3.36Å; L15-A18 PolarHBondContact O-N 3.16Å; L15-T19 PolarHBondContact O-N 3.02Å; L15-T19 PolarHBondContact O-OG1 2.84Å; L15-I233 HydrophobicContact CD1-CG2 4.44Å; L15-I233 HydrophobicContact CD2-CG2 3.46Å; L15-I233 VanDerWaalsContact CD2-CG2 3.46Å; L15-I233 HydrophobicContact CG-CG2 4.45Å; L15-W234 HydrophobicContact CB-CH2 4.47Å; L15-W234 HydrophobicContact CB-CZ3 4.5Å; L15-W234 HydrophobicContact CD1-CD2 4.38Å; L15-W234 HydrophobicContact CD1-CE3 4.19Å; L15-P237 HydrophobicContact CD1-CG 4.14Å |
| 16 | L | 80.5 | Confident | 79.3 | Confident | 27 Ų | 27 | 57.3 Ų | 57.3 | 14% | 0.141 | 31% | 0.314 | C | S | . | . | H | α-helix | trans | -66.3 | -42.8 | 178.5 | 174.7 | 64.1 | 0 | 0 | 0 | 111.4 | W9 N13 A18 T19 L20 I300 L304 | W9-L16 HydrophobicContact CZ2-CD2 4.34Å; N13-L16 HydrophobicContact CB-CB 4.33Å; N13-L16 WeakPolarHBondContact O-CB 3.46Å; N13-L16 PolarHBondContact O-N 2.92Å; L16-A18 VanDerWaalsContact C-N 3.29Å; L16-A18 PolarHBondContact O-N 3.32Å; L16-T19 WeakPolarHBondContact CA-OG1 3.26Å; L16-T19 PolarHBondContact O-N 2.86Å; L16-T19 PolarHBondContact O-OG1 3.21Å; L16-L20 HydrophobicContact CD1-CD1 4.28Å; L16-L20 HydrophobicContact CD1-CG 4.36Å; L16-L20 HydrophobicContact CG-CD1 4.18Å; L16-L20 WeakPolarHBondContact O-CB 3.39Å; L16-L20 WeakPolarHBondContact O-CG 3.39Å; L16-L20 PolarHBondContact O-N 2.84Å; L16-I300 HydrophobicContact CD1-CB 3.67Å; L16-I300 HydrophobicContact CD1-CG2 3.46Å; L16-I300 VanDerWaalsContact CD1-CG2 3.46Å; L16-I300 HydrophobicContact CD2-CD1 4.47Å; L16-L304 HydrophobicContact CD1-CD1 4.44Å |
| 17 | A | 83.8 | Confident | 80.3 | Confident | 14 Ų | 14 | 57.8 Ų | 57.8 | 12% | 0.116 | 31% | 0.314 | C | S | . | . | H | α-helix | trans | -62.2 | -41.4 | 175.5 | 0 | 0 | 0 | 0 | 0 | 110.9 | W9 L10 N13 G14 L20 S21 | W9-A17 HydrophobicContact CH2-CB 4.49Å; W9-A17 HydrophobicContact CZ3-CB 4.02Å; L10-A17 HydrophobicContact CD2-CB 3.69Å; N13-A17 PolarHBondContact O-N 3.37Å; G14-A17 PolarHBondContact O-N 3.44Å; A17-L20 PolarHBondContact O-N 2.81Å; A17-S21 WeakPolarHBondContact O-CB 3.5Å; A17-S21 PolarHBondContact O-N 3.3Å; A17-S21 PolarHBondContact O-OG 3.28Å |
| 18 | A | 88.4 | Confident | 81.7 | Confident | 39 Ų | 39 | 59.8 Ų | 59.8 | 32% | 0.322 | 32% | 0.321 | S | S | . | . | H | α-helix | trans | -64.1 | -42.2 | 176.5 | 0 | 0 | 0 | 0 | 0 | 112.3 | G14 L15 L16 S21 A22 P237 | G14-A18 VanDerWaalsContact O-CB 3.29Å; G14-A18 WeakPolarHBondContact O-CB 3.12Å; G14-A18 PolarHBondContact O-N 3.11Å; L15-A18 PolarHBondContact O-N 3.16Å; L16-A18 VanDerWaalsContact C-N 3.29Å; L16-A18 PolarHBondContact O-N 3.32Å; A18-S21 PolarHBondContact O-N 3.37Å; A18-A22 VanDerWaalsContact O-CB 3.23Å; A18-A22 WeakPolarHBondContact O-CB 3.31Å; A18-A22 PolarHBondContact O-N 3.47Å; A18-P237 HydrophobicContact CB-CB 4.08Å; A18-P237 HydrophobicContact CB-CG 3.79Å |
| 19 | T | 85.4 | Confident | 83.1 | Confident | 0 Ų | 0 | 58.2 Ų | 58.2 | 0% | 0 | 32% | 0.315 | C | S | . | . | H | α-helix | trans | -70.5 | -37.1 | 177.3 | 50.2 | 0 | 0 | 0 | 0 | 113.3 | L15 L16 S21 A22 V23 S236 P237 I240 Q301 L304 | L15-T19 PolarHBondContact O-N 3.02Å; L15-T19 PolarHBondContact O-OG1 2.84Å; L16-T19 WeakPolarHBondContact CA-OG1 3.26Å; L16-T19 PolarHBondContact O-N 2.86Å; L16-T19 PolarHBondContact O-OG1 3.21Å; T19-S21 VanDerWaalsContact C-N 3.33Å; T19-A22 WeakPolarHBondContact O-CB 3.27Å; T19-A22 PolarHBondContact O-N 2.74Å; T19-V23 PolarHBondContact O-N 3.34Å; T19-S236 WeakPolarHBondContact CG2-OG 3.48Å; T19-P237 HydrophobicContact CG2-CB 4.48Å; T19-P237 HydrophobicContact CG2-CG 3.89Å; T19-I240 HydrophobicContact CG2-CD1 4.14Å; T19-Q301 VanDerWaalsContact CG2-OE1 3.27Å; T19-Q301 PolarHBondContact OG1-OE1 2.99Å; T19-L304 WeakPolarHBondContact OG1-CD1 3.49Å |
| 20 | L | 86.6 | Confident | 84.1 | Confident | 74 Ų | 74 | 53 Ų | 53 | 39% | 0.387 | 30% | 0.295 | S | S | . | . | H | α-helix | trans | -61.5 | -45.2 | 172 | -75.5 | 169.2 | 0 | 0 | 0 | 111.2 | L16 A17 A22 V23 V24 I300 L304 | L16-L20 HydrophobicContact CD1-CD1 4.28Å; L16-L20 HydrophobicContact CD1-CG 4.36Å; L16-L20 HydrophobicContact CG-CD1 4.18Å; L16-L20 WeakPolarHBondContact O-CB 3.39Å; L16-L20 WeakPolarHBondContact O-CG 3.39Å; L16-L20 PolarHBondContact O-N 2.84Å; A17-L20 PolarHBondContact O-N 2.81Å; L20-A22 VanDerWaalsContact C-N 3.3Å; L20-A22 PolarHBondContact O-N 2.85Å; L20-V23 PolarHBondContact O-N 3.16Å; L20-V24 PolarHBondContact O-N 3.08Å; L20-I300 HydrophobicContact CD2-CG2 4.23Å; L20-L304 HydrophobicContact CD2-CD1 3.71Å; L20-L304 HydrophobicContact CD2-CD2 4.06Å; L20-L304 HydrophobicContact CD2-CG 4.46Å; L20-L304 HydrophobicContact CG-CD1 3.87Å |
| 21 | S | 90.3 | Very high | 85.2 | Confident | 76 Ų | 76 | 52.4 Ų | 52.4 | 53% | 0.531 | 30% | 0.295 | S | S | . | . | H | α-helix | trans | -64 | -38.2 | 176.6 | -54.4 | 0 | 0 | 0 | 0 | 111.2 | A17 A18 T19 V24 L25 | A17-S21 WeakPolarHBondContact O-CB 3.5Å; A17-S21 PolarHBondContact O-N 3.3Å; A17-S21 PolarHBondContact O-OG 3.28Å; A18-S21 PolarHBondContact O-N 3.37Å; T19-S21 VanDerWaalsContact C-N 3.33Å; S21-V24 PolarHBondContact O-N 2.99Å; S21-L25 WeakPolarHBondContact O-CB 3.45Å; S21-L25 PolarHBondContact O-N 2.89Å |
| 22 | A | 91 | Very high | 86.5 | Confident | 4 Ų | 4 | 44 Ų | 44 | 3% | 0.033 | 28% | 0.277 | C | S | . | . | H | α-helix | trans | -62 | -41 | 176.4 | 0 | 0 | 0 | 0 | 0 | 113 | A18 T19 L20 G26 P237 I240 V241 | A18-A22 VanDerWaalsContact O-CB 3.23Å; A18-A22 WeakPolarHBondContact O-CB 3.31Å; A18-A22 PolarHBondContact O-N 3.47Å; T19-A22 WeakPolarHBondContact O-CB 3.27Å; T19-A22 PolarHBondContact O-N 2.74Å; L20-A22 VanDerWaalsContact C-N 3.3Å; L20-A22 PolarHBondContact O-N 2.85Å; A22-G26 PolarHBondContact O-N 2.92Å; A22-P237 HydrophobicContact CB-CB 4.1Å; A22-P237 WeakPolarHBondContact CB-O 3.34Å; A22-I240 HydrophobicContact CB-CB 4.45Å; A22-I240 HydrophobicContact CB-CG2 4.38Å; A22-V241 VanDerWaalsContact CA-CG2 3.46Å; A22-V241 HydrophobicContact CB-CG2 3.56Å; A22-V241 VanDerWaalsContact O-CG2 3.31Å; A22-V241 WeakPolarHBondContact O-CG2 3.32Å |
| 23 | V | 88.2 | Confident | 87.7 | Confident | 16 Ų | 16 | 44.4 Ų | 44.4 | 10% | 0.097 | 28% | 0.275 | C | S | . | . | H | α-helix | trans | -62.9 | -50 | 176.4 | 169.9 | 0 | 0 | 0 | 0 | 110.8 | T19 L20 L25 G26 I27 I240 I244 L304 L307 | T19-V23 PolarHBondContact O-N 3.34Å; L20-V23 PolarHBondContact O-N 3.16Å; V23-L25 PolarHBondContact O-N 3.49Å; V23-G26 PolarHBondContact O-N 3.12Å; V23-I27 HydrophobicContact CG1-CD1 4.11Å; V23-I27 WeakPolarHBondContact O-CG1 3.22Å; V23-I27 PolarHBondContact O-N 3.23Å; V23-I240 HydrophobicContact CG2-CG2 3.6Å; V23-I244 HydrophobicContact CB-CD1 4.06Å; V23-I244 HydrophobicContact CG1-CD1 3.94Å; V23-I244 HydrophobicContact CG2-CD1 3.81Å; V23-L304 HydrophobicContact CB-CD2 4.45Å; V23-L304 HydrophobicContact CG2-CB 4.3Å; V23-L304 HydrophobicContact CG2-CD2 3.73Å; V23-L304 HydrophobicContact CG2-CG 4.47Å; V23-L307 HydrophobicContact CG1-CD2 4.39Å |
| 24 | V | 89.7 | Confident | 88.2 | Confident | 93 Ų | 93 | 45.5 Ų | 45.5 | 56% | 0.564 | 28% | 0.276 | S | S | * | . | H | α-helix | trans | -60.8 | -46.8 | 178.9 | 178.1 | 0 | 0 | 0 | 0 | 110.7 | L20 S21 G26 I27 V28 | L20-V24 PolarHBondContact O-N 3.08Å; S21-V24 PolarHBondContact O-N 2.99Å; V24-G26 PolarHBondContact O-N 3.32Å; V24-I27 PolarHBondContact O-N 2.93Å; V24-V28 HydrophobicContact CG1-CG2 4.41Å; V24-V28 WeakPolarHBondContact O-CG2 3.27Å; V24-V28 PolarHBondContact O-N 3.48Å |
| 25 | L | 94.3 | Very high | 88.4 | Confident | 86 Ų | 86 | 53 Ų | 53 | 45% | 0.45 | 30% | 0.296 | S | S | . | . | H | α-helix | trans | -62.5 | -41.6 | 178.8 | -178.1 | 62.9 | 0 | 0 | 0 | 111.9 | S21 V23 I27 V28 L29 V241 | S21-L25 WeakPolarHBondContact O-CB 3.45Å; S21-L25 PolarHBondContact O-N 2.89Å; V23-L25 PolarHBondContact O-N 3.49Å; L25-I27 VanDerWaalsContact C-N 3.34Å; L25-I27 PolarHBondContact O-N 3.29Å; L25-V28 PolarHBondContact O-N 3.16Å; L25-L29 HydrophobicContact CD1-CD1 3.92Å; L25-L29 HydrophobicContact CD1-CG 3.92Å; L25-L29 HydrophobicContact CD2-CD1 4.44Å; L25-L29 HydrophobicContact CG-CD1 3.82Å; L25-L29 HydrophobicContact CG-CG 4.21Å; L25-L29 VanDerWaalsContact O-CB 3.32Å; L25-L29 WeakPolarHBondContact O-CB 3.25Å; L25-L29 VanDerWaalsContact O-CG 3.28Å; L25-L29 WeakPolarHBondContact O-CG 3.35Å; L25-L29 PolarHBondContact O-N 3Å; L25-V241 HydrophobicContact CB-CG2 4.28Å; L25-V241 HydrophobicContact CD2-CG1 4.38Å; L25-V241 HydrophobicContact CD2-CG2 4.06Å; L25-V241 HydrophobicContact CG-CG1 4.29Å; L25-V241 HydrophobicContact CG-CG2 4.36Å |
| 26 | G | 92 | Very high | 88.5 | Confident | 0 Ų | 0 | 55.1 Ų | 55.1 | 0% | 0 | 32% | 0.318 | C | S | . | . | H | α-helix | trans | -61.2 | -41.2 | 176 | 0 | 0 | 0 | 0 | 0 | 112.6 | A22 V23 V24 G30 A245 | A22-G26 PolarHBondContact O-N 2.92Å; V23-G26 PolarHBondContact O-N 3.12Å; V24-G26 PolarHBondContact O-N 3.32Å; G26-G30 PolarHBondContact O-N 3.48Å; G26-A245 WeakPolarHBondContact O-CA 3.44Å |
| 27 | I | 89.3 | Confident | 88.7 | Confident | 82 Ų | 82 | 61.8 Ų | 61.8 | 42% | 0.421 | 35% | 0.348 | S | S | . | . | H | α-helix | trans | -64.8 | -50.2 | 175.2 | -64.6 | 169.8 | 0 | 0 | 0 | 110.4 | V23 V24 L25 L29 G30 V31 I244 | V23-I27 HydrophobicContact CG1-CD1 4.11Å; V23-I27 WeakPolarHBondContact O-CG1 3.22Å; V23-I27 PolarHBondContact O-N 3.23Å; V24-I27 PolarHBondContact O-N 2.93Å; L25-I27 VanDerWaalsContact C-N 3.34Å; L25-I27 PolarHBondContact O-N 3.29Å; I27-L29 PolarHBondContact O-N 2.82Å; I27-G30 PolarHBondContact O-N 2.88Å; I27-V31 HydrophobicContact CG2-CG2 4.43Å; I27-V31 WeakPolarHBondContact O-CB 3.47Å; I27-V31 WeakPolarHBondContact O-CG2 3.46Å; I27-V31 PolarHBondContact O-N 3.37Å; I27-I244 HydrophobicContact CG1-CG2 3.73Å |
| 28 | V | 91.8 | Very high | 88.9 | Confident | 91 Ų | 91 | 62.8 Ų | 62.8 | 55% | 0.552 | 35% | 0.353 | S | S | * | . | H | α-helix | trans | -61.4 | -46.1 | -178.4 | 171.2 | 0 | 0 | 0 | 0 | 111.2 | V24 L25 G32 | V24-V28 HydrophobicContact CG1-CG2 4.41Å; V24-V28 WeakPolarHBondContact O-CG2 3.27Å; V24-V28 PolarHBondContact O-N 3.48Å; L25-V28 PolarHBondContact O-N 3.16Å; V28-G32 PolarHBondContact O-N 3.48Å |
| 29 | L | 92.5 | Very high | 89 | Confident | 69 Ų | 69 | 64.5 Ų | 64.5 | 36% | 0.361 | 36% | 0.363 | S | S | . | . | H | α-helix | trans | -66.3 | -43.1 | 176.9 | -70.4 | 177.4 | 0 | 0 | 0 | 111.6 | L25 I27 G32 I33 V241 A245 | L25-L29 HydrophobicContact CD1-CD1 3.92Å; L25-L29 HydrophobicContact CD1-CG 3.92Å; L25-L29 HydrophobicContact CD2-CD1 4.44Å; L25-L29 HydrophobicContact CG-CD1 3.82Å; L25-L29 HydrophobicContact CG-CG 4.21Å; L25-L29 VanDerWaalsContact O-CB 3.32Å; L25-L29 WeakPolarHBondContact O-CB 3.25Å; L25-L29 VanDerWaalsContact O-CG 3.28Å; L25-L29 WeakPolarHBondContact O-CG 3.35Å; L25-L29 PolarHBondContact O-N 3Å; I27-L29 PolarHBondContact O-N 2.82Å; L29-G32 PolarHBondContact O-N 2.98Å; L29-I33 HydrophobicContact CB-CD1 4.26Å; L29-I33 WeakPolarHBondContact O-CB 3.36Å; L29-I33 WeakPolarHBondContact O-CD1 3.32Å; L29-I33 WeakPolarHBondContact O-CG1 3.37Å; L29-I33 PolarHBondContact O-N 3.19Å; L29-V241 HydrophobicContact CD1-CG1 3.93Å; L29-A245 HydrophobicContact CB-CB 4.38Å |
| 30 | G | 89.6 | Confident | 89.2 | Confident | 0 Ų | 0 | 69.4 Ų | 69.4 | 0% | 0 | 40% | 0.397 | C | S | . | . | H | α-helix | trans | -59.6 | -47.9 | 177.9 | 0 | 0 | 0 | 0 | 0 | 112.5 | G26 I27 R34 L249 | G26-G30 PolarHBondContact O-N 3.48Å; I27-G30 PolarHBondContact O-N 2.88Å; G30-R34 WeakPolarHBondContact O-CB 3.47Å; G30-R34 PolarHBondContact O-N 2.99Å; G30-L249 WeakPolarHBondContact O-CD2 3.33Å |
| 31 | V | 87.6 | Confident | 89.5 | Confident | 66 Ų | 66 | 71.1 Ų | 71.1 | 40% | 0.4 | 41% | 0.406 | S | S | . | . | H | α-helix | trans | -68.9 | -45.7 | 177.4 | 173.9 | 0 | 0 | 0 | 0 | 111.3 | I27 R34 Y35 L248 | I27-V31 HydrophobicContact CG2-CG2 4.43Å; I27-V31 WeakPolarHBondContact O-CB 3.47Å; I27-V31 WeakPolarHBondContact O-CG2 3.46Å; I27-V31 PolarHBondContact O-N 3.37Å; V31-R34 WeakPolarHBondContact O-CB 3.3Å; V31-R34 PolarHBondContact O-N 2.93Å; V31-Y35 HydrophobicContact CG1-CE2 3.86Å; V31-Y35 WeakPolarHBondContact O-CD2 3.37Å; V31-L248 HydrophobicContact CG2-CD1 4.34Å |
| 32 | G | 89.7 | Confident | 89.6 | Confident | 43 Ų | 43 | 69 Ų | 69 | 44% | 0.443 | 39% | 0.393 | S | S | . | . | H | α-helix | trans | -63.4 | -47.4 | -177.9 | 0 | 0 | 0 | 0 | 0 | 113 | V28 L29 R34 Y35 | V28-G32 PolarHBondContact O-N 3.48Å; L29-G32 PolarHBondContact O-N 2.98Å; G32-R34 VanDerWaalsContact C-N 3.27Å; G32-R34 PolarHBondContact O-N 3.22Å; G32-Y35 PolarHBondContact O-N 3.29Å |
| 33 | I | 90.6 | Very high | 89.6 | Confident | 47 Ų | 47 | 70.3 Ų | 70.3 | 24% | 0.241 | 40% | 0.399 | C | S | . | . | H | α-helix | trans | -67.5 | -31.3 | 179.9 | -64.3 | 169.4 | 0 | 0 | 0 | 110.6 | L29 Y35 A36 P38 I46 L249 | L29-I33 HydrophobicContact CB-CD1 4.26Å; L29-I33 WeakPolarHBondContact O-CB 3.36Å; L29-I33 WeakPolarHBondContact O-CD1 3.32Å; L29-I33 WeakPolarHBondContact O-CG1 3.37Å; L29-I33 PolarHBondContact O-N 3.19Å; I33-Y35 PolarHBondContact O-N 3.38Å; I33-A36 WeakPolarHBondContact O-CB 3.37Å; I33-A36 PolarHBondContact O-N 3.1Å; I33-P38 HydrophobicContact CG2-CB 3.99Å; I33-P38 HydrophobicContact CG2-CG 3.89Å; I33-P38 WeakPolarHBondContact O-CD 3.46Å; I33-I46 HydrophobicContact CD1-CD1 3.79Å; I33-I46 HydrophobicContact CG2-CD1 4.01Å; I33-L249 HydrophobicContact CB-CD1 4.46Å; I33-L249 HydrophobicContact CB-CD2 4.08Å; I33-L249 HydrophobicContact CG2-CD1 4.01Å; I33-L249 HydrophobicContact CG2-CD2 3.97Å |
| 34 | R | 85.5 | Confident | 89.8 | Confident | 66 Ų | 66 | 73.8 Ų | 73.8 | 25% | 0.249 | 42% | 0.417 | C | S | . | . | H | α-helix | trans | -55.9 | -38.1 | 177.5 | -173 | 176.8 | 175.8 | 139.4 | 1.2 | 112.6 | G30 V31 G32 A36 H37 L248 L249 I251 D252 | G30-R34 WeakPolarHBondContact O-CB 3.47Å; G30-R34 PolarHBondContact O-N 2.99Å; V31-R34 WeakPolarHBondContact O-CB 3.3Å; V31-R34 PolarHBondContact O-N 2.93Å; G32-R34 VanDerWaalsContact C-N 3.27Å; G32-R34 PolarHBondContact O-N 3.22Å; R34-A36 PolarHBondContact O-N 2.82Å; R34-H37 PolarHBondContact O-N 3.44Å; R34-H37 VanDerWaalsContact O-N 3.16Å; R34-L248 PolarHBondContact NH1-O 3.33Å; R34-L249 HydrophobicContact CB-CD2 3.86Å; R34-I251 PolarHBondContact NH1-O 3.33Å; R34-I251 PolarHBondContact NH2-O 3.29Å; R34-D252 PolarHBondContact NH2-O 2.93Å |
| 35 | Y | 85.6 | Confident | 90.1 | Very high | 187 Ų | 187 | 74.7 Ų | 74.7 | 73% | 0.733 | 42% | 0.418 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -63.9 | -23.3 | 176.9 | -71.3 | -75.1 | 0 | 0 | 0 | 113.6 | V31 G32 I33 H37 | V31-Y35 HydrophobicContact CG1-CE2 3.86Å; V31-Y35 WeakPolarHBondContact O-CD2 3.37Å; G32-Y35 PolarHBondContact O-N 3.29Å; I33-Y35 PolarHBondContact O-N 3.38Å; Y35-H37 VanDerWaalsContact C-N 3.3Å |
| 36 | A | 86.9 | Confident | 90.1 | Very high | 77 Ų | 77 | 72.8 Ų | 72.8 | 64% | 0.636 | 41% | 0.408 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -85 | -0.4 | 178.6 | 0 | 0 | 0 | 0 | 0 | 113.5 | I33 R34 | I33-A36 WeakPolarHBondContact O-CB 3.37Å; I33-A36 PolarHBondContact O-N 3.1Å; R34-A36 PolarHBondContact O-N 2.82Å |
| 37 | H | 84.3 | Confident | 90 | Very high | 168 Ų | 168 | 73.1 Ų | 73.1 | 78% | 0.778 | 41% | 0.41 | S | S | * | . | trans | 47.7 | 63.2 | -177 | -61.9 | -71.5 | 0 | 0 | 0 | 112.6 | R34 Y35 | R34-H37 PolarHBondContact O-N 3.44Å; R34-H37 VanDerWaalsContact O-N 3.16Å; Y35-H37 VanDerWaalsContact C-N 3.3Å | ||
| 38 | P | 87.3 | Confident | 90.3 | Very high | 34 Ų | 34 | 74.3 Ų | 74.3 | 22% | 0.221 | 41% | 0.413 | C | S | . | . | trans | -62.5 | 147.6 | -173.7 | 30 | -37.8 | 0 | 0 | 0 | 111.1 | I33 A42 I43 L249 | I33-P38 HydrophobicContact CG2-CB 3.99Å; I33-P38 HydrophobicContact CG2-CG 3.89Å; I33-P38 WeakPolarHBondContact O-CD 3.46Å; P38-A42 HydrophobicContact CB-CB 3.94Å; P38-I43 HydrophobicContact CB-CG1 4.25Å; P38-I43 HydrophobicContact CG-CD1 4.19Å; P38-I43 HydrophobicContact CG-CG1 3.81Å; P38-L249 HydrophobicContact CG-CD1 4.42Å; P38-L249 HydrophobicContact CG-CD2 4.03Å | ||
| 39 | S | 91.1 | Very high | 90.5 | Very high | 75 Ų | 75 | 71.7 Ų | 71.7 | 52% | 0.524 | 40% | 0.397 | S | S | . | . | trans | -64.6 | 158.6 | 172.6 | 68.5 | 0 | 0 | 0 | 0 | 111.5 | L41 A42 I43 | S39-L41 PolarHBondContact O-N 2.98Å; S39-L41 VanDerWaalsContact O-N 3.15Å; S39-A42 WeakPolarHBondContact O-CB 3.46Å; S39-A42 PolarHBondContact O-N 3.29Å; S39-A42 PolarHBondContact OG-N 3.05Å; S39-I43 PolarHBondContact O-N 3.31Å | ||
| 40 | S | 89.2 | Confident | 90.4 | Very high | 103 Ų | 103 | 68.4 Ų | 68.4 | 72% | 0.72 | 38% | 0.38 | S | S | * | . | H | α-helix | trans | -56.5 | -33.2 | 176.9 | -46.3 | 0 | 0 | 0 | 0 | 112.8 | I43 L44 | S40-I43 PolarHBondContact O-N 3.21Å; S40-L44 WeakPolarHBondContact O-CB 3.42Å; S40-L44 PolarHBondContact O-N 3.46Å |
| 41 | L | 92.8 | Very high | 90.4 | Very high | 110 Ų | 110 | 72.3 Ų | 72.3 | 58% | 0.576 | 40% | 0.399 | S | S | * | . | H | α-helix | trans | -65.4 | -42.7 | 173.9 | 179.4 | 63.3 | 0 | 0 | 0 | 111.8 | S39 L44 L45 | S39-L41 PolarHBondContact O-N 2.98Å; S39-L41 VanDerWaalsContact O-N 3.15Å; L41-L44 HydrophobicContact CD1-CD2 4.45Å; L41-L44 WeakPolarHBondContact O-CB 3.32Å; L41-L44 PolarHBondContact O-N 3.1Å; L41-L45 HydrophobicContact CD1-CD1 4.41Å; L41-L45 HydrophobicContact CD1-CG 4.36Å; L41-L45 HydrophobicContact CG-CD1 4.21Å; L41-L45 WeakPolarHBondContact O-CG 3.35Å; L41-L45 PolarHBondContact O-N 3.18Å |
| 42 | A | 92.7 | Very high | 90.7 | Very high | 31 Ų | 31 | 71.9 Ų | 71.9 | 26% | 0.256 | 39% | 0.393 | S | S | . | . | H | α-helix | trans | -64.2 | -42.4 | 176.7 | 0 | 0 | 0 | 0 | 0 | 111.2 | P38 S39 L44 L45 I46 | P38-A42 HydrophobicContact CB-CB 3.94Å; S39-A42 WeakPolarHBondContact O-CB 3.46Å; S39-A42 PolarHBondContact O-N 3.29Å; S39-A42 PolarHBondContact OG-N 3.05Å; A42-L44 VanDerWaalsContact C-N 3.32Å; A42-L44 PolarHBondContact O-N 3.03Å; A42-L45 PolarHBondContact O-N 3.06Å; A42-I46 WeakPolarHBondContact O-CB 3.44Å; A42-I46 WeakPolarHBondContact O-CD1 3.44Å; A42-I46 WeakPolarHBondContact O-CG1 3.36Å; A42-I46 PolarHBondContact O-N 2.81Å |
| 43 | I | 91.3 | Very high | 90.7 | Very high | 32 Ų | 32 | 69.9 Ų | 69.9 | 16% | 0.164 | 37% | 0.373 | C | S | . | . | H | α-helix | trans | -60.3 | -43.4 | 175 | -60.7 | 174.4 | 0 | 0 | 0 | 110.7 | P38 S39 S40 I46 S47 L249 R250 | P38-I43 HydrophobicContact CB-CG1 4.25Å; P38-I43 HydrophobicContact CG-CD1 4.19Å; P38-I43 HydrophobicContact CG-CG1 3.81Å; S39-I43 PolarHBondContact O-N 3.31Å; S40-I43 PolarHBondContact O-N 3.21Å; I43-I46 PolarHBondContact O-N 3.48Å; I43-S47 VanDerWaalsContact O-CB 3.3Å; I43-S47 WeakPolarHBondContact O-CB 3.46Å; I43-S47 PolarHBondContact O-N 3.19Å; I43-S47 PolarHBondContact O-OG 3.08Å; I43-L249 HydrophobicContact CD1-CB 4.38Å; I43-L249 HydrophobicContact CG1-CB 4.16Å; I43-L249 HydrophobicContact CG1-CD1 4.36Å; I43-L249 HydrophobicContact CG2-CB 4.23Å; I43-R250 HydrophobicContact CG2-CG 4.18Å |
| 44 | L | 92.1 | Very high | 90.5 | Very high | 89 Ų | 89 | 69.2 Ų | 69.2 | 47% | 0.466 | 37% | 0.37 | S | S | . | . | H | α-helix | trans | -58.6 | -52.6 | 175.7 | 178.9 | 69.8 | 0 | 0 | 0 | 111.2 | S40 L41 A42 I46 S47 F48 | S40-L44 WeakPolarHBondContact O-CB 3.42Å; S40-L44 PolarHBondContact O-N 3.46Å; L41-L44 HydrophobicContact CD1-CD2 4.45Å; L41-L44 WeakPolarHBondContact O-CB 3.32Å; L41-L44 PolarHBondContact O-N 3.1Å; A42-L44 VanDerWaalsContact C-N 3.32Å; A42-L44 PolarHBondContact O-N 3.03Å; L44-I46 VanDerWaalsContact C-N 3.34Å; L44-I46 PolarHBondContact O-N 3.17Å; L44-S47 PolarHBondContact O-N 2.93Å; L44-S47 VanDerWaalsContact O-N 3.14Å; L44-F48 WeakPolarHBondContact O-CB 3.45Å; L44-F48 PolarHBondContact O-N 3.35Å |
| 45 | L | 95 | Very high | 90.7 | Very high | 112 Ų | 112 | 69.7 Ų | 69.7 | 59% | 0.586 | 38% | 0.377 | S | S | * | . | H | α-helix | trans | -62.4 | -39.9 | -178.9 | -69.7 | 174.4 | 0 | 0 | 0 | 112.5 | L41 A42 S47 P49 | L41-L45 HydrophobicContact CD1-CD1 4.41Å; L41-L45 HydrophobicContact CD1-CG 4.36Å; L41-L45 HydrophobicContact CG-CD1 4.21Å; L41-L45 WeakPolarHBondContact O-CG 3.35Å; L41-L45 PolarHBondContact O-N 3.18Å; A42-L45 PolarHBondContact O-N 3.06Å; L45-S47 VanDerWaalsContact C-N 3.31Å; L45-S47 PolarHBondContact O-N 3.4Å; L45-P49 WeakPolarHBondContact O-CD 3.36Å |
| 46 | I | 94.2 | Very high | 90.9 | Very high | 46 Ų | 46 | 63.8 Ų | 63.8 | 24% | 0.236 | 36% | 0.357 | C | S | . | . | H | α-helix | trans | -65.9 | -35.8 | 176.2 | -69.5 | 163.1 | 0 | 0 | 0 | 111 | I33 A42 I43 L44 S242 A245 L249 | I33-I46 HydrophobicContact CD1-CD1 3.79Å; I33-I46 HydrophobicContact CG2-CD1 4.01Å; A42-I46 WeakPolarHBondContact O-CB 3.44Å; A42-I46 WeakPolarHBondContact O-CD1 3.44Å; A42-I46 WeakPolarHBondContact O-CG1 3.36Å; A42-I46 PolarHBondContact O-N 2.81Å; I43-I46 PolarHBondContact O-N 3.48Å; L44-I46 VanDerWaalsContact C-N 3.34Å; L44-I46 PolarHBondContact O-N 3.17Å; I46-S242 VanDerWaalsContact O-CB 3.32Å; I46-S242 WeakPolarHBondContact O-CB 3.31Å; I46-S242 PolarHBondContact O-OG 2.96Å; I46-A245 HydrophobicContact CG2-CB 3.9Å; I46-L249 HydrophobicContact CD1-CD1 3.81Å; I46-L249 HydrophobicContact CG2-CD1 4.16Å |
| 47 | S | 91.3 | Very high | 90.8 | Very high | 8 Ų | 8 | 60.2 Ų | 60.2 | 6% | 0.056 | 33% | 0.327 | C | S | . | . | H | α-helix | trans | -82.7 | -21.2 | -178 | -53.7 | 0 | 0 | 0 | 0 | 113.7 | I43 L44 L45 G50 E51 S242 G246 | I43-S47 VanDerWaalsContact O-CB 3.3Å; I43-S47 WeakPolarHBondContact O-CB 3.46Å; I43-S47 PolarHBondContact O-N 3.19Å; I43-S47 PolarHBondContact O-OG 3.08Å; L44-S47 PolarHBondContact O-N 2.93Å; L44-S47 VanDerWaalsContact O-N 3.14Å; L45-S47 VanDerWaalsContact C-N 3.31Å; L45-S47 PolarHBondContact O-N 3.4Å; S47-G50 WeakPolarHBondContact O-CA 3.02Å; S47-G50 PolarHBondContact O-N 3.37Å; S47-G50 VanDerWaalsContact O-N 3.12Å; S47-E51 PolarHBondContact O-N 3.13Å; S47-S242 VanDerWaalsContact C-OG 3.25Å; S47-S242 WeakPolarHBondContact CA-OG 3.32Å; S47-S242 PolarHBondContact O-OG 3.27Å; S47-G246 VanDerWaalsContact OG-CA 3.22Å; S47-G246 WeakPolarHBondContact OG-CA 3.26Å |
| 48 | F | 95.3 | Very high | 90.9 | Very high | 106 Ų | 106 | 57.2 Ų | 57.2 | 47% | 0.465 | 31% | 0.312 | S | S | . | . | H | α-helix | trans | -62.5 | -45.9 | -168.8 | -175.5 | -106.2 | 0 | 0 | 0 | 114.3 | L44 G50 E51 I52 | L44-F48 WeakPolarHBondContact O-CB 3.45Å; L44-F48 PolarHBondContact O-N 3.35Å; F48-G50 PolarHBondContact O-N 3.05Å; F48-E51 WeakPolarHBondContact O-CB 3.44Å; F48-E51 PolarHBondContact O-N 3.31Å; F48-I52 HydrophobicContact CD1-CG1 4.35Å; F48-I52 HydrophobicContact CE1-CD1 4.14Å; F48-I52 HydrophobicContact CE1-CG1 4.03Å; F48-I52 HydrophobicContact CE2-CD1 4.24Å; F48-I52 HydrophobicContact CZ-CD1 3.81Å; F48-I52 HydrophobicContact CZ-CG1 4.18Å; F48-I52 WeakPolarHBondContact O-CG1 3.25Å; F48-I52 PolarHBondContact O-N 3.19Å |
| 49 | P | 95.6 | Very high | 91 | Very high | 36 Ų | 36 | 61.5 Ų | 61.5 | 23% | 0.234 | 33% | 0.332 | C | S | . | . | H | α-helix | trans | -55.9 | -34.9 | 173.8 | -24.7 | 33.1 | 0 | 0 | 0 | 113.3 | L45 I52 L53 Y235 V238 S242 | L45-P49 WeakPolarHBondContact O-CD 3.36Å; P49-I52 PolarHBondContact O-N 3.28Å; P49-L53 PolarHBondContact O-N 2.65Å; P49-L53 VanDerWaalsContact O-N 3.09Å; P49-Y235 WeakPolarHBondContact CA-OH 3.47Å; P49-Y235 WeakPolarHBondContact CB-OH 3.44Å; P49-Y235 VanDerWaalsContact O-CE1 3.32Å; P49-Y235 WeakPolarHBondContact O-CE1 3.32Å; P49-Y235 PolarHBondContact O-OH 3.32Å; P49-V238 HydrophobicContact CB-CG1 4.18Å; P49-S242 WeakPolarHBondContact CD-OG 3.48Å |
| 50 | G | 91.1 | Very high | 90.9 | Very high | 0 Ų | 0 | 58.3 Ų | 58.3 | 0% | 0 | 31% | 0.309 | C | S | . | . | H | α-helix | trans | -67.6 | -40 | 175.7 | 0 | 0 | 0 | 0 | 0 | 113.2 | S47 F48 I52 L53 L54 G239 S242 L243 | S47-G50 WeakPolarHBondContact O-CA 3.02Å; S47-G50 PolarHBondContact O-N 3.37Å; S47-G50 VanDerWaalsContact O-N 3.12Å; F48-G50 PolarHBondContact O-N 3.05Å; G50-I52 VanDerWaalsContact C-N 3.33Å; G50-L53 WeakPolarHBondContact O-CB 3.46Å; G50-L53 PolarHBondContact O-N 2.82Å; G50-L54 PolarHBondContact O-N 2.97Å; G50-G239 WeakPolarHBondContact CA-O 3.2Å; G50-S242 VanDerWaalsContact N-CB 3.33Å; G50-S242 PolarHBondContact N-OG 3.46Å; G50-L243 WeakPolarHBondContact O-CD2 3.32Å |
| 51 | E | 89.9 | Confident | 90.9 | Very high | 82 Ų | 82 | 53.8 Ų | 53.8 | 38% | 0.383 | 28% | 0.277 | S | S | . | . | H | α-helix | trans | -61.6 | -42.1 | 172.7 | -170 | -176.8 | 145.4 | 0 | 0 | 111.6 | S47 F48 L53 L54 N55 | S47-E51 PolarHBondContact O-N 3.13Å; F48-E51 WeakPolarHBondContact O-CB 3.44Å; F48-E51 PolarHBondContact O-N 3.31Å; E51-L53 VanDerWaalsContact C-N 3.34Å; E51-L53 PolarHBondContact O-N 3.11Å; E51-L54 WeakPolarHBondContact O-CB 3.42Å; E51-L54 PolarHBondContact O-N 3.3Å; E51-N55 WeakPolarHBondContact O-CB 3.5Å; E51-N55 VanDerWaalsContact O-CG 3.29Å; E51-N55 PolarHBondContact O-N 3.42Å; E51-N55 PolarHBondContact O-ND2 2.95Å |
| 52 | I | 93.6 | Very high | 90.8 | Very high | 57 Ų | 57 | 50.7 Ų | 50.7 | 29% | 0.292 | 26% | 0.26 | S | S | . | . | H | α-helix | trans | -59.6 | -44.5 | 174.5 | -62 | -56.4 | 0 | 0 | 0 | 111 | F48 P49 G50 L54 N55 M56 Y235 | F48-I52 HydrophobicContact CD1-CG1 4.35Å; F48-I52 HydrophobicContact CE1-CD1 4.14Å; F48-I52 HydrophobicContact CE1-CG1 4.03Å; F48-I52 HydrophobicContact CE2-CD1 4.24Å; F48-I52 HydrophobicContact CZ-CD1 3.81Å; F48-I52 HydrophobicContact CZ-CG1 4.18Å; F48-I52 WeakPolarHBondContact O-CG1 3.25Å; F48-I52 PolarHBondContact O-N 3.19Å; P49-I52 PolarHBondContact O-N 3.28Å; G50-I52 VanDerWaalsContact C-N 3.33Å; I52-L54 PolarHBondContact O-N 2.92Å; I52-N55 PolarHBondContact O-N 3.34Å; I52-M56 HydrophobicContact CG2-CG 4.28Å; I52-M56 HydrophobicContact CG2-SD 3.97Å; I52-M56 WeakPolarHBondContact O-CB 3.46Å; I52-M56 VanDerWaalsContact O-CG 3.26Å; I52-M56 WeakPolarHBondContact O-CG 3.41Å; I52-M56 PolarHBondContact O-N 2.97Å; I52-Y235 HydrophobicContact CB-CE1 4.23Å; I52-Y235 HydrophobicContact CG2-CE1 4.04Å |
| 53 | L | 89.7 | Confident | 90.8 | Very high | 1 Ų | 1 | 52 Ų | 52 | 1% | 0.005 | 27% | 0.266 | C | S | . | . | H | α-helix | trans | -58.6 | -46.5 | 175.3 | 175.4 | 66.6 | 0 | 0 | 0 | 111.4 | P49 G50 E51 N55 M56 L57 Y235 I240 L243 | P49-L53 PolarHBondContact O-N 2.65Å; P49-L53 VanDerWaalsContact O-N 3.09Å; G50-L53 WeakPolarHBondContact O-CB 3.46Å; G50-L53 PolarHBondContact O-N 2.82Å; E51-L53 VanDerWaalsContact C-N 3.34Å; E51-L53 PolarHBondContact O-N 3.11Å; L53-N55 VanDerWaalsContact C-N 3.32Å; L53-N55 PolarHBondContact O-N 3.28Å; L53-M56 PolarHBondContact O-N 3.08Å; L53-L57 HydrophobicContact CD1-CD1 4.14Å; L53-L57 HydrophobicContact CD1-CG 4.22Å; L53-L57 HydrophobicContact CG-CD1 4.14Å; L53-L57 WeakPolarHBondContact O-CG 3.43Å; L53-L57 PolarHBondContact O-N 3.14Å; L53-Y235 HydrophobicContact CB-CD1 3.89Å; L53-Y235 HydrophobicContact CB-CE1 3.9Å; L53-Y235 HydrophobicContact CD1-CD1 4.02Å; L53-I240 HydrophobicContact CD2-CG1 4.14Å; L53-L243 HydrophobicContact CD2-CD1 4.02Å |
| 54 | L | 85.6 | Confident | 90.8 | Very high | 34 Ų | 34 | 50.6 Ų | 50.6 | 18% | 0.178 | 26% | 0.259 | C | S | . | . | H | α-helix | trans | -59.6 | -43.1 | 177.1 | -78 | 174.6 | 0 | 0 | 0 | 111.9 | G50 E51 I52 L57 K58 L243 T309 | G50-L54 PolarHBondContact O-N 2.97Å; E51-L54 WeakPolarHBondContact O-CB 3.42Å; E51-L54 PolarHBondContact O-N 3.3Å; I52-L54 PolarHBondContact O-N 2.92Å; L54-L57 PolarHBondContact O-N 3.49Å; L54-K58 WeakPolarHBondContact O-CB 3.26Å; L54-K58 VanDerWaalsContact O-CG 3.27Å; L54-K58 WeakPolarHBondContact O-CG 3.33Å; L54-K58 PolarHBondContact O-N 3.3Å; L54-L243 HydrophobicContact CD1-CD2 3.6Å; L54-L243 HydrophobicContact CD2-CD1 4.48Å; L54-L243 HydrophobicContact CG-CD1 4.15Å; L54-L243 HydrophobicContact CG-CD2 3.96Å; L54-T309 HydrophobicContact CD2-CG2 3.69Å |
| 55 | N | 89.4 | Confident | 90.7 | Very high | 76 Ų | 76 | 46.4 Ų | 46.4 | 41% | 0.406 | 24% | 0.237 | S | C | . | . | H | α-helix | trans | -67.4 | -41.1 | 179.2 | -69.9 | -16.7 | 0 | 0 | 0 | 111.7 | E51 I52 L53 L57 K58 L59 | E51-N55 WeakPolarHBondContact O-CB 3.5Å; E51-N55 VanDerWaalsContact O-CG 3.29Å; E51-N55 PolarHBondContact O-N 3.42Å; E51-N55 PolarHBondContact O-ND2 2.95Å; I52-N55 PolarHBondContact O-N 3.34Å; L53-N55 VanDerWaalsContact C-N 3.32Å; L53-N55 PolarHBondContact O-N 3.28Å; N55-L57 PolarHBondContact O-N 3.44Å; N55-K58 PolarHBondContact O-N 3.22Å; N55-L59 VanDerWaalsContact O-CB 3.27Å; N55-L59 WeakPolarHBondContact O-CB 3.47Å; N55-L59 PolarHBondContact O-N 2.93Å |
| 56 | M | 90.5 | Very high | 90.6 | Very high | 62 Ų | 62 | 43 Ų | 43 | 31% | 0.305 | 22% | 0.22 | S | C | . | . | H | α-helix | trans | -60 | -45.4 | 173.8 | -72.3 | 174.2 | 71.7 | 0 | 0 | 111.6 | I52 L53 L60 A232 Y235 | I52-M56 HydrophobicContact CG2-CG 4.28Å; I52-M56 HydrophobicContact CG2-SD 3.97Å; I52-M56 WeakPolarHBondContact O-CB 3.46Å; I52-M56 VanDerWaalsContact O-CG 3.26Å; I52-M56 WeakPolarHBondContact O-CG 3.41Å; I52-M56 PolarHBondContact O-N 2.97Å; L53-M56 PolarHBondContact O-N 3.08Å; M56-L60 VanDerWaalsContact O-CG 3.31Å; M56-L60 WeakPolarHBondContact O-CG 3.22Å; M56-L60 PolarHBondContact O-N 3.07Å; M56-A232 HydrophobicContact CE-CB 3.79Å; M56-Y235 HydrophobicContact SD-CD1 3.86Å; M56-Y235 HydrophobicContact SD-CE1 4.37Å; M56-Y235 HydrophobicContact SD-CG 4.25Å |
| 57 | L | 85.9 | Confident | 90.6 | Very high | 2 Ų | 2 | 41 Ų | 41 | 1% | 0.01 | 21% | 0.209 | C | C | . | . | H | α-helix | trans | -65.8 | -47.5 | 178.5 | -69.7 | 176 | 0 | 0 | 0 | 111.1 | L53 L54 N55 L59 L60 I61 T305 T309 A314 V318 | L53-L57 HydrophobicContact CD1-CD1 4.14Å; L53-L57 HydrophobicContact CD1-CG 4.22Å; L53-L57 HydrophobicContact CG-CD1 4.14Å; L53-L57 WeakPolarHBondContact O-CG 3.43Å; L53-L57 PolarHBondContact O-N 3.14Å; L54-L57 PolarHBondContact O-N 3.49Å; N55-L57 PolarHBondContact O-N 3.44Å; L57-L59 VanDerWaalsContact C-N 3.33Å; L57-L59 PolarHBondContact O-N 3Å; L57-L60 PolarHBondContact O-N 3.33Å; L57-I61 VanDerWaalsContact O-CG1 3.27Å; L57-I61 WeakPolarHBondContact O-CG1 3.35Å; L57-I61 PolarHBondContact O-N 2.98Å; L57-T305 HydrophobicContact CD1-CG2 3.98Å; L57-T309 HydrophobicContact CD1-CG2 3.8Å; L57-A314 HydrophobicContact CB-CB 4.15Å; L57-A314 WeakPolarHBondContact CB-O 3.33Å; L57-V318 HydrophobicContact CD2-CG2 4.32Å |
| 58 | K | 84.6 | Confident | 90.5 | Very high | 106 Ų | 106 | 40.7 Ų | 40.7 | 46% | 0.461 | 21% | 0.207 | S | C | . | . | H | α-helix | trans | -57 | -42.4 | 176.7 | -76.4 | 175.3 | -179.4 | 178.6 | 0 | 113 | L54 N55 L60 I61 | L54-K58 WeakPolarHBondContact O-CB 3.26Å; L54-K58 VanDerWaalsContact O-CG 3.27Å; L54-K58 WeakPolarHBondContact O-CG 3.33Å; L54-K58 PolarHBondContact O-N 3.3Å; N55-K58 PolarHBondContact O-N 3.22Å; K58-L60 PolarHBondContact O-N 2.93Å; K58-I61 HydrophobicContact CB-CD1 4.47Å; K58-I61 HydrophobicContact CG-CD1 4.32Å; K58-I61 PolarHBondContact O-N 3.2Å |
| 59 | L | 89.7 | Confident | 90.3 | Very high | 123 Ų | 123 | 35.7 Ų | 35.7 | 64% | 0.644 | 19% | 0.185 | S | C | * | . | H | α-helix | trans | -57.5 | -36.6 | 176.2 | 177.8 | 69.1 | 0 | 0 | 0 | 112.1 | N55 L57 P63 | N55-L59 VanDerWaalsContact O-CB 3.27Å; N55-L59 WeakPolarHBondContact O-CB 3.47Å; N55-L59 PolarHBondContact O-N 2.93Å; L57-L59 VanDerWaalsContact C-N 3.33Å; L57-L59 PolarHBondContact O-N 3Å; L59-P63 WeakPolarHBondContact O-CD 3.48Å |
| 60 | L | 90.5 | Very high | 90.2 | Very high | 9 Ų | 9 | 34 Ų | 34 | 5% | 0.047 | 18% | 0.175 | C | C | . | . | H | α-helix | trans | -84.4 | -15.6 | -175.8 | -66.2 | 170.9 | 0 | 0 | 0 | 113.5 | M56 L57 K58 L64 V225 M228 V229 A232 | M56-L60 VanDerWaalsContact O-CG 3.31Å; M56-L60 WeakPolarHBondContact O-CG 3.22Å; M56-L60 PolarHBondContact O-N 3.07Å; L57-L60 PolarHBondContact O-N 3.33Å; K58-L60 PolarHBondContact O-N 2.93Å; L60-L64 WeakPolarHBondContact O-CB 3.48Å; L60-L64 PolarHBondContact O-N 2.83Å; L60-L64 VanDerWaalsContact O-N 3.11Å; L60-V225 HydrophobicContact CD2-CG1 4.47Å; L60-M228 HydrophobicContact CD2-CB 3.75Å; L60-M228 HydrophobicContact CD2-CE 3.94Å; L60-M228 HydrophobicContact CD2-SD 4.42Å; L60-V229 HydrophobicContact CB-CG2 4.24Å; L60-V229 HydrophobicContact CD1-CG2 3.93Å; L60-V229 HydrophobicContact CG-CG2 4.48Å; L60-A232 HydrophobicContact CD1-CB 3.69Å |
| 61 | I | 88.5 | Confident | 90.2 | Very high | 7 Ų | 7 | 34.1 Ų | 34.1 | 4% | 0.036 | 18% | 0.175 | C | C | . | . | H | α-helix | trans | -62.1 | -55.4 | -175.6 | -54.8 | 174.6 | 0 | 0 | 0 | 111.1 | L57 K58 L64 V65 M188 M190 A313 | L57-I61 VanDerWaalsContact O-CG1 3.27Å; L57-I61 WeakPolarHBondContact O-CG1 3.35Å; L57-I61 PolarHBondContact O-N 2.98Å; K58-I61 HydrophobicContact CB-CD1 4.47Å; K58-I61 HydrophobicContact CG-CD1 4.32Å; K58-I61 PolarHBondContact O-N 3.2Å; I61-L64 PolarHBondContact O-N 2.83Å; I61-V65 HydrophobicContact CG2-CG2 4.04Å; I61-V65 WeakPolarHBondContact O-CB 3.32Å; I61-V65 VanDerWaalsContact O-CG2 3.26Å; I61-V65 WeakPolarHBondContact O-CG2 3.24Å; I61-V65 PolarHBondContact O-N 3.22Å; I61-M188 HydrophobicContact CB-CE 4.25Å; I61-M188 HydrophobicContact CG2-CE 3.88Å; I61-M190 HydrophobicContact CG2-CE 3.2Å; I61-A313 VanDerWaalsContact CD1-C 3.46Å; I61-A313 HydrophobicContact CD1-CB 3.96Å; I61-A313 VanDerWaalsContact CD1-O 3.31Å; I61-A313 WeakPolarHBondContact CD1-O 3.23Å; I61-A313 WeakPolarHBondContact CG1-O 3.38Å |
| 62 | L | 90.7 | Very high | 90.1 | Very high | 45 Ų | 45 | 30.3 Ų | 30.3 | 24% | 0.236 | 16% | 0.158 | C | C | . | . | H | α-helix | trans | -63.1 | -52 | -174.2 | 176 | 70.6 | 0 | 0 | 0 | 112.4 | L64 V65 I66 T152 M188 I193 | L62-L64 VanDerWaalsContact C-N 3.27Å; L62-L64 PolarHBondContact O-N 3.35Å; L62-V65 PolarHBondContact O-N 2.98Å; L62-I66 HydrophobicContact CD1-CD1 3.51Å; L62-I66 HydrophobicContact CD1-CG1 4.01Å; L62-I66 HydrophobicContact CG-CD1 3.92Å; L62-I66 WeakPolarHBondContact O-CG1 3.38Å; L62-I66 PolarHBondContact O-N 3.06Å; L62-T152 HydrophobicContact CD1-CG2 4.19Å; L62-T152 HydrophobicContact CD2-CG2 3.74Å; L62-M188 HydrophobicContact CB-SD 3.85Å; L62-M188 HydrophobicContact CD1-SD 3.82Å; L62-M188 HydrophobicContact CG-SD 4.35Å; L62-I193 HydrophobicContact CD1-CD1 3.67Å; L62-I193 HydrophobicContact CD1-CG1 4.47Å; L62-I193 HydrophobicContact CD1-CG2 4.12Å |
| 63 | P | 92.6 | Very high | 89.9 | Confident | 58 Ų | 58 | 27.7 Ų | 27.7 | 38% | 0.377 | 14% | 0.144 | S | C | . | . | H | α-helix | trans | -59.2 | -39.1 | 177.1 | -24 | 35 | 0 | 0 | 0 | 112.4 | L59 S67 V225 | L59-P63 WeakPolarHBondContact O-CD 3.48Å; P63-S67 VanDerWaalsContact O-CB 3.24Å; P63-S67 WeakPolarHBondContact O-CB 3.33Å; P63-S67 PolarHBondContact O-N 3.35Å; P63-S67 PolarHBondContact O-OG 3.09Å; P63-V225 HydrophobicContact CB-CG1 4.33Å; P63-V225 HydrophobicContact CB-CG2 3.79Å |
| 64 | L | 90.9 | Very high | 89.9 | Confident | 3 Ų | 3 | 28.4 Ų | 28.4 | 2% | 0.016 | 15% | 0.149 | C | C | . | . | H | α-helix | trans | -66.2 | -54 | 178.8 | -176.8 | 68 | 0 | 0 | 0 | 110.6 | L60 I61 L62 I66 S67 S68 V225 V229 P317 F320 | L60-L64 WeakPolarHBondContact O-CB 3.48Å; L60-L64 PolarHBondContact O-N 2.83Å; L60-L64 VanDerWaalsContact O-N 3.11Å; I61-L64 PolarHBondContact O-N 2.83Å; L62-L64 VanDerWaalsContact C-N 3.27Å; L62-L64 PolarHBondContact O-N 3.35Å; L64-I66 VanDerWaalsContact C-N 3.34Å; L64-I66 PolarHBondContact O-N 3.48Å; L64-S67 PolarHBondContact O-N 3.24Å; L64-S67 PolarHBondContact O-OG 2.93Å; L64-S68 WeakPolarHBondContact CD1-OG 3.49Å; L64-S68 WeakPolarHBondContact O-CA 3.24Å; L64-S68 WeakPolarHBondContact O-CB 3.36Å; L64-S68 PolarHBondContact O-N 2.99Å; L64-S68 PolarHBondContact O-OG 3.39Å; L64-S68 VanDerWaalsContact O-OG 3.11Å; L64-V225 HydrophobicContact CB-CG1 3.76Å; L64-V225 HydrophobicContact CD1-CG1 3.97Å; L64-V225 HydrophobicContact CG-CG1 4.46Å; L64-V229 HydrophobicContact CD2-CG2 4.44Å; L64-P317 HydrophobicContact CD2-CB 3.67Å; L64-P317 HydrophobicContact CD2-CG 3.8Å; L64-F320 HydrophobicContact CD2-CD2 3.63Å; L64-F320 HydrophobicContact CD2-CE2 4.1Å; L64-F320 HydrophobicContact CG-CD2 4.3Å; L64-F320 HydrophobicContact CG-CE2 4.41Å |
| 65 | V | 89.7 | Confident | 89.8 | Confident | 2 Ų | 2 | 31 Ų | 31 | 1% | 0.012 | 16% | 0.161 | C | C | . | . | H | α-helix | trans | -56.5 | -47.9 | -178.2 | 169.3 | 0 | 0 | 0 | 0 | 111.1 | I61 L62 L69 M190 I194 L316 P338 | I61-V65 HydrophobicContact CG2-CG2 4.04Å; I61-V65 WeakPolarHBondContact O-CB 3.32Å; I61-V65 VanDerWaalsContact O-CG2 3.26Å; I61-V65 WeakPolarHBondContact O-CG2 3.24Å; I61-V65 PolarHBondContact O-N 3.22Å; L62-V65 PolarHBondContact O-N 2.98Å; V65-L69 HydrophobicContact CG1-CD1 3.62Å; V65-L69 WeakPolarHBondContact O-CB 3.19Å; V65-L69 WeakPolarHBondContact O-CG 3.47Å; V65-L69 PolarHBondContact O-N 2.88Å; V65-M190 HydrophobicContact CG2-CE 4.3Å; V65-I194 HydrophobicContact CG1-CG1 4.15Å; V65-L316 HydrophobicContact CG2-CD2 3.63Å; V65-P338 HydrophobicContact CG1-CB 4.24Å; V65-P338 HydrophobicContact CG2-CB 4.35Å; V65-P338 HydrophobicContact CG2-CG 4.48Å |
| 66 | I | 93.3 | Very high | 89.5 | Confident | 41 Ų | 41 | 28 Ų | 28 | 21% | 0.21 | 14% | 0.144 | C | C | . | . | H | α-helix | trans | -63.5 | -54.4 | 179.8 | -66.3 | 177.3 | 0 | 0 | 0 | 111 | L62 L64 I70 I193 F218 | L62-I66 HydrophobicContact CD1-CD1 3.51Å; L62-I66 HydrophobicContact CD1-CG1 4.01Å; L62-I66 HydrophobicContact CG-CD1 3.92Å; L62-I66 WeakPolarHBondContact O-CG1 3.38Å; L62-I66 PolarHBondContact O-N 3.06Å; L64-I66 VanDerWaalsContact C-N 3.34Å; L64-I66 PolarHBondContact O-N 3.48Å; I66-I70 HydrophobicContact CG2-CD1 3.82Å; I66-I70 WeakPolarHBondContact O-CB 3.48Å; I66-I70 WeakPolarHBondContact O-CG1 3.4Å; I66-I70 PolarHBondContact O-N 3.21Å; I66-I70 VanDerWaalsContact O-N 3.13Å; I66-I193 HydrophobicContact CD1-CG2 4.28Å; I66-I193 HydrophobicContact CG1-CG2 3.83Å; I66-F218 HydrophobicContact CG2-CE1 3.83Å |
| 67 | S | 93.3 | Very high | 89.3 | Confident | 3 Ų | 3 | 30 Ų | 30 | 2% | 0.021 | 15% | 0.153 | C | C | . | . | H | α-helix | trans | -65.2 | -45.8 | -175.7 | 60.5 | 0 | 0 | 0 | 0 | 111.8 | P63 L64 A71 | P63-S67 VanDerWaalsContact O-CB 3.24Å; P63-S67 WeakPolarHBondContact O-CB 3.33Å; P63-S67 PolarHBondContact O-N 3.35Å; P63-S67 PolarHBondContact O-OG 3.09Å; L64-S67 PolarHBondContact O-N 3.24Å; L64-S67 PolarHBondContact O-OG 2.93Å; S67-A71 WeakPolarHBondContact O-CB 3.48Å; S67-A71 PolarHBondContact O-N 3.44Å |
| 68 | S | 90.1 | Very high | 89.1 | Confident | 2 Ų | 2 | 33.4 Ų | 33.4 | 1% | 0.014 | 17% | 0.174 | C | C | . | . | H | α-helix | trans | -63.4 | -47.2 | 177.8 | -72.8 | 0 | 0 | 0 | 0 | 113.3 | L64 G72 D222 R334 | L64-S68 WeakPolarHBondContact CD1-OG 3.49Å; L64-S68 WeakPolarHBondContact O-CA 3.24Å; L64-S68 WeakPolarHBondContact O-CB 3.36Å; L64-S68 PolarHBondContact O-N 2.99Å; L64-S68 PolarHBondContact O-OG 3.39Å; L64-S68 VanDerWaalsContact O-OG 3.11Å; S68-G72 WeakPolarHBondContact O-CA 3.49Å; S68-G72 PolarHBondContact O-N 3.43Å; S68-D222 WeakPolarHBondContact CA-OD1 3.34Å; S68-D222 WeakPolarHBondContact CB-OD1 3.38Å; S68-D222 PolarHBondContact OG-OD1 2.72Å; S68-R334 WeakPolarHBondContact O-CB 3.22Å; S68-R334 WeakPolarHBondContact O-CD 3.38Å |
| 69 | L | 91.1 | Very high | 89.3 | Confident | 1 Ų | 1 | 36.5 Ų | 36.5 | 1% | 0.005 | 19% | 0.187 | C | C | . | . | H | α-helix | trans | -64.8 | -48.1 | -179.5 | -81.5 | 167.8 | 0 | 0 | 0 | 111.3 | V65 G72 L73 I194 C197 R334 F335 P338 | V65-L69 HydrophobicContact CG1-CD1 3.62Å; V65-L69 WeakPolarHBondContact O-CB 3.19Å; V65-L69 WeakPolarHBondContact O-CG 3.47Å; V65-L69 PolarHBondContact O-N 2.88Å; L69-G72 PolarHBondContact O-N 3.46Å; L69-L73 WeakPolarHBondContact O-CB 3.28Å; L69-L73 PolarHBondContact O-N 3.01Å; L69-I194 HydrophobicContact CD1-CB 4.28Å; L69-I194 HydrophobicContact CD1-CG1 3.92Å; L69-I194 HydrophobicContact CD1-CG2 4.2Å; L69-C197 HydrophobicContact CB-CB 3.84Å; L69-C197 HydrophobicContact CD1-CB 3.94Å; L69-R334 WeakPolarHBondContact CD2-O 3.44Å; L69-F335 HydrophobicContact CD2-CD2 4.45Å; L69-P338 HydrophobicContact CD1-CB 4.16Å; L69-P338 HydrophobicContact CD1-CG 4.33Å; L69-P338 HydrophobicContact CD2-CG 4.3Å; L69-P338 HydrophobicContact CG-CG 4.19Å |
| 70 | I | 93.4 | Very high | 89.1 | Confident | 1 Ų | 1 | 31 Ų | 31 | 1% | 0.005 | 16% | 0.159 | C | C | . | . | H | α-helix | trans | -66.9 | -47.2 | -178.5 | -64.5 | 171.4 | 0 | 0 | 0 | 110.2 | I66 G72 S74 C197 F200 F218 | I66-I70 HydrophobicContact CG2-CD1 3.82Å; I66-I70 WeakPolarHBondContact O-CB 3.48Å; I66-I70 WeakPolarHBondContact O-CG1 3.4Å; I66-I70 PolarHBondContact O-N 3.21Å; I66-I70 VanDerWaalsContact O-N 3.13Å; I70-G72 VanDerWaalsContact C-N 3.31Å; I70-G72 PolarHBondContact O-N 2.85Å; I70-S74 WeakPolarHBondContact O-CB 3.33Å; I70-S74 PolarHBondContact O-N 3.42Å; I70-S74 PolarHBondContact O-OG 2.94Å; I70-C197 HydrophobicContact CG1-CB 4.03Å; I70-F200 HydrophobicContact CB-CD1 4.46Å; I70-F200 HydrophobicContact CD1-CB 4.48Å; I70-F200 HydrophobicContact CD1-CD1 3.74Å; I70-F200 HydrophobicContact CD1-CE1 4.18Å; I70-F200 HydrophobicContact CD1-CG 4.15Å; I70-F200 HydrophobicContact CG1-CD1 3.96Å; I70-F200 HydrophobicContact CG2-CD1 3.65Å; I70-F200 HydrophobicContact CG2-CE1 3.84Å; I70-F218 HydrophobicContact CB-CB 4.36Å; I70-F218 HydrophobicContact CB-CD1 4.3Å; I70-F218 HydrophobicContact CB-CD2 4.24Å; I70-F218 HydrophobicContact CB-CG 4.05Å; I70-F218 HydrophobicContact CD1-CD1 4.2Å; I70-F218 HydrophobicContact CD1-CD2 4.41Å; I70-F218 HydrophobicContact CD1-CE1 3.77Å; I70-F218 HydrophobicContact CD1-CE2 4.01Å; I70-F218 HydrophobicContact CD1-CZ 3.66Å; I70-F218 HydrophobicContact CG2-CB 4.02Å; I70-F218 HydrophobicContact CG2-CD1 4.36Å; I70-F218 HydrophobicContact CG2-CD2 3.43Å; I70-F218 VanDerWaalsContact CG2-CD2 3.43Å; I70-F218 HydrophobicContact CG2-CE2 3.93Å; I70-F218 HydrophobicContact CG2-CG 3.68Å |
| 71 | A | 90.6 | Very high | 89 | Confident | 1 Ų | 1 | 30.9 Ų | 30.9 | 1% | 0.008 | 16% | 0.159 | C | C | . | . | H | α-helix | trans | -62.4 | -39.3 | 176.4 | 0 | 0 | 0 | 0 | 0 | 111.8 | S67 S74 Q75 F218 I219 D222 | S67-A71 WeakPolarHBondContact O-CB 3.48Å; S67-A71 PolarHBondContact O-N 3.44Å; A71-S74 WeakPolarHBondContact CA-OG 2.96Å; A71-S74 PolarHBondContact O-OG 3.48Å; A71-S74 VanDerWaalsContact O-OG 3.14Å; A71-Q75 WeakPolarHBondContact O-CG 3.12Å; A71-Q75 PolarHBondContact O-NE2 3.19Å; A71-F218 HydrophobicContact CB-CB 4.36Å; A71-I219 HydrophobicContact CB-CG1 3.87Å; A71-D222 HydrophobicContact CB-CB 4.31Å |
| 72 | G | 88.1 | Confident | 89 | Confident | 2 Ų | 2 | 33.4 Ų | 33.4 | 2% | 0.021 | 18% | 0.181 | C | C | . | . | H | α-helix | trans | -63.3 | -53.4 | 178.1 | 0 | 0 | 0 | 0 | 0 | 112 | S68 L69 I70 Q75 M76 | S68-G72 WeakPolarHBondContact O-CA 3.49Å; S68-G72 PolarHBondContact O-N 3.43Å; L69-G72 PolarHBondContact O-N 3.46Å; I70-G72 VanDerWaalsContact C-N 3.31Å; I70-G72 PolarHBondContact O-N 2.85Å; G72-Q75 PolarHBondContact O-N 2.82Å; G72-M76 WeakPolarHBondContact O-CG 3.31Å |
| 73 | L | 89.7 | Confident | 89 | Confident | 3 Ų | 3 | 31.7 Ų | 31.7 | 2% | 0.016 | 17% | 0.173 | C | C | . | . | H | α-helix | trans | -73.9 | -34.7 | -175.6 | -77 | 169.3 | 0 | 0 | 0 | 114 | L69 Q75 M76 A81 V198 F335 | L69-L73 WeakPolarHBondContact O-CB 3.28Å; L69-L73 PolarHBondContact O-N 3.01Å; L73-Q75 PolarHBondContact O-N 3.5Å; L73-M76 PolarHBondContact O-N 3.19Å; L73-A81 HydrophobicContact CD2-CB 3.71Å; L73-V198 HydrophobicContact CD1-CB 4.09Å; L73-V198 HydrophobicContact CD1-CG1 4.17Å; L73-V198 HydrophobicContact CD1-CG2 3.98Å; L73-F335 HydrophobicContact CD1-CD2 3.95Å; L73-F335 HydrophobicContact CD1-CE2 4.14Å; L73-F335 HydrophobicContact CD2-CD2 3.64Å; L73-F335 HydrophobicContact CD2-CE2 3.99Å; L73-F335 HydrophobicContact CG-CD2 3.99Å |
| 74 | S | 88.9 | Confident | 89 | Confident | 15 Ų | 15 | 29 Ų | 29 | 11% | 0.105 | 16% | 0.155 | C | C | . | . | H | α-helix | trans | -63 | -21.2 | 176.9 | 55 | 0 | 0 | 0 | 0 | 113.4 | I70 A71 T215 | I70-S74 WeakPolarHBondContact O-CB 3.33Å; I70-S74 PolarHBondContact O-N 3.42Å; I70-S74 PolarHBondContact O-OG 2.94Å; A71-S74 WeakPolarHBondContact CA-OG 2.96Å; A71-S74 PolarHBondContact O-OG 3.48Å; A71-S74 VanDerWaalsContact O-OG 3.14Å; S74-T215 WeakPolarHBondContact OG-CG2 3.18Å |
| 75 | Q | 84.4 | Confident | 88.9 | Confident | 90 Ų | 90 | 30.1 Ų | 30.1 | 42% | 0.421 | 17% | 0.165 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -93.8 | 9.6 | 176.7 | -67 | 177.5 | 77.9 | 0 | 0 | 113.4 | A71 G72 L73 I219 | A71-Q75 WeakPolarHBondContact O-CG 3.12Å; A71-Q75 PolarHBondContact O-NE2 3.19Å; G72-Q75 PolarHBondContact O-N 2.82Å; L73-Q75 PolarHBondContact O-N 3.5Å; Q75-I219 HydrophobicContact CG-CD1 4.2Å |
| 76 | M | 83.7 | Confident | 89.1 | Confident | 12 Ų | 12 | 36.3 Ų | 36.3 | 6% | 0.059 | 19% | 0.192 | C | C | . | . | S | Bend | trans | -120.1 | 147.3 | -175.8 | -67 | -171 | 75.6 | 0 | 0 | 112.4 | G72 L73 I84 A205 R331 L448 | G72-M76 WeakPolarHBondContact O-CG 3.31Å; L73-M76 PolarHBondContact O-N 3.19Å; M76-I84 HydrophobicContact CE-CD1 3.24Å; M76-I84 HydrophobicContact CE-CG1 4.34Å; M76-I84 HydrophobicContact SD-CD1 4.06Å; M76-A205 WeakPolarHBondContact O-CB 3.47Å; M76-R331 HydrophobicContact CG-CB 4.05Å; M76-R331 HydrophobicContact CG-CG 4.21Å; M76-R331 HydrophobicContact SD-CB 3.73Å; M76-L448 HydrophobicContact CE-CD2 3.78Å |
| 77 | E | 85.4 | Confident | 89.1 | Confident | 103 Ų | 103 | 38.8 Ų | 38.8 | 48% | 0.481 | 20% | 0.199 | S | C | . | . | trans | -69.4 | 143.1 | 164.5 | -65.2 | -176.7 | -173.9 | 0 | 0 | 110.7 | K79 S80 A81 | E77-K79 PolarHBondContact O-N 3.08Å; E77-S80 WeakPolarHBondContact O-CB 3Å; E77-S80 PolarHBondContact O-N 3.05Å; E77-A81 PolarHBondContact O-N 3.26Å | ||
| 78 | V | 83 | Confident | 89.2 | Confident | 75 Ų | 75 | 38.7 Ų | 38.7 | 46% | 0.455 | 20% | 0.198 | S | C | . | . | H | α-helix | trans | -55.4 | -38.5 | -178.8 | -177.4 | 0 | 0 | 0 | 0 | 112 | S80 A81 A82 I202 | V78-S80 PolarHBondContact O-N 3.3Å; V78-A81 PolarHBondContact O-N 2.96Å; V78-A82 WeakPolarHBondContact O-CB 3.22Å; V78-A82 PolarHBondContact O-N 3.32Å; V78-I202 HydrophobicContact CG1-CG2 4.34Å; V78-I202 HydrophobicContact CG2-CG2 4.23Å |
| 79 | K | 87 | Confident | 89.2 | Confident | 171 Ų | 171 | 41.7 Ų | 41.7 | 74% | 0.743 | 22% | 0.218 | S | C | * | . | H | α-helix | trans | -64.7 | -37.9 | 177.6 | -68.3 | -177.2 | -179 | 176.8 | 0 | 112.5 | E77 S83 | E77-K79 PolarHBondContact O-N 3.08Å; K79-S83 WeakPolarHBondContact O-CB 3.45Å; K79-S83 PolarHBondContact O-N 3.23Å; K79-S83 VanDerWaalsContact O-N 3.09Å |
| 80 | S | 87.1 | Confident | 89.3 | Confident | 8 Ų | 8 | 43.3 Ų | 43.3 | 6% | 0.056 | 23% | 0.232 | C | C | . | . | H | α-helix | trans | -71.4 | -42.2 | 177.2 | -58.5 | 0 | 0 | 0 | 0 | 110.8 | E77 V78 S83 I84 K447 | E77-S80 WeakPolarHBondContact O-CB 3Å; E77-S80 PolarHBondContact O-N 3.05Å; V78-S80 PolarHBondContact O-N 3.3Å; S80-S83 WeakPolarHBondContact O-CB 3.21Å; S80-S83 PolarHBondContact O-N 3.18Å; S80-I84 WeakPolarHBondContact O-CG1 3.46Å; S80-I84 PolarHBondContact O-N 2.82Å; S80-K447 PolarHBondContact OG-O 2.8Å |
| 81 | A | 87.2 | Confident | 89.5 | Confident | 5 Ų | 5 | 44 Ų | 44 | 4% | 0.041 | 23% | 0.234 | C | C | . | . | H | α-helix | trans | -59.6 | -48.1 | 174.6 | 0 | 0 | 0 | 0 | 0 | 112 | L73 E77 V78 S83 I84 A85 | L73-A81 HydrophobicContact CD2-CB 3.71Å; E77-A81 PolarHBondContact O-N 3.26Å; V78-A81 PolarHBondContact O-N 2.96Å; A81-S83 VanDerWaalsContact C-N 3.28Å; A81-S83 PolarHBondContact O-N 2.88Å; A81-I84 PolarHBondContact O-N 3.11Å; A81-A85 PolarHBondContact O-N 3.39Å |
| 82 | A | 88.1 | Confident | 89.6 | Confident | 60 Ų | 60 | 44.1 Ų | 44.1 | 50% | 0.496 | 24% | 0.235 | S | C | . | . | H | α-helix | trans | -60.1 | -38.5 | 176.4 | 0 | 0 | 0 | 0 | 0 | 112.3 | V78 A85 F86 | V78-A82 WeakPolarHBondContact O-CB 3.22Å; V78-A82 PolarHBondContact O-N 3.32Å; A82-A85 PolarHBondContact O-N 3.46Å; A82-F86 WeakPolarHBondContact O-CB 3.41Å; A82-F86 PolarHBondContact O-N 3.49Å |
| 83 | S | 91.8 | Very high | 89.8 | Confident | 9 Ų | 9 | 48.3 Ų | 48.3 | 6% | 0.063 | 26% | 0.26 | C | S | . | . | H | α-helix | trans | -66.6 | -41.4 | 176.5 | -166 | 0 | 0 | 0 | 0 | 112.7 | K79 S80 A81 A85 F86 W87 K447 | K79-S83 WeakPolarHBondContact O-CB 3.45Å; K79-S83 PolarHBondContact O-N 3.23Å; K79-S83 VanDerWaalsContact O-N 3.09Å; S80-S83 WeakPolarHBondContact O-CB 3.21Å; S80-S83 PolarHBondContact O-N 3.18Å; A81-S83 VanDerWaalsContact C-N 3.28Å; A81-S83 PolarHBondContact O-N 2.88Å; S83-A85 VanDerWaalsContact C-N 3.34Å; S83-F86 PolarHBondContact O-N 2.92Å; S83-W87 PolarHBondContact O-N 3.34Å; S83-K447 PolarHBondContact OG-NZ 3.19Å |
| 84 | I | 92.1 | Very high | 90 | Very high | 1 Ų | 1 | 51.9 Ų | 51.9 | 1% | 0.005 | 28% | 0.282 | C | S | . | . | H | α-helix | trans | -62 | -46.1 | 175.8 | -70.7 | 177.6 | 0 | 0 | 0 | 109.7 | M76 S80 A81 F86 W87 A88 V332 F335 V336 V440 C444 L448 | M76-I84 HydrophobicContact CE-CD1 3.24Å; M76-I84 HydrophobicContact CE-CG1 4.34Å; M76-I84 HydrophobicContact SD-CD1 4.06Å; S80-I84 WeakPolarHBondContact O-CG1 3.46Å; S80-I84 PolarHBondContact O-N 2.82Å; A81-I84 PolarHBondContact O-N 3.11Å; I84-F86 PolarHBondContact O-N 2.86Å; I84-W87 PolarHBondContact O-N 3.35Å; I84-A88 VanDerWaalsContact O-CB 3.26Å; I84-A88 WeakPolarHBondContact O-CB 3.38Å; I84-A88 PolarHBondContact O-N 3.42Å; I84-V332 HydrophobicContact CD1-CB 4.5Å; I84-V332 HydrophobicContact CD1-CG2 3.85Å; I84-F335 HydrophobicContact CB-CD1 4.43Å; I84-F335 HydrophobicContact CG2-CB 4.24Å; I84-F335 HydrophobicContact CG2-CD1 3.43Å; I84-F335 VanDerWaalsContact CG2-CD1 3.43Å; I84-F335 HydrophobicContact CG2-CE1 4.12Å; I84-F335 HydrophobicContact CG2-CG 4.06Å; I84-V336 HydrophobicContact CG2-CG2 3.68Å; I84-V440 HydrophobicContact CB-CG1 4.21Å; I84-V440 HydrophobicContact CG1-CG1 4.31Å; I84-V440 HydrophobicContact CG2-CG1 3.78Å; I84-C444 HydrophobicContact CG1-CB 4.08Å; I84-L448 HydrophobicContact CD1-CD2 4.2Å |
| 85 | A | 89.6 | Confident | 90.3 | Very high | 28 Ų | 28 | 51.2 Ų | 51.2 | 23% | 0.231 | 28% | 0.277 | C | S | . | . | H | α-helix | trans | -58.2 | -48.3 | 178.1 | 0 | 0 | 0 | 0 | 0 | 112.2 | A81 A82 S83 W87 A88 C89 F335 | A81-A85 PolarHBondContact O-N 3.39Å; A82-A85 PolarHBondContact O-N 3.46Å; S83-A85 VanDerWaalsContact C-N 3.34Å; A85-W87 PolarHBondContact O-N 3.43Å; A85-A88 PolarHBondContact O-N 3.24Å; A85-C89 PolarHBondContact O-N 3.29Å; A85-C89 PolarHBondContact O-SG 3.23Å; A85-C89 VanDerWaalsContact O-SG 3.35Å; A85-F335 HydrophobicContact CB-CE1 3.66Å; A85-F335 HydrophobicContact CB-CZ 3.57Å |
| 86 | F | 92.5 | Very high | 90.8 | Very high | 131 Ų | 131 | 47.1 Ų | 47.1 | 58% | 0.575 | 26% | 0.258 | S | S | * | . | H | α-helix | trans | -57.6 | -50.8 | 177.6 | 176.7 | -97.3 | 0 | 0 | 0 | 112.1 | A82 S83 I84 A88 C89 A90 | A82-F86 WeakPolarHBondContact O-CB 3.41Å; A82-F86 PolarHBondContact O-N 3.49Å; S83-F86 PolarHBondContact O-N 2.92Å; I84-F86 PolarHBondContact O-N 2.86Å; F86-A88 PolarHBondContact O-N 3.46Å; F86-C89 PolarHBondContact O-N 2.85Å; F86-A90 WeakPolarHBondContact O-CB 3.36Å; F86-A90 PolarHBondContact O-N 3.2Å |
| 87 | W | 95 | Very high | 91.3 | Very high | 94 Ų | 94 | 48.5 Ų | 48.5 | 36% | 0.356 | 27% | 0.271 | S | S | . | . | H | α-helix | trans | -69.4 | -31.9 | -178.7 | -72.5 | 120.9 | 0 | 0 | 0 | 113.1 | S83 I84 A85 Y91 V440 L443 C444 | S83-W87 PolarHBondContact O-N 3.34Å; I84-W87 PolarHBondContact O-N 3.35Å; A85-W87 PolarHBondContact O-N 3.43Å; W87-Y91 VanDerWaalsContact O-CB 3.25Å; W87-Y91 WeakPolarHBondContact O-CB 3.48Å; W87-Y91 PolarHBondContact O-N 3.43Å; W87-V440 HydrophobicContact CB-CG1 4.17Å; W87-V440 HydrophobicContact CB-CG2 4.1Å; W87-L443 HydrophobicContact CB-CD1 4.45Å; W87-L443 HydrophobicContact CD2-CB 4.38Å; W87-L443 HydrophobicContact CD2-CD1 3.84Å; W87-L443 HydrophobicContact CE3-CD1 3.72Å; W87-L443 HydrophobicContact CG-CB 4.29Å; W87-L443 HydrophobicContact CG-CD1 4.18Å; W87-L443 HydrophobicContact CZ3-CD1 4.24Å; W87-C444 VanDerWaalsContact CD1-SG 3.55Å |
| 88 | A | 94 | Very high | 91.8 | Very high | 1 Ų | 1 | 46.9 Ų | 46.9 | 1% | 0.008 | 27% | 0.266 | C | S | . | . | H | α-helix | trans | -64.8 | -50.7 | 174 | 0 | 0 | 0 | 0 | 0 | 110.9 | I84 A85 F86 A90 Y91 Y92 V336 V440 | I84-A88 VanDerWaalsContact O-CB 3.26Å; I84-A88 WeakPolarHBondContact O-CB 3.38Å; I84-A88 PolarHBondContact O-N 3.42Å; A85-A88 PolarHBondContact O-N 3.24Å; F86-A88 PolarHBondContact O-N 3.46Å; A88-A90 PolarHBondContact O-N 2.78Å; A88-Y91 PolarHBondContact O-N 2.78Å; A88-Y92 HydrophobicContact CB-CE2 4.15Å; A88-Y92 WeakPolarHBondContact O-CD2 3.47Å; A88-Y92 PolarHBondContact O-N 2.9Å; A88-V336 HydrophobicContact CB-CG1 4.38Å; A88-V336 HydrophobicContact CB-CG2 4.16Å; A88-V440 HydrophobicContact CB-CG2 4.13Å |
| 89 | C | 91.3 | Very high | 92.5 | Very high | 64 Ų | 64 | 43.3 Ų | 43.3 | 43% | 0.432 | 24% | 0.244 | S | C | . | . | H | α-helix | trans | -60.3 | -44.3 | 176.5 | -66.9 | 0 | 0 | 0 | 0 | 112 | A85 F86 Y91 Y92 V93 | A85-C89 PolarHBondContact O-N 3.29Å; A85-C89 PolarHBondContact O-SG 3.23Å; A85-C89 VanDerWaalsContact O-SG 3.35Å; F86-C89 PolarHBondContact O-N 2.85Å; C89-Y91 PolarHBondContact O-N 3.14Å; C89-Y92 PolarHBondContact O-N 3.38Å; C89-V93 WeakPolarHBondContact O-CG2 3.42Å; C89-V93 PolarHBondContact O-N 3.24Å |
| 90 | A | 93.5 | Very high | 92.9 | Very high | 35 Ų | 35 | 35.2 Ų | 35.2 | 29% | 0.289 | 21% | 0.209 | S | C | . | . | H | α-helix | trans | -61.6 | -43.1 | 177.3 | 0 | 0 | 0 | 0 | 0 | 111.9 | F86 A88 V94 | F86-A90 WeakPolarHBondContact O-CB 3.36Å; F86-A90 PolarHBondContact O-N 3.2Å; A88-A90 PolarHBondContact O-N 2.78Å; A90-V94 WeakPolarHBondContact O-CB 3.48Å; A90-V94 VanDerWaalsContact O-CG2 3.25Å; A90-V94 WeakPolarHBondContact O-CG2 3.35Å; A90-V94 PolarHBondContact O-N 3.44Å; A90-V94 VanDerWaalsContact O-N 3.14Å |
| 91 | Y | 96 | Very high | 93.4 | Very high | 15 Ų | 15 | 38 Ų | 38 | 6% | 0.059 | 23% | 0.225 | C | C | . | . | H | α-helix | trans | -60 | -50 | 175.3 | 172.1 | -91.4 | 0 | 0 | 0 | 111.1 | W87 A88 C89 V93 V94 T95 V283 G432 Y435 G436 V439 | W87-Y91 VanDerWaalsContact O-CB 3.25Å; W87-Y91 WeakPolarHBondContact O-CB 3.48Å; W87-Y91 PolarHBondContact O-N 3.43Å; A88-Y91 PolarHBondContact O-N 2.78Å; C89-Y91 PolarHBondContact O-N 3.14Å; Y91-V93 PolarHBondContact O-N 3.01Å; Y91-V94 PolarHBondContact O-N 2.85Å; Y91-T95 HydrophobicContact CD1-CG2 4.31Å; Y91-T95 HydrophobicContact CD2-CG2 4.05Å; Y91-T95 HydrophobicContact CE1-CG2 3.89Å; Y91-T95 HydrophobicContact CE2-CG2 3.63Å; Y91-T95 HydrophobicContact CG-CG2 4.37Å; Y91-T95 WeakPolarHBondContact O-CG2 3.31Å; Y91-T95 PolarHBondContact O-N 2.86Å; Y91-T95 PolarHBondContact O-OG1 3.15Å; Y91-V283 HydrophobicContact CD2-CG1 4.25Å; Y91-V283 HydrophobicContact CE2-CG1 3.86Å; Y91-G432 WeakPolarHBondContact CE1-O 3.24Å; Y91-G432 PolarHBondContact OH-O 2.89Å; Y91-Y435 WeakPolarHBondContact OH-CB 3.41Å; Y91-G436 PolarHBondContact OH-N 2.91Å; Y91-V439 HydrophobicContact CD2-CB 4.21Å; Y91-V439 HydrophobicContact CD2-CG1 3.98Å; Y91-V439 HydrophobicContact CD2-CG2 4.43Å; Y91-V439 HydrophobicContact CE2-CB 4.3Å; Y91-V439 HydrophobicContact CE2-CG1 4.47Å; Y91-V439 HydrophobicContact CE2-CG2 4.11Å |
| 92 | Y | 93.4 | Very high | 93.9 | Very high | 5 Ų | 5 | 39 Ų | 39 | 2% | 0.02 | 23% | 0.231 | C | C | . | . | H | α-helix | trans | -61.9 | -45.8 | -178.6 | -60.8 | -34.4 | 0 | 0 | 0 | 112.6 | A88 C89 V94 T95 T96 V336 I339 G340 N344 | A88-Y92 HydrophobicContact CB-CE2 4.15Å; A88-Y92 WeakPolarHBondContact O-CD2 3.47Å; A88-Y92 PolarHBondContact O-N 2.9Å; C89-Y92 PolarHBondContact O-N 3.38Å; Y92-V94 VanDerWaalsContact C-N 3.28Å; Y92-V94 PolarHBondContact O-N 3.48Å; Y92-T95 PolarHBondContact O-N 2.99Å; Y92-T95 PolarHBondContact O-OG1 3.42Å; Y92-T96 VanDerWaalsContact O-CB 3.28Å; Y92-T96 WeakPolarHBondContact O-CB 3.39Å; Y92-T96 PolarHBondContact O-N 3.29Å; Y92-T96 PolarHBondContact O-OG1 2.68Å; Y92-V336 WeakPolarHBondContact OH-CG1 3.49Å; Y92-V336 PolarHBondContact OH-O 2.94Å; Y92-I339 HydrophobicContact CE2-CG2 4.29Å; Y92-G340 VanDerWaalsContact CZ-CA 3.44Å; Y92-G340 WeakPolarHBondContact OH-CA 3.35Å; Y92-N344 HydrophobicContact CD1-CB 3.27Å; Y92-N344 WeakPolarHBondContact CD1-ND2 3.38Å; Y92-N344 VanDerWaalsContact CD1-OD1 3.31Å; Y92-N344 WeakPolarHBondContact CD1-OD1 3.49Å; Y92-N344 HydrophobicContact CD2-CB 4.07Å; Y92-N344 HydrophobicContact CE1-CB 3.51Å; Y92-N344 VanDerWaalsContact CE1-CG 3.49Å; Y92-N344 WeakPolarHBondContact CE1-ND2 3.33Å; Y92-N344 HydrophobicContact CE2-CB 4.25Å; Y92-N344 HydrophobicContact CG-CB 3.59Å |
| 93 | V | 91.5 | Very high | 94.3 | Very high | 90 Ų | 90 | 36.1 Ų | 36.1 | 55% | 0.545 | 21% | 0.207 | S | C | . | . | H | α-helix | trans | -58.3 | -43.1 | 176.2 | 170.7 | 0 | 0 | 0 | 0 | 111.2 | C89 Y91 A97 | C89-V93 WeakPolarHBondContact O-CG2 3.42Å; C89-V93 PolarHBondContact O-N 3.24Å; Y91-V93 PolarHBondContact O-N 3.01Å; V93-A97 VanDerWaalsContact O-CB 3.29Å; V93-A97 WeakPolarHBondContact O-CB 3.27Å; V93-A97 PolarHBondContact O-N 3.08Å; V93-A97 VanDerWaalsContact O-N 3.1Å |
| 94 | V | 93.8 | Very high | 94.6 | Very high | 78 Ų | 78 | 36.5 Ų | 36.5 | 47% | 0.473 | 21% | 0.209 | S | C | . | . | H | α-helix | trans | -68.8 | -47.9 | -179.7 | 171 | 0 | 0 | 0 | 0 | 111.6 | A90 Y91 Y92 T96 A97 L98 | A90-V94 WeakPolarHBondContact O-CB 3.48Å; A90-V94 VanDerWaalsContact O-CG2 3.25Å; A90-V94 WeakPolarHBondContact O-CG2 3.35Å; A90-V94 PolarHBondContact O-N 3.44Å; A90-V94 VanDerWaalsContact O-N 3.14Å; Y91-V94 PolarHBondContact O-N 2.85Å; Y92-V94 VanDerWaalsContact C-N 3.28Å; Y92-V94 PolarHBondContact O-N 3.48Å; V94-T96 PolarHBondContact O-N 3.16Å; V94-A97 PolarHBondContact O-N 3.27Å; V94-L98 HydrophobicContact CG1-CD1 4.02Å; V94-L98 VanDerWaalsContact O-CG 3.28Å; V94-L98 WeakPolarHBondContact O-CG 3.47Å; V94-L98 PolarHBondContact O-N 2.9Å |
| 95 | T | 96.2 | Very high | 94.9 | Very high | 0 Ų | 0 | 40.8 Ų | 40.8 | 0% | 0 | 23% | 0.23 | C | C | . | . | H | α-helix | trans | -67.1 | -38.2 | -178 | 55 | 0 | 0 | 0 | 0 | 112.1 | Y91 Y92 L98 A99 H275 L280 D346 | Y91-T95 HydrophobicContact CD1-CG2 4.31Å; Y91-T95 HydrophobicContact CD2-CG2 4.05Å; Y91-T95 HydrophobicContact CE1-CG2 3.89Å; Y91-T95 HydrophobicContact CE2-CG2 3.63Å; Y91-T95 HydrophobicContact CG-CG2 4.37Å; Y91-T95 WeakPolarHBondContact O-CG2 3.31Å; Y91-T95 PolarHBondContact O-N 2.86Å; Y91-T95 PolarHBondContact O-OG1 3.15Å; Y92-T95 PolarHBondContact O-N 2.99Å; Y92-T95 PolarHBondContact O-OG1 3.42Å; T95-L98 PolarHBondContact O-N 3.45Å; T95-A99 WeakPolarHBondContact O-CB 3.48Å; T95-A99 PolarHBondContact O-N 3.42Å; T95-H275 PolarHBondContact O-CE1 3.22Å; T95-L280 HydrophobicContact CG2-CD2 3.96Å; T95-D346 WeakPolarHBondContact CB-OD2 3.28Å; T95-D346 PolarHBondContact OG1-OD1 3.39Å; T95-D346 PolarHBondContact OG1-OD2 3Å |
| 96 | T | 94.6 | Very high | 95.2 | Very high | 5 Ų | 5 | 40.5 Ų | 40.5 | 3% | 0.031 | 23% | 0.225 | C | C | . | . | H | α-helix | trans | -67.5 | -42.6 | 177.5 | -56.7 | 0 | 0 | 0 | 0 | 111 | Y92 V94 L98 A99 V100 D346 A349 T380 | Y92-T96 VanDerWaalsContact O-CB 3.28Å; Y92-T96 WeakPolarHBondContact O-CB 3.39Å; Y92-T96 PolarHBondContact O-N 3.29Å; Y92-T96 PolarHBondContact O-OG1 2.68Å; V94-T96 PolarHBondContact O-N 3.16Å; T96-L98 VanDerWaalsContact C-N 3.32Å; T96-L98 PolarHBondContact O-N 3.4Å; T96-A99 WeakPolarHBondContact O-CB 3.44Å; T96-A99 PolarHBondContact O-N 2.98Å; T96-V100 WeakPolarHBondContact O-CG2 3.46Å; T96-V100 PolarHBondContact O-N 3.32Å; T96-D346 WeakPolarHBondContact CA-OD1 3.36Å; T96-D346 WeakPolarHBondContact CB-OD1 3.47Å; T96-D346 PolarHBondContact N-OD1 3.34Å; T96-D346 PolarHBondContact OG1-OD1 2.93Å; T96-A349 HydrophobicContact CG2-CB 3.49Å; T96-A349 VanDerWaalsContact CG2-CB 3.49Å; T96-T380 HydrophobicContact CG2-CG2 3.92Å |
| 97 | A | 93.4 | Very high | 95.5 | Very high | 41 Ų | 41 | 34.3 Ų | 34.3 | 34% | 0.339 | 20% | 0.198 | S | C | . | . | H | α-helix | trans | -60.7 | -40.3 | 174.4 | 0 | 0 | 0 | 0 | 0 | 112.2 | V93 V94 T101 | V93-A97 VanDerWaalsContact O-CB 3.29Å; V93-A97 WeakPolarHBondContact O-CB 3.27Å; V93-A97 PolarHBondContact O-N 3.08Å; V93-A97 VanDerWaalsContact O-N 3.1Å; V94-A97 PolarHBondContact O-N 3.27Å; A97-T101 WeakPolarHBondContact O-CB 3.35Å; A97-T101 PolarHBondContact O-N 3.5Å; A97-T101 PolarHBondContact O-OG1 3.16Å |
| 98 | L | 96.5 | Very high | 95.5 | Very high | 69 Ų | 69 | 33.4 Ų | 33.4 | 36% | 0.361 | 20% | 0.199 | S | C | . | . | H | α-helix | trans | -65.5 | -41.4 | 174.2 | -69 | 171.7 | 0 | 0 | 0 | 111.9 | V94 T95 T96 T101 V102 T279 V283 | V94-L98 HydrophobicContact CG1-CD1 4.02Å; V94-L98 VanDerWaalsContact O-CG 3.28Å; V94-L98 WeakPolarHBondContact O-CG 3.47Å; V94-L98 PolarHBondContact O-N 2.9Å; T95-L98 PolarHBondContact O-N 3.45Å; T96-L98 VanDerWaalsContact C-N 3.32Å; T96-L98 PolarHBondContact O-N 3.4Å; L98-T101 PolarHBondContact O-N 3.32Å; L98-V102 WeakPolarHBondContact O-CG2 3.07Å; L98-V102 PolarHBondContact O-N 3.46Å; L98-T279 HydrophobicContact CB-CG2 3.79Å; L98-T279 HydrophobicContact CD1-CG2 3.99Å; L98-T279 HydrophobicContact CG-CG2 4.47Å; L98-V283 HydrophobicContact CD1-CG2 4.08Å |
| 99 | A | 97.7 | Very high | 95.6 | Very high | 0 Ų | 0 | 39.9 Ų | 39.9 | 0% | 0 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -61.3 | -48.9 | 178 | 0 | 0 | 0 | 0 | 0 | 111.5 | T95 T96 T101 V102 G103 D346 L350 | T95-A99 WeakPolarHBondContact O-CB 3.48Å; T95-A99 PolarHBondContact O-N 3.42Å; T96-A99 WeakPolarHBondContact O-CB 3.44Å; T96-A99 PolarHBondContact O-N 2.98Å; A99-T101 VanDerWaalsContact C-N 3.31Å; A99-T101 PolarHBondContact O-N 2.97Å; A99-V102 PolarHBondContact O-N 3.25Å; A99-G103 PolarHBondContact O-N 2.58Å; A99-D346 HydrophobicContact CB-CB 3.88Å; A99-D346 WeakPolarHBondContact CB-O 3.15Å; A99-L350 HydrophobicContact CB-CB 4.24Å; A99-L350 WeakPolarHBondContact O-CD1 3.29Å; A99-L350 WeakPolarHBondContact O-CG 3.36Å |
| 100 | V | 96.5 | Very high | 95.8 | Very high | 0 Ų | 0 | 39.8 Ų | 39.8 | 0% | 0 | 23% | 0.228 | C | C | . | . | H | α-helix | trans | -59.9 | -43.3 | 176.2 | 172.3 | 0 | 0 | 0 | 0 | 110.9 | T96 V102 G103 I104 A349 A353 S376 | T96-V100 WeakPolarHBondContact O-CG2 3.46Å; T96-V100 PolarHBondContact O-N 3.32Å; V100-V102 PolarHBondContact O-N 3.33Å; V100-G103 PolarHBondContact O-N 3.4Å; V100-I104 HydrophobicContact CG1-CD1 3.69Å; V100-I104 HydrophobicContact CG1-CG1 4.24Å; V100-I104 WeakPolarHBondContact O-CG1 3.26Å; V100-I104 PolarHBondContact O-N 2.9Å; V100-A349 HydrophobicContact CG2-CB 3.43Å; V100-A349 VanDerWaalsContact CG2-CB 3.43Å; V100-A353 HydrophobicContact CG1-CB 3.99Å; V100-S376 VanDerWaalsContact CG1-OG 3.23Å; V100-S376 WeakPolarHBondContact CG1-OG 3.27Å |
| 101 | T | 96.2 | Very high | 95.7 | Very high | 66 Ų | 66 | 44.6 Ų | 44.6 | 41% | 0.405 | 24% | 0.244 | S | C | . | . | H | α-helix | trans | -59.8 | -45.3 | 177.3 | -58.5 | 0 | 0 | 0 | 0 | 111.6 | A97 L98 A99 G103 I104 I105 | A97-T101 WeakPolarHBondContact O-CB 3.35Å; A97-T101 PolarHBondContact O-N 3.5Å; A97-T101 PolarHBondContact O-OG1 3.16Å; L98-T101 PolarHBondContact O-N 3.32Å; A99-T101 VanDerWaalsContact C-N 3.31Å; A99-T101 PolarHBondContact O-N 2.97Å; T101-G103 VanDerWaalsContact C-N 3.35Å; T101-G103 PolarHBondContact O-N 3.26Å; T101-I104 PolarHBondContact O-N 3.47Å; T101-I105 HydrophobicContact CG2-CD1 3.79Å; T101-I105 HydrophobicContact CG2-CG1 4.45Å; T101-I105 WeakPolarHBondContact O-CB 3.24Å; T101-I105 VanDerWaalsContact O-CG1 3.26Å; T101-I105 WeakPolarHBondContact O-CG1 3.45Å; T101-I105 PolarHBondContact O-N 3.46Å |
| 102 | V | 97.5 | Very high | 95.5 | Very high | 27 Ų | 27 | 44.4 Ų | 44.4 | 16% | 0.164 | 25% | 0.245 | C | C | . | . | H | α-helix | trans | -59.9 | -45.7 | 174.9 | 170.3 | 0 | 0 | 0 | 0 | 110.9 | L98 A99 V100 I105 L106 I274 L350 | L98-V102 WeakPolarHBondContact O-CG2 3.07Å; L98-V102 PolarHBondContact O-N 3.46Å; A99-V102 PolarHBondContact O-N 3.25Å; V100-V102 PolarHBondContact O-N 3.33Å; V102-I105 PolarHBondContact O-N 2.76Å; V102-L106 HydrophobicContact CG1-CD1 3.91Å; V102-L106 WeakPolarHBondContact O-CB 3.25Å; V102-L106 WeakPolarHBondContact O-CG 3.44Å; V102-L106 PolarHBondContact O-N 3.11Å; V102-I274 HydrophobicContact CG1-CB 4.22Å; V102-I274 HydrophobicContact CG1-CG2 3.92Å; V102-L350 HydrophobicContact CG1-CD1 4.37Å |
| 103 | G | 98 | Very high | 95.2 | Very high | 0 Ų | 0 | 44.7 Ų | 44.7 | 0% | 0 | 25% | 0.249 | C | C | . | . | H | α-helix | trans | -58.3 | -50.5 | 177.3 | 0 | 0 | 0 | 0 | 0 | 112.9 | A99 V100 T101 L106 V107 V354 | A99-G103 PolarHBondContact O-N 2.58Å; V100-G103 PolarHBondContact O-N 3.4Å; T101-G103 VanDerWaalsContact C-N 3.35Å; T101-G103 PolarHBondContact O-N 3.26Å; G103-L106 PolarHBondContact O-N 3.45Å; G103-V107 WeakPolarHBondContact O-CG1 3.29Å; G103-V107 PolarHBondContact O-N 3.31Å; G103-V354 WeakPolarHBondContact O-CG2 3.39Å |
| 104 | I | 97.6 | Very high | 94.7 | Very high | 17 Ų | 17 | 44.4 Ų | 44.4 | 9% | 0.087 | 25% | 0.245 | C | C | . | . | H | α-helix | trans | -61.2 | -47.1 | 179.8 | -69.6 | 175.7 | 0 | 0 | 0 | 111.1 | V100 T101 L106 V107 L108 A353 I357 V372 | V100-I104 HydrophobicContact CG1-CD1 3.69Å; V100-I104 HydrophobicContact CG1-CG1 4.24Å; V100-I104 WeakPolarHBondContact O-CG1 3.26Å; V100-I104 PolarHBondContact O-N 2.9Å; T101-I104 PolarHBondContact O-N 3.47Å; I104-L106 VanDerWaalsContact C-N 3.31Å; I104-L106 PolarHBondContact O-N 2.89Å; I104-V107 WeakPolarHBondContact O-CG1 3.39Å; I104-V107 PolarHBondContact O-N 3.49Å; I104-L108 HydrophobicContact CG2-CD1 3.67Å; I104-L108 HydrophobicContact CG2-CG 4.31Å; I104-L108 WeakPolarHBondContact O-CB 3.36Å; I104-L108 WeakPolarHBondContact O-CG 3.16Å; I104-L108 PolarHBondContact O-N 2.9Å; I104-L108 VanDerWaalsContact O-N 3.07Å; I104-A353 HydrophobicContact CD1-CB 4.4Å; I104-A353 HydrophobicContact CG1-CB 3.9Å; I104-I357 HydrophobicContact CB-CD1 4.41Å; I104-I357 HydrophobicContact CG1-CD1 3.96Å; I104-I357 HydrophobicContact CG2-CD1 4.21Å; I104-V372 HydrophobicContact CD1-CG1 4.24Å; I104-V372 HydrophobicContact CG2-CG1 3.55Å |
| 105 | I | 97.5 | Very high | 94.1 | Very high | 90 Ų | 90 | 43.9 Ų | 43.9 | 46% | 0.462 | 24% | 0.243 | S | C | . | . | H | α-helix | trans | -58.3 | -46.8 | 178.3 | -70.8 | 169.2 | 0 | 0 | 0 | 110.1 | T101 V102 L109 | T101-I105 HydrophobicContact CG2-CD1 3.79Å; T101-I105 HydrophobicContact CG2-CG1 4.45Å; T101-I105 WeakPolarHBondContact O-CB 3.24Å; T101-I105 VanDerWaalsContact O-CG1 3.26Å; T101-I105 WeakPolarHBondContact O-CG1 3.45Å; T101-I105 PolarHBondContact O-N 3.46Å; V102-I105 PolarHBondContact O-N 2.76Å; I105-L109 HydrophobicContact CG2-CD1 3.74Å; I105-L109 HydrophobicContact CG2-CG 4.41Å; I105-L109 WeakPolarHBondContact O-CB 3.26Å; I105-L109 VanDerWaalsContact O-CG 3.22Å; I105-L109 WeakPolarHBondContact O-CG 3.48Å; I105-L109 PolarHBondContact O-N 3.43Å |
| 106 | L | 97.4 | Very high | 93.1 | Very high | 23 Ų | 23 | 46.7 Ų | 46.7 | 12% | 0.12 | 26% | 0.263 | C | S | . | . | H | α-helix | trans | -66.3 | -45.7 | -178 | -73 | 171.2 | 0 | 0 | 0 | 113.1 | V102 G103 I104 L108 L109 I110 T267 V270 I274 | V102-L106 HydrophobicContact CG1-CD1 3.91Å; V102-L106 WeakPolarHBondContact O-CB 3.25Å; V102-L106 WeakPolarHBondContact O-CG 3.44Å; V102-L106 PolarHBondContact O-N 3.11Å; G103-L106 PolarHBondContact O-N 3.45Å; I104-L106 VanDerWaalsContact C-N 3.31Å; I104-L106 PolarHBondContact O-N 2.89Å; L106-L108 VanDerWaalsContact C-N 3.29Å; L106-L108 PolarHBondContact O-N 3.11Å; L106-L109 PolarHBondContact O-N 3.08Å; L106-I110 HydrophobicContact CD2-CD1 4.45Å; L106-I110 WeakPolarHBondContact O-CB 3.13Å; L106-I110 WeakPolarHBondContact O-CG1 3.24Å; L106-I110 PolarHBondContact O-N 2.86Å; L106-T267 HydrophobicContact CB-CG2 4.22Å; L106-V270 HydrophobicContact CD1-CG1 4.3Å; L106-V270 HydrophobicContact CD2-CG1 4.46Å; L106-I274 HydrophobicContact CD1-CD1 4.17Å; L106-I274 HydrophobicContact CD2-CD1 4.31Å |
| 107 | V | 97.4 | Very high | 92.1 | Very high | 0 Ų | 0 | 47.3 Ų | 47.3 | 0% | 0 | 27% | 0.266 | C | S | . | . | H | α-helix | trans | -68.3 | -30.3 | -178.4 | 68.9 | 0 | 0 | 0 | 0 | 112.3 | G103 I104 Q111 P112 T267 V354 I357 Q361 | G103-V107 WeakPolarHBondContact O-CG1 3.29Å; G103-V107 PolarHBondContact O-N 3.31Å; I104-V107 WeakPolarHBondContact O-CG1 3.39Å; I104-V107 PolarHBondContact O-N 3.49Å; V107-Q111 WeakPolarHBondContact O-CA 3.38Å; V107-Q111 PolarHBondContact O-N 3.07Å; V107-P112 HydrophobicContact CG2-CG 3.87Å; V107-P112 WeakPolarHBondContact O-CD 3.35Å; V107-T267 HydrophobicContact CB-CG2 4.1Å; V107-V354 HydrophobicContact CB-CB 4.44Å; V107-V354 HydrophobicContact CB-CG1 4.1Å; V107-V354 HydrophobicContact CB-CG2 4.25Å; V107-V354 HydrophobicContact CG2-CG1 4.03Å; V107-I357 HydrophobicContact CB-CG2 4.48Å; V107-I357 HydrophobicContact CG1-CB 3.79Å; V107-I357 HydrophobicContact CG1-CD1 3.57Å; V107-I357 HydrophobicContact CG1-CG1 4.25Å; V107-I357 HydrophobicContact CG1-CG2 3.77Å; V107-I357 HydrophobicContact CG2-CB 4.04Å; V107-I357 HydrophobicContact CG2-CG2 3.88Å; V107-Q361 PolarHBondContact O-NE2 3.1Å |
| 108 | L | 96 | Very high | 90.9 | Very high | 75 Ų | 75 | 50.6 Ų | 50.6 | 39% | 0.393 | 27% | 0.269 | S | S | . | . | H | α-helix | trans | -74.2 | -33 | 173.9 | -68.1 | 176.5 | 0 | 0 | 0 | 112.6 | I104 L106 Q111 I357 V372 | I104-L108 HydrophobicContact CG2-CD1 3.67Å; I104-L108 HydrophobicContact CG2-CG 4.31Å; I104-L108 WeakPolarHBondContact O-CB 3.36Å; I104-L108 WeakPolarHBondContact O-CG 3.16Å; I104-L108 PolarHBondContact O-N 2.9Å; I104-L108 VanDerWaalsContact O-N 3.07Å; L106-L108 VanDerWaalsContact C-N 3.29Å; L106-L108 PolarHBondContact O-N 3.11Å; L108-Q111 VanDerWaalsContact O-CG 3.23Å; L108-Q111 WeakPolarHBondContact O-CG 3.34Å; L108-I357 HydrophobicContact CD2-CG2 4.15Å; L108-V372 HydrophobicContact CD1-CG1 4.42Å |
| 109 | L | 95.8 | Very high | 89.2 | Confident | 137 Ų | 137 | 56.3 Ų | 56.3 | 72% | 0.717 | 29% | 0.294 | S | S | * | . | H | α-helix | trans | -77.9 | -43.6 | 177.2 | -72.8 | 175.3 | 0 | 0 | 0 | 112.8 | I105 L106 | I105-L109 HydrophobicContact CG2-CD1 3.74Å; I105-L109 HydrophobicContact CG2-CG 4.41Å; I105-L109 WeakPolarHBondContact O-CB 3.26Å; I105-L109 VanDerWaalsContact O-CG 3.22Å; I105-L109 WeakPolarHBondContact O-CG 3.48Å; I105-L109 PolarHBondContact O-N 3.43Å; L106-L109 PolarHBondContact O-N 3.08Å |
| 110 | I | 95.1 | Very high | 87.2 | Confident | 62 Ų | 62 | 63.8 Ų | 63.8 | 32% | 0.318 | 33% | 0.327 | S | S | . | . | H | α-helix | trans | -80.6 | -32.7 | -176.1 | -64.6 | 171.8 | 0 | 0 | 0 | 111.1 | L106 P112 M263 T267 | L106-I110 HydrophobicContact CD2-CD1 4.45Å; L106-I110 WeakPolarHBondContact O-CB 3.13Å; L106-I110 WeakPolarHBondContact O-CG1 3.24Å; L106-I110 PolarHBondContact O-N 2.86Å; I110-P112 HydrophobicContact CG2-CB 4.44Å; I110-M263 HydrophobicContact CG2-CE 3.62Å; I110-T267 HydrophobicContact CD1-CG2 4.19Å |
| 111 | Q | 92.3 | Very high | 85.4 | Confident | 136 Ų | 136 | 67.3 Ų | 67.3 | 64% | 0.636 | 34% | 0.34 | S | S | * | . | trans | 49.2 | 59.8 | -175.5 | -57.8 | -173.2 | -23.5 | 0 | 0 | 112.9 | V107 L108 G113 | V107-Q111 WeakPolarHBondContact O-CA 3.38Å; V107-Q111 PolarHBondContact O-N 3.07Å; L108-Q111 VanDerWaalsContact O-CG 3.23Å; L108-Q111 WeakPolarHBondContact O-CG 3.34Å; Q111-G113 PolarHBondContact O-N 3.43Å | ||
| 112 | P | 91.5 | Very high | 83.1 | Confident | 11 Ų | 11 | 69.9 Ų | 69.9 | 7% | 0.071 | 36% | 0.361 | C | S | . | . | trans | -68.4 | -16.5 | -173.7 | 28.5 | -35.9 | 0 | 0 | 0 | 114.6 | V107 I110 D114 M263 T267 F358 | V107-P112 HydrophobicContact CG2-CG 3.87Å; V107-P112 WeakPolarHBondContact O-CD 3.35Å; I110-P112 HydrophobicContact CG2-CB 4.44Å; P112-D114 PolarHBondContact O-N 3.48Å; P112-M263 HydrophobicContact CB-CB 3.88Å; P112-T267 HydrophobicContact CG-CG2 4.4Å; P112-F358 HydrophobicContact CB-CD2 4.21Å; P112-F358 HydrophobicContact CG-CD2 4.06Å | ||
| 113 | G | 86.1 | Confident | 80.7 | Confident | 11 Ų | 11 | 72.2 Ų | 72.2 | 11% | 0.113 | 38% | 0.378 | C | S | . | . | trans | -84.5 | 105.4 | -179 | 0 | 0 | 0 | 0 | 0 | 112.6 | Q111 Q361 | Q111-G113 PolarHBondContact O-N 3.43Å; G113-Q361 WeakPolarHBondContact O-CB 3.25Å | ||
| 114 | D | 82.5 | Confident | 78 | Confident | 84 Ų | 84 | 78.1 Ų | 78.1 | 45% | 0.449 | 42% | 0.42 | S | S | . | . | trans | -100.6 | 122.1 | 169.7 | 178.6 | -1.1 | 0 | 0 | 0 | 109.8 | P112 S116 I117 L362 | P112-D114 PolarHBondContact O-N 3.48Å; D114-S116 PolarHBondContact O-N 2.83Å; D114-S116 WeakPolarHBondContact OD1-CB 3.04Å; D114-S116 PolarHBondContact OD1-N 3.04Å; D114-S116 PolarHBondContact OD1-OG 3.18Å; D114-S116 PolarHBondContact OD2-OG 2.97Å; D114-I117 HydrophobicContact CB-CD1 4.14Å; D114-I117 HydrophobicContact CB-CG1 4.34Å; D114-I117 WeakPolarHBondContact O-CB 3.48Å; D114-I117 WeakPolarHBondContact O-CG1 3.18Å; D114-I117 PolarHBondContact O-N 3.36Å; D114-L362 WeakPolarHBondContact O-CD2 3.37Å | ||
| 115 | P | 79.9 | Confident | 75.6 | Confident | 68 Ų | 68 | 79.4 Ų | 79.4 | 44% | 0.442 | 43% | 0.433 | S | S | . | . | G | 310 helix | trans | -53 | -23.6 | 175.5 | -27.2 | 34.6 | 0 | 0 | 0 | 115.3 | I117 R118 L362 | P115-I117 PolarHBondContact O-N 2.72Å; P115-R118 PolarHBondContact O-N 3.38Å; P115-L362 WeakPolarHBondContact CA-O 3.35Å |
| 116 | S | 75.9 | Confident | 72.9 | Confident | 59 Ų | 59 | 84.6 Ų | 84.6 | 41% | 0.413 | 46% | 0.455 | S | S | . | . | G | 310 helix | trans | -62 | -21.4 | 176.4 | 80.3 | 0 | 0 | 0 | 0 | 113.7 | D114 R118 | D114-S116 PolarHBondContact O-N 2.83Å; D114-S116 WeakPolarHBondContact OD1-CB 3.04Å; D114-S116 PolarHBondContact OD1-N 3.04Å; D114-S116 PolarHBondContact OD1-OG 3.18Å; D114-S116 PolarHBondContact OD2-OG 2.97Å; S116-R118 PolarHBondContact O-N 3.47Å |
| 117 | I | 72.7 | Confident | 70.7 | Confident | 17 Ų | 17 | 85.9 Ų | 85.9 | 9% | 0.087 | 46% | 0.462 | C | S | . | . | G | 310 helix | trans | -65.7 | -38.5 | 179.5 | -64.6 | 166 | 0 | 0 | 0 | 110.9 | D114 P115 Q119 K120 S260 L362 | D114-I117 HydrophobicContact CB-CD1 4.14Å; D114-I117 HydrophobicContact CB-CG1 4.34Å; D114-I117 WeakPolarHBondContact O-CB 3.48Å; D114-I117 WeakPolarHBondContact O-CG1 3.18Å; D114-I117 PolarHBondContact O-N 3.36Å; P115-I117 PolarHBondContact O-N 2.72Å; I117-Q119 VanDerWaalsContact C-N 3.29Å; I117-Q119 PolarHBondContact O-N 3.41Å; I117-K120 PolarHBondContact O-N 3Å; I117-S260 WeakPolarHBondContact CD1-O 3.45Å; I117-L362 HydrophobicContact CB-CD2 3.78Å; I117-L362 HydrophobicContact CD1-CD2 3.78Å; I117-L362 HydrophobicContact CG1-CD2 4.31Å; I117-L362 HydrophobicContact CG2-CD2 4.13Å |
| 118 | R | 68 | Low | 68.6 | Low | 110 Ų | 110 | 92 Ų | 92 | 42% | 0.415 | 49% | 0.489 | S | S | . | . | G | 310 helix | trans | -64.6 | -32.5 | -175.1 | -163.4 | 179.3 | -175.2 | -154.8 | -2.8 | 112.6 | P115 S116 K120 W121 N363 D410 | P115-R118 PolarHBondContact O-N 3.38Å; S116-R118 PolarHBondContact O-N 3.47Å; R118-K120 PolarHBondContact O-N 3.16Å; R118-W121 CarbonylContact O-C 3.48Å; R118-W121 PolarHBondContact O-N 2.96Å; R118-N363 PolarHBondContact NH1-OD1 3.24Å; R118-D410 IonicContact NE-OD1 3.57Å; R118-D410 IonicContact NE-OD2 2.8Å |
| 119 | Q | 61.7 | Low | 66.7 | Low | 189 Ų | 189 | 93.7 Ų | 93.7 | 88% | 0.883 | 50% | 0.498 | S | S | * | . | G | 310 helix | trans | -63.2 | -17 | -179.4 | -145.8 | 176.1 | 13.7 | 0 | 0 | 113 | I117 | I117-Q119 VanDerWaalsContact C-N 3.29Å; I117-Q119 PolarHBondContact O-N 3.41Å |
| 120 | K | 56.2 | Low | 65 | Low | 158 Ų | 158 | 88.8 Ų | 88.8 | 69% | 0.687 | 47% | 0.474 | S | S | * | . | G | 310 helix | trans | -92.4 | -13.4 | 176.9 | -66.8 | 176.1 | -177.9 | 169.1 | 0 | 114 | I117 R118 | I117-K120 PolarHBondContact O-N 3Å; R118-K120 PolarHBondContact O-N 3.16Å |
| 121 | W | 58.2 | Low | 63.7 | Low | 73 Ų | 73 | 88.8 Ų | 88.8 | 28% | 0.277 | 48% | 0.477 | S | S | . | . | trans | -127.9 | 87.2 | -171.9 | -67.4 | 84.6 | 0 | 0 | 0 | 110.2 | R118 L413 | R118-W121 CarbonylContact O-C 3.48Å; R118-W121 PolarHBondContact O-N 2.96Å; W121-L413 HydrophobicContact CB-CD2 3.57Å; W121-L413 HydrophobicContact CD2-CD2 3.18Å; W121-L413 HydrophobicContact CE3-CD2 3.4Å; W121-L413 HydrophobicContact CG-CD2 3.28Å; W121-L413 HydrophobicContact CZ2-CD2 4.48Å; W121-L413 HydrophobicContact CZ3-CD2 4.13Å | ||
| 122 | S | 47.3 | Very low | 62.5 | Low | 121 Ų | 121 | 83.8 Ų | 83.8 | 85% | 0.846 | 46% | 0.457 | S | S | * | . | trans | -97.2 | 93.7 | 167.6 | 60.2 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 123 | S | 48.1 | Very low | 61.5 | Low | 76 Ų | 76 | 88.4 Ų | 88.4 | 53% | 0.531 | 48% | 0.48 | S | S | . | . | trans | -143.1 | 108.3 | 166.6 | -26.5 | 0 | 0 | 0 | 0 | 108.4 | A125 | S123-A125 PolarHBondContact O-N 3.2Š| ||
| 124 | S | 41.5 | Very low | 61.1 | Low | 124 Ų | 124 | 89.1 Ų | 89.1 | 87% | 0.867 | 48% | 0.482 | S | S | * | . | trans | -75.4 | 107.9 | 171.9 | -61.4 | 0 | 0 | 0 | 0 | 108.5 | ||||
| 125 | A | 45.8 | Very low | 60.6 | Low | 44 Ų | 44 | 86.7 Ų | 86.7 | 36% | 0.364 | 47% | 0.47 | S | S | . | . | trans | -86.2 | 129.8 | 162.4 | 0 | 0 | 0 | 0 | 0 | 108 | S123 N127 | S123-A125 PolarHBondContact O-N 3.2Å; A125-N127 PolarHBondContact O-N 3.34Å | ||
| 126 | E | 42 | Very low | 60.2 | Low | 198 Ų | 198 | 87.1 Ų | 87.1 | 93% | 0.925 | 47% | 0.468 | S | S | * | . | trans | -70 | 96.1 | 173.5 | -166.4 | 176.9 | -155.8 | 0 | 0 | 108.4 | ||||
| 127 | N | 50.3 | Low | 60.5 | Low | 51 Ų | 51 | 87.1 Ų | 87.1 | 27% | 0.273 | 46% | 0.463 | S | S | . | . | trans | -83.9 | 129.3 | 179.7 | -78.4 | -37 | 0 | 0 | 0 | 110.3 | A125 T408 D409 | A125-N127 PolarHBondContact O-N 3.34Å; N127-T408 WeakPolarHBondContact CB-OG1 3.4Å; N127-T408 VanDerWaalsContact ND2-CB 3.34Å; N127-T408 WeakPolarHBondContact ND2-CB 3.46Å; N127-T408 PolarHBondContact ND2-O 3.47Å; N127-T408 PolarHBondContact ND2-OG1 2.96Å; N127-D409 PolarHBondContact ND2-N 3.23Å | ||
| 128 | K | 52.9 | Low | 61.1 | Low | 129 Ų | 129 | 86.9 Ų | 86.9 | 56% | 0.561 | 46% | 0.462 | S | S | * | . | trans | -77.3 | 132.4 | 174 | -74.8 | 172.5 | 177.3 | 164 | 0 | 109 | V130 | K128-V130 PolarHBondContact O-N 3.48Š| ||
| 129 | D | 56.8 | Low | 61.7 | Low | 109 Ų | 109 | 83.2 Ų | 83.2 | 58% | 0.583 | 45% | 0.45 | S | S | * | . | trans | -59.2 | 101.7 | 169.1 | -67.1 | -42.9 | 0 | 0 | 0 | 108.5 | H160 | D129-H160 PolarHBondContact O-CD2 3.08Š| ||
| 130 | V | 60.4 | Low | 62.9 | Low | 35 Ų | 35 | 78.2 Ų | 78.2 | 21% | 0.212 | 43% | 0.429 | C | S | . | . | trans | -104.6 | 110 | 169.2 | 177.3 | 0 | 0 | 0 | 0 | 106.2 | K128 T135 I398 N402 | K128-V130 PolarHBondContact O-N 3.48Å; V130-T135 HydrophobicContact CG1-CG2 3.47Å; V130-T135 VanDerWaalsContact CG1-CG2 3.47Å; V130-I398 HydrophobicContact CB-CG2 4Å; V130-N402 PolarHBondContact O-ND2 3.27Å | ||
| 131 | T | 67.2 | Low | 64.5 | Low | 62 Ų | 62 | 74.5 Ų | 74.5 | 38% | 0.38 | 41% | 0.411 | S | S | . | . | trans | -78.4 | 141 | 178.6 | -37.7 | 0 | 0 | 0 | 0 | 110.3 | L133 D134 T135 | T131-L133 HydrophobicContact CG2-CB 4.21Å; T131-L133 PolarHBondContact O-N 3.42Å; T131-D134 WeakPolarHBondContact CB-OD2 3.35Å; T131-D134 PolarHBondContact O-N 2.89Å; T131-D134 VanDerWaalsContact O-N 3.09Å; T131-D134 PolarHBondContact OG1-OD2 2.91Å; T131-T135 PolarHBondContact O-N 3.22Å | ||
| 132 | S | 66.7 | Low | 65.9 | Low | 30 Ų | 30 | 71.8 Ų | 71.8 | 21% | 0.21 | 40% | 0.401 | C | S | . | . | H | α-helix | trans | -57.3 | -37.6 | 174.8 | -39.3 | 0 | 0 | 0 | 0 | 112.6 | T135 L136 I399 T403 | S132-T135 PolarHBondContact O-N 2.92Å; S132-T135 PolarHBondContact O-OG1 3.48Å; S132-L136 PolarHBondContact O-N 3.37Å; S132-L136 VanDerWaalsContact O-N 3.15Å; S132-I399 PolarHBondContact OG-O 2.96Å; S132-I399 VanDerWaalsContact OG-O 3.13Å; S132-T403 PolarHBondContact OG-OG1 2.68Å |
| 133 | L | 71.8 | Confident | 67.9 | Low | 108 Ų | 108 | 69.2 Ų | 69.2 | 57% | 0.565 | 38% | 0.375 | S | S | * | . | H | α-helix | trans | -61.3 | -44.8 | 175.7 | -178.4 | 65 | 0 | 0 | 0 | 111.5 | T131 T135 L136 L137 | T131-L133 HydrophobicContact CG2-CB 4.21Å; T131-L133 PolarHBondContact O-N 3.42Å; L133-T135 VanDerWaalsContact C-N 3.32Å; L133-T135 PolarHBondContact O-N 2.73Å; L133-L136 PolarHBondContact O-N 2.97Å; L133-L137 HydrophobicContact CD1-CD1 4.23Å; L133-L137 HydrophobicContact CD1-CG 4.2Å; L133-L137 HydrophobicContact CD2-CD1 4.39Å; L133-L137 HydrophobicContact CG-CD1 3.85Å; L133-L137 HydrophobicContact CG-CG 4.24Å; L133-L137 WeakPolarHBondContact O-CB 3.01Å; L133-L137 VanDerWaalsContact O-CG 3.25Å; L133-L137 WeakPolarHBondContact O-CG 3.28Å; L133-L137 PolarHBondContact O-N 3.33Å |
| 134 | D | 76.7 | Confident | 70 | Confident | 27 Ų | 27 | 72.6 Ų | 72.6 | 14% | 0.144 | 38% | 0.38 | C | S | . | . | H | α-helix | trans | -61.6 | -42.4 | -179.5 | -71 | -52.7 | 0 | 0 | 0 | 111.7 | T131 L136 L137 D138 T158 H160 | T131-D134 WeakPolarHBondContact CB-OD2 3.35Å; T131-D134 PolarHBondContact O-N 2.89Å; T131-D134 VanDerWaalsContact O-N 3.09Å; T131-D134 PolarHBondContact OG1-OD2 2.91Å; D134-L136 PolarHBondContact O-N 3.45Å; D134-L137 CarbonylContact O-C 3.57Å; D134-L137 PolarHBondContact O-N 3.48Å; D134-D138 VanDerWaalsContact O-CB 3.3Å; D134-D138 WeakPolarHBondContact O-CB 3.22Å; D134-D138 PolarHBondContact O-N 3.47Å; D134-T158 HydrophobicContact CB-CG2 4.17Å; D134-H160 IonicContact OD2-CE1 3.92Å; D134-H160 IonicContact OD2-NE2 2.73Å; D134-H160 PolarHBondContact OD2-NE2 3.13Å |
| 135 | T | 73 | Confident | 72.3 | Confident | 32 Ų | 32 | 68.6 Ų | 68.6 | 20% | 0.196 | 35% | 0.352 | C | S | . | . | H | α-helix | trans | -66.6 | -35.7 | 178.3 | 61.9 | 0 | 0 | 0 | 0 | 113.2 | V130 T131 S132 L133 D138 L139 I399 | V130-T135 HydrophobicContact CG1-CG2 3.47Å; V130-T135 VanDerWaalsContact CG1-CG2 3.47Å; T131-T135 PolarHBondContact O-N 3.22Å; S132-T135 PolarHBondContact O-N 2.92Å; S132-T135 PolarHBondContact O-OG1 3.48Å; L133-T135 VanDerWaalsContact C-N 3.32Å; L133-T135 PolarHBondContact O-N 2.73Å; T135-D138 PolarHBondContact O-N 3.48Å; T135-L139 WeakPolarHBondContact O-CB 3.15Å; T135-L139 PolarHBondContact O-N 3.26Å; T135-I399 HydrophobicContact CG2-CD1 3.6Å; T135-I399 HydrophobicContact CG2-CG1 3.69Å; T135-I399 VanDerWaalsContact OG1-CD1 3.24Å; T135-I399 WeakPolarHBondContact OG1-CD1 3.36Å |
| 136 | L | 71.5 | Confident | 74.5 | Confident | 78 Ų | 78 | 74.2 Ų | 74.2 | 41% | 0.408 | 37% | 0.37 | S | S | . | . | H | α-helix | trans | -69.3 | -41.1 | 173.7 | -173.5 | 151.9 | 0 | 0 | 0 | 111 | S132 L133 D134 L139 I140 | S132-L136 PolarHBondContact O-N 3.37Å; S132-L136 VanDerWaalsContact O-N 3.15Å; L133-L136 PolarHBondContact O-N 2.97Å; D134-L136 PolarHBondContact O-N 3.45Å; L136-L139 WeakPolarHBondContact O-CB 3.45Å; L136-L139 PolarHBondContact O-N 3.35Å; L136-I140 HydrophobicContact CD2-CD1 3.7Å; L136-I140 HydrophobicContact CD2-CG1 4.5Å; L136-I140 WeakPolarHBondContact O-CG1 3.35Å; L136-I140 PolarHBondContact O-N 3.33Å; L136-I140 VanDerWaalsContact O-N 3.1Å |
| 137 | L | 82.7 | Confident | 76.9 | Confident | 58 Ų | 58 | 68.3 Ų | 68.3 | 30% | 0.304 | 35% | 0.345 | S | S | . | . | H | α-helix | trans | -65.7 | -39.3 | 174.8 | -68.8 | 175.1 | 0 | 0 | 0 | 111.4 | L133 D134 L139 I140 R141 | L133-L137 HydrophobicContact CD1-CD1 4.23Å; L133-L137 HydrophobicContact CD1-CG 4.2Å; L133-L137 HydrophobicContact CD2-CD1 4.39Å; L133-L137 HydrophobicContact CG-CD1 3.85Å; L133-L137 HydrophobicContact CG-CG 4.24Å; L133-L137 WeakPolarHBondContact O-CB 3.01Å; L133-L137 VanDerWaalsContact O-CG 3.25Å; L133-L137 WeakPolarHBondContact O-CG 3.28Å; L133-L137 PolarHBondContact O-N 3.33Å; D134-L137 CarbonylContact O-C 3.57Å; D134-L137 PolarHBondContact O-N 3.48Å; L137-L139 VanDerWaalsContact C-N 3.33Å; L137-I140 CarbonylContact O-C 3.57Å; L137-I140 PolarHBondContact O-N 2.95Å; L137-R141 VanDerWaalsContact O-CG 3.27Å; L137-R141 WeakPolarHBondContact O-CG 3.21Å; L137-R141 PolarHBondContact O-N 2.93Å |
| 138 | D | 83.6 | Confident | 79 | Confident | 13 Ų | 13 | 68.4 Ų | 68.4 | 7% | 0.07 | 35% | 0.345 | C | S | . | . | H | α-helix | trans | -64.2 | -39 | 174.9 | -72.5 | -21.1 | 0 | 0 | 0 | 111.6 | D134 T135 I140 R141 N142 R157 T158 | D134-D138 VanDerWaalsContact O-CB 3.3Å; D134-D138 WeakPolarHBondContact O-CB 3.22Å; D134-D138 PolarHBondContact O-N 3.47Å; T135-D138 PolarHBondContact O-N 3.48Å; D138-I140 VanDerWaalsContact C-N 3.34Å; D138-I140 PolarHBondContact O-N 2.86Å; D138-R141 PolarHBondContact O-N 2.97Å; D138-R141 IonicContact OD1-CZ 3.88Å; D138-R141 IonicContact OD1-NH1 2.89Å; D138-R141 PolarHBondContact OD1-NH1 3.41Å; D138-N142 WeakPolarHBondContact O-CB 3.36Å; D138-N142 PolarHBondContact O-N 2.97Å; D138-N142 PolarHBondContact O-ND2 3.35Å; D138-R157 WeakPolarHBondContact OD2-CA 3.24Å; D138-T158 PolarHBondContact OD1-N 2.98Å; D138-T158 PolarHBondContact OD1-OG1 3.26Å; D138-T158 VanDerWaalsContact OD1-OG1 3.14Å; D138-T158 PolarHBondContact OD2-N 2.79Å |
| 139 | L | 82.4 | Confident | 80.9 | Confident | 33 Ų | 33 | 70 Ų | 70 | 17% | 0.173 | 35% | 0.353 | C | S | . | . | H | α-helix | trans | -56.9 | -50.8 | 172 | -177.4 | 64.7 | 0 | 0 | 0 | 110.3 | T135 L136 L137 R141 N142 F143 L191 I384 | T135-L139 WeakPolarHBondContact O-CB 3.15Å; T135-L139 PolarHBondContact O-N 3.26Å; L136-L139 WeakPolarHBondContact O-CB 3.45Å; L136-L139 PolarHBondContact O-N 3.35Å; L137-L139 VanDerWaalsContact C-N 3.33Å; L139-R141 VanDerWaalsContact C-N 3.35Å; L139-R141 PolarHBondContact O-N 3.44Å; L139-N142 PolarHBondContact O-N 3.05Å; L139-N142 VanDerWaalsContact O-N 3.14Å; L139-F143 HydrophobicContact CD1-CE2 4.46Å; L139-F143 HydrophobicContact CG-CD2 4.4Å; L139-F143 HydrophobicContact CG-CE2 4.18Å; L139-F143 WeakPolarHBondContact O-CD2 3.43Å; L139-F143 PolarHBondContact O-N 3.33Å; L139-L191 HydrophobicContact CD1-CD2 3.44Å; L139-L191 VanDerWaalsContact CD1-CD2 3.44Å; L139-L191 HydrophobicContact CG-CD2 4.28Å; L139-I384 HydrophobicContact CD2-CG2 3.79Å |
| 140 | I | 85.6 | Confident | 82.7 | Confident | 83 Ų | 83 | 67.5 Ų | 67.5 | 43% | 0.426 | 34% | 0.337 | S | S | . | . | H | α-helix | trans | -62.1 | -40.6 | 177.6 | -63.6 | 169.9 | 0 | 0 | 0 | 111.2 | L136 L137 D138 N142 F143 F144 | L136-I140 HydrophobicContact CD2-CD1 3.7Å; L136-I140 HydrophobicContact CD2-CG1 4.5Å; L136-I140 WeakPolarHBondContact O-CG1 3.35Å; L136-I140 PolarHBondContact O-N 3.33Å; L136-I140 VanDerWaalsContact O-N 3.1Å; L137-I140 CarbonylContact O-C 3.57Å; L137-I140 PolarHBondContact O-N 2.95Å; D138-I140 VanDerWaalsContact C-N 3.34Å; D138-I140 PolarHBondContact O-N 2.86Å; I140-N142 VanDerWaalsContact C-N 3.29Å; I140-N142 PolarHBondContact O-N 3.29Å; I140-F143 WeakPolarHBondContact O-CB 3Å; I140-F143 PolarHBondContact O-N 2.93Å; I140-F144 WeakPolarHBondContact O-CD2 3.47Å |
| 141 | R | 89.3 | Confident | 84.2 | Confident | 81 Ų | 81 | 65.9 Ų | 65.9 | 31% | 0.306 | 33% | 0.328 | S | S | . | . | H | α-helix | trans | -60.6 | -40.8 | 174.7 | -71.1 | 169.3 | -171 | 125.1 | 1.2 | 111.1 | L137 D138 L139 F143 F144 V156 T158 | L137-R141 VanDerWaalsContact O-CG 3.27Å; L137-R141 WeakPolarHBondContact O-CG 3.21Å; L137-R141 PolarHBondContact O-N 2.93Å; D138-R141 PolarHBondContact O-N 2.97Å; D138-R141 IonicContact OD1-CZ 3.88Å; D138-R141 IonicContact OD1-NH1 2.89Å; D138-R141 PolarHBondContact OD1-NH1 3.41Å; L139-R141 VanDerWaalsContact C-N 3.35Å; L139-R141 PolarHBondContact O-N 3.44Å; R141-F143 VanDerWaalsContact C-N 3.32Å; R141-F143 PolarHBondContact O-N 3.48Å; R141-F144 CarbonylContact O-C 3.58Å; R141-F144 PolarHBondContact O-N 3.38Å; R141-V156 HydrophobicContact CB-CG1 4.43Å; R141-T158 PolarHBondContact NH1-OG1 3.33Å |
| 142 | N | 88.4 | Confident | 85.4 | Confident | 15 Ų | 15 | 64.7 Ų | 64.7 | 8% | 0.08 | 32% | 0.32 | C | S | . | . | H | α-helix | trans | -72 | -22.6 | 178.2 | -75.4 | -62.7 | 0 | 0 | 0 | 113.2 | D138 L139 I140 F144 Q155 V156 N189 G192 | D138-N142 WeakPolarHBondContact O-CB 3.36Å; D138-N142 PolarHBondContact O-N 2.97Å; D138-N142 PolarHBondContact O-ND2 3.35Å; L139-N142 PolarHBondContact O-N 3.05Å; L139-N142 VanDerWaalsContact O-N 3.14Å; I140-N142 VanDerWaalsContact C-N 3.29Å; I140-N142 PolarHBondContact O-N 3.29Å; N142-F144 PolarHBondContact O-N 3.42Å; N142-Q155 WeakPolarHBondContact OD1-CB 3.42Å; N142-V156 PolarHBondContact ND2-O 2.77Å; N142-V156 PolarHBondContact OD1-N 2.84Å; N142-N189 WeakPolarHBondContact CA-ND2 3.45Å; N142-N189 PolarHBondContact O-ND2 3.36Å; N142-N189 PolarHBondContact O-OD1 2.73Å; N142-N189 PolarHBondContact OD1-ND2 3.05Å; N142-G192 WeakPolarHBondContact O-CA 3.21Å; N142-G192 PolarHBondContact O-N 3.02Å; N142-G192 VanDerWaalsContact O-N 3.1Å |
| 143 | F | 88.7 | Confident | 86.5 | Confident | 68 Ų | 68 | 69.6 Ų | 69.6 | 30% | 0.298 | 34% | 0.341 | S | S | . | . | H | α-helix | trans | -60.7 | -32.5 | 166.2 | -93.2 | -95.5 | 0 | 0 | 0 | 112 | L139 I140 R141 P145 L191 V195 | L139-F143 HydrophobicContact CD1-CE2 4.46Å; L139-F143 HydrophobicContact CG-CD2 4.4Å; L139-F143 HydrophobicContact CG-CE2 4.18Å; L139-F143 WeakPolarHBondContact O-CD2 3.43Å; L139-F143 PolarHBondContact O-N 3.33Å; I140-F143 WeakPolarHBondContact O-CB 3Å; I140-F143 PolarHBondContact O-N 2.93Å; R141-F143 VanDerWaalsContact C-N 3.32Å; R141-F143 PolarHBondContact O-N 3.48Å; F143-P145 WeakPolarHBondContact O-CD 3.36Å; F143-L191 HydrophobicContact CD1-CD1 4.46Å; F143-L191 HydrophobicContact CD1-CG 4.39Å; F143-L191 HydrophobicContact CD2-CD1 4.34Å; F143-L191 HydrophobicContact CD2-CD2 3.35Å; F143-L191 HydrophobicContact CD2-CG 3.91Å; F143-L191 HydrophobicContact CE1-CD1 4.05Å; F143-L191 HydrophobicContact CE1-CG 4.45Å; F143-L191 HydrophobicContact CE2-CD1 3.95Å; F143-L191 HydrophobicContact CE2-CD2 3.46Å; F143-L191 VanDerWaalsContact CE2-CD2 3.46Å; F143-L191 HydrophobicContact CE2-CG 4.01Å; F143-L191 HydrophobicContact CG-CD2 4Å; F143-L191 HydrophobicContact CG-CG 4.09Å; F143-L191 HydrophobicContact CZ-CD1 3.77Å; F143-L191 HydrophobicContact CZ-CD2 4.17Å; F143-L191 HydrophobicContact CZ-CG 4.25Å; F143-V195 HydrophobicContact CB-CG2 4.48Å; F143-V195 HydrophobicContact CD1-CG2 3.39Å; F143-V195 HydrophobicContact CE1-CG2 3.95Å; F143-V195 HydrophobicContact CG-CG2 4.24Å |
| 144 | F | 91.6 | Very high | 87.4 | Confident | 147 Ų | 147 | 67.2 Ų | 67.2 | 65% | 0.645 | 33% | 0.328 | S | S | * | . | S | Bend | trans | -123.5 | 70.1 | -175.3 | -57.1 | -79 | 0 | 0 | 0 | 111.4 | I140 R141 N142 | I140-F144 WeakPolarHBondContact O-CD2 3.47Å; R141-F144 CarbonylContact O-C 3.58Å; R141-F144 PolarHBondContact O-N 3.38Å; N142-F144 PolarHBondContact O-N 3.42Å |
| 145 | P | 91.2 | Very high | 87.7 | Confident | 40 Ų | 40 | 67.4 Ų | 67.4 | 26% | 0.26 | 33% | 0.327 | S | S | . | . | trans | -64 | 143.8 | 179.6 | 28.7 | -35.2 | 0 | 0 | 0 | 111.3 | F143 N147 A151 | F143-P145 WeakPolarHBondContact O-CD 3.36Å; P145-N147 PolarHBondContact O-N 2.84Å; P145-A151 HydrophobicContact CB-CB 3.87Å; P145-A151 HydrophobicContact CG-CB 4.09Å | ||
| 146 | E | 91.2 | Very high | 88.4 | Confident | 161 Ų | 161 | 66.8 Ų | 66.8 | 75% | 0.752 | 32% | 0.324 | S | S | * | . | S | Bend | trans | -63.7 | -31.3 | 177.6 | -61.7 | 180 | 176.7 | 0 | 0 | 112.2 | Y184 | E146-Y184 PolarHBondContact OE2-OH 3.35Š|
| 147 | N | 93.3 | Very high | 88.9 | Confident | 75 Ų | 75 | 66.7 Ų | 66.7 | 40% | 0.401 | 32% | 0.318 | S | S | . | . | trans | -145.6 | 131.5 | -178.9 | -172.1 | -67.2 | 0 | 0 | 0 | 111.7 | P145 F149 Q150 A151 | P145-N147 PolarHBondContact O-N 2.84Å; N147-F149 PolarHBondContact O-N 3.2Å; N147-F149 WeakPolarHBondContact OD1-CA 3.23Å; N147-F149 WeakPolarHBondContact OD1-CB 3.48Å; N147-F149 PolarHBondContact OD1-N 2.82Å; N147-Q150 HydrophobicContact CB-CB 3.94Å; N147-Q150 PolarHBondContact O-N 2.91Å; N147-Q150 PolarHBondContact OD1-N 2.85Å; N147-Q150 VanDerWaalsContact OD1-N 3.16Å; N147-A151 WeakPolarHBondContact O-CB 3.39Å; N147-A151 PolarHBondContact O-N 2.9Å | ||
| 148 | L | 93 | Very high | 88.9 | Confident | 53 Ų | 53 | 65 Ų | 65 | 28% | 0.277 | 31% | 0.31 | S | S | . | . | H | α-helix | trans | -64.2 | -39.6 | -179.8 | -178.6 | 63.1 | 0 | 0 | 0 | 112.8 | A151 T152 I193 F196 | L148-A151 WeakPolarHBondContact O-CB 3.48Å; L148-A151 PolarHBondContact O-N 3.48Å; L148-T152 WeakPolarHBondContact O-CG2 3.45Å; L148-T152 PolarHBondContact O-N 3.36Å; L148-I193 HydrophobicContact CD1-CG1 4.25Å; L148-F196 HydrophobicContact CD1-CB 4.11Å; L148-F196 HydrophobicContact CD1-CD1 3.89Å; L148-F196 HydrophobicContact CD1-CG 3.93Å; L148-F196 HydrophobicContact CD2-CD1 3.73Å; L148-F196 HydrophobicContact CD2-CD2 4.3Å; L148-F196 HydrophobicContact CD2-CE1 3.5Å; L148-F196 HydrophobicContact CD2-CE2 4.09Å; L148-F196 HydrophobicContact CD2-CG 4.13Å; L148-F196 HydrophobicContact CD2-CZ 3.7Å; L148-F196 HydrophobicContact CG-CD1 4.49Å |
| 149 | F | 93.8 | Very high | 88.6 | Confident | 163 Ų | 163 | 67.8 Ų | 67.8 | 72% | 0.715 | 32% | 0.321 | S | S | * | . | H | α-helix | trans | -70 | -39.6 | 178.8 | -63.3 | -78.1 | 0 | 0 | 0 | 111.4 | N147 A151 T152 | N147-F149 PolarHBondContact O-N 3.2Å; N147-F149 WeakPolarHBondContact OD1-CA 3.23Å; N147-F149 WeakPolarHBondContact OD1-CB 3.48Å; N147-F149 PolarHBondContact OD1-N 2.82Å; F149-A151 VanDerWaalsContact C-N 3.3Å; F149-A151 PolarHBondContact O-N 2.9Å; F149-T152 WeakPolarHBondContact O-CB 3.05Å; F149-T152 PolarHBondContact O-N 2.86Å; F149-T152 VanDerWaalsContact O-N 3.09Å; F149-T152 PolarHBondContact O-OG1 3.05Å |
| 150 | Q | 93.8 | Very high | 88.2 | Confident | 55 Ų | 55 | 68 Ų | 68 | 26% | 0.257 | 32% | 0.321 | S | S | . | . | H | α-helix | trans | -62.6 | -40.1 | 173.2 | -170.3 | 176.3 | 8.6 | 0 | 0 | 111.4 | N147 T152 M153 E154 | N147-Q150 HydrophobicContact CB-CB 3.94Å; N147-Q150 PolarHBondContact O-N 2.91Å; N147-Q150 PolarHBondContact OD1-N 2.85Å; N147-Q150 VanDerWaalsContact OD1-N 3.16Å; Q150-T152 PolarHBondContact O-N 2.8Å; Q150-M153 PolarHBondContact O-N 3.24Å; Q150-E154 HydrophobicContact CG-CB 4.19Å; Q150-E154 WeakPolarHBondContact CG-OE2 3.45Å; Q150-E154 PolarHBondContact NE2-OE2 3.46Å; Q150-E154 PolarHBondContact O-N 3.26Å |
| 151 | A | 92.9 | Very high | 87.4 | Confident | 2 Ų | 2 | 66.1 Ų | 66.1 | 2% | 0.017 | 31% | 0.314 | C | S | . | . | H | α-helix | trans | -58.6 | -21.5 | 174.7 | 0 | 0 | 0 | 0 | 0 | 113.5 | P145 N147 L148 F149 M153 M188 N189 I193 | P145-A151 HydrophobicContact CB-CB 3.87Å; P145-A151 HydrophobicContact CG-CB 4.09Å; N147-A151 WeakPolarHBondContact O-CB 3.39Å; N147-A151 PolarHBondContact O-N 2.9Å; L148-A151 WeakPolarHBondContact O-CB 3.48Å; L148-A151 PolarHBondContact O-N 3.48Å; F149-A151 VanDerWaalsContact C-N 3.3Å; F149-A151 PolarHBondContact O-N 2.9Å; A151-M153 VanDerWaalsContact C-N 3.28Å; A151-M153 PolarHBondContact O-N 3.5Å; A151-M188 CarbonylContact O-C 3.03Å; A151-N189 HydrophobicContact CB-CB 4.08Å; A151-N189 PolarHBondContact O-N 2.83Å; A151-I193 HydrophobicContact CB-CG1 4.22Å |
| 152 | T | 91.6 | Very high | 86.3 | Confident | 36 Ų | 36 | 67 Ų | 67 | 22% | 0.221 | 33% | 0.328 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -73.6 | -19.3 | 173.4 | 72.5 | 0 | 0 | 0 | 0 | 113.6 | L62 L148 F149 Q150 I193 | L62-T152 HydrophobicContact CD1-CG2 4.19Å; L62-T152 HydrophobicContact CD2-CG2 3.74Å; L148-T152 WeakPolarHBondContact O-CG2 3.45Å; L148-T152 PolarHBondContact O-N 3.36Å; F149-T152 WeakPolarHBondContact O-CB 3.05Å; F149-T152 PolarHBondContact O-N 2.86Å; F149-T152 VanDerWaalsContact O-N 3.09Å; F149-T152 PolarHBondContact O-OG1 3.05Å; Q150-T152 PolarHBondContact O-N 2.8Å; T152-I193 HydrophobicContact CG2-CD1 4.36Å |
| 153 | M | 90.1 | Very high | 85 | Confident | 133 Ų | 133 | 68.9 Ų | 68.9 | 66% | 0.655 | 34% | 0.343 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -118.7 | -29.8 | -173.3 | -58.7 | -174.5 | -175 | 0 | 0 | 113.1 | Q150 A151 G187 | Q150-M153 PolarHBondContact O-N 3.24Å; A151-M153 VanDerWaalsContact C-N 3.28Å; A151-M153 PolarHBondContact O-N 3.5Å; M153-G187 CarbonylContact C-O 3.59Å; M153-G187 CarbonylContact O-C 3.55Å; M153-G187 PolarHBondContact O-N 3.11Å |
| 154 | E | 90.1 | Very high | 83.7 | Confident | 59 Ų | 59 | 68.7 Ų | 68.7 | 28% | 0.276 | 35% | 0.354 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -141.3 | 156.5 | -168.6 | -59.7 | 179.1 | 155.1 | 0 | 0 | 112.5 | Q150 Y184 T185 G187 N189 | Q150-E154 HydrophobicContact CG-CB 4.19Å; Q150-E154 WeakPolarHBondContact CG-OE2 3.45Å; Q150-E154 PolarHBondContact NE2-OE2 3.46Å; Q150-E154 PolarHBondContact O-N 3.26Å; E154-Y184 HydrophobicContact CB-CD1 4.23Å; E154-T185 VanDerWaalsContact CA-O 3.29Å; E154-T185 WeakPolarHBondContact CA-O 3.15Å; E154-G187 CarbonylContact C-O 3.6Å; E154-G187 WeakPolarHBondContact CA-O 3.3Å; E154-G187 PolarHBondContact N-O 3.15Å; E154-N189 WeakPolarHBondContact O-CB 3.33Å |
| 155 | Q | 84.7 | Confident | 81.9 | Confident | 30 Ų | 30 | 65 Ų | 65 | 14% | 0.14 | 35% | 0.347 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -133.6 | 151.6 | 174 | 65.4 | -176 | 2.1 | 0 | 0 | 110.2 | N142 T185 G187 N189 | N142-Q155 WeakPolarHBondContact OD1-CB 3.42Å; Q155-T185 PolarHBondContact N-O 2.84Å; Q155-T185 PolarHBondContact O-N 3.29Å; Q155-G187 PolarHBondContact N-O 3.44Å; Q155-N189 HydrophobicContact CB-CB 3.88Å |
| 156 | V | 87.6 | Confident | 80.3 | Confident | 19 Ų | 19 | 68.2 Ų | 68.2 | 12% | 0.115 | 37% | 0.37 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -82.3 | 137.1 | -178.4 | -179.8 | 0 | 0 | 0 | 0 | 110.1 | R141 N142 L182 Y184 | R141-V156 HydrophobicContact CB-CG1 4.43Å; N142-V156 PolarHBondContact ND2-O 2.77Å; N142-V156 PolarHBondContact OD1-N 2.84Å; V156-L182 HydrophobicContact CG1-CB 4.37Å; V156-L182 HydrophobicContact CG1-CD2 3.99Å; V156-Y184 HydrophobicContact CG2-CD1 3.95Å; V156-Y184 HydrophobicContact CG2-CE1 3.39Å |
| 157 | R | 81.4 | Confident | 78.7 | Confident | 77 Ų | 77 | 62.5 Ų | 62.5 | 29% | 0.291 | 35% | 0.354 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -140.2 | 144.6 | 168.6 | -69.2 | -173.1 | 171.6 | -179.7 | -6.6 | 111.1 | D138 E183 | D138-R157 WeakPolarHBondContact OD2-CA 3.24Å; R157-E183 PolarHBondContact N-O 2.88Å; R157-E183 PolarHBondContact O-N 3.13Å |
| 158 | T | 83 | Confident | 77 | Confident | 21 Ų | 21 | 65.8 Ų | 65.8 | 13% | 0.129 | 38% | 0.377 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -78.3 | 131.5 | 166.9 | -58.2 | 0 | 0 | 0 | 0 | 109.5 | D134 D138 R141 Q181 | D134-T158 HydrophobicContact CB-CG2 4.17Å; D138-T158 PolarHBondContact OD1-N 2.98Å; D138-T158 PolarHBondContact OD1-OG1 3.26Å; D138-T158 VanDerWaalsContact OD1-OG1 3.14Å; D138-T158 PolarHBondContact OD2-N 2.79Å; R141-T158 PolarHBondContact NH1-OG1 3.33Å; T158-Q181 WeakPolarHBondContact CA-O 3.33Å |
| 159 | K | 77.8 | Confident | 75.2 | Confident | 73 Ų | 73 | 69.2 Ų | 69.2 | 32% | 0.317 | 40% | 0.396 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -123 | 126.7 | 170.6 | -179.1 | 180 | 177.6 | -172.5 | 0 | 109.8 | T161 Q181 E183 | K159-T161 HydrophobicContact CG-CG2 4.34Å; K159-Q181 PolarHBondContact N-O 3.3Å; K159-Q181 PolarHBondContact O-N 3.09Å; K159-E183 WeakPolarHBondContact CD-OE2 3.33Å; K159-E183 WeakPolarHBondContact CE-OE2 3.39Å; K159-E183 IonicContact NZ-OE1 3.82Å; K159-E183 IonicContact NZ-OE2 3.75Å; K159-E183 PolarHBondContact NZ-OE2 3.33Å |
| 160 | H | 73 | Confident | 73.4 | Confident | 36 Ų | 36 | 65.8 Ų | 65.8 | 17% | 0.167 | 41% | 0.406 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -78.6 | 125.7 | 173 | -76.7 | -96.9 | 0 | 0 | 0 | 109.8 | D129 D134 D178 | D129-H160 PolarHBondContact O-CD2 3.08Å; D134-H160 IonicContact OD2-CE1 3.92Å; D134-H160 IonicContact OD2-NE2 2.73Å; D134-H160 PolarHBondContact OD2-NE2 3.13Å; H160-D178 VanDerWaalsContact CB-OD1 3.28Å; H160-D178 WeakPolarHBondContact CB-OD1 3.48Å; H160-D178 IonicContact CE1-OD2 3.6Å; H160-D178 IonicContact CG-OD1 3.57Å; H160-D178 IonicContact CG-OD2 3.64Å; H160-D178 IonicContact ND1-OD1 3.1Å; H160-D178 PolarHBondContact ND1-OD1 3.33Å; H160-D178 VanDerWaalsContact ND1-OD1 3.1Å; H160-D178 IonicContact ND1-OD2 2.74Å; H160-D178 PolarHBondContact ND1-OD2 2.89Å |
| 161 | T | 69.7 | Low | 71.6 | Confident | 45 Ų | 45 | 68.5 Ų | 68.5 | 28% | 0.276 | 43% | 0.431 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -126.8 | 125.2 | 174.7 | 53.3 | 0 | 0 | 0 | 0 | 109.3 | K159 S163 V179 | K159-T161 HydrophobicContact CG-CG2 4.34Å; T161-S163 PolarHBondContact O-N 2.94Å; T161-S163 VanDerWaalsContact O-N 3.12Å; T161-V179 PolarHBondContact N-O 2.63Å; T161-V179 PolarHBondContact O-N 3.3Å; T161-V179 PolarHBondContact OG1-O 3.39Å |
| 162 | T | 65.3 | Low | 69.9 | Low | 98 Ų | 98 | 74.7 Ų | 74.7 | 60% | 0.601 | 46% | 0.463 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -73.1 | 103.9 | 175.1 | -48 | 0 | 0 | 0 | 0 | 108.8 | N176 | T162-N176 HydrophobicContact CG2-CB 3.56Å |
| 163 | S | 60.9 | Low | 68.2 | Low | 56 Ų | 56 | 77 Ų | 77 | 39% | 0.392 | 49% | 0.485 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -91.7 | 117.7 | 175.6 | -70.2 | 0 | 0 | 0 | 0 | 109.6 | T161 F177 | T161-S163 PolarHBondContact O-N 2.94Å; T161-S163 VanDerWaalsContact O-N 3.12Å; S163-F177 PolarHBondContact N-O 2.96Å; S163-F177 PolarHBondContact O-N 3.19Å |
| 164 | A | 61 | Low | 66.7 | Low | 64 Ų | 64 | 74.3 Ų | 74.3 | 53% | 0.529 | 48% | 0.476 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -83.8 | 107.9 | 171.6 | 0 | 0 | 0 | 0 | 0 | 109.2 | S166 V174 | A164-S166 PolarHBondContact O-N 2.78Å; A164-V174 HydrophobicContact CB-CG1 3.52Å |
| 165 | S | 55 | Low | 65.2 | Low | 70 Ų | 70 | 78.3 Ų | 78.3 | 49% | 0.49 | 49% | 0.493 | S | S | . | . | trans | -81.7 | 108.4 | 169 | 65.2 | 0 | 0 | 0 | 0 | 109.5 | G167 | S165-G167 PolarHBondContact O-N 3.35Š| ||
| 166 | S | 58.1 | Low | 64.2 | Low | 107 Ų | 107 | 81.9 Ų | 81.9 | 75% | 0.748 | 51% | 0.513 | S | S | * | . | trans | -69.5 | 110.3 | 166.4 | -77.6 | 0 | 0 | 0 | 0 | 109.2 | A164 | A164-S166 PolarHBondContact O-N 2.78Š| ||
| 167 | G | 57.2 | Low | 63.3 | Low | 41 Ų | 41 | 86.3 Ų | 86.3 | 42% | 0.423 | 53% | 0.531 | S | S | . | . | trans | -62.1 | 136.1 | 169.3 | 0 | 0 | 0 | 0 | 0 | 110.3 | S165 N169 | S165-G167 PolarHBondContact O-N 3.35Å; G167-N169 PolarHBondContact O-N 3.02Å | ||
| 168 | T | 57.9 | Low | 62.7 | Low | 143 Ų | 143 | 86.5 Ų | 86.5 | 88% | 0.877 | 54% | 0.537 | S | S | * | . | S | Bend | trans | -64.1 | -10.4 | -170.3 | -19.3 | 0 | 0 | 0 | 0 | 114.8 | ||
| 169 | N | 55.5 | Low | 62.3 | Low | 126 Ų | 126 | 88.4 Ų | 88.4 | 67% | 0.674 | 55% | 0.549 | S | S | * | . | S | Bend | trans | -123.8 | 111.2 | 176.2 | -64 | -20.2 | 0 | 0 | 0 | 107.5 | G167 S171 | G167-N169 PolarHBondContact O-N 3.02Å; N169-S171 PolarHBondContact O-N 3.03Å |
| 170 | G | 55 | Low | 62.3 | Low | 91 Ų | 91 | 86.8 Ų | 86.8 | 94% | 0.938 | 55% | 0.553 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -63.4 | 42.4 | -162 | 0 | 0 | 0 | 0 | 0 | 118.6 | ||
| 171 | S | 54.9 | Low | 62.8 | Low | 112 Ų | 112 | 90.3 Ų | 90.3 | 78% | 0.783 | 57% | 0.57 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -134.5 | 5.8 | 174.1 | 62.2 | 0 | 0 | 0 | 0 | 115 | N169 | N169-S171 PolarHBondContact O-N 3.03Š|
| 172 | I | 57.3 | Low | 63.6 | Low | 132 Ų | 132 | 93 Ų | 93 | 68% | 0.677 | 58% | 0.582 | S | S | * | * | S | Bend | trans | -105.9 | 119.3 | 179.6 | -56.2 | 173.5 | 0 | 0 | 0 | 109.4 | V174 | I172-V174 PolarHBondContact O-N 3Š|
| 173 | A | 56.6 | Low | 64.6 | Low | 84 Ų | 84 | 92.5 Ų | 92.5 | 69% | 0.694 | 57% | 0.573 | S | S | * | * | trans | -43 | 127.7 | 179.5 | 0 | 0 | 0 | 0 | 0 | 111.8 | K175 | A173-K175 PolarHBondContact O-N 3.2Š| ||
| 174 | V | 59 | Low | 65.9 | Low | 76 Ų | 76 | 93.6 Ų | 93.6 | 46% | 0.461 | 57% | 0.569 | S | S | . | * | trans | -56.8 | 104.5 | 172.4 | -179.9 | 0 | 0 | 0 | 0 | 107.5 | A164 I172 N176 | A164-V174 HydrophobicContact CB-CG1 3.52Å; I172-V174 PolarHBondContact O-N 3Å; V174-N176 WeakPolarHBondContact CG1-OD1 3.41Å; V174-N176 PolarHBondContact O-N 3.15Å | ||
| 175 | K | 57.8 | Low | 66.9 | Low | 143 Ų | 143 | 92.8 Ų | 92.8 | 62% | 0.622 | 56% | 0.557 | S | S | * | * | trans | -76.5 | 104.1 | 165.5 | -75.9 | -173 | 178.2 | -178.5 | 0 | 106.2 | A173 F177 | A173-K175 PolarHBondContact O-N 3.2Å; K175-F177 HydrophobicContact CB-CD2 3.93Å; K175-F177 HydrophobicContact CB-CE1 4.2Å; K175-F177 HydrophobicContact CB-CE2 3.27Å; K175-F177 HydrophobicContact CB-CZ 3.44Å; K175-F177 VanDerWaalsContact CB-CZ 3.44Å; K175-F177 HydrophobicContact CD-CE1 4.19Å; K175-F177 HydrophobicContact CD-CE2 4.13Å; K175-F177 HydrophobicContact CD-CZ 3.48Å; K175-F177 VanDerWaalsContact CD-CZ 3.48Å; K175-F177 HydrophobicContact CG-CE2 4.33Å; K175-F177 HydrophobicContact CG-CZ 4.1Å; K175-F177 WeakPolarHBondContact O-CD2 3.31Å; K175-F177 PolarHBondContact O-N 2.99Å | ||
| 176 | N | 64.6 | Low | 68.2 | Low | 105 Ų | 105 | 100.2 Ų | 100.2 | 56% | 0.561 | 58% | 0.575 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -64.8 | 112.7 | 165 | -75.4 | -15.1 | 0 | 0 | 0 | 107 | T162 V174 | T162-N176 HydrophobicContact CG2-CB 3.56Å; V174-N176 WeakPolarHBondContact CG1-OD1 3.41Å; V174-N176 PolarHBondContact O-N 3.15Å |
| 177 | F | 68.5 | Low | 69.3 | Low | 113 Ų | 113 | 96.5 Ų | 96.5 | 50% | 0.496 | 55% | 0.553 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -104.7 | 130.1 | 170.8 | -62.9 | -80 | 0 | 0 | 0 | 108.2 | S163 K175 | S163-F177 PolarHBondContact N-O 2.96Å; S163-F177 PolarHBondContact O-N 3.19Å; K175-F177 HydrophobicContact CB-CD2 3.93Å; K175-F177 HydrophobicContact CB-CE1 4.2Å; K175-F177 HydrophobicContact CB-CE2 3.27Å; K175-F177 HydrophobicContact CB-CZ 3.44Å; K175-F177 VanDerWaalsContact CB-CZ 3.44Å; K175-F177 HydrophobicContact CD-CE1 4.19Å; K175-F177 HydrophobicContact CD-CE2 4.13Å; K175-F177 HydrophobicContact CD-CZ 3.48Å; K175-F177 VanDerWaalsContact CD-CZ 3.48Å; K175-F177 HydrophobicContact CG-CE2 4.33Å; K175-F177 HydrophobicContact CG-CZ 4.1Å; K175-F177 WeakPolarHBondContact O-CD2 3.31Å; K175-F177 PolarHBondContact O-N 2.99Å |
| 178 | D | 69.1 | Low | 70.7 | Confident | 81 Ų | 81 | 97 Ų | 97 | 43% | 0.433 | 55% | 0.545 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -79.2 | 121.6 | 172.7 | -179 | 25.2 | 0 | 0 | 0 | 109.2 | H160 | H160-D178 VanDerWaalsContact CB-OD1 3.28Å; H160-D178 WeakPolarHBondContact CB-OD1 3.48Å; H160-D178 IonicContact CE1-OD2 3.6Å; H160-D178 IonicContact CG-OD1 3.57Å; H160-D178 IonicContact CG-OD2 3.64Å; H160-D178 IonicContact ND1-OD1 3.1Å; H160-D178 PolarHBondContact ND1-OD1 3.33Å; H160-D178 VanDerWaalsContact ND1-OD1 3.1Å; H160-D178 IonicContact ND1-OD2 2.74Å; H160-D178 PolarHBondContact ND1-OD2 2.89Å |
| 179 | V | 73.9 | Confident | 72.1 | Confident | 60 Ų | 60 | 90.5 Ų | 90.5 | 36% | 0.364 | 51% | 0.505 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -122.9 | 116.3 | -179.7 | -175.4 | 0 | 0 | 0 | 0 | 108.3 | T161 Q181 | T161-V179 PolarHBondContact N-O 2.63Å; T161-V179 PolarHBondContact O-N 3.3Å; T161-V179 PolarHBondContact OG1-O 3.39Å; V179-Q181 HydrophobicContact CG1-CG 4.16Å; V179-Q181 PolarHBondContact O-N 2.83Å |
| 180 | G | 77.5 | Confident | 73.5 | Confident | 40 Ų | 40 | 85.1 Ų | 85.1 | 41% | 0.412 | 48% | 0.476 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -71.4 | 117.1 | 167.7 | 0 | 0 | 0 | 0 | 0 | 110.3 | ||
| 181 | Q | 83.5 | Confident | 75 | Confident | 110 Ų | 110 | 81.6 Ų | 81.6 | 51% | 0.514 | 44% | 0.435 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -114 | 143.7 | 173.6 | -66.6 | -168.1 | -9.7 | 0 | 0 | 110.4 | T158 K159 V179 | T158-Q181 WeakPolarHBondContact CA-O 3.33Å; K159-Q181 PolarHBondContact N-O 3.3Å; K159-Q181 PolarHBondContact O-N 3.09Å; V179-Q181 HydrophobicContact CG1-CG 4.16Å; V179-Q181 PolarHBondContact O-N 2.83Å |
| 182 | L | 86.4 | Confident | 76.7 | Confident | 102 Ų | 102 | 76.3 Ų | 76.3 | 53% | 0.534 | 40% | 0.399 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -76.9 | 126.2 | 174.1 | -60.9 | 177.4 | 0 | 0 | 0 | 109.5 | V156 | V156-L182 HydrophobicContact CG1-CB 4.37Å; V156-L182 HydrophobicContact CG1-CD2 3.99Å |
| 183 | E | 87.1 | Confident | 78.4 | Confident | 87 Ų | 87 | 70.1 Ų | 70.1 | 41% | 0.407 | 37% | 0.367 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -123.8 | 141 | 175.1 | -174.1 | 174.4 | -171.7 | 0 | 0 | 109.8 | R157 K159 | R157-E183 PolarHBondContact N-O 2.88Å; R157-E183 PolarHBondContact O-N 3.13Å; K159-E183 WeakPolarHBondContact CD-OE2 3.33Å; K159-E183 WeakPolarHBondContact CE-OE2 3.39Å; K159-E183 IonicContact NZ-OE1 3.82Å; K159-E183 IonicContact NZ-OE2 3.75Å; K159-E183 PolarHBondContact NZ-OE2 3.33Å |
| 184 | Y | 87.9 | Confident | 80 | Confident | 78 Ų | 78 | 66.4 Ų | 66.4 | 31% | 0.306 | 34% | 0.335 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -84.1 | 120.3 | 170.7 | -74.5 | -76.6 | 0 | 0 | 0 | 109.8 | E146 E154 V156 | E146-Y184 PolarHBondContact OE2-OH 3.35Å; E154-Y184 HydrophobicContact CB-CD1 4.23Å; V156-Y184 HydrophobicContact CG2-CD1 3.95Å; V156-Y184 HydrophobicContact CG2-CE1 3.39Å |
| 185 | T | 82.9 | Confident | 81.5 | Confident | 47 Ų | 47 | 64 Ų | 64 | 29% | 0.288 | 32% | 0.321 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -102.3 | 136.7 | 175.7 | -58.2 | 0 | 0 | 0 | 0 | 109.9 | E154 Q155 G187 | E154-T185 VanDerWaalsContact CA-O 3.29Å; E154-T185 WeakPolarHBondContact CA-O 3.15Å; Q155-T185 PolarHBondContact N-O 2.84Å; Q155-T185 PolarHBondContact O-N 3.29Å; T185-G187 PolarHBondContact O-N 2.94Å |
| 186 | R | 82.4 | Confident | 83.3 | Confident | 226 Ų | 226 | 61.2 Ų | 61.2 | 85% | 0.853 | 31% | 0.309 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -59.9 | 127.9 | 174.9 | -68.6 | -178.1 | -177.1 | 162.1 | 1.7 | 111.2 | ||
| 187 | G | 81 | Confident | 84.6 | Confident | 29 Ų | 29 | 56.2 Ų | 56.2 | 30% | 0.299 | 28% | 0.282 | S | S | . | . | S | Bend | trans | 147.1 | 133.4 | -176.3 | 0 | 0 | 0 | 0 | 0 | 109.9 | M153 E154 Q155 T185 N189 | M153-G187 CarbonylContact C-O 3.59Å; M153-G187 CarbonylContact O-C 3.55Å; M153-G187 PolarHBondContact O-N 3.11Å; E154-G187 CarbonylContact C-O 3.6Å; E154-G187 WeakPolarHBondContact CA-O 3.3Å; E154-G187 PolarHBondContact N-O 3.15Å; Q155-G187 PolarHBondContact N-O 3.44Å; T185-G187 PolarHBondContact O-N 2.94Å; G187-N189 PolarHBondContact O-N 3.33Å |
| 188 | M | 85.4 | Confident | 85.7 | Confident | 53 Ų | 53 | 52 Ų | 52 | 26% | 0.261 | 27% | 0.266 | S | S | . | . | trans | -62.3 | 121 | 179.9 | 176.7 | 175.9 | 52.3 | 0 | 0 | 110.7 | I61 L62 A151 M190 I193 | I61-M188 HydrophobicContact CB-CE 4.25Å; I61-M188 HydrophobicContact CG2-CE 3.88Å; L62-M188 HydrophobicContact CB-SD 3.85Å; L62-M188 HydrophobicContact CD1-SD 3.82Å; L62-M188 HydrophobicContact CG-SD 4.35Å; A151-M188 CarbonylContact O-C 3.03Å; M188-M190 HydrophobicContact CE-CE 3.31Å; M188-M190 PolarHBondContact O-N 3.5Å; M188-M190 HydrophobicContact SD-CE 4.37Å; M188-I193 HydrophobicContact CG-CD1 3.47Å; M188-I193 VanDerWaalsContact CG-CD1 3.47Å; M188-I193 HydrophobicContact SD-CD1 3.85Å | ||
| 189 | N | 87.3 | Confident | 86.7 | Confident | 5 Ų | 5 | 52.6 Ų | 52.6 | 3% | 0.027 | 27% | 0.268 | C | S | . | . | trans | -72.8 | 80.9 | 168.1 | 176.9 | 8.2 | 0 | 0 | 0 | 109.8 | N142 A151 E154 Q155 G187 L191 G192 I193 | N142-N189 WeakPolarHBondContact CA-ND2 3.45Å; N142-N189 PolarHBondContact O-ND2 3.36Å; N142-N189 PolarHBondContact O-OD1 2.73Å; N142-N189 PolarHBondContact OD1-ND2 3.05Å; A151-N189 HydrophobicContact CB-CB 4.08Å; A151-N189 PolarHBondContact O-N 2.83Å; E154-N189 WeakPolarHBondContact O-CB 3.33Å; Q155-N189 HydrophobicContact CB-CB 3.88Å; G187-N189 PolarHBondContact O-N 3.33Å; N189-L191 VanDerWaalsContact C-N 3.25Å; N189-L191 PolarHBondContact O-N 3.02Å; N189-L191 PolarHBondContact OD1-N 3.28Å; N189-G192 PolarHBondContact O-N 2.63Å; N189-G192 PolarHBondContact OD1-N 3Å; N189-I193 WeakPolarHBondContact O-CD1 3.15Å; N189-I193 WeakPolarHBondContact O-CG1 3.23Å; N189-I193 PolarHBondContact O-N 3.3Å | ||
| 190 | M | 86 | Confident | 87.7 | Confident | 14 Ų | 14 | 52.7 Ų | 52.7 | 7% | 0.069 | 26% | 0.264 | C | S | . | . | H | α-helix | trans | -60 | -36.5 | -179.9 | -176.6 | 157.3 | -77.7 | 0 | 0 | 112.4 | I61 V65 M188 I193 I194 A313 T342 | I61-M190 HydrophobicContact CG2-CE 3.2Å; V65-M190 HydrophobicContact CG2-CE 4.3Å; M188-M190 HydrophobicContact CE-CE 3.31Å; M188-M190 PolarHBondContact O-N 3.5Å; M188-M190 HydrophobicContact SD-CE 4.37Å; M190-I193 PolarHBondContact O-N 3.17Å; M190-I194 HydrophobicContact CG-CD1 3.63Å; M190-I194 HydrophobicContact CG-CG1 4.18Å; M190-I194 WeakPolarHBondContact O-CB 3.3Å; M190-I194 WeakPolarHBondContact O-CG1 3.28Å; M190-I194 PolarHBondContact O-N 3.32Å; M190-A313 HydrophobicContact CE-CB 4.35Å; M190-A313 HydrophobicContact SD-CB 4.38Å; M190-T342 HydrophobicContact CB-CG2 3.83Å; M190-T342 HydrophobicContact CG-CG2 3.53Å; M190-T342 HydrophobicContact SD-CG2 3.9Å |
| 191 | L | 86.7 | Confident | 88.4 | Confident | 16 Ų | 16 | 50.8 Ų | 50.8 | 8% | 0.084 | 24% | 0.244 | C | C | . | . | H | α-helix | trans | -62.9 | -49.1 | -178.3 | -173.3 | 62.4 | 0 | 0 | 0 | 111.7 | L139 F143 N189 I193 I194 V195 | L139-L191 HydrophobicContact CD1-CD2 3.44Å; L139-L191 VanDerWaalsContact CD1-CD2 3.44Å; L139-L191 HydrophobicContact CG-CD2 4.28Å; F143-L191 HydrophobicContact CD1-CD1 4.46Å; F143-L191 HydrophobicContact CD1-CG 4.39Å; F143-L191 HydrophobicContact CD2-CD1 4.34Å; F143-L191 HydrophobicContact CD2-CD2 3.35Å; F143-L191 HydrophobicContact CD2-CG 3.91Å; F143-L191 HydrophobicContact CE1-CD1 4.05Å; F143-L191 HydrophobicContact CE1-CG 4.45Å; F143-L191 HydrophobicContact CE2-CD1 3.95Å; F143-L191 HydrophobicContact CE2-CD2 3.46Å; F143-L191 VanDerWaalsContact CE2-CD2 3.46Å; F143-L191 HydrophobicContact CE2-CG 4.01Å; F143-L191 HydrophobicContact CG-CD2 4Å; F143-L191 HydrophobicContact CG-CG 4.09Å; F143-L191 HydrophobicContact CZ-CD1 3.77Å; F143-L191 HydrophobicContact CZ-CD2 4.17Å; F143-L191 HydrophobicContact CZ-CG 4.25Å; N189-L191 VanDerWaalsContact C-N 3.25Å; N189-L191 PolarHBondContact O-N 3.02Å; N189-L191 PolarHBondContact OD1-N 3.28Å; L191-I193 VanDerWaalsContact C-N 3.32Å; L191-I193 PolarHBondContact O-N 2.93Å; L191-I194 PolarHBondContact O-N 3.19Å; L191-V195 VanDerWaalsContact O-CG2 3.3Å; L191-V195 WeakPolarHBondContact O-CG2 3.48Å; L191-V195 PolarHBondContact O-N 3.45Å |
| 192 | G | 90.8 | Very high | 88.7 | Confident | 1 Ų | 1 | 48.2 Ų | 48.2 | 1% | 0.01 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -62.2 | -39.2 | 176.8 | 0 | 0 | 0 | 0 | 0 | 112.8 | N142 N189 V195 F196 | N142-G192 WeakPolarHBondContact O-CA 3.21Å; N142-G192 PolarHBondContact O-N 3.02Å; N142-G192 VanDerWaalsContact O-N 3.1Å; N189-G192 PolarHBondContact O-N 2.63Å; N189-G192 PolarHBondContact OD1-N 3Å; G192-V195 PolarHBondContact O-N 2.82Å; G192-F196 PolarHBondContact O-N 3.42Å |
| 193 | I | 92.1 | Very high | 89 | Confident | 2 Ų | 2 | 47.4 Ų | 47.4 | 1% | 0.01 | 23% | 0.228 | C | C | . | . | H | α-helix | trans | -63.7 | -44.6 | 174.5 | -66.4 | 159.2 | 0 | 0 | 0 | 110.7 | L62 I66 L148 A151 T152 M188 N189 M190 L191 F196 C197 | L62-I193 HydrophobicContact CD1-CD1 3.67Å; L62-I193 HydrophobicContact CD1-CG1 4.47Å; L62-I193 HydrophobicContact CD1-CG2 4.12Å; I66-I193 HydrophobicContact CD1-CG2 4.28Å; I66-I193 HydrophobicContact CG1-CG2 3.83Å; L148-I193 HydrophobicContact CD1-CG1 4.25Å; A151-I193 HydrophobicContact CB-CG1 4.22Å; T152-I193 HydrophobicContact CG2-CD1 4.36Å; M188-I193 HydrophobicContact CG-CD1 3.47Å; M188-I193 VanDerWaalsContact CG-CD1 3.47Å; M188-I193 HydrophobicContact SD-CD1 3.85Å; N189-I193 WeakPolarHBondContact O-CD1 3.15Å; N189-I193 WeakPolarHBondContact O-CG1 3.23Å; N189-I193 PolarHBondContact O-N 3.3Å; M190-I193 PolarHBondContact O-N 3.17Å; L191-I193 VanDerWaalsContact C-N 3.32Å; L191-I193 PolarHBondContact O-N 2.93Å; I193-F196 PolarHBondContact O-N 3.3Å; I193-C197 WeakPolarHBondContact O-CB 3.29Å; I193-C197 PolarHBondContact O-N 3.37Å; I193-C197 PolarHBondContact O-SG 3.05Å |
| 194 | I | 90.5 | Very high | 89.1 | Confident | 6 Ų | 6 | 43.7 Ų | 43.7 | 3% | 0.031 | 21% | 0.212 | C | C | . | . | H | α-helix | trans | -60.3 | -48.4 | 177.2 | -71.6 | 166.1 | 0 | 0 | 0 | 110.3 | V65 L69 M190 L191 F196 C197 V198 P338 I339 T342 | V65-I194 HydrophobicContact CG1-CG1 4.15Å; L69-I194 HydrophobicContact CD1-CB 4.28Å; L69-I194 HydrophobicContact CD1-CG1 3.92Å; L69-I194 HydrophobicContact CD1-CG2 4.2Å; M190-I194 HydrophobicContact CG-CD1 3.63Å; M190-I194 HydrophobicContact CG-CG1 4.18Å; M190-I194 WeakPolarHBondContact O-CB 3.3Å; M190-I194 WeakPolarHBondContact O-CG1 3.28Å; M190-I194 PolarHBondContact O-N 3.32Å; L191-I194 PolarHBondContact O-N 3.19Å; I194-F196 VanDerWaalsContact C-N 3.34Å; I194-F196 PolarHBondContact O-N 3.34Å; I194-C197 PolarHBondContact O-N 2.93Å; I194-V198 HydrophobicContact CG2-CG2 4.06Å; I194-V198 WeakPolarHBondContact O-CB 3.35Å; I194-V198 VanDerWaalsContact O-CG2 3.22Å; I194-V198 WeakPolarHBondContact O-CG2 3.43Å; I194-V198 PolarHBondContact O-N 3.11Å; I194-P338 HydrophobicContact CD1-CB 3.89Å; I194-P338 VanDerWaalsContact CD1-O 3.25Å; I194-P338 WeakPolarHBondContact CD1-O 3.2Å; I194-P338 HydrophobicContact CG1-CB 4.15Å; I194-I339 HydrophobicContact CG2-CD1 4.47Å; I194-I339 HydrophobicContact CG2-CG1 3.75Å; I194-T342 HydrophobicContact CD1-CG2 3.89Å |
| 195 | V | 90.4 | Very high | 89.1 | Confident | 27 Ų | 27 | 41.5 Ų | 41.5 | 16% | 0.164 | 21% | 0.21 | C | C | . | . | H | α-helix | trans | -57.7 | -47.6 | 179.3 | 172.3 | 0 | 0 | 0 | 0 | 110.8 | F143 L191 G192 V198 I199 | F143-V195 HydrophobicContact CB-CG2 4.48Å; F143-V195 HydrophobicContact CD1-CG2 3.39Å; F143-V195 HydrophobicContact CE1-CG2 3.95Å; F143-V195 HydrophobicContact CG-CG2 4.24Å; L191-V195 VanDerWaalsContact O-CG2 3.3Å; L191-V195 WeakPolarHBondContact O-CG2 3.48Å; L191-V195 PolarHBondContact O-N 3.45Å; G192-V195 PolarHBondContact O-N 2.82Å; V195-V198 PolarHBondContact O-N 2.87Å; V195-I199 HydrophobicContact CG1-CD1 3.92Å; V195-I199 WeakPolarHBondContact O-CG1 3.25Å; V195-I199 PolarHBondContact O-N 3.41Å |
| 196 | F | 94.6 | Very high | 89.2 | Confident | 83 Ų | 83 | 42.7 Ų | 42.7 | 36% | 0.364 | 22% | 0.221 | S | C | . | . | H | α-helix | trans | -57.3 | -51.3 | 174.6 | 172.1 | -95 | 0 | 0 | 0 | 111.7 | L148 G192 I193 I194 V198 I199 F200 | L148-F196 HydrophobicContact CD1-CB 4.11Å; L148-F196 HydrophobicContact CD1-CD1 3.89Å; L148-F196 HydrophobicContact CD1-CG 3.93Å; L148-F196 HydrophobicContact CD2-CD1 3.73Å; L148-F196 HydrophobicContact CD2-CD2 4.3Å; L148-F196 HydrophobicContact CD2-CE1 3.5Å; L148-F196 HydrophobicContact CD2-CE2 4.09Å; L148-F196 HydrophobicContact CD2-CG 4.13Å; L148-F196 HydrophobicContact CD2-CZ 3.7Å; L148-F196 HydrophobicContact CG-CD1 4.49Å; G192-F196 PolarHBondContact O-N 3.42Å; I193-F196 PolarHBondContact O-N 3.3Å; I194-F196 VanDerWaalsContact C-N 3.34Å; I194-F196 PolarHBondContact O-N 3.34Å; F196-V198 VanDerWaalsContact C-N 3.3Å; F196-V198 PolarHBondContact O-N 3.21Å; F196-I199 PolarHBondContact O-N 3.5Å; F196-F200 HydrophobicContact CE1-CB 4.43Å; F196-F200 HydrophobicContact CE1-CD2 4.11Å; F196-F200 HydrophobicContact CE2-CD2 4.42Å; F196-F200 AromaticContact CZ-CD2 3.71Å; F196-F200 HydrophobicContact CZ-CD2 3.71Å; F196-F200 HydrophobicContact CZ-CE2 4.39Å; F196-F200 HydrophobicContact CZ-CG 4.48Å; F196-F200 VanDerWaalsContact O-CB 3.22Å; F196-F200 WeakPolarHBondContact O-CB 3.36Å; F196-F200 PolarHBondContact O-N 3.32Å |
| 197 | C | 93.6 | Very high | 89.5 | Confident | 0 Ų | 0 | 39.8 Ų | 39.8 | 0% | 0 | 21% | 0.21 | C | C | . | . | H | α-helix | trans | -62.7 | -35.4 | -179.5 | -71.7 | 0 | 0 | 0 | 0 | 112.8 | L69 I70 I193 I194 G201 | L69-C197 HydrophobicContact CB-CB 3.84Å; L69-C197 HydrophobicContact CD1-CB 3.94Å; I70-C197 HydrophobicContact CG1-CB 4.03Å; I193-C197 WeakPolarHBondContact O-CB 3.29Å; I193-C197 PolarHBondContact O-N 3.37Å; I193-C197 PolarHBondContact O-SG 3.05Å; I194-C197 PolarHBondContact O-N 2.93Å; C197-G201 PolarHBondContact O-N 3.1Å |
| 198 | V | 90.1 | Very high | 89.4 | Confident | 26 Ų | 26 | 40.6 Ų | 40.6 | 16% | 0.158 | 22% | 0.217 | C | C | . | . | H | α-helix | trans | -65.5 | -50.6 | 176.8 | 169.5 | 0 | 0 | 0 | 0 | 110.5 | L73 I194 V195 F196 G201 I202 F335 | L73-V198 HydrophobicContact CD1-CB 4.09Å; L73-V198 HydrophobicContact CD1-CG1 4.17Å; L73-V198 HydrophobicContact CD1-CG2 3.98Å; I194-V198 HydrophobicContact CG2-CG2 4.06Å; I194-V198 WeakPolarHBondContact O-CB 3.35Å; I194-V198 VanDerWaalsContact O-CG2 3.22Å; I194-V198 WeakPolarHBondContact O-CG2 3.43Å; I194-V198 PolarHBondContact O-N 3.11Å; V195-V198 PolarHBondContact O-N 2.87Å; F196-V198 VanDerWaalsContact C-N 3.3Å; F196-V198 PolarHBondContact O-N 3.21Å; V198-G201 PolarHBondContact O-N 3.02Å; V198-I202 HydrophobicContact CG1-CD1 3.74Å; V198-I202 WeakPolarHBondContact O-CB 3.35Å; V198-I202 VanDerWaalsContact O-CG1 3.24Å; V198-I202 WeakPolarHBondContact O-CG1 3.46Å; V198-I202 PolarHBondContact O-N 3.43Å; V198-F335 HydrophobicContact CG1-CE2 4.23Å; V198-F335 HydrophobicContact CG2-CE2 3.9Å |
| 199 | I | 91.5 | Very high | 89.5 | Confident | 92 Ų | 92 | 45.1 Ų | 45.1 | 47% | 0.472 | 24% | 0.238 | S | C | . | . | H | α-helix | trans | -62 | -46.6 | 177.8 | -65.5 | 168.2 | 0 | 0 | 0 | 110.2 | V195 F196 G201 I202 I203 | V195-I199 HydrophobicContact CG1-CD1 3.92Å; V195-I199 WeakPolarHBondContact O-CG1 3.25Å; V195-I199 PolarHBondContact O-N 3.41Å; F196-I199 PolarHBondContact O-N 3.5Å; I199-G201 PolarHBondContact O-N 3.14Å; I199-I202 PolarHBondContact O-N 3.5Å; I199-I203 HydrophobicContact CG2-CD1 3.75Å; I199-I203 HydrophobicContact CG2-CG1 4.43Å; I199-I203 VanDerWaalsContact O-CG1 3.29Å; I199-I203 WeakPolarHBondContact O-CG1 3.48Å; I199-I203 PolarHBondContact O-N 3.34Å |
| 200 | F | 94.3 | Very high | 89.6 | Confident | 63 Ų | 63 | 54.3 Ų | 54.3 | 28% | 0.276 | 28% | 0.278 | S | S | . | . | H | α-helix | trans | -58.1 | -50 | 178.1 | -169.8 | -74.8 | 0 | 0 | 0 | 111.3 | I70 F196 I202 I203 C204 V214 F218 | I70-F200 HydrophobicContact CB-CD1 4.46Å; I70-F200 HydrophobicContact CD1-CB 4.48Å; I70-F200 HydrophobicContact CD1-CD1 3.74Å; I70-F200 HydrophobicContact CD1-CE1 4.18Å; I70-F200 HydrophobicContact CD1-CG 4.15Å; I70-F200 HydrophobicContact CG1-CD1 3.96Å; I70-F200 HydrophobicContact CG2-CD1 3.65Å; I70-F200 HydrophobicContact CG2-CE1 3.84Å; F196-F200 HydrophobicContact CE1-CB 4.43Å; F196-F200 HydrophobicContact CE1-CD2 4.11Å; F196-F200 HydrophobicContact CE2-CD2 4.42Å; F196-F200 AromaticContact CZ-CD2 3.71Å; F196-F200 HydrophobicContact CZ-CD2 3.71Å; F196-F200 HydrophobicContact CZ-CE2 4.39Å; F196-F200 HydrophobicContact CZ-CG 4.48Å; F196-F200 VanDerWaalsContact O-CB 3.22Å; F196-F200 WeakPolarHBondContact O-CB 3.36Å; F196-F200 PolarHBondContact O-N 3.32Å; F200-I202 PolarHBondContact O-N 3.44Å; F200-I203 PolarHBondContact O-N 2.86Å; F200-C204 WeakPolarHBondContact CE1-SG 3.39Å; F200-C204 PolarHBondContact O-N 3.32Å; F200-C204 PolarHBondContact O-SG 3.21Å; F200-C204 VanDerWaalsContact O-SG 3.42Å; F200-V214 HydrophobicContact CE1-CG1 3.95Å; F200-V214 HydrophobicContact CZ-CG1 3.88Å; F200-F218 HydrophobicContact CE1-CD2 4.33Å; F200-F218 AromaticContact CE1-CE2 3.7Å; F200-F218 HydrophobicContact CE1-CE2 3.7Å; F200-F218 HydrophobicContact CE1-CZ 4.46Å; F200-F218 AromaticContact CZ-CE2 3.98Å; F200-F218 HydrophobicContact CZ-CE2 3.98Å |
| 201 | G | 91.9 | Very high | 89.9 | Confident | 0 Ų | 0 | 55.1 Ų | 55.1 | 0% | 0 | 28% | 0.284 | C | S | . | . | H | α-helix | trans | -61.6 | -42.5 | 179.5 | 0 | 0 | 0 | 0 | 0 | 113.1 | C197 V198 I199 C204 A205 | C197-G201 PolarHBondContact O-N 3.1Å; V198-G201 PolarHBondContact O-N 3.02Å; I199-G201 PolarHBondContact O-N 3.14Å; G201-C204 WeakPolarHBondContact O-CB 3.28Å; G201-C204 PolarHBondContact O-N 2.97Å; G201-A205 PolarHBondContact O-N 3.36Å |
| 202 | I | 89.6 | Confident | 90.2 | Very high | 56 Ų | 56 | 58 Ų | 58 | 29% | 0.287 | 30% | 0.295 | S | S | . | . | H | α-helix | trans | -64.9 | -42.6 | 176.1 | -69.6 | 168.7 | 0 | 0 | 0 | 111.1 | V78 V198 I199 F200 C204 A205 S206 | V78-I202 HydrophobicContact CG1-CG2 4.34Å; V78-I202 HydrophobicContact CG2-CG2 4.23Å; V198-I202 HydrophobicContact CG1-CD1 3.74Å; V198-I202 WeakPolarHBondContact O-CB 3.35Å; V198-I202 VanDerWaalsContact O-CG1 3.24Å; V198-I202 WeakPolarHBondContact O-CG1 3.46Å; V198-I202 PolarHBondContact O-N 3.43Å; I199-I202 PolarHBondContact O-N 3.5Å; F200-I202 PolarHBondContact O-N 3.44Å; I202-C204 VanDerWaalsContact C-N 3.34Å; I202-A205 WeakPolarHBondContact O-CB 3.22Å; I202-A205 PolarHBondContact O-N 2.93Å; I202-S206 PolarHBondContact O-N 3.29Å; I202-S206 VanDerWaalsContact O-N 3.08Å |
| 203 | I | 91.9 | Very high | 90.4 | Very high | 84 Ų | 84 | 62.3 Ų | 62.3 | 43% | 0.431 | 32% | 0.323 | S | S | . | . | H | α-helix | trans | -62.4 | -44.8 | 175.5 | -69.1 | 170.4 | 0 | 0 | 0 | 109.7 | I199 F200 A205 S206 R207 | I199-I203 HydrophobicContact CG2-CD1 3.75Å; I199-I203 HydrophobicContact CG2-CG1 4.43Å; I199-I203 VanDerWaalsContact O-CG1 3.29Å; I199-I203 WeakPolarHBondContact O-CG1 3.48Å; I199-I203 PolarHBondContact O-N 3.34Å; F200-I203 PolarHBondContact O-N 2.86Å; I203-A205 VanDerWaalsContact C-N 3.32Å; I203-A205 PolarHBondContact O-N 3.03Å; I203-S206 PolarHBondContact O-N 3.16Å; I203-S206 PolarHBondContact O-OG 3.23Å; I203-R207 HydrophobicContact CG2-CG 4.16Å; I203-R207 WeakPolarHBondContact O-CG 3.42Å; I203-R207 PolarHBondContact O-N 3.38Å |
| 204 | C | 91.1 | Very high | 90.5 | Very high | 10 Ų | 10 | 64.9 Ų | 64.9 | 7% | 0.068 | 34% | 0.339 | C | S | . | . | H | α-helix | trans | -56.2 | -46.1 | 175.4 | -75.9 | 0 | 0 | 0 | 0 | 112.1 | F200 G201 I202 S206 R207 V211 | F200-C204 WeakPolarHBondContact CE1-SG 3.39Å; F200-C204 PolarHBondContact O-N 3.32Å; F200-C204 PolarHBondContact O-SG 3.21Å; F200-C204 VanDerWaalsContact O-SG 3.42Å; G201-C204 WeakPolarHBondContact O-CB 3.28Å; G201-C204 PolarHBondContact O-N 2.97Å; I202-C204 VanDerWaalsContact C-N 3.34Å; C204-S206 PolarHBondContact O-N 3.38Å; C204-R207 PolarHBondContact O-N 2.87Å; C204-V211 HydrophobicContact CB-CG2 4.39Å; C204-V211 VanDerWaalsContact O-CG2 3.24Å; C204-V211 WeakPolarHBondContact O-CG2 3.31Å |
| 205 | A | 87.5 | Confident | 90.7 | Very high | 32 Ų | 32 | 65.4 Ų | 65.4 | 26% | 0.264 | 34% | 0.342 | S | S | . | . | H | α-helix | trans | -58.1 | -36.1 | 176 | 0 | 0 | 0 | 0 | 0 | 112.7 | M76 G201 I202 I203 | M76-A205 WeakPolarHBondContact O-CB 3.47Å; G201-A205 PolarHBondContact O-N 3.36Å; I202-A205 WeakPolarHBondContact O-CB 3.22Å; I202-A205 PolarHBondContact O-N 2.93Å; I203-A205 VanDerWaalsContact C-N 3.32Å; I203-A205 PolarHBondContact O-N 3.03Å |
| 206 | S | 85.3 | Confident | 90.9 | Very high | 72 Ų | 72 | 67.3 Ų | 67.3 | 50% | 0.503 | 35% | 0.351 | S | S | . | . | H | α-helix | trans | -78.4 | -18 | -178.5 | 76.3 | 0 | 0 | 0 | 0 | 115.2 | I202 I203 C204 | I202-S206 PolarHBondContact O-N 3.29Å; I202-S206 VanDerWaalsContact O-N 3.08Å; I203-S206 PolarHBondContact O-N 3.16Å; I203-S206 PolarHBondContact O-OG 3.23Å; C204-S206 PolarHBondContact O-N 3.38Å |
| 207 | R | 87.8 | Confident | 91 | Very high | 165 Ų | 165 | 68 Ų | 68 | 62% | 0.623 | 36% | 0.359 | S | S | * | . | H | α-helix | trans | -98.9 | -4.5 | -172.8 | -63.7 | -59.6 | -178.7 | -175.6 | -0 | 114.3 | I203 C204 Q209 V211 | I203-R207 HydrophobicContact CG2-CG 4.16Å; I203-R207 WeakPolarHBondContact O-CG 3.42Å; I203-R207 PolarHBondContact O-N 3.38Å; C204-R207 PolarHBondContact O-N 2.87Å; R207-Q209 PolarHBondContact O-N 3.04Å; R207-V211 HydrophobicContact CB-CB 4.32Å; R207-V211 HydrophobicContact CB-CG1 3.66Å; R207-V211 HydrophobicContact CB-CG2 3.67Å; R207-V211 HydrophobicContact CG-CG1 4.33Å |
| 208 | G | 79.3 | Confident | 91.1 | Very high | 45 Ų | 45 | 69.4 Ų | 69.4 | 46% | 0.464 | 37% | 0.365 | S | S | . | . | G | 310 helix | trans | 55.6 | -132 | 172.1 | 0 | 0 | 0 | 0 | 0 | 113.4 | K210 V211 | G208-K210 VanDerWaalsContact C-N 3.3Å; G208-K210 PolarHBondContact O-N 2.93Å; G208-V211 VanDerWaalsContact O-CG2 3.27Å; G208-V211 WeakPolarHBondContact O-CG2 3.37Å; G208-V211 PolarHBondContact O-N 3.34Å |
| 209 | Q | 87 | Confident | 91.2 | Very high | 149 Ų | 149 | 70.1 Ų | 70.1 | 70% | 0.696 | 37% | 0.367 | S | S | * | . | G | 310 helix | trans | -63.4 | -29.2 | -169.9 | -164.4 | 65.7 | 5.9 | 0 | 0 | 114.5 | R207 V211 K212 | R207-Q209 PolarHBondContact O-N 3.04Å; Q209-V211 PolarHBondContact O-N 3.33Å; Q209-K212 WeakPolarHBondContact O-CB 3.25Å; Q209-K212 PolarHBondContact O-N 3.42Å |
| 210 | K | 89.4 | Confident | 91.5 | Very high | 198 Ų | 198 | 68 Ų | 68 | 86% | 0.861 | 36% | 0.363 | S | S | * | . | G | 310 helix | trans | -62 | -27.8 | -177.9 | -71 | -172.2 | 177.1 | -177.1 | 0 | 113.2 | G208 | G208-K210 VanDerWaalsContact C-N 3.3Å; G208-K210 PolarHBondContact O-N 2.93Å |
| 211 | V | 92.7 | Very high | 91.5 | Very high | 31 Ų | 31 | 68.2 Ų | 68.2 | 19% | 0.188 | 37% | 0.367 | C | S | . | . | G | 310 helix | trans | -110.1 | 7.2 | -178.2 | -61.7 | 0 | 0 | 0 | 0 | 112.4 | C204 R207 G208 Q209 P213 V214 T215 | C204-V211 HydrophobicContact CB-CG2 4.39Å; C204-V211 VanDerWaalsContact O-CG2 3.24Å; C204-V211 WeakPolarHBondContact O-CG2 3.31Å; R207-V211 HydrophobicContact CB-CB 4.32Å; R207-V211 HydrophobicContact CB-CG1 3.66Å; R207-V211 HydrophobicContact CB-CG2 3.67Å; R207-V211 HydrophobicContact CG-CG1 4.33Å; G208-V211 VanDerWaalsContact O-CG2 3.27Å; G208-V211 WeakPolarHBondContact O-CG2 3.37Å; G208-V211 PolarHBondContact O-N 3.34Å; Q209-V211 PolarHBondContact O-N 3.33Å; V211-P213 VanDerWaalsContact C-CD 3.49Å; V211-V214 WeakPolarHBondContact O-CB 3.34Å; V211-V214 PolarHBondContact O-N 2.92Å; V211-V214 VanDerWaalsContact O-N 3.08Å; V211-T215 PolarHBondContact O-N 3.38Å; V211-T215 PolarHBondContact O-OG1 3.16Å |
| 212 | K | 91.8 | Very high | 91.5 | Very high | 75 Ų | 75 | 68.3 Ų | 68.3 | 33% | 0.326 | 37% | 0.367 | S | S | . | . | H | α-helix | trans | -54.4 | -43.3 | 179.6 | 177.9 | 167.6 | 175.9 | 48.4 | 0 | 112.9 | Q209 V214 T215 D216 | Q209-K212 WeakPolarHBondContact O-CB 3.25Å; Q209-K212 PolarHBondContact O-N 3.42Å; K212-V214 VanDerWaalsContact C-N 3.28Å; K212-V214 PolarHBondContact O-N 3.4Å; K212-T215 WeakPolarHBondContact O-CB 3.25Å; K212-T215 PolarHBondContact O-N 2.81Å; K212-T215 VanDerWaalsContact O-N 3.11Å; K212-D216 VanDerWaalsContact CE-OD2 3.29Å; K212-D216 WeakPolarHBondContact CE-OD2 3.32Å; K212-D216 VanDerWaalsContact CG-OD2 3.3Å; K212-D216 WeakPolarHBondContact CG-OD2 3.3Å; K212-D216 IonicContact NZ-OD1 2.84Å; K212-D216 PolarHBondContact NZ-OD1 3.09Å; K212-D216 IonicContact NZ-OD2 3.34Å; K212-D216 PolarHBondContact NZ-OD2 2.77Å; K212-D216 WeakPolarHBondContact O-CB 3.45Å; K212-D216 VanDerWaalsContact O-CG 3.3Å; K212-D216 PolarHBondContact O-N 3.01Å |
| 213 | P | 95.7 | Very high | 91.5 | Very high | 93 Ų | 93 | 71.3 Ų | 71.3 | 60% | 0.604 | 38% | 0.38 | S | S | * | . | H | α-helix | trans | -58.5 | -38 | 177 | -26 | 35.6 | 0 | 0 | 0 | 113.6 | V211 L217 | V211-P213 VanDerWaalsContact C-CD 3.49Å; P213-L217 WeakPolarHBondContact O-CB 3.48Å; P213-L217 PolarHBondContact O-N 3.3Å |
| 214 | V | 95.2 | Very high | 91.7 | Very high | 56 Ų | 56 | 72 Ų | 72 | 34% | 0.339 | 38% | 0.384 | S | S | . | . | H | α-helix | trans | -69.2 | -41.7 | 176.9 | 179 | 0 | 0 | 0 | 0 | 110.6 | F200 V211 K212 L217 F218 | F200-V214 HydrophobicContact CE1-CG1 3.95Å; F200-V214 HydrophobicContact CZ-CG1 3.88Å; V211-V214 WeakPolarHBondContact O-CB 3.34Å; V211-V214 PolarHBondContact O-N 2.92Å; V211-V214 VanDerWaalsContact O-N 3.08Å; K212-V214 VanDerWaalsContact C-N 3.28Å; K212-V214 PolarHBondContact O-N 3.4Å; V214-L217 WeakPolarHBondContact O-CB 3.33Å; V214-L217 PolarHBondContact O-N 2.87Å; V214-F218 HydrophobicContact CG1-CD2 3.95Å; V214-F218 HydrophobicContact CG1-CE2 3.74Å; V214-F218 WeakPolarHBondContact O-CD2 3.41Å; V214-F218 PolarHBondContact O-N 2.75Å; V214-F218 VanDerWaalsContact O-N 3.15Å |
| 215 | T | 93.5 | Very high | 91.7 | Very high | 17 Ų | 17 | 72 Ų | 72 | 10% | 0.104 | 38% | 0.383 | C | S | . | . | H | α-helix | trans | -62.7 | -47.1 | 176.7 | -59.5 | 0 | 0 | 0 | 0 | 111.3 | S74 V211 K212 L217 F218 I219 | S74-T215 WeakPolarHBondContact OG-CG2 3.18Å; V211-T215 PolarHBondContact O-N 3.38Å; V211-T215 PolarHBondContact O-OG1 3.16Å; K212-T215 WeakPolarHBondContact O-CB 3.25Å; K212-T215 PolarHBondContact O-N 2.81Å; K212-T215 VanDerWaalsContact O-N 3.11Å; T215-L217 VanDerWaalsContact C-N 3.31Å; T215-L217 PolarHBondContact O-N 2.78Å; T215-F218 PolarHBondContact O-N 3.12Å; T215-I219 HydrophobicContact CG2-CD1 3.87Å; T215-I219 WeakPolarHBondContact O-CG1 3.39Å; T215-I219 PolarHBondContact O-N 3.48Å |
| 216 | D | 95.3 | Very high | 91.7 | Very high | 66 Ų | 66 | 71.3 Ų | 71.3 | 35% | 0.353 | 38% | 0.376 | S | S | . | . | H | α-helix | trans | -64 | -36.2 | 179.1 | -67.7 | -14.9 | 0 | 0 | 0 | 111.3 | K212 I219 A220 | K212-D216 VanDerWaalsContact CE-OD2 3.29Å; K212-D216 WeakPolarHBondContact CE-OD2 3.32Å; K212-D216 VanDerWaalsContact CG-OD2 3.3Å; K212-D216 WeakPolarHBondContact CG-OD2 3.3Å; K212-D216 IonicContact NZ-OD1 2.84Å; K212-D216 PolarHBondContact NZ-OD1 3.09Å; K212-D216 IonicContact NZ-OD2 3.34Å; K212-D216 PolarHBondContact NZ-OD2 2.77Å; K212-D216 WeakPolarHBondContact O-CB 3.45Å; K212-D216 VanDerWaalsContact O-CG 3.3Å; K212-D216 PolarHBondContact O-N 3.01Å; D216-I219 PolarHBondContact O-N 3.43Å; D216-A220 WeakPolarHBondContact O-CB 3.16Å; D216-A220 PolarHBondContact O-N 3.36Å |
| 217 | L | 96.2 | Very high | 92 | Very high | 98 Ų | 98 | 71 Ų | 71 | 51% | 0.513 | 37% | 0.373 | S | S | . | . | H | α-helix | trans | -58.6 | -50.9 | 172 | 173.6 | 66.5 | 0 | 0 | 0 | 111.7 | P213 V214 T215 I219 A220 L221 | P213-L217 WeakPolarHBondContact O-CB 3.48Å; P213-L217 PolarHBondContact O-N 3.3Å; V214-L217 WeakPolarHBondContact O-CB 3.33Å; V214-L217 PolarHBondContact O-N 2.87Å; T215-L217 VanDerWaalsContact C-N 3.31Å; T215-L217 PolarHBondContact O-N 2.78Å; L217-I219 VanDerWaalsContact C-N 3.32Å; L217-I219 PolarHBondContact O-N 3.37Å; L217-A220 PolarHBondContact O-N 3.41Å; L217-L221 HydrophobicContact CD1-CD1 4.26Å; L217-L221 HydrophobicContact CD1-CG 4.32Å; L217-L221 HydrophobicContact CG-CD1 4.14Å; L217-L221 WeakPolarHBondContact O-CG 3.41Å; L217-L221 PolarHBondContact O-N 3.39Å |
| 218 | F | 95.4 | Very high | 92.1 | Very high | 30 Ų | 30 | 67.2 Ų | 67.2 | 13% | 0.132 | 36% | 0.364 | C | S | . | . | H | α-helix | trans | -67.6 | -33.1 | -179.2 | -77.5 | -68.5 | 0 | 0 | 0 | 112.6 | I66 I70 A71 F200 V214 T215 L221 D222 | I66-F218 HydrophobicContact CG2-CE1 3.83Å; I70-F218 HydrophobicContact CB-CB 4.36Å; I70-F218 HydrophobicContact CB-CD1 4.3Å; I70-F218 HydrophobicContact CB-CD2 4.24Å; I70-F218 HydrophobicContact CB-CG 4.05Å; I70-F218 HydrophobicContact CD1-CD1 4.2Å; I70-F218 HydrophobicContact CD1-CD2 4.41Å; I70-F218 HydrophobicContact CD1-CE1 3.77Å; I70-F218 HydrophobicContact CD1-CE2 4.01Å; I70-F218 HydrophobicContact CD1-CZ 3.66Å; I70-F218 HydrophobicContact CG2-CB 4.02Å; I70-F218 HydrophobicContact CG2-CD1 4.36Å; I70-F218 HydrophobicContact CG2-CD2 3.43Å; I70-F218 VanDerWaalsContact CG2-CD2 3.43Å; I70-F218 HydrophobicContact CG2-CE2 3.93Å; I70-F218 HydrophobicContact CG2-CG 3.68Å; A71-F218 HydrophobicContact CB-CB 4.36Å; F200-F218 HydrophobicContact CE1-CD2 4.33Å; F200-F218 AromaticContact CE1-CE2 3.7Å; F200-F218 HydrophobicContact CE1-CE2 3.7Å; F200-F218 HydrophobicContact CE1-CZ 4.46Å; F200-F218 AromaticContact CZ-CE2 3.98Å; F200-F218 HydrophobicContact CZ-CE2 3.98Å; V214-F218 HydrophobicContact CG1-CD2 3.95Å; V214-F218 HydrophobicContact CG1-CE2 3.74Å; V214-F218 WeakPolarHBondContact O-CD2 3.41Å; V214-F218 PolarHBondContact O-N 2.75Å; V214-F218 VanDerWaalsContact O-N 3.15Å; T215-F218 PolarHBondContact O-N 3.12Å; F218-L221 HydrophobicContact CD1-CD1 4.18Å; F218-L221 HydrophobicContact CE1-CD1 4.45Å; F218-L221 PolarHBondContact O-N 3.02Å; F218-D222 WeakPolarHBondContact O-CB 3.26Å; F218-D222 PolarHBondContact O-N 3.44Å |
| 219 | I | 93.1 | Very high | 92.5 | Very high | 41 Ų | 41 | 65.3 Ų | 65.3 | 21% | 0.21 | 34% | 0.343 | C | S | . | . | H | α-helix | trans | -62.4 | -46 | 171.4 | -68.4 | 166.6 | 0 | 0 | 0 | 110.4 | A71 Q75 T215 D216 L217 D222 H223 | A71-I219 HydrophobicContact CB-CG1 3.87Å; Q75-I219 HydrophobicContact CG-CD1 4.2Å; T215-I219 HydrophobicContact CG2-CD1 3.87Å; T215-I219 WeakPolarHBondContact O-CG1 3.39Å; T215-I219 PolarHBondContact O-N 3.48Å; D216-I219 PolarHBondContact O-N 3.43Å; L217-I219 VanDerWaalsContact C-N 3.32Å; L217-I219 PolarHBondContact O-N 3.37Å; I219-D222 PolarHBondContact O-N 3.44Å; I219-H223 PolarHBondContact O-CD2 2.89Å; I219-H223 VanDerWaalsContact O-CD2 3.3Å; I219-H223 PolarHBondContact O-N 2.8Å |
| 220 | A | 96.6 | Very high | 92.4 | Very high | 47 Ų | 47 | 63.7 Ų | 63.7 | 39% | 0.388 | 33% | 0.33 | S | S | . | . | H | α-helix | trans | -62.9 | -43.5 | 177.3 | 0 | 0 | 0 | 0 | 0 | 111.9 | D216 L217 D222 H223 I224 | D216-A220 WeakPolarHBondContact O-CB 3.16Å; D216-A220 PolarHBondContact O-N 3.36Å; L217-A220 PolarHBondContact O-N 3.41Å; A220-D222 PolarHBondContact O-N 2.92Å; A220-H223 WeakPolarHBondContact O-CB 3.4Å; A220-H223 PolarHBondContact O-N 3.2Å; A220-I224 VanDerWaalsContact O-CG1 3.31Å; A220-I224 WeakPolarHBondContact O-CG1 3.36Å; A220-I224 PolarHBondContact O-N 2.86Å |
| 221 | L | 95.2 | Very high | 92.4 | Very high | 67 Ų | 67 | 61.1 Ų | 61.1 | 35% | 0.351 | 32% | 0.323 | S | S | . | . | H | α-helix | trans | -60.6 | -43.5 | 175.1 | -72.5 | 173.9 | 0 | 0 | 0 | 111.9 | L217 F218 H223 I224 V225 | L217-L221 HydrophobicContact CD1-CD1 4.26Å; L217-L221 HydrophobicContact CD1-CG 4.32Å; L217-L221 HydrophobicContact CG-CD1 4.14Å; L217-L221 WeakPolarHBondContact O-CG 3.41Å; L217-L221 PolarHBondContact O-N 3.39Å; F218-L221 HydrophobicContact CD1-CD1 4.18Å; F218-L221 HydrophobicContact CE1-CD1 4.45Å; F218-L221 PolarHBondContact O-N 3.02Å; L221-H223 VanDerWaalsContact C-N 3.31Å; L221-H223 PolarHBondContact O-N 2.86Å; L221-I224 PolarHBondContact O-N 2.84Å; L221-V225 WeakPolarHBondContact O-CB 3.25Å; L221-V225 VanDerWaalsContact O-CG2 3.28Å; L221-V225 WeakPolarHBondContact O-CG2 3.39Å; L221-V225 PolarHBondContact O-N 2.88Å |
| 222 | D | 90.9 | Very high | 92.1 | Very high | 2 Ų | 2 | 59.8 Ų | 59.8 | 1% | 0.011 | 32% | 0.315 | C | S | . | . | H | α-helix | trans | -59.6 | -42.1 | 176.5 | 174 | 95.5 | 0 | 0 | 0 | 111.5 | S68 A71 F218 I219 A220 T226 R334 | S68-D222 WeakPolarHBondContact CA-OD1 3.34Å; S68-D222 WeakPolarHBondContact CB-OD1 3.38Å; S68-D222 PolarHBondContact OG-OD1 2.72Å; A71-D222 HydrophobicContact CB-CB 4.31Å; F218-D222 WeakPolarHBondContact O-CB 3.26Å; F218-D222 PolarHBondContact O-N 3.44Å; I219-D222 PolarHBondContact O-N 3.44Å; A220-D222 PolarHBondContact O-N 2.92Å; D222-T226 VanDerWaalsContact O-CB 3.24Å; D222-T226 WeakPolarHBondContact O-CB 3.38Å; D222-T226 PolarHBondContact O-N 3.18Å; D222-T226 PolarHBondContact O-OG1 3.04Å; D222-R334 IonicContact OD1-CZ 3.44Å; D222-R334 IonicContact OD1-NE 3.66Å; D222-R334 PolarHBondContact OD1-NE 2.9Å; D222-R334 IonicContact OD1-NH2 2.65Å; D222-R334 IonicContact OD2-CZ 3.06Å; D222-R334 IonicContact OD2-NE 3.72Å; D222-R334 IonicContact OD2-NH2 3.83Å; D222-R334 PolarHBondContact OD2-NH2 3.12Å |
| 223 | H | 90.9 | Very high | 91.7 | Very high | 119 Ų | 119 | 56.5 Ų | 56.5 | 55% | 0.551 | 30% | 0.301 | S | S | * | . | H | α-helix | trans | -61.4 | -46.5 | 173.9 | -88.2 | -77.9 | 0 | 0 | 0 | 112.3 | I219 A220 L221 T226 C227 | I219-H223 PolarHBondContact O-CD2 2.89Å; I219-H223 VanDerWaalsContact O-CD2 3.3Å; I219-H223 PolarHBondContact O-N 2.8Å; A220-H223 WeakPolarHBondContact O-CB 3.4Å; A220-H223 PolarHBondContact O-N 3.2Å; L221-H223 VanDerWaalsContact C-N 3.31Å; L221-H223 PolarHBondContact O-N 2.86Å; H223-T226 PolarHBondContact O-N 3.46Å; H223-C227 PolarHBondContact O-N 3.35Å; H223-C227 VanDerWaalsContact O-N 3.11Å; H223-C227 PolarHBondContact O-SG 3.25Å; H223-C227 VanDerWaalsContact O-SG 3.36Å |
| 224 | I | 95 | Very high | 91.4 | Very high | 99 Ų | 99 | 60.5 Ų | 60.5 | 51% | 0.508 | 30% | 0.304 | S | S | . | . | H | α-helix | trans | -62.8 | -49.9 | 179.3 | -67.8 | 164.3 | 0 | 0 | 0 | 110.6 | A220 L221 T226 C227 M228 | A220-I224 VanDerWaalsContact O-CG1 3.31Å; A220-I224 WeakPolarHBondContact O-CG1 3.36Å; A220-I224 PolarHBondContact O-N 2.86Å; L221-I224 PolarHBondContact O-N 2.84Å; I224-T226 VanDerWaalsContact C-N 3.33Å; I224-T226 PolarHBondContact O-N 2.99Å; I224-C227 WeakPolarHBondContact O-CB 3.48Å; I224-C227 PolarHBondContact O-N 3Å; I224-C227 VanDerWaalsContact O-N 3.1Å; I224-M228 HydrophobicContact CG2-SD 4.32Å; I224-M228 WeakPolarHBondContact O-CG 3.47Å; I224-M228 PolarHBondContact O-N 2.94Å |
| 225 | V | 92.1 | Very high | 91.2 | Very high | 10 Ų | 10 | 61.1 Ų | 61.1 | 6% | 0.061 | 30% | 0.301 | C | S | . | . | H | α-helix | trans | -64.5 | -40.1 | -178.8 | 177.9 | 0 | 0 | 0 | 0 | 110.5 | L60 P63 L64 L221 C227 M228 V229 | L60-V225 HydrophobicContact CD2-CG1 4.47Å; P63-V225 HydrophobicContact CB-CG1 4.33Å; P63-V225 HydrophobicContact CB-CG2 3.79Å; L64-V225 HydrophobicContact CB-CG1 3.76Å; L64-V225 HydrophobicContact CD1-CG1 3.97Å; L64-V225 HydrophobicContact CG-CG1 4.46Å; L221-V225 WeakPolarHBondContact O-CB 3.25Å; L221-V225 VanDerWaalsContact O-CG2 3.28Å; L221-V225 WeakPolarHBondContact O-CG2 3.39Å; L221-V225 PolarHBondContact O-N 2.88Å; V225-C227 VanDerWaalsContact C-N 3.26Å; V225-C227 PolarHBondContact O-N 3.19Å; V225-M228 WeakPolarHBondContact O-CB 3.37Å; V225-M228 PolarHBondContact O-N 3.3Å; V225-V229 HydrophobicContact CG1-CG2 4.32Å; V225-V229 VanDerWaalsContact O-CG2 3.27Å; V225-V229 WeakPolarHBondContact O-CG2 3.27Å; V225-V229 PolarHBondContact O-N 3.19Å |
| 226 | T | 87.3 | Confident | 90.9 | Very high | 18 Ų | 18 | 60.5 Ų | 60.5 | 11% | 0.11 | 30% | 0.297 | C | S | . | . | H | α-helix | trans | -58.8 | -37.8 | 174 | -62.5 | 0 | 0 | 0 | 0 | 111.8 | D222 H223 I224 V229 R230 | D222-T226 VanDerWaalsContact O-CB 3.24Å; D222-T226 WeakPolarHBondContact O-CB 3.38Å; D222-T226 PolarHBondContact O-N 3.18Å; D222-T226 PolarHBondContact O-OG1 3.04Å; H223-T226 PolarHBondContact O-N 3.46Å; I224-T226 VanDerWaalsContact C-N 3.33Å; I224-T226 PolarHBondContact O-N 2.99Å; T226-V229 PolarHBondContact O-N 3.19Å; T226-R230 WeakPolarHBondContact O-CG 3.4Å; T226-R230 PolarHBondContact O-N 2.86Å; T226-R230 VanDerWaalsContact O-N 3.08Å |
| 227 | C | 90.6 | Very high | 90.7 | Very high | 66 Ų | 66 | 58.3 Ų | 58.3 | 45% | 0.446 | 29% | 0.287 | S | S | . | . | H | α-helix | trans | -65.2 | -43 | 173.2 | -70.7 | 0 | 0 | 0 | 0 | 112.1 | H223 I224 V225 V229 R230 M231 | H223-C227 PolarHBondContact O-N 3.35Å; H223-C227 VanDerWaalsContact O-N 3.11Å; H223-C227 PolarHBondContact O-SG 3.25Å; H223-C227 VanDerWaalsContact O-SG 3.36Å; I224-C227 WeakPolarHBondContact O-CB 3.48Å; I224-C227 PolarHBondContact O-N 3Å; I224-C227 VanDerWaalsContact O-N 3.1Å; V225-C227 VanDerWaalsContact C-N 3.26Å; V225-C227 PolarHBondContact O-N 3.19Å; C227-V229 VanDerWaalsContact C-N 3.31Å; C227-V229 PolarHBondContact O-N 3.29Å; C227-R230 WeakPolarHBondContact O-CB 3.39Å; C227-R230 PolarHBondContact O-N 3.41Å; C227-M231 WeakPolarHBondContact O-CG 3.22Å; C227-M231 PolarHBondContact O-N 2.97Å; C227-M231 VanDerWaalsContact O-N 3.16Å |
| 228 | M | 91.1 | Very high | 90.6 | Very high | 85 Ų | 85 | 57.6 Ų | 57.6 | 42% | 0.419 | 29% | 0.286 | S | S | . | . | H | α-helix | trans | -61 | -40.3 | 175 | -62.1 | 171.3 | 71.1 | 0 | 0 | 111.9 | L60 I224 V225 R230 M231 A232 | L60-M228 HydrophobicContact CD2-CB 3.75Å; L60-M228 HydrophobicContact CD2-CE 3.94Å; L60-M228 HydrophobicContact CD2-SD 4.42Å; I224-M228 HydrophobicContact CG2-SD 4.32Å; I224-M228 WeakPolarHBondContact O-CG 3.47Å; I224-M228 PolarHBondContact O-N 2.94Å; V225-M228 WeakPolarHBondContact O-CB 3.37Å; V225-M228 PolarHBondContact O-N 3.3Å; M228-R230 PolarHBondContact O-N 3.23Å; M228-M231 WeakPolarHBondContact O-CB 3.31Å; M228-M231 PolarHBondContact O-N 3.44Å; M228-A232 PolarHBondContact O-N 3.46Å |
| 229 | V | 87.3 | Confident | 90.5 | Very high | 4 Ų | 4 | 56.1 Ų | 56.1 | 2% | 0.024 | 28% | 0.28 | C | S | . | . | H | α-helix | trans | -60.4 | -44.7 | 175.6 | 169.7 | 0 | 0 | 0 | 0 | 111.3 | L60 L64 V225 T226 C227 M231 A232 I233 P317 | L60-V229 HydrophobicContact CB-CG2 4.24Å; L60-V229 HydrophobicContact CD1-CG2 3.93Å; L60-V229 HydrophobicContact CG-CG2 4.48Å; L64-V229 HydrophobicContact CD2-CG2 4.44Å; V225-V229 HydrophobicContact CG1-CG2 4.32Å; V225-V229 VanDerWaalsContact O-CG2 3.27Å; V225-V229 WeakPolarHBondContact O-CG2 3.27Å; V225-V229 PolarHBondContact O-N 3.19Å; T226-V229 PolarHBondContact O-N 3.19Å; C227-V229 VanDerWaalsContact C-N 3.31Å; C227-V229 PolarHBondContact O-N 3.29Å; V229-M231 VanDerWaalsContact C-N 3.27Å; V229-M231 PolarHBondContact O-N 3.13Å; V229-A232 PolarHBondContact O-N 2.95Å; V229-I233 HydrophobicContact CG1-CD1 3.61Å; V229-I233 HydrophobicContact CG1-CG1 4.37Å; V229-I233 WeakPolarHBondContact O-CD1 3.26Å; V229-I233 VanDerWaalsContact O-CG1 3.3Å; V229-I233 WeakPolarHBondContact O-CG1 3.35Å; V229-I233 PolarHBondContact O-N 3.32Å; V229-P317 HydrophobicContact CB-CB 4.22Å; V229-P317 HydrophobicContact CG1-CB 3.47Å; V229-P317 VanDerWaalsContact CG1-CB 3.47Å; V229-P317 HydrophobicContact CG2-CB 3.65Å |
| 230 | R | 86 | Confident | 90.3 | Very high | 116 Ų | 116 | 54.2 Ų | 54.2 | 44% | 0.438 | 27% | 0.27 | S | S | . | . | H | α-helix | trans | -58.8 | -40.5 | 176.2 | -71 | 172.5 | -175.9 | 177 | 3.8 | 111.7 | T226 C227 M228 W234 | T226-R230 WeakPolarHBondContact O-CG 3.4Å; T226-R230 PolarHBondContact O-N 2.86Å; T226-R230 VanDerWaalsContact O-N 3.08Å; C227-R230 WeakPolarHBondContact O-CB 3.39Å; C227-R230 PolarHBondContact O-N 3.41Å; M228-R230 PolarHBondContact O-N 3.23Å; R230-W234 VanDerWaalsContact O-CD1 3.24Å |
| 231 | M | 88.1 | Confident | 90.2 | Very high | 144 Ų | 144 | 53.1 Ų | 53.1 | 71% | 0.709 | 26% | 0.258 | S | S | * | . | H | α-helix | trans | -65.9 | -45.7 | 176 | -64 | 170.4 | 66 | 0 | 0 | 111.6 | C227 M228 V229 I233 W234 | C227-M231 WeakPolarHBondContact O-CG 3.22Å; C227-M231 PolarHBondContact O-N 2.97Å; C227-M231 VanDerWaalsContact O-N 3.16Å; M228-M231 WeakPolarHBondContact O-CB 3.31Å; M228-M231 PolarHBondContact O-N 3.44Å; V229-M231 VanDerWaalsContact C-N 3.27Å; V229-M231 PolarHBondContact O-N 3.13Å; M231-I233 VanDerWaalsContact C-N 3.3Å; M231-I233 PolarHBondContact O-N 3.24Å; M231-W234 PolarHBondContact O-N 2.99Å |
| 232 | A | 87.1 | Confident | 90.2 | Very high | 3 Ų | 3 | 50.3 Ų | 50.3 | 3% | 0.025 | 24% | 0.244 | C | C | . | . | H | α-helix | trans | -61.9 | -36.9 | 178.7 | 0 | 0 | 0 | 0 | 0 | 112.8 | M56 L60 M228 V229 W234 Y235 | M56-A232 HydrophobicContact CE-CB 3.79Å; L60-A232 HydrophobicContact CD1-CB 3.69Å; M228-A232 PolarHBondContact O-N 3.46Å; V229-A232 PolarHBondContact O-N 2.95Å; A232-W234 VanDerWaalsContact C-N 3.26Å; A232-W234 PolarHBondContact O-N 2.86Å; A232-Y235 WeakPolarHBondContact O-CB 3.27Å; A232-Y235 PolarHBondContact O-N 3.39Å |
| 233 | I | 84 | Confident | 90.1 | Very high | 5 Ų | 5 | 50.8 Ų | 50.8 | 3% | 0.026 | 25% | 0.247 | C | C | . | . | H | α-helix | trans | -63.8 | -30.3 | 178.7 | -74.2 | 163.6 | 0 | 0 | 0 | 112.3 | L15 V229 M231 Y235 S236 V318 | L15-I233 HydrophobicContact CD1-CG2 4.44Å; L15-I233 HydrophobicContact CD2-CG2 3.46Å; L15-I233 VanDerWaalsContact CD2-CG2 3.46Å; L15-I233 HydrophobicContact CG-CG2 4.45Å; V229-I233 HydrophobicContact CG1-CD1 3.61Å; V229-I233 HydrophobicContact CG1-CG1 4.37Å; V229-I233 WeakPolarHBondContact O-CD1 3.26Å; V229-I233 VanDerWaalsContact O-CG1 3.3Å; V229-I233 WeakPolarHBondContact O-CG1 3.35Å; V229-I233 PolarHBondContact O-N 3.32Å; M231-I233 VanDerWaalsContact C-N 3.3Å; M231-I233 PolarHBondContact O-N 3.24Å; I233-Y235 PolarHBondContact O-N 3.46Å; I233-S236 WeakPolarHBondContact O-CB 3.22Å; I233-S236 PolarHBondContact O-N 3.19Å; I233-S236 PolarHBondContact O-OG 3.27Å; I233-V318 HydrophobicContact CD1-CB 4.2Å; I233-V318 HydrophobicContact CD1-CG1 4.16Å; I233-V318 HydrophobicContact CD1-CG2 3.88Å; I233-V318 HydrophobicContact CG1-CB 4.48Å; I233-V318 HydrophobicContact CG1-CG1 4.42Å; I233-V318 HydrophobicContact CG1-CG2 3.7Å |
| 234 | W | 88.2 | Confident | 90 | Very high | 178 Ų | 178 | 46 Ų | 46 | 67% | 0.674 | 23% | 0.225 | S | C | * | . | H | α-helix | trans | -66.3 | -22.2 | 174.5 | -83.3 | 100.9 | 0 | 0 | 0 | 113.5 | L15 R230 M231 A232 S236 P237 | L15-W234 HydrophobicContact CB-CH2 4.47Å; L15-W234 HydrophobicContact CB-CZ3 4.5Å; L15-W234 HydrophobicContact CD1-CD2 4.38Å; L15-W234 HydrophobicContact CD1-CE3 4.19Å; R230-W234 VanDerWaalsContact O-CD1 3.24Å; M231-W234 PolarHBondContact O-N 2.99Å; A232-W234 VanDerWaalsContact C-N 3.26Å; A232-W234 PolarHBondContact O-N 2.86Å; W234-S236 VanDerWaalsContact C-N 3.29Å; W234-P237 VanDerWaalsContact O-CD 3.3Å; W234-P237 WeakPolarHBondContact O-CD 3.13Å |
| 235 | Y | 91.2 | Very high | 89.8 | Confident | 69 Ų | 69 | 41.4 Ų | 41.4 | 27% | 0.271 | 20% | 0.202 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -78 | -15.4 | 171.8 | -171.7 | -107.8 | 0 | 0 | 0 | 112.8 | P49 I52 L53 M56 A232 I233 P237 V238 G239 | P49-Y235 WeakPolarHBondContact CA-OH 3.47Å; P49-Y235 WeakPolarHBondContact CB-OH 3.44Å; P49-Y235 VanDerWaalsContact O-CE1 3.32Å; P49-Y235 WeakPolarHBondContact O-CE1 3.32Å; P49-Y235 PolarHBondContact O-OH 3.32Å; I52-Y235 HydrophobicContact CB-CE1 4.23Å; I52-Y235 HydrophobicContact CG2-CE1 4.04Å; L53-Y235 HydrophobicContact CB-CD1 3.89Å; L53-Y235 HydrophobicContact CB-CE1 3.9Å; L53-Y235 HydrophobicContact CD1-CD1 4.02Å; M56-Y235 HydrophobicContact SD-CD1 3.86Å; M56-Y235 HydrophobicContact SD-CE1 4.37Å; M56-Y235 HydrophobicContact SD-CG 4.25Å; A232-Y235 WeakPolarHBondContact O-CB 3.27Å; A232-Y235 PolarHBondContact O-N 3.39Å; I233-Y235 PolarHBondContact O-N 3.46Å; Y235-P237 VanDerWaalsContact C-CD 3.43Å; Y235-V238 HydrophobicContact CE2-CB 4.42Å; Y235-V238 HydrophobicContact CE2-CG1 4.36Å; Y235-V238 PolarHBondContact O-N 2.81Å; Y235-G239 PolarHBondContact O-N 3.29Å; Y235-G239 VanDerWaalsContact O-N 3.11Å |
| 236 | S | 87.4 | Confident | 89.6 | Confident | 3 Ų | 3 | 41 Ų | 41 | 2% | 0.021 | 20% | 0.199 | C | C | . | . | H | α-helix | trans | -55.9 | -38.6 | -174.2 | 68.5 | 0 | 0 | 0 | 0 | 115.3 | T19 I233 W234 V238 G239 I240 Q301 | T19-S236 WeakPolarHBondContact CG2-OG 3.48Å; I233-S236 WeakPolarHBondContact O-CB 3.22Å; I233-S236 PolarHBondContact O-N 3.19Å; I233-S236 PolarHBondContact O-OG 3.27Å; W234-S236 VanDerWaalsContact C-N 3.29Å; S236-V238 VanDerWaalsContact C-N 3.34Å; S236-V238 PolarHBondContact O-N 3.07Å; S236-G239 PolarHBondContact O-N 3.36Å; S236-I240 WeakPolarHBondContact O-CB 3.35Å; S236-I240 WeakPolarHBondContact O-CD1 3.27Å; S236-I240 WeakPolarHBondContact O-CG1 3.48Å; S236-I240 PolarHBondContact O-N 3.39Å; S236-Q301 PolarHBondContact OG-NE2 2.97Å |
| 237 | P | 91 | Very high | 89.3 | Confident | 21 Ų | 21 | 41.9 Ų | 41.9 | 14% | 0.136 | 20% | 0.203 | C | C | . | . | H | α-helix | trans | -59.4 | -45.7 | 179 | -22.3 | 34 | 0 | 0 | 0 | 112 | L15 A18 T19 A22 W234 Y235 V241 | L15-P237 HydrophobicContact CD1-CG 4.14Å; A18-P237 HydrophobicContact CB-CB 4.08Å; A18-P237 HydrophobicContact CB-CG 3.79Å; T19-P237 HydrophobicContact CG2-CB 4.48Å; T19-P237 HydrophobicContact CG2-CG 3.89Å; A22-P237 HydrophobicContact CB-CB 4.1Å; A22-P237 WeakPolarHBondContact CB-O 3.34Å; W234-P237 VanDerWaalsContact O-CD 3.3Å; W234-P237 WeakPolarHBondContact O-CD 3.13Å; Y235-P237 VanDerWaalsContact C-CD 3.43Å; P237-V241 WeakPolarHBondContact O-CG2 3.47Å; P237-V241 PolarHBondContact O-N 2.95Å; P237-V241 VanDerWaalsContact O-N 3.15Å |
| 238 | V | 94.2 | Very high | 88.9 | Confident | 82 Ų | 82 | 39.9 Ų | 39.9 | 50% | 0.497 | 19% | 0.188 | S | C | . | . | H | α-helix | trans | -66.8 | -47.6 | 179.4 | 178.6 | 0 | 0 | 0 | 0 | 110.7 | P49 Y235 S236 I240 V241 S242 | P49-V238 HydrophobicContact CB-CG1 4.18Å; Y235-V238 HydrophobicContact CE2-CB 4.42Å; Y235-V238 HydrophobicContact CE2-CG1 4.36Å; Y235-V238 PolarHBondContact O-N 2.81Å; S236-V238 VanDerWaalsContact C-N 3.34Å; S236-V238 PolarHBondContact O-N 3.07Å; V238-I240 VanDerWaalsContact C-N 3.35Å; V238-I240 PolarHBondContact O-N 3.44Å; V238-V241 PolarHBondContact O-N 3.35Å; V238-S242 PolarHBondContact O-N 3.3Å |
| 239 | G | 92.9 | Very high | 88.6 | Confident | 0 Ų | 0 | 36.5 Ų | 36.5 | 0% | 0 | 17% | 0.172 | C | C | . | . | H | α-helix | trans | -64.1 | -37.2 | 179.4 | 0 | 0 | 0 | 0 | 0 | 113.1 | G50 Y235 S236 S242 L243 | G50-G239 WeakPolarHBondContact CA-O 3.2Å; Y235-G239 PolarHBondContact O-N 3.29Å; Y235-G239 VanDerWaalsContact O-N 3.11Å; S236-G239 PolarHBondContact O-N 3.36Å; G239-S242 PolarHBondContact O-N 3.5Å; G239-L243 WeakPolarHBondContact O-CB 3.26Å; G239-L243 VanDerWaalsContact O-CG 3.26Å; G239-L243 WeakPolarHBondContact O-CG 3.28Å; G239-L243 PolarHBondContact O-N 3.31Å |
| 240 | I | 90.3 | Very high | 88.1 | Confident | 0 Ų | 0 | 43.2 Ų | 43.2 | 0% | 0 | 20% | 0.197 | C | C | . | . | H | α-helix | trans | -68.5 | -42.7 | 178.9 | -71.6 | 167.9 | 0 | 0 | 0 | 111.4 | T19 A22 V23 L53 S236 V238 S242 L243 I244 | T19-I240 HydrophobicContact CG2-CD1 4.14Å; A22-I240 HydrophobicContact CB-CB 4.45Å; A22-I240 HydrophobicContact CB-CG2 4.38Å; V23-I240 HydrophobicContact CG2-CG2 3.6Å; L53-I240 HydrophobicContact CD2-CG1 4.14Å; S236-I240 WeakPolarHBondContact O-CB 3.35Å; S236-I240 WeakPolarHBondContact O-CD1 3.27Å; S236-I240 WeakPolarHBondContact O-CG1 3.48Å; S236-I240 PolarHBondContact O-N 3.39Å; V238-I240 VanDerWaalsContact C-N 3.35Å; V238-I240 PolarHBondContact O-N 3.44Å; I240-S242 VanDerWaalsContact C-N 3.29Å; I240-S242 PolarHBondContact O-N 3.4Å; I240-L243 PolarHBondContact O-N 2.81Å; I240-I244 HydrophobicContact CG2-CD1 3.67Å; I240-I244 HydrophobicContact CG2-CG1 4.4Å; I240-I244 WeakPolarHBondContact O-CG1 3.37Å; I240-I244 PolarHBondContact O-N 3.04Å |
| 241 | V | 94.3 | Very high | 87.4 | Confident | 25 Ų | 25 | 38.9 Ų | 38.9 | 15% | 0.152 | 18% | 0.182 | C | C | . | . | H | α-helix | trans | -53.9 | -51.9 | 172.9 | 173 | 0 | 0 | 0 | 0 | 109.6 | A22 L25 L29 P237 V238 I244 A245 | A22-V241 VanDerWaalsContact CA-CG2 3.46Å; A22-V241 HydrophobicContact CB-CG2 3.56Å; A22-V241 VanDerWaalsContact O-CG2 3.31Å; A22-V241 WeakPolarHBondContact O-CG2 3.32Å; L25-V241 HydrophobicContact CB-CG2 4.28Å; L25-V241 HydrophobicContact CD2-CG1 4.38Å; L25-V241 HydrophobicContact CD2-CG2 4.06Å; L25-V241 HydrophobicContact CG-CG1 4.29Å; L25-V241 HydrophobicContact CG-CG2 4.36Å; L29-V241 HydrophobicContact CD1-CG1 3.93Å; P237-V241 WeakPolarHBondContact O-CG2 3.47Å; P237-V241 PolarHBondContact O-N 2.95Å; P237-V241 VanDerWaalsContact O-N 3.15Å; V238-V241 PolarHBondContact O-N 3.35Å; V241-I244 PolarHBondContact O-N 3.15Å; V241-A245 VanDerWaalsContact O-CB 3.26Å; V241-A245 WeakPolarHBondContact O-CB 3.34Å; V241-A245 PolarHBondContact O-N 3.44Å |
| 242 | S | 94.5 | Very high | 86.3 | Confident | 8 Ų | 8 | 38.9 Ų | 38.9 | 6% | 0.056 | 19% | 0.185 | C | C | . | . | H | α-helix | trans | -64.4 | -42.9 | -177.1 | 171.3 | 0 | 0 | 0 | 0 | 112.6 | I46 S47 P49 G50 V238 G239 I240 G246 | I46-S242 VanDerWaalsContact O-CB 3.32Å; I46-S242 WeakPolarHBondContact O-CB 3.31Å; I46-S242 PolarHBondContact O-OG 2.96Å; S47-S242 VanDerWaalsContact C-OG 3.25Å; S47-S242 WeakPolarHBondContact CA-OG 3.32Å; S47-S242 PolarHBondContact O-OG 3.27Å; P49-S242 WeakPolarHBondContact CD-OG 3.48Å; G50-S242 VanDerWaalsContact N-CB 3.33Å; G50-S242 PolarHBondContact N-OG 3.46Å; V238-S242 PolarHBondContact O-N 3.3Å; G239-S242 PolarHBondContact O-N 3.5Å; I240-S242 VanDerWaalsContact C-N 3.29Å; I240-S242 PolarHBondContact O-N 3.4Å; S242-G246 WeakPolarHBondContact O-CA 3.36Å; S242-G246 PolarHBondContact O-N 2.85Å |
| 243 | L | 89.2 | Confident | 85.3 | Confident | 12 Ų | 12 | 43.4 Ų | 43.4 | 6% | 0.063 | 21% | 0.209 | C | C | . | . | H | α-helix | trans | -61.3 | -49.9 | 176.1 | -77.4 | 171.7 | 0 | 0 | 0 | 111 | G50 L53 L54 G239 I240 N247 G308 T309 | G50-L243 WeakPolarHBondContact O-CD2 3.32Å; L53-L243 HydrophobicContact CD2-CD1 4.02Å; L54-L243 HydrophobicContact CD1-CD2 3.6Å; L54-L243 HydrophobicContact CD2-CD1 4.48Å; L54-L243 HydrophobicContact CG-CD1 4.15Å; L54-L243 HydrophobicContact CG-CD2 3.96Å; G239-L243 WeakPolarHBondContact O-CB 3.26Å; G239-L243 VanDerWaalsContact O-CG 3.26Å; G239-L243 WeakPolarHBondContact O-CG 3.28Å; G239-L243 PolarHBondContact O-N 3.31Å; I240-L243 PolarHBondContact O-N 2.81Å; L243-N247 VanDerWaalsContact O-CB 3.29Å; L243-N247 WeakPolarHBondContact O-CB 3.39Å; L243-N247 PolarHBondContact O-N 3.46Å; L243-N247 PolarHBondContact O-ND2 2.84Å; L243-G308 WeakPolarHBondContact CD1-O 3.49Å; L243-T309 HydrophobicContact CD1-CG2 4.28Å |
| 244 | I | 88 | Confident | 84.4 | Confident | 19 Ų | 19 | 46.4 Ų | 46.4 | 10% | 0.097 | 22% | 0.224 | C | C | . | . | H | α-helix | trans | -66.9 | -46.8 | -176.6 | -67.4 | 170.6 | 0 | 0 | 0 | 110.5 | V23 I27 I240 V241 N247 L248 | V23-I244 HydrophobicContact CB-CD1 4.06Å; V23-I244 HydrophobicContact CG1-CD1 3.94Å; V23-I244 HydrophobicContact CG2-CD1 3.81Å; I27-I244 HydrophobicContact CG1-CG2 3.73Å; I240-I244 HydrophobicContact CG2-CD1 3.67Å; I240-I244 HydrophobicContact CG2-CG1 4.4Å; I240-I244 WeakPolarHBondContact O-CG1 3.37Å; I240-I244 PolarHBondContact O-N 3.04Å; V241-I244 PolarHBondContact O-N 3.15Å; I244-N247 PolarHBondContact O-N 3.45Å; I244-L248 HydrophobicContact CG2-CD1 4.05Å; I244-L248 WeakPolarHBondContact O-CG 3.49Å; I244-L248 PolarHBondContact O-N 2.72Å; I244-L248 VanDerWaalsContact O-N 3.07Å |
| 245 | A | 91.4 | Very high | 83.4 | Confident | 1 Ų | 1 | 42.1 Ų | 42.1 | 1% | 0.008 | 22% | 0.222 | C | C | . | . | H | α-helix | trans | -61.4 | -50 | 178.3 | 0 | 0 | 0 | 0 | 0 | 111.5 | G26 L29 I46 V241 N247 L248 L249 | G26-A245 WeakPolarHBondContact O-CA 3.44Å; L29-A245 HydrophobicContact CB-CB 4.38Å; I46-A245 HydrophobicContact CG2-CB 3.9Å; V241-A245 VanDerWaalsContact O-CB 3.26Å; V241-A245 WeakPolarHBondContact O-CB 3.34Å; V241-A245 PolarHBondContact O-N 3.44Å; A245-N247 VanDerWaalsContact C-N 3.32Å; A245-N247 PolarHBondContact O-N 2.78Å; A245-L248 PolarHBondContact O-N 3Å; A245-L249 VanDerWaalsContact O-CG 3.31Å; A245-L249 WeakPolarHBondContact O-CG 3.38Å; A245-L249 PolarHBondContact O-N 3.49Å; A245-L249 VanDerWaalsContact O-N 3.17Å |
| 246 | G | 87.6 | Confident | 82.3 | Confident | 1 Ų | 1 | 47.5 Ų | 47.5 | 1% | 0.01 | 24% | 0.241 | C | C | . | . | H | α-helix | trans | -59.8 | -39.4 | 179.8 | 0 | 0 | 0 | 0 | 0 | 113.3 | S47 S242 L249 R250 | S47-G246 VanDerWaalsContact OG-CA 3.22Å; S47-G246 WeakPolarHBondContact OG-CA 3.26Å; S242-G246 WeakPolarHBondContact O-CA 3.36Å; S242-G246 PolarHBondContact O-N 2.85Å; G246-L249 PolarHBondContact O-N 3.18Å; G246-R250 WeakPolarHBondContact O-CG 3.46Å; G246-R250 PolarHBondContact O-N 3.36Å |
| 247 | N | 81.5 | Confident | 81.3 | Confident | 37 Ų | 37 | 48 Ų | 48 | 20% | 0.198 | 24% | 0.244 | C | C | . | . | H | α-helix | trans | -70.9 | -37.3 | 177.8 | -72.3 | -50.7 | 0 | 0 | 0 | 112.7 | L243 I244 A245 L249 R250 R423 | L243-N247 VanDerWaalsContact O-CB 3.29Å; L243-N247 WeakPolarHBondContact O-CB 3.39Å; L243-N247 PolarHBondContact O-N 3.46Å; L243-N247 PolarHBondContact O-ND2 2.84Å; I244-N247 PolarHBondContact O-N 3.45Å; A245-N247 VanDerWaalsContact C-N 3.32Å; A245-N247 PolarHBondContact O-N 2.78Å; N247-L249 VanDerWaalsContact C-N 3.27Å; N247-L249 PolarHBondContact O-N 3.19Å; N247-R250 PolarHBondContact O-N 3.38Å; N247-R423 VanDerWaalsContact CG-NH2 3.25Å; N247-R423 PolarHBondContact ND2-NH2 3.09Å |
| 248 | L | 82.7 | Confident | 80.4 | Confident | 25 Ų | 25 | 48.9 Ų | 48.9 | 13% | 0.131 | 25% | 0.253 | C | S | . | . | H | α-helix | trans | -65.8 | -30.2 | 176.3 | -76.1 | 171 | 0 | 0 | 0 | 113.3 | V31 R34 I244 A245 I251 W419 | V31-L248 HydrophobicContact CG2-CD1 4.34Å; R34-L248 PolarHBondContact NH1-O 3.33Å; I244-L248 HydrophobicContact CG2-CD1 4.05Å; I244-L248 WeakPolarHBondContact O-CG 3.49Å; I244-L248 PolarHBondContact O-N 2.72Å; I244-L248 VanDerWaalsContact O-N 3.07Å; A245-L248 PolarHBondContact O-N 3Å; L248-I251 HydrophobicContact CD2-CD1 4.5Å; L248-W419 HydrophobicContact CD2-CH2 3.89Å; L248-W419 HydrophobicContact CD2-CZ3 4.33Å |
| 249 | L | 84.7 | Confident | 79.4 | Confident | 14 Ų | 14 | 53.1 Ų | 53.1 | 7% | 0.073 | 27% | 0.268 | C | S | . | . | H | α-helix | trans | -77.5 | -19.7 | 179.1 | -68 | 175.9 | 0 | 0 | 0 | 114 | G30 I33 R34 P38 I43 I46 A245 G246 N247 I251 | G30-L249 WeakPolarHBondContact O-CD2 3.33Å; I33-L249 HydrophobicContact CB-CD1 4.46Å; I33-L249 HydrophobicContact CB-CD2 4.08Å; I33-L249 HydrophobicContact CG2-CD1 4.01Å; I33-L249 HydrophobicContact CG2-CD2 3.97Å; R34-L249 HydrophobicContact CB-CD2 3.86Å; P38-L249 HydrophobicContact CG-CD1 4.42Å; P38-L249 HydrophobicContact CG-CD2 4.03Å; I43-L249 HydrophobicContact CD1-CB 4.38Å; I43-L249 HydrophobicContact CG1-CB 4.16Å; I43-L249 HydrophobicContact CG1-CD1 4.36Å; I43-L249 HydrophobicContact CG2-CB 4.23Å; I46-L249 HydrophobicContact CD1-CD1 3.81Å; I46-L249 HydrophobicContact CG2-CD1 4.16Å; A245-L249 VanDerWaalsContact O-CG 3.31Å; A245-L249 WeakPolarHBondContact O-CG 3.38Å; A245-L249 PolarHBondContact O-N 3.49Å; A245-L249 VanDerWaalsContact O-N 3.17Å; G246-L249 PolarHBondContact O-N 3.18Å; N247-L249 VanDerWaalsContact C-N 3.27Å; N247-L249 PolarHBondContact O-N 3.19Å; L249-I251 VanDerWaalsContact C-N 3.32Å |
| 250 | R | 75.7 | Confident | 78.4 | Confident | 144 Ų | 144 | 54.5 Ų | 54.5 | 54% | 0.543 | 28% | 0.277 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -83.9 | -4.3 | -179 | -73.1 | 174.8 | -176.4 | -170.5 | -0.8 | 114.4 | I43 G246 N247 | I43-R250 HydrophobicContact CG2-CG 4.18Å; G246-R250 WeakPolarHBondContact O-CG 3.46Å; G246-R250 PolarHBondContact O-N 3.36Å; N247-R250 PolarHBondContact O-N 3.38Å |
| 251 | I | 70.9 | Confident | 78.2 | Confident | 26 Ų | 26 | 54.5 Ų | 54.5 | 13% | 0.133 | 28% | 0.278 | C | S | . | . | trans | -95.2 | 114.6 | -176.2 | -58.1 | 153.5 | 0 | 0 | 0 | 107.5 | R34 L248 L249 L254 W419 | R34-I251 PolarHBondContact NH1-O 3.33Å; R34-I251 PolarHBondContact NH2-O 3.29Å; L248-I251 HydrophobicContact CD2-CD1 4.5Å; L249-I251 VanDerWaalsContact C-N 3.32Å; I251-L254 HydrophobicContact CG2-CB 4.11Å; I251-L254 HydrophobicContact CG2-CD1 4.16Å; I251-W419 HydrophobicContact CD1-CD2 3.7Å; I251-W419 HydrophobicContact CD1-CE3 4.03Å; I251-W419 HydrophobicContact CD1-CG 4.46Å; I251-W419 HydrophobicContact CD1-CH2 3.56Å; I251-W419 HydrophobicContact CD1-CZ2 3.18Å; I251-W419 HydrophobicContact CD1-CZ3 3.96Å; I251-W419 HydrophobicContact CG1-CD2 4.26Å; I251-W419 HydrophobicContact CG1-CZ2 4.34Å | ||
| 252 | D | 64.8 | Low | 77.9 | Confident | 143 Ų | 143 | 54.5 Ų | 54.5 | 77% | 0.765 | 28% | 0.283 | S | S | * | . | S | Bend | trans | -71.8 | -57.1 | -175.7 | -60.3 | -46.9 | 0 | 0 | 0 | 112.2 | R34 | R34-D252 PolarHBondContact NH2-O 2.93Š|
| 253 | D | 68 | Low | 77.7 | Confident | 98 Ų | 98 | 58.9 Ų | 58.9 | 52% | 0.524 | 30% | 0.303 | S | S | . | . | trans | -124.8 | 73.8 | -170.9 | -80.2 | -33.3 | 0 | 0 | 0 | 114.3 | S255 T257 | D253-S255 PolarHBondContact O-N 2.96Å; D253-T257 PolarHBondContact O-OG1 3.48Å | ||
| 254 | L | 64.4 | Low | 77.9 | Confident | 68 Ų | 68 | 58.3 Ų | 58.3 | 36% | 0.356 | 30% | 0.3 | S | S | . | . | H | α-helix | trans | -66.3 | -36.3 | -178.7 | -170.1 | 66.3 | 0 | 0 | 0 | 113 | I251 A258 W419 | I251-L254 HydrophobicContact CG2-CB 4.11Å; I251-L254 HydrophobicContact CG2-CD1 4.16Å; L254-A258 WeakPolarHBondContact O-CB 3.43Å; L254-A258 PolarHBondContact O-N 2.97Å; L254-W419 HydrophobicContact CD1-CZ2 4.15Å |
| 255 | S | 67.9 | Low | 78.1 | Confident | 89 Ų | 89 | 58.6 Ų | 58.6 | 62% | 0.622 | 30% | 0.302 | S | S | * | . | H | α-helix | trans | -68.5 | -48.9 | -171.3 | 59.5 | 0 | 0 | 0 | 0 | 113.1 | D253 Q259 | D253-S255 PolarHBondContact O-N 2.96Å; S255-Q259 WeakPolarHBondContact O-CB 3.35Å; S255-Q259 PolarHBondContact O-N 3.44Å |
| 256 | R | 67.5 | Low | 78.2 | Confident | 181 Ų | 181 | 62.8 Ų | 62.8 | 68% | 0.683 | 32% | 0.323 | S | S | * | . | H | α-helix | trans | -67.5 | -40.3 | -179.8 | -70.2 | -174.8 | 176.4 | 176.9 | 0.4 | 112.2 | Q259 S260 | R256-Q259 PolarHBondContact O-N 3.26Å; R256-S260 PolarHBondContact O-N 2.97Å; R256-S260 PolarHBondContact O-OG 3.06Å |
| 257 | T | 67.2 | Low | 78.7 | Confident | 13 Ų | 13 | 62.7 Ų | 62.7 | 8% | 0.08 | 32% | 0.323 | C | S | . | . | H | α-helix | trans | -65.4 | -49.1 | 177.1 | -51.2 | 0 | 0 | 0 | 0 | 110.5 | D253 Q259 S260 L261 T416 V417 | D253-T257 PolarHBondContact O-OG1 3.48Å; T257-Q259 VanDerWaalsContact C-N 3.29Å; T257-Q259 PolarHBondContact O-N 3.44Å; T257-S260 PolarHBondContact O-N 3.31Å; T257-L261 HydrophobicContact CG2-CD1 3.98Å; T257-L261 WeakPolarHBondContact O-CB 3.36Å; T257-L261 PolarHBondContact O-N 3.43Å; T257-T416 HydrophobicContact CG2-CG2 3.52Å; T257-V417 HydrophobicContact CG2-CG1 3.38Å |
| 258 | A | 71.8 | Confident | 79.4 | Confident | 40 Ų | 40 | 61 Ų | 61 | 33% | 0.331 | 31% | 0.313 | S | S | . | . | H | α-helix | trans | -64.2 | -32.4 | 178.4 | 0 | 0 | 0 | 0 | 0 | 112.5 | L254 G262 | L254-A258 WeakPolarHBondContact O-CB 3.43Å; L254-A258 PolarHBondContact O-N 2.97Å; A258-G262 WeakPolarHBondContact O-CA 3.13Å; A258-G262 PolarHBondContact O-N 3.17Å |
| 259 | Q | 72.2 | Confident | 80.1 | Confident | 172 Ų | 172 | 61.2 Ų | 61.2 | 80% | 0.804 | 32% | 0.319 | S | S | * | . | H | α-helix | trans | -69.9 | -34.5 | 176.3 | -167 | 174.3 | 20.9 | 0 | 0 | 112.3 | S255 R256 T257 | S255-Q259 WeakPolarHBondContact O-CB 3.35Å; S255-Q259 PolarHBondContact O-N 3.44Å; R256-Q259 PolarHBondContact O-N 3.26Å; T257-Q259 VanDerWaalsContact C-N 3.29Å; T257-Q259 PolarHBondContact O-N 3.44Å |
| 260 | S | 73.1 | Confident | 80.7 | Confident | 28 Ų | 28 | 63 Ų | 63 | 20% | 0.196 | 33% | 0.331 | C | S | . | . | H | α-helix | trans | -87.2 | -34.2 | -177.1 | -51.5 | 0 | 0 | 0 | 0 | 112.9 | I117 R256 T257 | I117-S260 WeakPolarHBondContact CD1-O 3.45Å; R256-S260 PolarHBondContact O-N 2.97Å; R256-S260 PolarHBondContact O-OG 3.06Å; T257-S260 PolarHBondContact O-N 3.31Å |
| 261 | L | 84.8 | Confident | 81.8 | Confident | 1 Ų | 1 | 56.1 Ų | 56.1 | 1% | 0.005 | 31% | 0.305 | C | S | . | . | H | α-helix | trans | -111.6 | 7.6 | -176.9 | -62.4 | 174.5 | 0 | 0 | 0 | 112.9 | T257 M263 Y264 M265 F358 L413 V417 | T257-L261 HydrophobicContact CG2-CD1 3.98Å; T257-L261 WeakPolarHBondContact O-CB 3.36Å; T257-L261 PolarHBondContact O-N 3.43Å; L261-M263 VanDerWaalsContact C-N 3.33Å; L261-M263 PolarHBondContact O-N 2.73Å; L261-Y264 WeakPolarHBondContact O-CB 3.46Å; L261-Y264 PolarHBondContact O-N 3.47Å; L261-Y264 VanDerWaalsContact O-N 3.11Å; L261-M265 WeakPolarHBondContact O-CG 3.46Å; L261-M265 PolarHBondContact O-N 2.93Å; L261-F358 HydrophobicContact CD2-CE1 4.09Å; L261-F358 HydrophobicContact CD2-CZ 3.61Å; L261-L413 HydrophobicContact CD1-CB 4.16Å; L261-L413 WeakPolarHBondContact CD1-O 3.46Å; L261-L413 HydrophobicContact CD2-CB 4.36Å; L261-V417 HydrophobicContact CB-CG1 4.11Å; L261-V417 HydrophobicContact CD1-CG1 3.8Å; L261-V417 HydrophobicContact CD1-CG2 4.34Å |
| 262 | G | 87.5 | Confident | 83.1 | Confident | 25 Ų | 25 | 55.1 Ų | 55.1 | 26% | 0.258 | 30% | 0.299 | S | S | . | . | H | α-helix | trans | -60.2 | -39.9 | -173.4 | 0 | 0 | 0 | 0 | 0 | 113.4 | A258 M265 L266 | A258-G262 WeakPolarHBondContact O-CA 3.13Å; A258-G262 PolarHBondContact O-N 3.17Å; G262-M265 PolarHBondContact O-N 3.39Å; G262-L266 WeakPolarHBondContact O-CB 3.42Å; G262-L266 PolarHBondContact O-N 2.94Å |
| 263 | M | 91.2 | Very high | 84.7 | Confident | 99 Ų | 99 | 50.6 Ų | 50.6 | 49% | 0.488 | 28% | 0.282 | S | S | . | . | H | α-helix | trans | -67 | -36.9 | 176.8 | -68.9 | -55.2 | -64 | 0 | 0 | 112.3 | I110 P112 L261 L266 T267 | I110-M263 HydrophobicContact CG2-CE 3.62Å; P112-M263 HydrophobicContact CB-CB 3.88Å; L261-M263 VanDerWaalsContact C-N 3.33Å; L261-M263 PolarHBondContact O-N 2.73Å; M263-L266 HydrophobicContact CE-CD2 4.41Å; M263-L266 HydrophobicContact SD-CD2 4.27Å; M263-T267 WeakPolarHBondContact O-CB 3.35Å; M263-T267 PolarHBondContact O-N 3.2Å; M263-T267 PolarHBondContact O-OG1 3.24Å |
| 264 | Y | 93.1 | Very high | 86.1 | Confident | 1 Ų | 1 | 48.9 Ų | 48.9 | 0% | 0.004 | 27% | 0.272 | C | S | . | . | H | α-helix | trans | -64.1 | -50.8 | 172.9 | 165.6 | -106.9 | 0 | 0 | 0 | 111.1 | L261 L266 T267 V268 Y351 V354 A355 F358 I414 V417 L421 | L261-Y264 WeakPolarHBondContact O-CB 3.46Å; L261-Y264 PolarHBondContact O-N 3.47Å; L261-Y264 VanDerWaalsContact O-N 3.11Å; Y264-L266 VanDerWaalsContact C-N 3.27Å; Y264-L266 PolarHBondContact O-N 3.34Å; Y264-T267 WeakPolarHBondContact O-CB 3.49Å; Y264-T267 PolarHBondContact O-N 2.75Å; Y264-T267 VanDerWaalsContact O-N 3.12Å; Y264-V268 HydrophobicContact CD2-CG2 4.23Å; Y264-V268 HydrophobicContact CE2-CG2 3.72Å; Y264-V268 PolarHBondContact O-N 2.88Å; Y264-Y351 WeakPolarHBondContact OH-CD2 3.15Å; Y264-Y351 WeakPolarHBondContact OH-CE2 3.38Å; Y264-V354 HydrophobicContact CD2-CG1 4.17Å; Y264-V354 HydrophobicContact CE2-CG1 3.97Å; Y264-A355 HydrophobicContact CE2-CB 4.33Å; Y264-F358 HydrophobicContact CD2-CB 3.86Å; Y264-F358 AromaticContact CD2-CD1 3.69Å; Y264-F358 HydrophobicContact CD2-CD1 3.69Å; Y264-F358 HydrophobicContact CD2-CD2 4.03Å; Y264-F358 HydrophobicContact CD2-CE1 4.22Å; Y264-F358 AromaticContact CD2-CG 3.57Å; Y264-F358 HydrophobicContact CD2-CG 3.57Å; Y264-F358 HydrophobicContact CE2-CB 4.19Å; Y264-F358 HydrophobicContact CE2-CD1 4.05Å; Y264-F358 HydrophobicContact CE2-CG 4.18Å; Y264-F358 HydrophobicContact CG-CD1 4.04Å; Y264-F358 HydrophobicContact CG-CD2 4.29Å; Y264-F358 HydrophobicContact CG-CE1 4.09Å; Y264-F358 HydrophobicContact CG-CE2 4.34Å; Y264-F358 HydrophobicContact CG-CG 4.14Å; Y264-F358 HydrophobicContact CG-CZ 4.24Å; Y264-I414 HydrophobicContact CE1-CG1 4.27Å; Y264-I414 HydrophobicContact CE1-CG2 4.08Å; Y264-I414 WeakPolarHBondContact OH-CG2 3.3Å; Y264-V417 HydrophobicContact CD1-CG2 4.09Å; Y264-V417 HydrophobicContact CE1-CG2 3.88Å; Y264-L421 HydrophobicContact CD1-CD1 4.45Å; Y264-L421 HydrophobicContact CE1-CD1 3.75Å |
| 265 | M | 92.7 | Very high | 87.7 | Confident | 25 Ų | 25 | 45.7 Ų | 45.7 | 12% | 0.123 | 26% | 0.255 | C | S | . | . | H | α-helix | trans | -57.3 | -43 | 176.9 | -67.6 | 174.7 | 67.3 | 0 | 0 | 111.7 | L261 G262 A269 V417 L420 | L261-M265 WeakPolarHBondContact O-CG 3.46Å; L261-M265 PolarHBondContact O-N 2.93Å; G262-M265 PolarHBondContact O-N 3.39Å; M265-A269 WeakPolarHBondContact O-CB 3.39Å; M265-A269 PolarHBondContact O-N 2.89Å; M265-V417 HydrophobicContact CE-CB 4.36Å; M265-V417 HydrophobicContact CG-CB 3.84Å; M265-V417 HydrophobicContact CG-CG1 4.02Å; M265-V417 HydrophobicContact CG-CG2 4.01Å; M265-V417 HydrophobicContact SD-CB 3.77Å; M265-V417 HydrophobicContact SD-CG1 3.5Å; M265-V417 WeakPolarHBondContact SD-CG1 3.45Å; M265-L420 HydrophobicContact CE-CD2 3.74Å |
| 266 | L | 94 | Very high | 89.2 | Confident | 88 Ų | 88 | 43.6 Ų | 43.6 | 46% | 0.461 | 24% | 0.235 | S | C | . | . | H | α-helix | trans | -63.1 | -44 | 177 | -177.7 | 66.1 | 0 | 0 | 0 | 111.3 | G262 M263 Y264 V268 A269 V270 | G262-L266 WeakPolarHBondContact O-CB 3.42Å; G262-L266 PolarHBondContact O-N 2.94Å; M263-L266 HydrophobicContact CE-CD2 4.41Å; M263-L266 HydrophobicContact SD-CD2 4.27Å; Y264-L266 VanDerWaalsContact C-N 3.27Å; Y264-L266 PolarHBondContact O-N 3.34Å; L266-V268 PolarHBondContact O-N 3.38Å; L266-A269 PolarHBondContact O-N 3.43Å; L266-V270 HydrophobicContact CD1-CG2 3.87Å; L266-V270 HydrophobicContact CG-CG2 4.18Å; L266-V270 VanDerWaalsContact O-CB 3.28Å; L266-V270 WeakPolarHBondContact O-CB 3.11Å; L266-V270 WeakPolarHBondContact O-CG2 3.2Å; L266-V270 PolarHBondContact O-N 3.27Å |
| 267 | T | 96.8 | Very high | 90.5 | Very high | 0 Ų | 0 | 38.5 Ų | 38.5 | 0% | 0 | 23% | 0.227 | C | C | . | . | H | α-helix | trans | -59.2 | -49.3 | 178.4 | -59 | 0 | 0 | 0 | 0 | 111 | L106 V107 I110 P112 M263 Y264 G271 V354 | L106-T267 HydrophobicContact CB-CG2 4.22Å; V107-T267 HydrophobicContact CB-CG2 4.1Å; I110-T267 HydrophobicContact CD1-CG2 4.19Å; P112-T267 HydrophobicContact CG-CG2 4.4Å; M263-T267 WeakPolarHBondContact O-CB 3.35Å; M263-T267 PolarHBondContact O-N 3.2Å; M263-T267 PolarHBondContact O-OG1 3.24Å; Y264-T267 WeakPolarHBondContact O-CB 3.49Å; Y264-T267 PolarHBondContact O-N 2.75Å; Y264-T267 VanDerWaalsContact O-N 3.12Å; T267-G271 PolarHBondContact O-N 3.42Å; T267-V354 HydrophobicContact CG2-CG1 3.76Å; T267-V354 HydrophobicContact CG2-CG2 4.49Å |
| 268 | V | 97 | Very high | 92 | Very high | 0 Ų | 0 | 41.9 Ų | 41.9 | 0% | 0 | 25% | 0.248 | C | C | . | . | H | α-helix | trans | -63.5 | -48.8 | 177 | 177.6 | 0 | 0 | 0 | 0 | 110.5 | Y264 L266 V270 G271 L272 Y351 V354 L421 | Y264-V268 HydrophobicContact CD2-CG2 4.23Å; Y264-V268 HydrophobicContact CE2-CG2 3.72Å; Y264-V268 PolarHBondContact O-N 2.88Å; L266-V268 PolarHBondContact O-N 3.38Å; V268-V270 PolarHBondContact O-N 3.36Å; V268-G271 PolarHBondContact O-N 3.26Å; V268-L272 HydrophobicContact CG1-CD1 3.79Å; V268-L272 HydrophobicContact CG1-CG 4.22Å; V268-L272 WeakPolarHBondContact O-CB 3.28Å; V268-L272 VanDerWaalsContact O-CG 3.27Å; V268-L272 WeakPolarHBondContact O-CG 3.34Å; V268-L272 PolarHBondContact O-N 3.45Å; V268-Y351 HydrophobicContact CG1-CD2 3.99Å; V268-Y351 HydrophobicContact CG2-CD2 4.18Å; V268-V354 HydrophobicContact CG2-CB 4.08Å; V268-V354 HydrophobicContact CG2-CG1 3.57Å; V268-L421 HydrophobicContact CB-CD1 4.16Å; V268-L421 HydrophobicContact CB-CD2 4.02Å; V268-L421 HydrophobicContact CG1-CB 4.44Å; V268-L421 HydrophobicContact CG1-CD1 4.17Å; V268-L421 HydrophobicContact CG1-CD2 3.92Å; V268-L421 HydrophobicContact CG1-CG 4.4Å; V268-L421 HydrophobicContact CG2-CD1 4.22Å |
| 269 | A | 96.8 | Very high | 93.2 | Very high | 31 Ų | 31 | 40.8 Ų | 40.8 | 26% | 0.256 | 24% | 0.237 | S | C | . | . | H | α-helix | trans | -61.9 | -41.8 | -177.7 | 0 | 0 | 0 | 0 | 0 | 112.4 | M265 L266 A273 L424 | M265-A269 WeakPolarHBondContact O-CB 3.39Å; M265-A269 PolarHBondContact O-N 2.89Å; L266-A269 PolarHBondContact O-N 3.43Å; A269-A273 VanDerWaalsContact O-CB 3.25Å; A269-A273 WeakPolarHBondContact O-CB 3.48Å; A269-A273 PolarHBondContact O-N 3.21Å; A269-L424 HydrophobicContact CB-CD1 4.03Å |
| 270 | V | 98 | Very high | 94.4 | Very high | 51 Ų | 51 | 32.6 Ų | 32.6 | 31% | 0.309 | 20% | 0.199 | S | C | . | . | H | α-helix | trans | -66.1 | -43.2 | 175.2 | 170.5 | 0 | 0 | 0 | 0 | 110.6 | L106 L266 V268 L272 A273 I274 | L106-V270 HydrophobicContact CD1-CG1 4.3Å; L106-V270 HydrophobicContact CD2-CG1 4.46Å; L266-V270 HydrophobicContact CD1-CG2 3.87Å; L266-V270 HydrophobicContact CG-CG2 4.18Å; L266-V270 VanDerWaalsContact O-CB 3.28Å; L266-V270 WeakPolarHBondContact O-CB 3.11Å; L266-V270 WeakPolarHBondContact O-CG2 3.2Å; L266-V270 PolarHBondContact O-N 3.27Å; V268-V270 PolarHBondContact O-N 3.36Å; V270-L272 PolarHBondContact O-N 3.34Å; V270-A273 PolarHBondContact O-N 3.35Å; V270-I274 HydrophobicContact CG1-CD1 3.88Å; V270-I274 HydrophobicContact CG1-CG1 4.36Å; V270-I274 WeakPolarHBondContact O-CG1 3.27Å; V270-I274 PolarHBondContact O-N 3.49Å |
| 271 | G | 98.4 | Very high | 95.6 | Very high | 0 Ų | 0 | 32 Ų | 32 | 0% | 0 | 19% | 0.194 | C | C | . | . | H | α-helix | trans | -59.7 | -46.9 | 175.9 | 0 | 0 | 0 | 0 | 0 | 112.8 | T267 V268 A273 I274 H275 | T267-G271 PolarHBondContact O-N 3.42Å; V268-G271 PolarHBondContact O-N 3.26Å; G271-A273 VanDerWaalsContact C-N 3.34Å; G271-A273 PolarHBondContact O-N 2.99Å; G271-I274 PolarHBondContact O-N 3.1Å; G271-H275 PolarHBondContact O-N 2.88Å |
| 272 | L | 98.1 | Very high | 96.2 | Very high | 4 Ų | 4 | 36.3 Ų | 36.3 | 2% | 0.021 | 22% | 0.217 | C | C | . | . | H | α-helix | trans | -62 | -41.3 | 174.4 | -67.3 | 174.3 | 0 | 0 | 0 | 111.8 | V268 V270 H275 F276 G347 L350 L424 R425 V428 | V268-L272 HydrophobicContact CG1-CD1 3.79Å; V268-L272 HydrophobicContact CG1-CG 4.22Å; V268-L272 WeakPolarHBondContact O-CB 3.28Å; V268-L272 VanDerWaalsContact O-CG 3.27Å; V268-L272 WeakPolarHBondContact O-CG 3.34Å; V268-L272 PolarHBondContact O-N 3.45Å; V270-L272 PolarHBondContact O-N 3.34Å; L272-H275 PolarHBondContact O-N 2.88Å; L272-F276 WeakPolarHBondContact O-CB 3.45Å; L272-F276 PolarHBondContact O-N 2.96Å; L272-G347 VanDerWaalsContact CD2-CA 3.42Å; L272-L350 HydrophobicContact CD2-CD1 4.43Å; L272-L350 HydrophobicContact CD2-CD2 4.26Å; L272-L350 HydrophobicContact CG-CD2 4.31Å; L272-L424 HydrophobicContact CD1-CB 3.61Å; L272-R425 HydrophobicContact CD1-CG 3.72Å; L272-R425 HydrophobicContact CD2-CG 4.16Å; L272-V428 HydrophobicContact CB-CG2 4.01Å; L272-V428 HydrophobicContact CD2-CB 4.39Å; L272-V428 HydrophobicContact CD2-CG2 4.1Å |
| 273 | A | 97.9 | Very high | 96.6 | Very high | 49 Ų | 49 | 36.3 Ų | 36.3 | 41% | 0.405 | 21% | 0.211 | S | C | . | . | H | α-helix | trans | -65.3 | -39.4 | 177.9 | 0 | 0 | 0 | 0 | 0 | 112.4 | A269 V270 G271 S277 | A269-A273 VanDerWaalsContact O-CB 3.25Å; A269-A273 WeakPolarHBondContact O-CB 3.48Å; A269-A273 PolarHBondContact O-N 3.21Å; V270-A273 PolarHBondContact O-N 3.35Å; G271-A273 VanDerWaalsContact C-N 3.34Å; G271-A273 PolarHBondContact O-N 2.99Å; A273-S277 WeakPolarHBondContact O-CB 3.32Å; A273-S277 PolarHBondContact O-N 3.34Å; A273-S277 PolarHBondContact O-OG 3.47Å |
| 274 | I | 98.3 | Very high | 96.9 | Very high | 62 Ų | 62 | 32.1 Ų | 32.1 | 32% | 0.318 | 19% | 0.19 | S | C | . | . | H | α-helix | trans | -65.3 | -47.3 | 174.1 | -71.1 | 174.7 | 0 | 0 | 0 | 110 | V102 L106 V270 G271 F276 S277 V278 T279 | V102-I274 HydrophobicContact CG1-CB 4.22Å; V102-I274 HydrophobicContact CG1-CG2 3.92Å; L106-I274 HydrophobicContact CD1-CD1 4.17Å; L106-I274 HydrophobicContact CD2-CD1 4.31Å; V270-I274 HydrophobicContact CG1-CD1 3.88Å; V270-I274 HydrophobicContact CG1-CG1 4.36Å; V270-I274 WeakPolarHBondContact O-CG1 3.27Å; V270-I274 PolarHBondContact O-N 3.49Å; G271-I274 PolarHBondContact O-N 3.1Å; I274-F276 VanDerWaalsContact C-N 3.34Å; I274-F276 PolarHBondContact O-N 2.82Å; I274-S277 PolarHBondContact O-N 3.42Å; I274-V278 HydrophobicContact CG2-CB 4.44Å; I274-V278 WeakPolarHBondContact O-CA 3.26Å; I274-V278 VanDerWaalsContact O-CB 3.26Å; I274-V278 WeakPolarHBondContact O-CB 3.4Å; I274-V278 PolarHBondContact O-N 3.38Å; I274-T279 PolarHBondContact O-N 2.54Å |
| 275 | H | 98.1 | Very high | 97.1 | Very high | 0 Ų | 0 | 37.5 Ų | 37.5 | 0% | 0 | 21% | 0.214 | C | C | . | . | I | π-helix | trans | -61.7 | -43.4 | 179 | -165.3 | 64.9 | 0 | 0 | 0 | 112.1 | T95 G271 L272 T279 L280 D346 L350 | T95-H275 PolarHBondContact O-CE1 3.22Å; G271-H275 PolarHBondContact O-N 2.88Å; L272-H275 PolarHBondContact O-N 2.88Å; H275-T279 WeakPolarHBondContact ND1-CB 3.4Å; H275-T279 WeakPolarHBondContact ND1-CG2 3.44Å; H275-T279 PolarHBondContact O-N 2.91Å; H275-L280 PolarHBondContact O-N 3.38Å; H275-D346 IonicContact CD2-OD2 3.77Å; H275-D346 IonicContact CE1-OD2 2.81Å; H275-D346 IonicContact NE2-OD2 3.27Å; H275-D346 PolarHBondContact NE2-OD2 3.21Å; H275-L350 HydrophobicContact CB-CD1 4.35Å |
| 276 | F | 97.8 | Very high | 97.4 | Very high | 46 Ų | 46 | 41.2 Ų | 41.2 | 20% | 0.202 | 23% | 0.233 | C | C | . | . | I | π-helix | trans | -64.7 | -45.1 | 176.7 | 176.8 | -90.9 | 0 | 0 | 0 | 113.8 | L272 I274 P281 L296 M303 V428 I431 | L272-F276 WeakPolarHBondContact O-CB 3.45Å; L272-F276 PolarHBondContact O-N 2.96Å; I274-F276 VanDerWaalsContact C-N 3.34Å; I274-F276 PolarHBondContact O-N 2.82Å; F276-P281 WeakPolarHBondContact O-CD 3.18Å; F276-P281 VanDerWaalsContact O-CG 3.24Å; F276-P281 WeakPolarHBondContact O-CG 3.43Å; F276-L296 HydrophobicContact CE1-CD2 4.16Å; F276-L296 HydrophobicContact CE2-CD1 4.35Å; F276-L296 HydrophobicContact CZ-CD1 4.03Å; F276-L296 HydrophobicContact CZ-CD2 3.97Å; F276-M303 HydrophobicContact CE2-SD 3.64Å; F276-M303 HydrophobicContact CZ-SD 3.53Å; F276-M303 VanDerWaalsContact CZ-SD 3.53Å; F276-V428 HydrophobicContact CB-CG2 4.04Å; F276-V428 HydrophobicContact CD2-CG2 4.42Å; F276-I431 HydrophobicContact CD2-CB 4.41Å; F276-I431 HydrophobicContact CD2-CG2 4.3Å; F276-I431 HydrophobicContact CE2-CB 4.23Å; F276-I431 HydrophobicContact CE2-CG1 3.9Å; F276-I431 HydrophobicContact CE2-CG2 4.16Å |
| 277 | S | 96.5 | Very high | 97.5 | Very high | 73 Ų | 73 | 39.1 Ų | 39.1 | 51% | 0.51 | 22% | 0.224 | S | C | . | . | I | π-helix | trans | -93.6 | -24 | -169.3 | -49.3 | 0 | 0 | 0 | 0 | 113.3 | A273 I274 | A273-S277 WeakPolarHBondContact O-CB 3.32Å; A273-S277 PolarHBondContact O-N 3.34Å; A273-S277 PolarHBondContact O-OG 3.47Å; I274-S277 PolarHBondContact O-N 3.42Å |
| 278 | V | 97.5 | Very high | 97.5 | Very high | 84 Ų | 84 | 39.6 Ų | 39.6 | 51% | 0.509 | 23% | 0.227 | S | C | . | . | I | π-helix | trans | -119.4 | -63.6 | -173.5 | -173.7 | 0 | 0 | 0 | 0 | 110.3 | I274 P281 L282 | I274-V278 HydrophobicContact CG2-CB 4.44Å; I274-V278 WeakPolarHBondContact O-CA 3.26Å; I274-V278 VanDerWaalsContact O-CB 3.26Å; I274-V278 WeakPolarHBondContact O-CB 3.4Å; I274-V278 PolarHBondContact O-N 3.38Å; V278-P281 WeakPolarHBondContact O-CD 3.47Å; V278-L282 WeakPolarHBondContact O-CB 3.33Å; V278-L282 PolarHBondContact O-N 2.84Å |
| 279 | T | 97.5 | Very high | 97.3 | Very high | 18 Ų | 18 | 49.5 Ų | 49.5 | 11% | 0.11 | 26% | 0.264 | C | S | . | . | I | π-helix | trans | -62.3 | -55.4 | -169.6 | -49.1 | 0 | 0 | 0 | 0 | 112.7 | L98 I274 H275 L282 V283 | L98-T279 HydrophobicContact CB-CG2 3.79Å; L98-T279 HydrophobicContact CD1-CG2 3.99Å; L98-T279 HydrophobicContact CG-CG2 4.47Å; I274-T279 PolarHBondContact O-N 2.54Å; H275-T279 WeakPolarHBondContact ND1-CB 3.4Å; H275-T279 WeakPolarHBondContact ND1-CG2 3.44Å; H275-T279 PolarHBondContact O-N 2.91Å; T279-L282 PolarHBondContact O-N 3.38Å; T279-V283 WeakPolarHBondContact O-CG2 3.41Å; T279-V283 PolarHBondContact O-N 2.74Å |
| 280 | L | 97.5 | Very high | 97.2 | Very high | 0 Ų | 0 | 54.2 Ų | 54.2 | 0% | 0 | 28% | 0.279 | C | S | . | . | H | α-helix | trans | -64.3 | -48 | -178.8 | -68.5 | 172 | 0 | 0 | 0 | 112.6 | T95 H275 L282 V283 Y284 V428 Y435 | T95-L280 HydrophobicContact CG2-CD2 3.96Å; H275-L280 PolarHBondContact O-N 3.38Å; L280-L282 VanDerWaalsContact C-N 3.28Å; L280-L282 PolarHBondContact O-N 3.48Å; L280-V283 PolarHBondContact O-N 3.39Å; L280-Y284 PolarHBondContact O-N 3.49Å; L280-V428 HydrophobicContact CD1-CG1 4.21Å; L280-Y435 HydrophobicContact CB-CD2 3.84Å; L280-Y435 HydrophobicContact CB-CE2 4.13Å |
| 281 | P | 97.6 | Very high | 97 | Very high | 14 Ų | 14 | 56.3 Ų | 56.3 | 9% | 0.091 | 29% | 0.288 | C | S | . | . | H | α-helix | trans | -59.5 | -35.6 | 174.5 | -29.4 | 39.7 | 0 | 0 | 0 | 113.8 | F276 V278 Y284 F285 P292 Y435 | F276-P281 WeakPolarHBondContact O-CD 3.18Å; F276-P281 VanDerWaalsContact O-CG 3.24Å; F276-P281 WeakPolarHBondContact O-CG 3.43Å; V278-P281 WeakPolarHBondContact O-CD 3.47Å; P281-Y284 PolarHBondContact O-N 2.85Å; P281-F285 VanDerWaalsContact O-CB 3.26Å; P281-F285 WeakPolarHBondContact O-CB 3.44Å; P281-F285 PolarHBondContact O-N 3.47Å; P281-P292 HydrophobicContact CB-CB 3.75Å; P281-P292 HydrophobicContact CB-CG 3.81Å; P281-Y435 HydrophobicContact CG-CE2 4.26Å |
| 282 | L | 97 | Very high | 96.9 | Very high | 92 Ų | 92 | 57.1 Ų | 57.1 | 48% | 0.482 | 29% | 0.294 | S | S | . | . | H | α-helix | trans | -67 | -46.9 | 178 | -178.7 | 64.3 | 0 | 0 | 0 | 111.1 | V278 T279 L280 Y284 F285 I286 | V278-L282 WeakPolarHBondContact O-CB 3.33Å; V278-L282 PolarHBondContact O-N 2.84Å; T279-L282 PolarHBondContact O-N 3.38Å; L280-L282 VanDerWaalsContact C-N 3.28Å; L280-L282 PolarHBondContact O-N 3.48Å; L282-Y284 VanDerWaalsContact C-N 3.33Å; L282-Y284 PolarHBondContact O-N 3.44Å; L282-F285 PolarHBondContact O-N 3.05Å; L282-I286 HydrophobicContact CD1-CD1 3.96Å; L282-I286 HydrophobicContact CD1-CG1 4.22Å; L282-I286 HydrophobicContact CG-CD1 3.8Å; L282-I286 HydrophobicContact CG-CG1 4.45Å; L282-I286 WeakPolarHBondContact O-CB 3.5Å; L282-I286 VanDerWaalsContact O-CG1 3.25Å; L282-I286 WeakPolarHBondContact O-CG1 3.4Å; L282-I286 PolarHBondContact O-N 3.39Å |
| 283 | V | 97.2 | Very high | 96.7 | Very high | 25 Ų | 25 | 62 Ų | 62 | 15% | 0.152 | 32% | 0.319 | C | S | . | . | H | α-helix | trans | -57.9 | -47.1 | 174.7 | 173.9 | 0 | 0 | 0 | 0 | 110.5 | Y91 L98 T279 L280 F285 I286 V287 | Y91-V283 HydrophobicContact CD2-CG1 4.25Å; Y91-V283 HydrophobicContact CE2-CG1 3.86Å; L98-V283 HydrophobicContact CD1-CG2 4.08Å; T279-V283 WeakPolarHBondContact O-CG2 3.41Å; T279-V283 PolarHBondContact O-N 2.74Å; L280-V283 PolarHBondContact O-N 3.39Å; V283-F285 PolarHBondContact O-N 3.15Å; V283-I286 PolarHBondContact O-N 3.4Å; V283-V287 PolarHBondContact O-N 3.48Å |
| 284 | Y | 97.7 | Very high | 96.4 | Very high | 11 Ų | 11 | 66.3 Ų | 66.3 | 4% | 0.043 | 33% | 0.329 | C | S | . | . | H | α-helix | trans | -58.7 | -46.8 | 175.7 | 175.4 | -92.8 | 0 | 0 | 0 | 112.2 | L280 P281 L282 V287 V288 K290 P292 F295 Y435 A438 V439 | L280-Y284 PolarHBondContact O-N 3.49Å; P281-Y284 PolarHBondContact O-N 2.85Å; L282-Y284 VanDerWaalsContact C-N 3.33Å; L282-Y284 PolarHBondContact O-N 3.44Å; Y284-V287 PolarHBondContact O-N 2.92Å; Y284-V288 HydrophobicContact CD2-CB 4.14Å; Y284-V288 HydrophobicContact CD2-CG2 3.71Å; Y284-V288 HydrophobicContact CE1-CB 4.31Å; Y284-V288 HydrophobicContact CE1-CG1 4.45Å; Y284-V288 HydrophobicContact CE2-CB 3.91Å; Y284-V288 HydrophobicContact CE2-CG1 3.95Å; Y284-V288 HydrophobicContact CE2-CG2 3.69Å; Y284-V288 HydrophobicContact CG-CB 4.49Å; Y284-V288 HydrophobicContact CG-CG2 4.36Å; Y284-V288 WeakPolarHBondContact O-CA 3.46Å; Y284-V288 VanDerWaalsContact O-CB 3.27Å; Y284-V288 WeakPolarHBondContact O-CB 3.4Å; Y284-V288 PolarHBondContact O-N 3.21Å; Y284-K290 HydrophobicContact CE1-CB 4.02Å; Y284-K290 WeakPolarHBondContact CE1-O 3.35Å; Y284-P292 HydrophobicContact CD1-CB 3.78Å; Y284-P292 HydrophobicContact CE1-CB 4.3Å; Y284-F295 HydrophobicContact CE2-CG 4.48Å; Y284-Y435 HydrophobicContact CD1-CD1 4.33Å; Y284-Y435 HydrophobicContact CD1-CE1 4.08Å; Y284-Y435 AromaticContact CD2-CD1 3.39Å; Y284-Y435 HydrophobicContact CD2-CD1 3.39Å; Y284-Y435 AromaticContact CD2-CE1 3.94Å; Y284-Y435 HydrophobicContact CD2-CE1 3.94Å; Y284-Y435 HydrophobicContact CD2-CG 4.43Å; Y284-Y435 HydrophobicContact CE2-CD1 4.1Å; Y284-Y435 HydrophobicContact CE2-CE1 4.48Å; Y284-Y435 AromaticContact CG-CD1 3.5Å; Y284-Y435 HydrophobicContact CG-CD1 3.5Å; Y284-Y435 VanDerWaalsContact CG-CD1 3.5Å; Y284-Y435 AromaticContact CG-CE1 3.68Å; Y284-Y435 HydrophobicContact CG-CE1 3.68Å; Y284-A438 HydrophobicContact CD2-CB 4.29Å; Y284-A438 HydrophobicContact CE2-CB 3.71Å; Y284-V439 HydrophobicContact CD2-CG2 4.21Å |
| 285 | F | 97.7 | Very high | 96.3 | Very high | 114 Ų | 114 | 63.9 Ų | 63.9 | 50% | 0.5 | 32% | 0.316 | S | S | . | . | H | α-helix | trans | -65.3 | -42.3 | -178.4 | 178.9 | -101.8 | 0 | 0 | 0 | 112 | P281 L282 V283 V287 R289 | P281-F285 VanDerWaalsContact O-CB 3.26Å; P281-F285 WeakPolarHBondContact O-CB 3.44Å; P281-F285 PolarHBondContact O-N 3.47Å; L282-F285 PolarHBondContact O-N 3.05Å; V283-F285 PolarHBondContact O-N 3.15Å; F285-V287 VanDerWaalsContact C-N 3.35Å; F285-V287 PolarHBondContact O-N 3.08Å; F285-R289 WeakPolarHBondContact O-CA 3.27Å; F285-R289 PolarHBondContact O-N 2.75Å |
| 286 | I | 97.4 | Very high | 96.1 | Very high | 104 Ų | 104 | 65.1 Ų | 65.1 | 53% | 0.533 | 32% | 0.323 | S | S | . | . | H | α-helix | trans | -60.4 | -45.1 | 179.1 | -71.7 | 167.9 | 0 | 0 | 0 | 110.9 | L282 V283 | L282-I286 HydrophobicContact CD1-CD1 3.96Å; L282-I286 HydrophobicContact CD1-CG1 4.22Å; L282-I286 HydrophobicContact CG-CD1 3.8Å; L282-I286 HydrophobicContact CG-CG1 4.45Å; L282-I286 WeakPolarHBondContact O-CB 3.5Å; L282-I286 VanDerWaalsContact O-CG1 3.25Å; L282-I286 WeakPolarHBondContact O-CG1 3.4Å; L282-I286 PolarHBondContact O-N 3.39Å; V283-I286 PolarHBondContact O-N 3.4Å |
| 287 | V | 97.1 | Very high | 95.8 | Very high | 44 Ų | 44 | 71.8 Ų | 71.8 | 27% | 0.267 | 35% | 0.346 | S | S | . | . | H | α-helix | trans | -85 | -52.1 | -174.8 | -177.7 | 0 | 0 | 0 | 0 | 112.3 | V283 Y284 F285 V439 H442 L443 | V283-V287 PolarHBondContact O-N 3.48Å; Y284-V287 PolarHBondContact O-N 2.92Å; F285-V287 VanDerWaalsContact C-N 3.35Å; F285-V287 PolarHBondContact O-N 3.08Å; V287-V439 HydrophobicContact CB-CG1 4.25Å; V287-V439 HydrophobicContact CG1-CG1 3.94Å; V287-V439 HydrophobicContact CG2-CG1 4.42Å; V287-H442 PolarHBondContact O-CD2 2.66Å; V287-H442 PolarHBondContact O-NE2 3.27Å; V287-L443 HydrophobicContact CG1-CD1 4.22Å; V287-L443 HydrophobicContact CG1-CD2 3.71Å; V287-L443 HydrophobicContact CG1-CG 3.87Å |
| 288 | V | 96.1 | Very high | 95.6 | Very high | 9 Ų | 9 | 69.7 Ų | 69.7 | 6% | 0.055 | 34% | 0.336 | C | S | . | . | H | α-helix | trans | -84.4 | -21.9 | -172.7 | -173.6 | 0 | 0 | 0 | 0 | 112 | Y284 K290 V439 H442 | Y284-V288 HydrophobicContact CD2-CB 4.14Å; Y284-V288 HydrophobicContact CD2-CG2 3.71Å; Y284-V288 HydrophobicContact CE1-CB 4.31Å; Y284-V288 HydrophobicContact CE1-CG1 4.45Å; Y284-V288 HydrophobicContact CE2-CB 3.91Å; Y284-V288 HydrophobicContact CE2-CG1 3.95Å; Y284-V288 HydrophobicContact CE2-CG2 3.69Å; Y284-V288 HydrophobicContact CG-CB 4.49Å; Y284-V288 HydrophobicContact CG-CG2 4.36Å; Y284-V288 WeakPolarHBondContact O-CA 3.46Å; Y284-V288 VanDerWaalsContact O-CB 3.27Å; Y284-V288 WeakPolarHBondContact O-CB 3.4Å; Y284-V288 PolarHBondContact O-N 3.21Å; V288-K290 HydrophobicContact CG1-CB 4.12Å; V288-K290 HydrophobicContact CG1-CD 3.94Å; V288-K290 HydrophobicContact CG1-CG 4.03Å; V288-K290 PolarHBondContact O-N 2.72Å; V288-V439 HydrophobicContact CG2-CB 4.48Å; V288-V439 HydrophobicContact CG2-CG2 3.91Å; V288-H442 HydrophobicContact CG1-CB 4.42Å; V288-H442 HydrophobicContact CG2-CB 3.97Å |
| 289 | R | 94.2 | Very high | 95.5 | Very high | 208 Ų | 208 | 65.7 Ų | 65.7 | 79% | 0.785 | 31% | 0.312 | S | S | * | . | trans | 53.5 | 35.6 | -178.4 | -56.6 | -168.6 | -178.4 | 134.9 | -1.4 | 113.8 | F285 | F285-R289 WeakPolarHBondContact O-CA 3.27Å; F285-R289 PolarHBondContact O-N 2.75Å | ||
| 290 | K | 94.2 | Very high | 95.3 | Very high | 130 Ų | 130 | 66.8 Ų | 66.8 | 57% | 0.565 | 32% | 0.317 | S | S | * | . | S | Bend | trans | -120.4 | 158.8 | 174.1 | -70.5 | -178.3 | -175.6 | 176.2 | 0 | 109.9 | Y284 V288 P292 | Y284-K290 HydrophobicContact CE1-CB 4.02Å; Y284-K290 WeakPolarHBondContact CE1-O 3.35Å; V288-K290 HydrophobicContact CG1-CB 4.12Å; V288-K290 HydrophobicContact CG1-CD 3.94Å; V288-K290 HydrophobicContact CG1-CG 4.03Å; V288-K290 PolarHBondContact O-N 2.72Å; K290-P292 VanDerWaalsContact O-CD 3.25Å; K290-P292 WeakPolarHBondContact O-CD 3.39Å |
| 291 | N | 93.6 | Very high | 94.9 | Very high | 95 Ų | 95 | 67.7 Ų | 67.7 | 51% | 0.508 | 32% | 0.321 | S | S | . | . | trans | -66.8 | 115.3 | 178.6 | -175.1 | -23.6 | 0 | 0 | 0 | 110.8 | L293 K294 | N291-L293 VanDerWaalsContact C-N 3.32Å; N291-L293 PolarHBondContact O-N 2.86Å; N291-L293 WeakPolarHBondContact OD1-CB 3.37Å; N291-L293 PolarHBondContact OD1-N 3.5Å; N291-K294 HydrophobicContact CB-CB 4.46Å; N291-K294 PolarHBondContact O-N 3.26Å | ||
| 292 | P | 95.7 | Very high | 94.7 | Very high | 18 Ų | 18 | 67 Ų | 67 | 12% | 0.117 | 32% | 0.317 | C | S | . | . | H | α-helix | trans | -65.4 | -32.3 | -178.9 | 24.7 | -32.7 | 0 | 0 | 0 | 112.8 | P281 Y284 K290 K294 F295 L296 Y435 | P281-P292 HydrophobicContact CB-CB 3.75Å; P281-P292 HydrophobicContact CB-CG 3.81Å; Y284-P292 HydrophobicContact CD1-CB 3.78Å; Y284-P292 HydrophobicContact CE1-CB 4.3Å; K290-P292 VanDerWaalsContact O-CD 3.25Å; K290-P292 WeakPolarHBondContact O-CD 3.39Å; P292-K294 VanDerWaalsContact C-N 3.28Å; P292-K294 PolarHBondContact O-N 2.9Å; P292-F295 WeakPolarHBondContact O-CB 3.49Å; P292-F295 PolarHBondContact O-N 3.43Å; P292-F295 VanDerWaalsContact O-N 3.08Å; P292-L296 WeakPolarHBondContact O-CB 3.48Å; P292-L296 PolarHBondContact O-N 2.89Å; P292-Y435 HydrophobicContact CB-CE1 4.07Å; P292-Y435 WeakPolarHBondContact CB-OH 3.34Å; P292-Y435 PolarHBondContact O-OH 2.89Å |
| 293 | L | 93.3 | Very high | 94.5 | Very high | 105 Ų | 105 | 63.8 Ų | 63.8 | 55% | 0.55 | 30% | 0.3 | S | S | . | . | H | α-helix | trans | -65.3 | -33.6 | -179.3 | -59.4 | 179.1 | 0 | 0 | 0 | 112 | N291 F295 L296 R297 | N291-L293 VanDerWaalsContact C-N 3.32Å; N291-L293 PolarHBondContact O-N 2.86Å; N291-L293 WeakPolarHBondContact OD1-CB 3.37Å; N291-L293 PolarHBondContact OD1-N 3.5Å; L293-F295 VanDerWaalsContact C-N 3.32Å; L293-L296 PolarHBondContact O-N 3.23Å; L293-R297 WeakPolarHBondContact O-CG 3.49Å; L293-R297 PolarHBondContact O-N 3.33Å; L293-R297 VanDerWaalsContact O-N 3.08Å |
| 294 | K | 93.2 | Very high | 94.2 | Very high | 140 Ų | 140 | 63.4 Ų | 63.4 | 61% | 0.609 | 30% | 0.297 | S | S | * | . | H | α-helix | trans | -65.9 | -38.9 | 174.8 | -174.9 | 175 | -179.8 | 174.6 | 0 | 111.1 | N291 P292 | N291-K294 HydrophobicContact CB-CB 4.46Å; N291-K294 PolarHBondContact O-N 3.26Å; P292-K294 VanDerWaalsContact C-N 3.28Å; P292-K294 PolarHBondContact O-N 2.9Å |
| 295 | F | 95 | Very high | 93.8 | Very high | 11 Ų | 11 | 63 Ų | 63 | 5% | 0.048 | 30% | 0.295 | C | S | . | . | H | α-helix | trans | -67.7 | -46.3 | 176.1 | -178.6 | -97.9 | 0 | 0 | 0 | 111.4 | Y284 P292 L293 R297 G298 M299 L323 N326 I328 A434 Y435 A438 | Y284-F295 HydrophobicContact CE2-CG 4.48Å; P292-F295 WeakPolarHBondContact O-CB 3.49Å; P292-F295 PolarHBondContact O-N 3.43Å; P292-F295 VanDerWaalsContact O-N 3.08Å; L293-F295 VanDerWaalsContact C-N 3.32Å; F295-R297 VanDerWaalsContact C-N 3.27Å; F295-R297 PolarHBondContact O-N 3.2Å; F295-G298 PolarHBondContact O-N 3.01Å; F295-M299 HydrophobicContact CD1-CG 4.3Å; F295-M299 HydrophobicContact CE1-CG 4.02Å; F295-M299 HydrophobicContact CZ-CG 4.49Å; F295-M299 PolarHBondContact O-N 2.92Å; F295-L323 HydrophobicContact CE1-CD2 4.41Å; F295-L323 HydrophobicContact CE2-CD2 3.86Å; F295-L323 HydrophobicContact CZ-CD2 3.38Å; F295-N326 HydrophobicContact CD2-CB 4.29Å; F295-N326 HydrophobicContact CE2-CB 4.11Å; F295-N326 PolarHBondContact O-ND2 2.85Å; F295-N326 VanDerWaalsContact O-ND2 3.14Å; F295-I328 HydrophobicContact CE2-CD1 4.16Å; F295-I328 HydrophobicContact CE2-CG1 4.1Å; F295-A434 HydrophobicContact CE1-CB 4.11Å; F295-A434 HydrophobicContact CZ-CB 4.35Å; F295-A434 WeakPolarHBondContact CZ-O 3.34Å; F295-Y435 AromaticContact CD1-CD1 3.65Å; F295-Y435 HydrophobicContact CD1-CD1 3.65Å; F295-Y435 AromaticContact CD1-CE1 3.44Å; F295-Y435 HydrophobicContact CD1-CE1 3.44Å; F295-Y435 VanDerWaalsContact CD1-CE1 3.44Å; F295-Y435 AromaticContact CE1-CD1 3.72Å; F295-Y435 HydrophobicContact CE1-CD1 3.72Å; F295-Y435 AromaticContact CE1-CE1 3.99Å; F295-Y435 HydrophobicContact CE1-CE1 3.99Å; F295-Y435 HydrophobicContact CE1-CG 4.33Å; F295-Y435 HydrophobicContact CG-CE1 4.3Å; F295-A438 HydrophobicContact CE2-CB 3.8Å; F295-A438 HydrophobicContact CZ-CB 3.79Å |
| 296 | L | 94.7 | Very high | 93.5 | Very high | 27 Ų | 27 | 57.5 Ų | 57.5 | 14% | 0.141 | 27% | 0.271 | C | S | . | . | H | α-helix | trans | -59.4 | -35.8 | 179.3 | -168.3 | 65.5 | 0 | 0 | 0 | 112.6 | F276 P292 L293 G298 M299 I300 M303 I431 | F276-L296 HydrophobicContact CE1-CD2 4.16Å; F276-L296 HydrophobicContact CE2-CD1 4.35Å; F276-L296 HydrophobicContact CZ-CD1 4.03Å; F276-L296 HydrophobicContact CZ-CD2 3.97Å; P292-L296 WeakPolarHBondContact O-CB 3.48Å; P292-L296 PolarHBondContact O-N 2.89Å; L293-L296 PolarHBondContact O-N 3.23Å; L296-G298 PolarHBondContact O-N 3.36Å; L296-M299 WeakPolarHBondContact O-CA 3.26Å; L296-M299 PolarHBondContact O-N 2.9Å; L296-I300 PolarHBondContact O-N 3.45Å; L296-M303 HydrophobicContact CD1-CE 3.81Å; L296-M303 HydrophobicContact CD1-SD 3.65Å; L296-M303 HydrophobicContact CG-CE 3.88Å; L296-M303 HydrophobicContact CG-SD 4.31Å; L296-I431 HydrophobicContact CD1-CD1 4Å; L296-I431 HydrophobicContact CD1-CG1 4.26Å; L296-I431 HydrophobicContact CD1-CG2 4.05Å |
| 297 | R | 91.8 | Very high | 93.1 | Very high | 185 Ų | 185 | 55 Ų | 55 | 70% | 0.698 | 26% | 0.258 | S | S | * | . | H | α-helix | trans | -56.7 | -37.1 | 172.9 | -76.9 | 176 | -173.4 | 178.9 | 2.4 | 112.9 | L293 F295 M299 I300 | L293-R297 WeakPolarHBondContact O-CG 3.49Å; L293-R297 PolarHBondContact O-N 3.33Å; L293-R297 VanDerWaalsContact O-N 3.08Å; F295-R297 VanDerWaalsContact C-N 3.27Å; F295-R297 PolarHBondContact O-N 3.2Å; R297-M299 PolarHBondContact O-N 3.32Å; R297-I300 WeakPolarHBondContact O-CG1 3.5Å |
| 298 | G | 92 | Very high | 92.5 | Very high | 29 Ų | 29 | 52.9 Ų | 52.9 | 30% | 0.299 | 25% | 0.245 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -74.2 | -11 | 175.6 | 0 | 0 | 0 | 0 | 0 | 114.1 | F295 L296 C322 | F295-G298 PolarHBondContact O-N 3.01Å; L296-G298 PolarHBondContact O-N 3.36Å; G298-C322 WeakPolarHBondContact O-CB 3.49Å |
| 299 | M | 95.1 | Very high | 91.9 | Very high | 0 Ų | 0 | 52.6 Ų | 52.6 | 0% | 0 | 24% | 0.244 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -104.2 | -1.7 | -178.2 | -60.4 | -54.9 | -53.8 | 0 | 0 | 113.9 | F295 L296 R297 Q301 A302 M303 T319 C322 L323 I431 A434 | F295-M299 HydrophobicContact CD1-CG 4.3Å; F295-M299 HydrophobicContact CE1-CG 4.02Å; F295-M299 HydrophobicContact CZ-CG 4.49Å; F295-M299 PolarHBondContact O-N 2.92Å; L296-M299 WeakPolarHBondContact O-CA 3.26Å; L296-M299 PolarHBondContact O-N 2.9Å; R297-M299 PolarHBondContact O-N 3.32Å; M299-Q301 VanDerWaalsContact C-N 3.27Å; M299-Q301 PolarHBondContact O-N 3.48Å; M299-A302 HydrophobicContact CE-CB 3.94Å; M299-A302 WeakPolarHBondContact O-CB 3.39Å; M299-A302 PolarHBondContact O-N 3.47Å; M299-M303 PolarHBondContact O-N 2.89Å; M299-T319 HydrophobicContact CE-CG2 3.87Å; M299-C322 HydrophobicContact CE-CB 3.62Å; M299-C322 HydrophobicContact SD-CB 3.55Å; M299-C322 VanDerWaalsContact SD-CB 3.55Å; M299-L323 HydrophobicContact CE-CD2 4.38Å; M299-L323 HydrophobicContact CE-CG 4.21Å; M299-L323 HydrophobicContact SD-CD2 3.75Å; M299-L323 HydrophobicContact SD-CG 4.03Å; M299-I431 HydrophobicContact CB-CD1 3.6Å; M299-I431 HydrophobicContact CG-CD1 4.2Å; M299-A434 HydrophobicContact CE-CB 3.58Å; M299-A434 HydrophobicContact CG-CB 4.3Å; M299-A434 HydrophobicContact SD-CB 4.12Å |
| 300 | I | 92.4 | Very high | 91.6 | Very high | 42 Ų | 42 | 43 Ų | 43 | 22% | 0.215 | 21% | 0.209 | C | C | . | . | H | α-helix | trans | -56.5 | -40.7 | -174.3 | -60.4 | 169 | 0 | 0 | 0 | 112.2 | L16 L20 L296 R297 A302 M303 L304 | L16-I300 HydrophobicContact CD1-CB 3.67Å; L16-I300 HydrophobicContact CD1-CG2 3.46Å; L16-I300 VanDerWaalsContact CD1-CG2 3.46Å; L16-I300 HydrophobicContact CD2-CD1 4.47Å; L20-I300 HydrophobicContact CD2-CG2 4.23Å; L296-I300 PolarHBondContact O-N 3.45Å; R297-I300 WeakPolarHBondContact O-CG1 3.5Å; I300-A302 VanDerWaalsContact C-N 3.31Å; I300-A302 PolarHBondContact O-N 3.4Å; I300-M303 VanDerWaalsContact CA-CE 3.49Å; I300-M303 HydrophobicContact CB-CE 4.04Å; I300-M303 HydrophobicContact CG1-CE 3.62Å; I300-M303 HydrophobicContact CG2-CE 4.47Å; I300-M303 WeakPolarHBondContact O-CB 3.48Å; I300-M303 PolarHBondContact O-N 3.41Å; I300-M303 VanDerWaalsContact O-N 3.15Å; I300-L304 HydrophobicContact CG2-CD1 3.8Å; I300-L304 HydrophobicContact CG2-CG 4.05Å; I300-L304 WeakPolarHBondContact O-CG 3.26Å; I300-L304 PolarHBondContact O-N 3.39Å |
| 301 | Q | 89.8 | Confident | 91.2 | Very high | 18 Ų | 18 | 37 Ų | 37 | 8% | 0.084 | 18% | 0.183 | C | C | . | . | H | α-helix | trans | -59.9 | -41 | 177.9 | -174.7 | 67.4 | 13.2 | 0 | 0 | 112.2 | T19 S236 M299 T305 V318 | T19-Q301 VanDerWaalsContact CG2-OE1 3.27Å; T19-Q301 PolarHBondContact OG1-OE1 2.99Å; S236-Q301 PolarHBondContact OG-NE2 2.97Å; M299-Q301 VanDerWaalsContact C-N 3.27Å; M299-Q301 PolarHBondContact O-N 3.48Å; Q301-T305 WeakPolarHBondContact O-CB 3.47Å; Q301-T305 PolarHBondContact O-N 2.93Å; Q301-T305 PolarHBondContact O-OG1 3.44Å; Q301-V318 HydrophobicContact CB-CG1 4.43Å; Q301-V318 HydrophobicContact CG-CG1 3.76Å |
| 302 | A | 93.3 | Very high | 91 | Very high | 0 Ų | 0 | 32.8 Ų | 32.8 | 0% | 0 | 16% | 0.161 | C | C | . | . | H | α-helix | trans | -68.1 | -39.7 | 175.9 | 0 | 0 | 0 | 0 | 0 | 111.3 | M299 I300 T305 A306 T315 V318 V430 | M299-A302 HydrophobicContact CE-CB 3.94Å; M299-A302 WeakPolarHBondContact O-CB 3.39Å; M299-A302 PolarHBondContact O-N 3.47Å; I300-A302 VanDerWaalsContact C-N 3.31Å; I300-A302 PolarHBondContact O-N 3.4Å; A302-T305 PolarHBondContact O-N 2.81Å; A302-A306 WeakPolarHBondContact O-CB 3.4Å; A302-A306 PolarHBondContact O-N 2.83Å; A302-T315 HydrophobicContact CB-CG2 4.2Å; A302-T315 VanDerWaalsContact O-CG2 3.27Å; A302-T315 WeakPolarHBondContact O-CG2 3.41Å; A302-V318 HydrophobicContact CB-CG1 4.36Å; A302-V430 HydrophobicContact CB-CG1 4.23Å |
| 303 | M | 93.7 | Very high | 90.5 | Very high | 25 Ų | 25 | 32.3 Ų | 32.3 | 12% | 0.123 | 16% | 0.159 | C | C | . | . | H | α-helix | trans | -60.6 | -48.3 | 176 | -65.5 | -169 | -73.9 | 0 | 0 | 112.4 | F276 L296 M299 I300 T305 A306 L307 I431 | F276-M303 HydrophobicContact CE2-SD 3.64Å; F276-M303 HydrophobicContact CZ-SD 3.53Å; F276-M303 VanDerWaalsContact CZ-SD 3.53Å; L296-M303 HydrophobicContact CD1-CE 3.81Å; L296-M303 HydrophobicContact CD1-SD 3.65Å; L296-M303 HydrophobicContact CG-CE 3.88Å; L296-M303 HydrophobicContact CG-SD 4.31Å; M299-M303 PolarHBondContact O-N 2.89Å; I300-M303 VanDerWaalsContact CA-CE 3.49Å; I300-M303 HydrophobicContact CB-CE 4.04Å; I300-M303 HydrophobicContact CG1-CE 3.62Å; I300-M303 HydrophobicContact CG2-CE 4.47Å; I300-M303 WeakPolarHBondContact O-CB 3.48Å; I300-M303 PolarHBondContact O-N 3.41Å; I300-M303 VanDerWaalsContact O-N 3.15Å; M303-T305 VanDerWaalsContact C-N 3.3Å; M303-T305 PolarHBondContact O-N 2.81Å; M303-A306 PolarHBondContact O-N 3.12Å; M303-L307 WeakPolarHBondContact O-CB 3.48Å; M303-L307 PolarHBondContact O-N 3.09Å; M303-I431 HydrophobicContact CG-CD1 3.49Å; M303-I431 VanDerWaalsContact CG-CD1 3.49Å; M303-I431 HydrophobicContact CG-CG1 3.57Å; M303-I431 HydrophobicContact SD-CD1 3.88Å; M303-I431 HydrophobicContact SD-CG1 3.76Å |
| 304 | L | 90.5 | Very high | 90.2 | Very high | 17 Ų | 17 | 27.3 Ų | 27.3 | 9% | 0.089 | 13% | 0.133 | C | C | . | . | H | α-helix | trans | -65.7 | -37.3 | 179.1 | -61 | 170.3 | 0 | 0 | 0 | 111.3 | L16 T19 L20 V23 I300 L307 G308 | L16-L304 HydrophobicContact CD1-CD1 4.44Å; T19-L304 WeakPolarHBondContact OG1-CD1 3.49Å; L20-L304 HydrophobicContact CD2-CD1 3.71Å; L20-L304 HydrophobicContact CD2-CD2 4.06Å; L20-L304 HydrophobicContact CD2-CG 4.46Å; L20-L304 HydrophobicContact CG-CD1 3.87Å; V23-L304 HydrophobicContact CB-CD2 4.45Å; V23-L304 HydrophobicContact CG2-CB 4.3Å; V23-L304 HydrophobicContact CG2-CD2 3.73Å; V23-L304 HydrophobicContact CG2-CG 4.47Å; I300-L304 HydrophobicContact CG2-CD1 3.8Å; I300-L304 HydrophobicContact CG2-CG 4.05Å; I300-L304 WeakPolarHBondContact O-CG 3.26Å; I300-L304 PolarHBondContact O-N 3.39Å; L304-L307 PolarHBondContact O-N 3.4Å; L304-G308 PolarHBondContact O-N 3.49Å |
| 305 | T | 88.1 | Confident | 90 | Very high | 1 Ų | 1 | 20.6 Ų | 20.6 | 1% | 0.006 | 10% | 0.104 | C | C | . | . | H | α-helix | trans | -63.6 | -49.5 | 174.1 | -53.9 | 0 | 0 | 0 | 0 | 110.6 | L57 Q301 A302 M303 L307 G308 T309 T315 V318 | L57-T305 HydrophobicContact CD1-CG2 3.98Å; Q301-T305 WeakPolarHBondContact O-CB 3.47Å; Q301-T305 PolarHBondContact O-N 2.93Å; Q301-T305 PolarHBondContact O-OG1 3.44Å; A302-T305 PolarHBondContact O-N 2.81Å; M303-T305 VanDerWaalsContact C-N 3.3Å; M303-T305 PolarHBondContact O-N 2.81Å; T305-L307 VanDerWaalsContact C-N 3.32Å; T305-L307 PolarHBondContact O-N 3.01Å; T305-G308 PolarHBondContact O-N 3.04Å; T305-G308 VanDerWaalsContact O-N 3.13Å; T305-T309 HydrophobicContact CG2-CG2 3.97Å; T305-T309 WeakPolarHBondContact O-CB 3.38Å; T305-T309 WeakPolarHBondContact O-CG2 3.37Å; T305-T309 PolarHBondContact O-N 3.21Å; T305-T309 PolarHBondContact O-OG1 2.54Å; T305-T315 HydrophobicContact CG2-CG2 4.17Å; T305-V318 HydrophobicContact CG2-CG2 3.95Å |
| 306 | A | 91.3 | Very high | 89.8 | Confident | 0 Ų | 0 | 20.3 Ų | 20.3 | 0% | 0 | 10% | 0.102 | C | C | . | . | H | α-helix | trans | -56.9 | -43.6 | 175.3 | 0 | 0 | 0 | 0 | 0 | 112.7 | A302 M303 G308 T309 A310 T315 T426 V430 | A302-A306 WeakPolarHBondContact O-CB 3.4Å; A302-A306 PolarHBondContact O-N 2.83Å; M303-A306 PolarHBondContact O-N 3.12Å; A306-G308 VanDerWaalsContact C-N 3.3Å; A306-G308 PolarHBondContact O-N 3.07Å; A306-T309 PolarHBondContact O-N 3.44Å; A306-A310 WeakPolarHBondContact O-CA 3.37Å; A306-A310 PolarHBondContact O-N 3.27Å; A306-T315 VanDerWaalsContact CA-OG1 3.26Å; A306-T315 WeakPolarHBondContact CA-OG1 3.32Å; A306-T315 HydrophobicContact CB-CG2 4.09Å; A306-T315 PolarHBondContact N-OG1 3.18Å; A306-T426 HydrophobicContact CB-CG2 3.97Å; A306-V430 HydrophobicContact CB-CB 4.38Å; A306-V430 HydrophobicContact CB-CG2 4.06Å |
| 307 | L | 90.1 | Very high | 89.4 | Confident | 50 Ų | 50 | 19.1 Ų | 19.1 | 26% | 0.262 | 10% | 0.096 | S | C | . | . | H | α-helix | trans | -62.8 | -38.5 | 177.4 | -172.3 | 72.9 | 0 | 0 | 0 | 111.6 | V23 M303 L304 T305 R423 L424 | V23-L307 HydrophobicContact CG1-CD2 4.39Å; M303-L307 WeakPolarHBondContact O-CB 3.48Å; M303-L307 PolarHBondContact O-N 3.09Å; L304-L307 PolarHBondContact O-N 3.4Å; T305-L307 VanDerWaalsContact C-N 3.32Å; T305-L307 PolarHBondContact O-N 3.01Å; L307-R423 HydrophobicContact CD1-CB 4.08Å; L307-R423 WeakPolarHBondContact O-CD 3.38Å; L307-R423 PolarHBondContact O-NH1 3.42Å; L307-L424 HydrophobicContact CD1-CD2 4.36Å |
| 308 | G | 84.1 | Confident | 89.3 | Confident | 0 Ų | 0 | 10.4 Ų | 10.4 | 0% | 0 | 6% | 0.064 | C | C | . | . | H | α-helix | trans | -75.2 | -41.7 | 177.7 | 0 | 0 | 0 | 0 | 0 | 113.7 | L243 L304 T305 A306 R423 | L243-G308 WeakPolarHBondContact CD1-O 3.49Å; L304-G308 PolarHBondContact O-N 3.49Å; T305-G308 PolarHBondContact O-N 3.04Å; T305-G308 VanDerWaalsContact O-N 3.13Å; A306-G308 VanDerWaalsContact C-N 3.3Å; A306-G308 PolarHBondContact O-N 3.07Å; G308-R423 VanDerWaalsContact C-NH1 3.27Å; G308-R423 PolarHBondContact O-NH1 3.25Å |
| 309 | T | 83.7 | Confident | 89.4 | Confident | 4 Ų | 4 | 9.2 Ų | 9.2 | 3% | 0.025 | 5% | 0.051 | C | C | . | . | H | α-helix | trans | -86.9 | -25.4 | -174.5 | 62.6 | 0 | 0 | 0 | 0 | 114.2 | L54 L57 L243 T305 A306 S311 T315 | L54-T309 HydrophobicContact CD2-CG2 3.69Å; L57-T309 HydrophobicContact CD1-CG2 3.8Å; L243-T309 HydrophobicContact CD1-CG2 4.28Å; T305-T309 HydrophobicContact CG2-CG2 3.97Å; T305-T309 WeakPolarHBondContact O-CB 3.38Å; T305-T309 WeakPolarHBondContact O-CG2 3.37Å; T305-T309 PolarHBondContact O-N 3.21Å; T305-T309 PolarHBondContact O-OG1 2.54Å; A306-T309 PolarHBondContact O-N 3.44Å; T309-S311 PolarHBondContact O-N 3.27Å; T309-S311 PolarHBondContact OG1-N 2.84Å; T309-S311 PolarHBondContact OG1-O 2.73Å; T309-T315 PolarHBondContact OG1-OG1 3.39Å |
| 310 | A | 87.4 | Confident | 89.2 | Confident | 5 Ų | 5 | 9.6 Ų | 9.6 | 4% | 0.041 | 5% | 0.052 | C | C | . | . | trans | 54.3 | 28.2 | -169.5 | 0 | 0 | 0 | 0 | 0 | 113.6 | A306 P390 R423 T426 | A306-A310 WeakPolarHBondContact O-CA 3.37Å; A306-A310 PolarHBondContact O-N 3.27Å; A310-P390 HydrophobicContact CB-CB 4.49Å; A310-R423 HydrophobicContact CB-CG 3.75Å; A310-T426 PolarHBondContact O-OG1 3.36Å | ||
| 311 | S | 87.1 | Confident | 89 | Confident | 5 Ų | 5 | 9.7 Ų | 9.7 | 4% | 0.035 | 5% | 0.052 | C | C | . | . | trans | -141 | 120.9 | 179.2 | 173.1 | 0 | 0 | 0 | 0 | 112.5 | T309 A313 A314 T315 S388 | T309-S311 PolarHBondContact O-N 3.27Å; T309-S311 PolarHBondContact OG1-N 2.84Å; T309-S311 PolarHBondContact OG1-O 2.73Å; S311-A313 VanDerWaalsContact C-N 3.33Å; S311-A313 PolarHBondContact O-N 3.32Å; S311-A314 PolarHBondContact O-N 2.96Å; S311-A314 PolarHBondContact OG-N 3.24Å; S311-T315 PolarHBondContact O-N 3.25Å; S311-T315 VanDerWaalsContact O-N 3.08Å; S311-T315 PolarHBondContact O-OG1 3Å; S311-S388 PolarHBondContact OG-O 2.98Å | ||
| 312 | S | 89.6 | Confident | 89.1 | Confident | 7 Ų | 7 | 9.3 Ų | 9.3 | 5% | 0.049 | 5% | 0.051 | C | C | . | . | H | α-helix | trans | -62.2 | -41.6 | 176.1 | -57.2 | 0 | 0 | 0 | 0 | 111.5 | T315 L316 | S312-T315 PolarHBondContact O-N 3.47Å; S312-L316 PolarHBondContact O-N 3.29Å |
| 313 | A | 84.9 | Confident | 89.2 | Confident | 7 Ų | 7 | 9.3 Ų | 9.3 | 6% | 0.058 | 5% | 0.051 | C | C | . | . | H | α-helix | trans | -66.9 | -40.7 | 179.3 | 0 | 0 | 0 | 0 | 0 | 112.2 | I61 M190 S311 T315 L316 | I61-A313 VanDerWaalsContact CD1-C 3.46Å; I61-A313 HydrophobicContact CD1-CB 3.96Å; I61-A313 VanDerWaalsContact CD1-O 3.31Å; I61-A313 WeakPolarHBondContact CD1-O 3.23Å; I61-A313 WeakPolarHBondContact CG1-O 3.38Å; M190-A313 HydrophobicContact CE-CB 4.35Å; M190-A313 HydrophobicContact SD-CB 4.38Å; S311-A313 VanDerWaalsContact C-N 3.33Å; S311-A313 PolarHBondContact O-N 3.32Å; A313-T315 VanDerWaalsContact C-N 3.27Å; A313-T315 PolarHBondContact O-N 3.15Å; A313-L316 VanDerWaalsContact O-CB 3.22Å; A313-L316 WeakPolarHBondContact O-CB 3.39Å; A313-L316 PolarHBondContact O-N 3.07Å |
| 314 | A | 85.8 | Confident | 89 | Confident | 0 Ų | 0 | 10.3 Ų | 10.3 | 0% | 0 | 6% | 0.055 | C | C | . | . | H | α-helix | trans | -66.5 | -29.8 | 174.9 | 0 | 0 | 0 | 0 | 0 | 112.4 | L57 S311 P317 | L57-A314 HydrophobicContact CB-CB 4.15Å; L57-A314 WeakPolarHBondContact CB-O 3.33Å; S311-A314 PolarHBondContact O-N 2.96Å; S311-A314 PolarHBondContact OG-N 3.24Å; A314-P317 WeakPolarHBondContact O-CD 3.22Å |
| 315 | T | 90.3 | Very high | 88.9 | Confident | 0 Ų | 0 | 11.7 Ų | 11.7 | 0% | 0 | 7% | 0.069 | C | C | . | . | H | α-helix | trans | -82.5 | -18.2 | 177.5 | -61.2 | 0 | 0 | 0 | 0 | 113 | A302 T305 A306 T309 S311 S312 A313 P317 V318 T319 V430 | A302-T315 HydrophobicContact CB-CG2 4.2Å; A302-T315 VanDerWaalsContact O-CG2 3.27Å; A302-T315 WeakPolarHBondContact O-CG2 3.41Å; T305-T315 HydrophobicContact CG2-CG2 4.17Å; A306-T315 VanDerWaalsContact CA-OG1 3.26Å; A306-T315 WeakPolarHBondContact CA-OG1 3.32Å; A306-T315 HydrophobicContact CB-CG2 4.09Å; A306-T315 PolarHBondContact N-OG1 3.18Å; T309-T315 PolarHBondContact OG1-OG1 3.39Å; S311-T315 PolarHBondContact O-N 3.25Å; S311-T315 VanDerWaalsContact O-N 3.08Å; S311-T315 PolarHBondContact O-OG1 3Å; S312-T315 PolarHBondContact O-N 3.47Å; A313-T315 VanDerWaalsContact C-N 3.27Å; A313-T315 PolarHBondContact O-N 3.15Å; T315-P317 VanDerWaalsContact C-CD 3.41Å; T315-P317 VanDerWaalsContact C-N 3.34Å; T315-P317 VanDerWaalsContact O-N 3.15Å; T315-V318 HydrophobicContact CG2-CB 4.48Å; T315-V318 WeakPolarHBondContact O-CA 3.43Å; T315-V318 WeakPolarHBondContact O-CB 3.36Å; T315-V318 PolarHBondContact O-N 3.05Å; T315-T319 PolarHBondContact O-N 2.99Å; T315-T319 PolarHBondContact O-OG1 3.3Å; T315-V430 HydrophobicContact CG2-CG1 4.1Å; T315-V430 HydrophobicContact CG2-CG2 4.29Å |
| 316 | L | 89.9 | Confident | 89.1 | Confident | 4 Ų | 4 | 13.7 Ų | 13.7 | 2% | 0.021 | 8% | 0.08 | C | C | . | . | H | α-helix | trans | -46.6 | -45.9 | -177.1 | -177.1 | 62.9 | 0 | 0 | 0 | 114.1 | V65 S312 A313 V318 T319 F320 L337 P338 | V65-L316 HydrophobicContact CG2-CD2 3.63Å; S312-L316 PolarHBondContact O-N 3.29Å; A313-L316 VanDerWaalsContact O-CB 3.22Å; A313-L316 WeakPolarHBondContact O-CB 3.39Å; A313-L316 PolarHBondContact O-N 3.07Å; L316-V318 VanDerWaalsContact C-N 3.3Å; L316-V318 PolarHBondContact O-N 3.47Å; L316-T319 WeakPolarHBondContact O-CB 3.42Å; L316-T319 PolarHBondContact O-N 3.49Å; L316-F320 HydrophobicContact CD1-CD2 4.01Å; L316-F320 HydrophobicContact CD1-CE2 3.65Å; L316-F320 HydrophobicContact CD1-CZ 4.42Å; L316-F320 HydrophobicContact CD2-CE2 4.15Å; L316-F320 HydrophobicContact CG-CD2 3.91Å; L316-F320 HydrophobicContact CG-CE2 3.65Å; L316-F320 VanDerWaalsContact O-CD2 3.23Å; L316-F320 WeakPolarHBondContact O-CD2 3.37Å; L316-F320 PolarHBondContact O-N 3.28Å; L316-L337 HydrophobicContact CD1-CB 3.48Å; L316-L337 VanDerWaalsContact CD1-CB 3.48Å; L316-L337 HydrophobicContact CD1-CD1 4.31Å; L316-P338 HydrophobicContact CD2-CB 4.43Å; L316-P338 HydrophobicContact CD2-CG 4.38Å |
| 317 | P | 87.2 | Confident | 89.1 | Confident | 2 Ų | 2 | 21.9 Ų | 21.9 | 1% | 0.013 | 12% | 0.116 | C | C | . | . | H | α-helix | trans | -60.4 | -37.7 | 177.2 | -22.3 | 34.5 | 0 | 0 | 0 | 114.1 | L64 V229 A314 T315 F320 Q321 | L64-P317 HydrophobicContact CD2-CB 3.67Å; L64-P317 HydrophobicContact CD2-CG 3.8Å; V229-P317 HydrophobicContact CB-CB 4.22Å; V229-P317 HydrophobicContact CG1-CB 3.47Å; V229-P317 VanDerWaalsContact CG1-CB 3.47Å; V229-P317 HydrophobicContact CG2-CB 3.65Å; A314-P317 WeakPolarHBondContact O-CD 3.22Å; T315-P317 VanDerWaalsContact C-CD 3.41Å; T315-P317 VanDerWaalsContact C-N 3.34Å; T315-P317 VanDerWaalsContact O-N 3.15Å; P317-F320 WeakPolarHBondContact O-CB 3.21Å; P317-Q321 PolarHBondContact O-N 3.48Å |
| 318 | V | 89.1 | Confident | 89.3 | Confident | 3 Ų | 3 | 21 Ų | 21 | 2% | 0.018 | 11% | 0.111 | C | C | . | . | H | α-helix | trans | -71.1 | -40.4 | 177.6 | -169.6 | 0 | 0 | 0 | 0 | 110.4 | L57 I233 Q301 A302 T305 T315 L316 F320 Q321 C322 | L57-V318 HydrophobicContact CD2-CG2 4.32Å; I233-V318 HydrophobicContact CD1-CB 4.2Å; I233-V318 HydrophobicContact CD1-CG1 4.16Å; I233-V318 HydrophobicContact CD1-CG2 3.88Å; I233-V318 HydrophobicContact CG1-CB 4.48Å; I233-V318 HydrophobicContact CG1-CG1 4.42Å; I233-V318 HydrophobicContact CG1-CG2 3.7Å; Q301-V318 HydrophobicContact CB-CG1 4.43Å; Q301-V318 HydrophobicContact CG-CG1 3.76Å; A302-V318 HydrophobicContact CB-CG1 4.36Å; T305-V318 HydrophobicContact CG2-CG2 3.95Å; T315-V318 HydrophobicContact CG2-CB 4.48Å; T315-V318 WeakPolarHBondContact O-CA 3.43Å; T315-V318 WeakPolarHBondContact O-CB 3.36Å; T315-V318 PolarHBondContact O-N 3.05Å; L316-V318 VanDerWaalsContact C-N 3.3Å; L316-V318 PolarHBondContact O-N 3.47Å; V318-F320 VanDerWaalsContact C-N 3.33Å; V318-F320 PolarHBondContact O-N 2.86Å; V318-Q321 PolarHBondContact O-N 3.45Å; V318-C322 PolarHBondContact O-N 3.49Å; V318-C322 PolarHBondContact O-SG 2.75Å |
| 319 | T | 94.1 | Very high | 89.6 | Confident | 4 Ų | 4 | 23.6 Ų | 23.6 | 3% | 0.025 | 12% | 0.124 | C | C | . | . | H | α-helix | trans | -60.1 | -43.2 | 176.4 | -50.5 | 0 | 0 | 0 | 0 | 111.3 | M299 T315 L316 Q321 C322 L323 L337 V430 | M299-T319 HydrophobicContact CE-CG2 3.87Å; T315-T319 PolarHBondContact O-N 2.99Å; T315-T319 PolarHBondContact O-OG1 3.3Å; L316-T319 WeakPolarHBondContact O-CB 3.42Å; L316-T319 PolarHBondContact O-N 3.49Å; T319-Q321 PolarHBondContact O-N 3.49Å; T319-C322 PolarHBondContact O-N 3.22Å; T319-L323 HydrophobicContact CG2-CD1 4.26Å; T319-L323 WeakPolarHBondContact O-CG 3.5Å; T319-L323 PolarHBondContact O-N 3.45Å; T319-L337 HydrophobicContact CG2-CD1 3.93Å; T319-L337 HydrophobicContact CG2-CD2 4.07Å; T319-V430 HydrophobicContact CG2-CG1 4.22Å; T319-V430 WeakPolarHBondContact OG1-CG1 3.45Å |
| 320 | F | 91.1 | Very high | 89.8 | Confident | 7 Ų | 7 | 25 Ų | 25 | 3% | 0.031 | 14% | 0.135 | C | C | . | . | H | α-helix | trans | -53.9 | -51.9 | 173.3 | -90.8 | -64.1 | 0 | 0 | 0 | 112.5 | L64 L316 P317 V318 C322 L323 Q324 T333 R334 L337 P338 | L64-F320 HydrophobicContact CD2-CD2 3.63Å; L64-F320 HydrophobicContact CD2-CE2 4.1Å; L64-F320 HydrophobicContact CG-CD2 4.3Å; L64-F320 HydrophobicContact CG-CE2 4.41Å; L316-F320 HydrophobicContact CD1-CD2 4.01Å; L316-F320 HydrophobicContact CD1-CE2 3.65Å; L316-F320 HydrophobicContact CD1-CZ 4.42Å; L316-F320 HydrophobicContact CD2-CE2 4.15Å; L316-F320 HydrophobicContact CG-CD2 3.91Å; L316-F320 HydrophobicContact CG-CE2 3.65Å; L316-F320 VanDerWaalsContact O-CD2 3.23Å; L316-F320 WeakPolarHBondContact O-CD2 3.37Å; L316-F320 PolarHBondContact O-N 3.28Å; P317-F320 WeakPolarHBondContact O-CB 3.21Å; V318-F320 VanDerWaalsContact C-N 3.33Å; V318-F320 PolarHBondContact O-N 2.86Å; F320-C322 PolarHBondContact O-N 3.1Å; F320-L323 PolarHBondContact O-N 3.01Å; F320-Q324 WeakPolarHBondContact O-CG 3.31Å; F320-Q324 PolarHBondContact O-N 3.07Å; F320-T333 VanDerWaalsContact CE1-C 3.45Å; F320-T333 VanDerWaalsContact CE1-O 3.31Å; F320-T333 WeakPolarHBondContact CE1-O 3.37Å; F320-R334 VanDerWaalsContact CE1-CA 3.43Å; F320-R334 HydrophobicContact CE1-CB 4.26Å; F320-R334 HydrophobicContact CE1-CG 3.92Å; F320-L337 HydrophobicContact CD1-CD1 3.76Å; F320-L337 HydrophobicContact CD2-CD1 4.3Å; F320-L337 HydrophobicContact CE1-CB 4.48Å; F320-L337 HydrophobicContact CE1-CD1 3.84Å; F320-L337 HydrophobicContact CE2-CB 4.49Å; F320-L337 HydrophobicContact CE2-CD1 4.39Å; F320-L337 HydrophobicContact CG-CD1 3.99Å; F320-L337 HydrophobicContact CZ-CB 4.15Å; F320-L337 HydrophobicContact CZ-CD1 4.16Å; F320-P338 HydrophobicContact CE2-CG 4.32Å; F320-P338 HydrophobicContact CZ-CG 3.95Å |
| 321 | Q | 87.3 | Confident | 89.8 | Confident | 44 Ų | 44 | 27.2 Ų | 27.2 | 21% | 0.206 | 14% | 0.142 | C | C | . | . | H | α-helix | trans | -65.1 | -40 | -178.6 | -173.5 | 175.8 | -5.6 | 0 | 0 | 112 | P317 V318 T319 L323 Q324 A325 | P317-Q321 PolarHBondContact O-N 3.48Å; V318-Q321 PolarHBondContact O-N 3.45Å; T319-Q321 PolarHBondContact O-N 3.49Å; Q321-L323 VanDerWaalsContact C-N 3.35Å; Q321-L323 PolarHBondContact O-N 2.76Å; Q321-Q324 PolarHBondContact O-N 3.33Å; Q321-A325 WeakPolarHBondContact O-CB 3.47Å; Q321-A325 PolarHBondContact O-N 3.41Å |
| 322 | C | 92.8 | Very high | 90 | Very high | 10 Ų | 10 | 27 Ų | 27 | 7% | 0.068 | 14% | 0.14 | C | C | . | . | H | α-helix | trans | -62.2 | -42.2 | 177 | -66.4 | 0 | 0 | 0 | 0 | 111.6 | G298 M299 V318 T319 F320 A325 N326 | G298-C322 WeakPolarHBondContact O-CB 3.49Å; M299-C322 HydrophobicContact CE-CB 3.62Å; M299-C322 HydrophobicContact SD-CB 3.55Å; M299-C322 VanDerWaalsContact SD-CB 3.55Å; V318-C322 PolarHBondContact O-N 3.49Å; V318-C322 PolarHBondContact O-SG 2.75Å; T319-C322 PolarHBondContact O-N 3.22Å; F320-C322 PolarHBondContact O-N 3.1Å; C322-A325 PolarHBondContact O-N 3.45Å; C322-N326 WeakPolarHBondContact O-CB 3.45Å; C322-N326 PolarHBondContact O-N 3.19Å |
| 323 | L | 94.9 | Very high | 90.2 | Very high | 0 Ų | 0 | 26.6 Ų | 26.6 | 0% | 0 | 14% | 0.138 | C | C | . | . | H | α-helix | trans | -70.8 | -36.9 | 178.7 | -73.4 | 175.2 | 0 | 0 | 0 | 113.5 | F295 M299 T319 F320 Q321 A325 N326 K327 I328 T333 L337 A434 A437 | F295-L323 HydrophobicContact CE1-CD2 4.41Å; F295-L323 HydrophobicContact CE2-CD2 3.86Å; F295-L323 HydrophobicContact CZ-CD2 3.38Å; M299-L323 HydrophobicContact CE-CD2 4.38Å; M299-L323 HydrophobicContact CE-CG 4.21Å; M299-L323 HydrophobicContact SD-CD2 3.75Å; M299-L323 HydrophobicContact SD-CG 4.03Å; T319-L323 HydrophobicContact CG2-CD1 4.26Å; T319-L323 WeakPolarHBondContact O-CG 3.5Å; T319-L323 PolarHBondContact O-N 3.45Å; F320-L323 PolarHBondContact O-N 3.01Å; Q321-L323 VanDerWaalsContact C-N 3.35Å; Q321-L323 PolarHBondContact O-N 2.76Å; L323-A325 VanDerWaalsContact C-N 3.33Å; L323-N326 CarbonylContact O-C 3.48Å; L323-N326 WeakPolarHBondContact O-CA 3.35Å; L323-N326 PolarHBondContact O-N 3.14Å; L323-K327 PolarHBondContact O-N 2.84Å; L323-K327 VanDerWaalsContact O-N 3.13Å; L323-I328 HydrophobicContact CB-CB 4.44Å; L323-I328 HydrophobicContact CD2-CG1 4.03Å; L323-I328 PolarHBondContact O-N 3.14Å; L323-T333 HydrophobicContact CB-CG2 3.77Å; L323-T333 HydrophobicContact CD1-CG2 3.93Å; L323-T333 HydrophobicContact CG-CG2 4.46Å; L323-L337 HydrophobicContact CD1-CD1 3.53Å; L323-L337 HydrophobicContact CD1-CD2 3.59Å; L323-L337 HydrophobicContact CD1-CG 3.9Å; L323-A434 HydrophobicContact CD1-CB 4.46Å; L323-A434 HydrophobicContact CD2-CB 4.09Å; L323-A437 HydrophobicContact CD1-CB 3.91Å |
| 324 | Q | 89.2 | Confident | 90.3 | Very high | 47 Ų | 47 | 27.5 Ų | 27.5 | 22% | 0.22 | 14% | 0.14 | C | C | . | . | H | α-helix | trans | -62.1 | -42.2 | 171.4 | -72.2 | 176.5 | 5.7 | 0 | 0 | 111 | F320 Q321 N326 K327 | F320-Q324 WeakPolarHBondContact O-CG 3.31Å; F320-Q324 PolarHBondContact O-N 3.07Å; Q321-Q324 PolarHBondContact O-N 3.33Å; Q324-N326 VanDerWaalsContact C-N 3.28Å; Q324-N326 PolarHBondContact O-N 3.41Å; Q324-K327 WeakPolarHBondContact O-CA 3.38Å; Q324-K327 PolarHBondContact O-N 2.96Å |
| 325 | A | 88.8 | Confident | 90.3 | Very high | 46 Ų | 46 | 28.1 Ų | 28.1 | 38% | 0.38 | 14% | 0.143 | S | C | . | . | H | α-helix | trans | -64.1 | -33.6 | 174.1 | 0 | 0 | 0 | 0 | 0 | 112.3 | Q321 C322 L323 K327 | Q321-A325 WeakPolarHBondContact O-CB 3.47Å; Q321-A325 PolarHBondContact O-N 3.41Å; C322-A325 PolarHBondContact O-N 3.45Å; L323-A325 VanDerWaalsContact C-N 3.33Å; A325-K327 PolarHBondContact O-N 3.47Å |
| 326 | N | 92.5 | Very high | 90.4 | Very high | 42 Ų | 42 | 28.1 Ų | 28.1 | 23% | 0.225 | 14% | 0.143 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -76.1 | 5.2 | 170.5 | -89.3 | -32.6 | 0 | 0 | 0 | 114.1 | F295 C322 L323 Q324 I328 | F295-N326 HydrophobicContact CD2-CB 4.29Å; F295-N326 HydrophobicContact CE2-CB 4.11Å; F295-N326 PolarHBondContact O-ND2 2.85Å; F295-N326 VanDerWaalsContact O-ND2 3.14Å; C322-N326 WeakPolarHBondContact O-CB 3.45Å; C322-N326 PolarHBondContact O-N 3.19Å; L323-N326 CarbonylContact O-C 3.48Å; L323-N326 WeakPolarHBondContact O-CA 3.35Å; L323-N326 PolarHBondContact O-N 3.14Å; Q324-N326 VanDerWaalsContact C-N 3.28Å; Q324-N326 PolarHBondContact O-N 3.41Å; N326-I328 VanDerWaalsContact C-N 3.3Å; N326-I328 PolarHBondContact O-N 3.24Å |
| 327 | K | 91.1 | Very high | 90.6 | Very high | 173 Ų | 173 | 28 Ų | 28 | 75% | 0.752 | 14% | 0.142 | S | C | * | . | T | Hydrogen-bonded Turn | trans | 61.5 | 30.7 | 176.4 | -51.5 | -178.5 | 178.4 | -175.6 | 0 | 114.3 | L323 Q324 A325 | L323-K327 PolarHBondContact O-N 2.84Å; L323-K327 VanDerWaalsContact O-N 3.13Å; Q324-K327 WeakPolarHBondContact O-CA 3.38Å; Q324-K327 PolarHBondContact O-N 2.96Å; A325-K327 PolarHBondContact O-N 3.47Å |
| 328 | I | 93.7 | Very high | 90.6 | Very high | 31 Ų | 31 | 27.9 Ų | 27.9 | 16% | 0.159 | 14% | 0.141 | C | C | . | . | trans | -78.5 | 137.3 | 167.6 | -53.1 | -53.6 | 0 | 0 | 0 | 108.4 | F295 L323 N326 S330 T333 A438 | F295-I328 HydrophobicContact CE2-CD1 4.16Å; F295-I328 HydrophobicContact CE2-CG1 4.1Å; L323-I328 HydrophobicContact CB-CB 4.44Å; L323-I328 HydrophobicContact CD2-CG1 4.03Å; L323-I328 PolarHBondContact O-N 3.14Å; N326-I328 VanDerWaalsContact C-N 3.3Å; N326-I328 PolarHBondContact O-N 3.24Å; I328-S330 PolarHBondContact O-N 3.4Å; I328-T333 HydrophobicContact CB-CG2 3.85Å; I328-T333 HydrophobicContact CG2-CG2 3.53Å; I328-A438 HydrophobicContact CD1-CB 3.79Å; I328-A438 HydrophobicContact CG1-CB 4.31Å | ||
| 329 | D | 90.9 | Very high | 90.6 | Very high | 54 Ų | 54 | 28.7 Ų | 28.7 | 29% | 0.289 | 15% | 0.145 | S | C | . | . | trans | -57.1 | 125.1 | -178.5 | -171.9 | -53 | 0 | 0 | 0 | 110.6 | R331 V332 T333 | D329-R331 PolarHBondContact O-N 3.42Å; D329-R331 VanDerWaalsContact OD1-CB 3.22Å; D329-R331 WeakPolarHBondContact OD1-CB 3.37Å; D329-R331 WeakPolarHBondContact OD1-CG 3.36Å; D329-R331 IonicContact OD1-CZ 3.95Å; D329-R331 PolarHBondContact OD1-N 2.82Å; D329-R331 IonicContact OD1-NE 2.81Å; D329-R331 PolarHBondContact OD1-NE 3.13Å; D329-R331 IonicContact OD1-NH2 3.94Å; D329-R331 IonicContact OD2-CZ 3.46Å; D329-R331 IonicContact OD2-NE 3.06Å; D329-R331 PolarHBondContact OD2-NE 3.03Å; D329-R331 IonicContact OD2-NH2 2.74Å; D329-R331 PolarHBondContact OD2-NH2 3.48Å; D329-V332 HydrophobicContact CB-CG2 4.13Å; D329-V332 WeakPolarHBondContact O-CB 3.38Å; D329-V332 PolarHBondContact O-N 3.02Å; D329-T333 PolarHBondContact O-N 3.48Å; D329-T333 VanDerWaalsContact O-N 3.1Å | ||
| 330 | S | 88.1 | Confident | 90.4 | Very high | 35 Ų | 35 | 28.5 Ų | 28.5 | 25% | 0.245 | 14% | 0.144 | C | C | . | . | H | α-helix | trans | -58.7 | -30.7 | -177.1 | -60.4 | 0 | 0 | 0 | 0 | 112.7 | I328 V332 T333 R334 | I328-S330 PolarHBondContact O-N 3.4Å; S330-V332 VanDerWaalsContact C-N 3.29Å; S330-V332 PolarHBondContact O-N 3.03Å; S330-T333 WeakPolarHBondContact CA-OG1 3.33Å; S330-T333 PolarHBondContact O-N 3.28Å; S330-T333 PolarHBondContact O-OG1 3.33Å; S330-R334 WeakPolarHBondContact O-CB 3.32Å; S330-R334 VanDerWaalsContact O-CD 3.28Å; S330-R334 WeakPolarHBondContact O-CD 3.45Å; S330-R334 WeakPolarHBondContact O-CG 3.48Å; S330-R334 PolarHBondContact O-N 2.7Å |
| 331 | R | 87.3 | Confident | 90.2 | Very high | 50 Ų | 50 | 28.2 Ų | 28.2 | 19% | 0.189 | 14% | 0.143 | C | C | . | . | H | α-helix | trans | -65.1 | -37.1 | 178.1 | -61.2 | 170.1 | -69 | 178.3 | 1.2 | 111.2 | M76 D329 F335 L448 | M76-R331 HydrophobicContact CG-CB 4.05Å; M76-R331 HydrophobicContact CG-CG 4.21Å; M76-R331 HydrophobicContact SD-CB 3.73Å; D329-R331 PolarHBondContact O-N 3.42Å; D329-R331 VanDerWaalsContact OD1-CB 3.22Å; D329-R331 WeakPolarHBondContact OD1-CB 3.37Å; D329-R331 WeakPolarHBondContact OD1-CG 3.36Å; D329-R331 IonicContact OD1-CZ 3.95Å; D329-R331 PolarHBondContact OD1-N 2.82Å; D329-R331 IonicContact OD1-NE 2.81Å; D329-R331 PolarHBondContact OD1-NE 3.13Å; D329-R331 IonicContact OD1-NH2 3.94Å; D329-R331 IonicContact OD2-CZ 3.46Å; D329-R331 IonicContact OD2-NE 3.06Å; D329-R331 PolarHBondContact OD2-NE 3.03Å; D329-R331 IonicContact OD2-NH2 2.74Å; D329-R331 PolarHBondContact OD2-NH2 3.48Å; R331-F335 PolarHBondContact O-N 3.39Å; R331-L448 PolarHBondContact NH2-O 3.31Å; R331-L448 VanDerWaalsContact NH2-O 3.16Å |
| 332 | V | 92.3 | Very high | 90 | Very high | 0 Ų | 0 | 26.7 Ų | 26.7 | 0% | 0 | 14% | 0.137 | C | C | . | . | H | α-helix | trans | -70.9 | -51 | 175.5 | -178.6 | 0 | 0 | 0 | 0 | 110.4 | I84 D329 S330 R334 F335 V336 A437 V440 L448 | I84-V332 HydrophobicContact CD1-CB 4.5Å; I84-V332 HydrophobicContact CD1-CG2 3.85Å; D329-V332 HydrophobicContact CB-CG2 4.13Å; D329-V332 WeakPolarHBondContact O-CB 3.38Å; D329-V332 PolarHBondContact O-N 3.02Å; S330-V332 VanDerWaalsContact C-N 3.29Å; S330-V332 PolarHBondContact O-N 3.03Å; V332-R334 VanDerWaalsContact C-N 3.29Å; V332-R334 PolarHBondContact O-N 3.34Å; V332-F335 PolarHBondContact O-N 3.3Å; V332-V336 HydrophobicContact CG1-CG2 3.78Å; V332-V336 WeakPolarHBondContact O-CB 3.44Å; V332-V336 VanDerWaalsContact O-CG2 3.24Å; V332-V336 WeakPolarHBondContact O-CG2 3.27Å; V332-V336 PolarHBondContact O-N 2.86Å; V332-A437 WeakPolarHBondContact CG1-O 3.35Å; V332-V440 HydrophobicContact CG1-CB 4.31Å; V332-V440 HydrophobicContact CG1-CG1 4.12Å; V332-L448 HydrophobicContact CG2-CD1 3.55Å; V332-L448 HydrophobicContact CG2-CD2 4.24Å |
| 333 | T | 92.3 | Very high | 89.5 | Confident | 0 Ų | 0 | 27.8 Ų | 27.8 | 0% | 0 | 14% | 0.142 | C | C | . | . | H | α-helix | trans | -61.6 | -40.8 | -177.7 | 62.2 | 0 | 0 | 0 | 0 | 111.5 | F320 L323 I328 D329 S330 F335 V336 L337 A437 | F320-T333 VanDerWaalsContact CE1-C 3.45Å; F320-T333 VanDerWaalsContact CE1-O 3.31Å; F320-T333 WeakPolarHBondContact CE1-O 3.37Å; L323-T333 HydrophobicContact CB-CG2 3.77Å; L323-T333 HydrophobicContact CD1-CG2 3.93Å; L323-T333 HydrophobicContact CG-CG2 4.46Å; I328-T333 HydrophobicContact CB-CG2 3.85Å; I328-T333 HydrophobicContact CG2-CG2 3.53Å; D329-T333 PolarHBondContact O-N 3.48Å; D329-T333 VanDerWaalsContact O-N 3.1Å; S330-T333 WeakPolarHBondContact CA-OG1 3.33Å; S330-T333 PolarHBondContact O-N 3.28Å; S330-T333 PolarHBondContact O-OG1 3.33Å; T333-F335 PolarHBondContact O-N 3.35Å; T333-V336 PolarHBondContact O-N 3.5Å; T333-L337 WeakPolarHBondContact O-CB 3.34Å; T333-L337 WeakPolarHBondContact O-CG 3.27Å; T333-L337 PolarHBondContact O-N 3.01Å; T333-A437 HydrophobicContact CG2-CB 4.4Å |
| 334 | R | 86.8 | Confident | 88.9 | Confident | 26 Ų | 26 | 27.8 Ų | 27.8 | 10% | 0.098 | 14% | 0.142 | C | C | . | . | H | α-helix | trans | -62.6 | -30.2 | -179.8 | -70.8 | 171.7 | 174.3 | 145.2 | 0.3 | 112.7 | S68 L69 D222 F320 S330 V332 P338 | S68-R334 WeakPolarHBondContact O-CB 3.22Å; S68-R334 WeakPolarHBondContact O-CD 3.38Å; L69-R334 WeakPolarHBondContact CD2-O 3.44Å; D222-R334 IonicContact OD1-CZ 3.44Å; D222-R334 IonicContact OD1-NE 3.66Å; D222-R334 PolarHBondContact OD1-NE 2.9Å; D222-R334 IonicContact OD1-NH2 2.65Å; D222-R334 IonicContact OD2-CZ 3.06Å; D222-R334 IonicContact OD2-NE 3.72Å; D222-R334 IonicContact OD2-NH2 3.83Å; D222-R334 PolarHBondContact OD2-NH2 3.12Å; F320-R334 VanDerWaalsContact CE1-CA 3.43Å; F320-R334 HydrophobicContact CE1-CB 4.26Å; F320-R334 HydrophobicContact CE1-CG 3.92Å; S330-R334 WeakPolarHBondContact O-CB 3.32Å; S330-R334 VanDerWaalsContact O-CD 3.28Å; S330-R334 WeakPolarHBondContact O-CD 3.45Å; S330-R334 WeakPolarHBondContact O-CG 3.48Å; S330-R334 PolarHBondContact O-N 2.7Å; V332-R334 VanDerWaalsContact C-N 3.29Å; V332-R334 PolarHBondContact O-N 3.34Å; R334-P338 VanDerWaalsContact O-CD 3.28Å; R334-P338 WeakPolarHBondContact O-CD 3Å; R334-P338 WeakPolarHBondContact O-CG 3.5Å |
| 335 | F | 86.7 | Confident | 88.8 | Confident | 13 Ų | 13 | 25.9 Ų | 25.9 | 6% | 0.057 | 13% | 0.133 | C | C | . | . | H | α-helix | trans | -86.5 | -49.7 | 175.6 | -172.6 | -89.5 | 0 | 0 | 0 | 112.6 | L69 L73 I84 A85 V198 R331 V332 T333 I339 | L69-F335 HydrophobicContact CD2-CD2 4.45Å; L73-F335 HydrophobicContact CD1-CD2 3.95Å; L73-F335 HydrophobicContact CD1-CE2 4.14Å; L73-F335 HydrophobicContact CD2-CD2 3.64Å; L73-F335 HydrophobicContact CD2-CE2 3.99Å; L73-F335 HydrophobicContact CG-CD2 3.99Å; I84-F335 HydrophobicContact CB-CD1 4.43Å; I84-F335 HydrophobicContact CG2-CB 4.24Å; I84-F335 HydrophobicContact CG2-CD1 3.43Å; I84-F335 VanDerWaalsContact CG2-CD1 3.43Å; I84-F335 HydrophobicContact CG2-CE1 4.12Å; I84-F335 HydrophobicContact CG2-CG 4.06Å; A85-F335 HydrophobicContact CB-CE1 3.66Å; A85-F335 HydrophobicContact CB-CZ 3.57Å; V198-F335 HydrophobicContact CG1-CE2 4.23Å; V198-F335 HydrophobicContact CG2-CE2 3.9Å; R331-F335 PolarHBondContact O-N 3.39Å; V332-F335 PolarHBondContact O-N 3.3Å; T333-F335 PolarHBondContact O-N 3.35Å; F335-I339 HydrophobicContact CD1-CD1 3.84Å; F335-I339 HydrophobicContact CD2-CD1 4.35Å; F335-I339 HydrophobicContact CE1-CD1 3.32Å; F335-I339 HydrophobicContact CE2-CD1 3.94Å; F335-I339 HydrophobicContact CG-CD1 4.33Å; F335-I339 HydrophobicContact CZ-CD1 3.39Å; F335-I339 WeakPolarHBondContact O-CD1 2.95Å; F335-I339 WeakPolarHBondContact O-CG1 3.29Å |
| 336 | V | 92.7 | Very high | 89.1 | Confident | 0 Ų | 0 | 23.7 Ų | 23.7 | 0% | 0 | 12% | 0.115 | C | C | . | . | H | α-helix | trans | -73.1 | -41.8 | -167.8 | 176.3 | 0 | 0 | 0 | 0 | 112 | I84 A88 Y92 V332 T333 G340 A437 V440 | I84-V336 HydrophobicContact CG2-CG2 3.68Å; A88-V336 HydrophobicContact CB-CG1 4.38Å; A88-V336 HydrophobicContact CB-CG2 4.16Å; Y92-V336 WeakPolarHBondContact OH-CG1 3.49Å; Y92-V336 PolarHBondContact OH-O 2.94Å; V332-V336 HydrophobicContact CG1-CG2 3.78Å; V332-V336 WeakPolarHBondContact O-CB 3.44Å; V332-V336 VanDerWaalsContact O-CG2 3.24Å; V332-V336 WeakPolarHBondContact O-CG2 3.27Å; V332-V336 PolarHBondContact O-N 2.86Å; T333-V336 PolarHBondContact O-N 3.5Å; V336-G340 PolarHBondContact O-N 2.87Å; V336-A437 HydrophobicContact CB-CB 4.26Å; V336-A437 HydrophobicContact CG1-CB 4.05Å; V336-V440 HydrophobicContact CG2-CB 4.29Å; V336-V440 HydrophobicContact CG2-CG1 4.04Å |
| 337 | L | 93 | Very high | 89.2 | Confident | 0 Ų | 0 | 21.7 Ų | 21.7 | 0% | 0 | 10% | 0.104 | C | C | . | . | H | α-helix | trans | -70.3 | -44.4 | -173 | -60.2 | 178.5 | 0 | 0 | 0 | 114.6 | L316 T319 F320 L323 T333 I339 G340 A341 D433 A437 | L316-L337 HydrophobicContact CD1-CB 3.48Å; L316-L337 VanDerWaalsContact CD1-CB 3.48Å; L316-L337 HydrophobicContact CD1-CD1 4.31Å; T319-L337 HydrophobicContact CG2-CD1 3.93Å; T319-L337 HydrophobicContact CG2-CD2 4.07Å; F320-L337 HydrophobicContact CD1-CD1 3.76Å; F320-L337 HydrophobicContact CD2-CD1 4.3Å; F320-L337 HydrophobicContact CE1-CB 4.48Å; F320-L337 HydrophobicContact CE1-CD1 3.84Å; F320-L337 HydrophobicContact CE2-CB 4.49Å; F320-L337 HydrophobicContact CE2-CD1 4.39Å; F320-L337 HydrophobicContact CG-CD1 3.99Å; F320-L337 HydrophobicContact CZ-CB 4.15Å; F320-L337 HydrophobicContact CZ-CD1 4.16Å; L323-L337 HydrophobicContact CD1-CD1 3.53Å; L323-L337 HydrophobicContact CD1-CD2 3.59Å; L323-L337 HydrophobicContact CD1-CG 3.9Å; T333-L337 WeakPolarHBondContact O-CB 3.34Å; T333-L337 WeakPolarHBondContact O-CG 3.27Å; T333-L337 PolarHBondContact O-N 3.01Å; L337-I339 VanDerWaalsContact C-N 3.3Å; L337-I339 PolarHBondContact O-N 2.81Å; L337-G340 PolarHBondContact O-N 3.09Å; L337-A341 WeakPolarHBondContact O-CB 3.46Å; L337-A341 PolarHBondContact O-N 2.87Å; L337-D433 HydrophobicContact CD2-CB 3.86Å; L337-A437 HydrophobicContact CD2-CB 4.18Å |
| 338 | P | 89 | Confident | 89.3 | Confident | 0 Ų | 0 | 13.6 Ų | 13.6 | 0% | 0 | 7% | 0.069 | C | C | . | . | H | α-helix | trans | -62.5 | -40.3 | 178.2 | -24.4 | 36.7 | 0 | 0 | 0 | 111.9 | V65 L69 I194 L316 F320 R334 T342 | V65-P338 HydrophobicContact CG1-CB 4.24Å; V65-P338 HydrophobicContact CG2-CB 4.35Å; V65-P338 HydrophobicContact CG2-CG 4.48Å; L69-P338 HydrophobicContact CD1-CB 4.16Å; L69-P338 HydrophobicContact CD1-CG 4.33Å; L69-P338 HydrophobicContact CD2-CG 4.3Å; L69-P338 HydrophobicContact CG-CG 4.19Å; I194-P338 HydrophobicContact CD1-CB 3.89Å; I194-P338 VanDerWaalsContact CD1-O 3.25Å; I194-P338 WeakPolarHBondContact CD1-O 3.2Å; I194-P338 HydrophobicContact CG1-CB 4.15Å; L316-P338 HydrophobicContact CD2-CB 4.43Å; L316-P338 HydrophobicContact CD2-CG 4.38Å; F320-P338 HydrophobicContact CE2-CG 4.32Å; F320-P338 HydrophobicContact CZ-CG 3.95Å; R334-P338 VanDerWaalsContact O-CD 3.28Å; R334-P338 WeakPolarHBondContact O-CD 3Å; R334-P338 WeakPolarHBondContact O-CG 3.5Å; P338-T342 PolarHBondContact O-N 3.33Å; P338-T342 PolarHBondContact O-OG1 3.45Å |
| 339 | I | 87.3 | Confident | 89.4 | Confident | 20 Ų | 20 | 12.1 Ų | 12.1 | 10% | 0.103 | 6% | 0.062 | C | C | . | . | H | α-helix | trans | -65.5 | -45.9 | 175.8 | -64.7 | 172.3 | 0 | 0 | 0 | 110.4 | Y92 I194 F335 L337 A341 T342 I343 | Y92-I339 HydrophobicContact CE2-CG2 4.29Å; I194-I339 HydrophobicContact CG2-CD1 4.47Å; I194-I339 HydrophobicContact CG2-CG1 3.75Å; F335-I339 HydrophobicContact CD1-CD1 3.84Å; F335-I339 HydrophobicContact CD2-CD1 4.35Å; F335-I339 HydrophobicContact CE1-CD1 3.32Å; F335-I339 HydrophobicContact CE2-CD1 3.94Å; F335-I339 HydrophobicContact CG-CD1 4.33Å; F335-I339 HydrophobicContact CZ-CD1 3.39Å; F335-I339 WeakPolarHBondContact O-CD1 2.95Å; F335-I339 WeakPolarHBondContact O-CG1 3.29Å; L337-I339 VanDerWaalsContact C-N 3.3Å; L337-I339 PolarHBondContact O-N 2.81Å; I339-A341 PolarHBondContact O-N 2.79Å; I339-T342 PolarHBondContact O-N 3.24Å; I339-T342 VanDerWaalsContact O-N 3.12Å; I339-T342 PolarHBondContact O-OG1 3.49Å; I339-I343 HydrophobicContact CG2-CD1 3.72Å; I339-I343 HydrophobicContact CG2-CG1 4.38Å; I339-I343 WeakPolarHBondContact O-CB 3.49Å; I339-I343 PolarHBondContact O-N 3.06Å |
| 340 | G | 90.7 | Very high | 89.7 | Confident | 0 Ų | 0 | 9.6 Ų | 9.6 | 0% | 0 | 5% | 0.048 | C | C | . | . | H | α-helix | trans | -57.8 | -47.3 | 177.2 | 0 | 0 | 0 | 0 | 0 | 112.2 | Y92 V336 L337 T342 I343 N344 D433 | Y92-G340 VanDerWaalsContact CZ-CA 3.44Å; Y92-G340 WeakPolarHBondContact OH-CA 3.35Å; V336-G340 PolarHBondContact O-N 2.87Å; L337-G340 PolarHBondContact O-N 3.09Å; G340-T342 PolarHBondContact O-N 2.99Å; G340-I343 PolarHBondContact O-N 3.45Å; G340-I343 VanDerWaalsContact O-N 3.16Å; G340-N344 WeakPolarHBondContact O-CA 3.35Å; G340-N344 WeakPolarHBondContact O-CB 3.4Å; G340-N344 PolarHBondContact O-N 2.81Å; G340-D433 VanDerWaalsContact C-OD2 3.27Å; G340-D433 WeakPolarHBondContact CA-OD1 3.36Å |
| 341 | A | 87.9 | Confident | 90 | Very high | 2 Ų | 2 | 7.9 Ų | 7.9 | 2% | 0.017 | 4% | 0.036 | C | C | . | . | H | α-helix | trans | -56.1 | -30.4 | 178.1 | 0 | 0 | 0 | 0 | 0 | 112.5 | L337 I339 M345 S388 D433 | L337-A341 WeakPolarHBondContact O-CB 3.46Å; L337-A341 PolarHBondContact O-N 2.87Å; I339-A341 PolarHBondContact O-N 2.79Å; A341-M345 VanDerWaalsContact O-CE 3.32Å; A341-M345 WeakPolarHBondContact O-CE 3.43Å; A341-S388 VanDerWaalsContact C-OG 3.26Å; A341-S388 VanDerWaalsContact O-CB 3.26Å; A341-S388 WeakPolarHBondContact O-CB 3.39Å; A341-S388 PolarHBondContact O-OG 2.84Å; A341-D433 PolarHBondContact N-OD2 2.93Å |
| 342 | T | 81.9 | Confident | 90.3 | Very high | 12 Ų | 12 | 5.5 Ų | 5.5 | 7% | 0.074 | 3% | 0.027 | C | C | . | . | H | α-helix | trans | -90.2 | -34.8 | 177.3 | 52.2 | 0 | 0 | 0 | 0 | 115.3 | M190 I194 P338 I339 G340 | M190-T342 HydrophobicContact CB-CG2 3.83Å; M190-T342 HydrophobicContact CG-CG2 3.53Å; M190-T342 HydrophobicContact SD-CG2 3.9Å; I194-T342 HydrophobicContact CD1-CG2 3.89Å; P338-T342 PolarHBondContact O-N 3.33Å; P338-T342 PolarHBondContact O-OG1 3.45Å; I339-T342 PolarHBondContact O-N 3.24Å; I339-T342 VanDerWaalsContact O-N 3.12Å; I339-T342 PolarHBondContact O-OG1 3.49Å; G340-T342 PolarHBondContact O-N 2.99Å |
| 343 | I | 82.5 | Confident | 90.5 | Very high | 33 Ų | 33 | 5.5 Ų | 5.5 | 17% | 0.169 | 3% | 0.027 | C | C | . | . | H | α-helix | trans | -110.3 | -35.7 | -168.4 | -64.6 | 179.8 | 0 | 0 | 0 | 112.1 | I339 G340 M345 I384 | I339-I343 HydrophobicContact CG2-CD1 3.72Å; I339-I343 HydrophobicContact CG2-CG1 4.38Å; I339-I343 WeakPolarHBondContact O-CB 3.49Å; I339-I343 PolarHBondContact O-N 3.06Å; G340-I343 PolarHBondContact O-N 3.45Å; G340-I343 VanDerWaalsContact O-N 3.16Å; I343-M345 PolarHBondContact O-N 3.4Å; I343-I384 HydrophobicContact CB-CG2 4.5Å; I343-I384 HydrophobicContact CG1-CG2 4.35Å; I343-I384 HydrophobicContact CG2-CB 4.49Å; I343-I384 HydrophobicContact CG2-CG1 4.17Å; I343-I384 HydrophobicContact CG2-CG2 3.98Å |
| 344 | N | 81.9 | Confident | 90.8 | Very high | 0 Ų | 0 | 5.5 Ų | 5.5 | 0% | 0 | 3% | 0.027 | C | C | . | . | trans | -92.2 | 85.4 | -173 | -175.9 | 46.7 | 0 | 0 | 0 | 111.2 | Y92 G340 D346 D433 | Y92-N344 HydrophobicContact CD1-CB 3.27Å; Y92-N344 WeakPolarHBondContact CD1-ND2 3.38Å; Y92-N344 VanDerWaalsContact CD1-OD1 3.31Å; Y92-N344 WeakPolarHBondContact CD1-OD1 3.49Å; Y92-N344 HydrophobicContact CD2-CB 4.07Å; Y92-N344 HydrophobicContact CE1-CB 3.51Å; Y92-N344 VanDerWaalsContact CE1-CG 3.49Å; Y92-N344 WeakPolarHBondContact CE1-ND2 3.33Å; Y92-N344 HydrophobicContact CE2-CB 4.25Å; Y92-N344 HydrophobicContact CG-CB 3.59Å; G340-N344 WeakPolarHBondContact O-CA 3.35Å; G340-N344 WeakPolarHBondContact O-CB 3.4Å; G340-N344 PolarHBondContact O-N 2.81Å; N344-D346 PolarHBondContact OD1-OD1 3.2Å; N344-D346 VanDerWaalsContact OD1-OD1 3.09Å; N344-D433 VanDerWaalsContact CB-OD1 3.3Å; N344-D433 WeakPolarHBondContact CB-OD1 3.36Å; N344-D433 PolarHBondContact ND2-OD1 3.46Å | ||
| 345 | M | 88.3 | Confident | 91.1 | Very high | 6 Ų | 6 | 4.3 Ų | 4.3 | 3% | 0.03 | 2% | 0.023 | C | C | . | . | trans | -115.6 | 56 | 179.2 | -60.6 | -144 | -177.1 | 0 | 0 | 113 | A341 I343 G347 T348 A349 A386 | A341-M345 VanDerWaalsContact O-CE 3.32Å; A341-M345 WeakPolarHBondContact O-CE 3.43Å; I343-M345 PolarHBondContact O-N 3.4Å; M345-G347 VanDerWaalsContact C-N 3.29Å; M345-G347 PolarHBondContact O-N 3.06Å; M345-T348 CarbonylContact O-C 3.36Å; M345-T348 WeakPolarHBondContact O-CA 3.22Å; M345-T348 WeakPolarHBondContact O-CB 3.21Å; M345-T348 PolarHBondContact O-N 3.16Å; M345-A349 PolarHBondContact O-N 3.47Å; M345-A386 HydrophobicContact CE-CB 4.26Å; M345-A386 WeakPolarHBondContact CE-O 3.47Å; M345-A386 HydrophobicContact SD-CB 3.57Å; M345-A386 VanDerWaalsContact SD-CB 3.57Å | ||
| 346 | D | 94.8 | Very high | 91.5 | Very high | 0 Ų | 0 | 3.7 Ų | 3.7 | 0% | 0 | 2% | 0.02 | C | C | . | . | H | α-helix | trans | -43.3 | -51 | 176.8 | -72.7 | -4.2 | 0 | 0 | 0 | 113.8 | T95 T96 A99 H275 N344 T348 A349 L350 N429 | T95-D346 WeakPolarHBondContact CB-OD2 3.28Å; T95-D346 PolarHBondContact OG1-OD1 3.39Å; T95-D346 PolarHBondContact OG1-OD2 3Å; T96-D346 WeakPolarHBondContact CA-OD1 3.36Å; T96-D346 WeakPolarHBondContact CB-OD1 3.47Å; T96-D346 PolarHBondContact N-OD1 3.34Å; T96-D346 PolarHBondContact OG1-OD1 2.93Å; A99-D346 HydrophobicContact CB-CB 3.88Å; A99-D346 WeakPolarHBondContact CB-O 3.15Å; H275-D346 IonicContact CD2-OD2 3.77Å; H275-D346 IonicContact CE1-OD2 2.81Å; H275-D346 IonicContact NE2-OD2 3.27Å; H275-D346 PolarHBondContact NE2-OD2 3.21Å; N344-D346 PolarHBondContact OD1-OD1 3.2Å; N344-D346 VanDerWaalsContact OD1-OD1 3.09Å; D346-T348 VanDerWaalsContact C-N 3.3Å; D346-T348 PolarHBondContact O-N 2.83Å; D346-A349 PolarHBondContact O-N 2.78Å; D346-L350 WeakPolarHBondContact O-CB 3.22Å; D346-L350 PolarHBondContact O-N 3.47Å; D346-N429 PolarHBondContact N-OD1 2.79Å |
| 347 | G | 94.7 | Very high | 91.7 | Very high | 0 Ų | 0 | 3.9 Ų | 3.9 | 0% | 0 | 2% | 0.021 | C | C | . | . | H | α-helix | trans | -66.2 | -32.6 | -179.9 | 0 | 0 | 0 | 0 | 0 | 112.7 | L272 M345 Y351 R425 N429 | L272-G347 VanDerWaalsContact CD2-CA 3.42Å; M345-G347 VanDerWaalsContact C-N 3.29Å; M345-G347 PolarHBondContact O-N 3.06Å; G347-Y351 WeakPolarHBondContact O-CB 3.3Å; G347-Y351 PolarHBondContact O-N 3.32Å; G347-Y351 VanDerWaalsContact O-N 3.14Å; G347-R425 VanDerWaalsContact O-CD 3.29Å; G347-R425 WeakPolarHBondContact O-CD 3.46Å; G347-R425 WeakPolarHBondContact O-CG 3.17Å; G347-N429 WeakPolarHBondContact CA-OD1 3.29Å; G347-N429 PolarHBondContact N-OD1 2.99Å |
| 348 | T | 93.4 | Very high | 91.8 | Very high | 4 Ų | 4 | 3.9 Ų | 3.9 | 3% | 0.025 | 2% | 0.021 | C | C | . | . | H | α-helix | trans | -70.9 | -46.6 | 174.6 | -56.7 | 0 | 0 | 0 | 0 | 110.8 | M345 D346 L350 Y351 E352 A386 R425 | M345-T348 CarbonylContact O-C 3.36Å; M345-T348 WeakPolarHBondContact O-CA 3.22Å; M345-T348 WeakPolarHBondContact O-CB 3.21Å; M345-T348 PolarHBondContact O-N 3.16Å; D346-T348 VanDerWaalsContact C-N 3.3Å; D346-T348 PolarHBondContact O-N 2.83Å; T348-L350 PolarHBondContact O-N 3.25Å; T348-Y351 PolarHBondContact O-N 3.25Å; T348-E352 HydrophobicContact CG2-CG 4.39Å; T348-E352 VanDerWaalsContact CG2-OE1 3.22Å; T348-E352 WeakPolarHBondContact CG2-OE1 3.39Å; T348-E352 WeakPolarHBondContact O-CB 3.4Å; T348-E352 WeakPolarHBondContact O-CG 3.31Å; T348-E352 PolarHBondContact O-N 2.77Å; T348-A386 HydrophobicContact CG2-CB 4.16Å; T348-R425 PolarHBondContact OG1-NH1 2.94Å |
| 349 | A | 94.6 | Very high | 91.9 | Very high | 0 Ų | 0 | 3.9 Ų | 3.9 | 0% | 0 | 2% | 0.021 | C | C | . | . | H | α-helix | trans | -62.3 | -44.3 | 178.4 | 0 | 0 | 0 | 0 | 0 | 112.2 | T96 V100 M345 D346 Y351 E352 A353 | T96-A349 HydrophobicContact CG2-CB 3.49Å; T96-A349 VanDerWaalsContact CG2-CB 3.49Å; V100-A349 HydrophobicContact CG2-CB 3.43Å; V100-A349 VanDerWaalsContact CG2-CB 3.43Å; M345-A349 PolarHBondContact O-N 3.47Å; D346-A349 PolarHBondContact O-N 2.78Å; A349-Y351 VanDerWaalsContact C-N 3.33Å; A349-Y351 PolarHBondContact O-N 2.6Å; A349-E352 PolarHBondContact O-N 3.29Å; A349-A353 WeakPolarHBondContact O-CB 3.49Å; A349-A353 PolarHBondContact O-N 2.89Å |
| 350 | L | 96.9 | Very high | 92.2 | Very high | 0 Ų | 0 | 3 Ų | 3 | 0% | 0 | 2% | 0.017 | C | C | . | . | H | α-helix | trans | -57.3 | -49.3 | 174.6 | -177.7 | 157.8 | 0 | 0 | 0 | 110.6 | A99 V102 L272 H275 D346 T348 A353 V354 | A99-L350 HydrophobicContact CB-CB 4.24Å; A99-L350 WeakPolarHBondContact O-CD1 3.29Å; A99-L350 WeakPolarHBondContact O-CG 3.36Å; V102-L350 HydrophobicContact CG1-CD1 4.37Å; L272-L350 HydrophobicContact CD2-CD1 4.43Å; L272-L350 HydrophobicContact CD2-CD2 4.26Å; L272-L350 HydrophobicContact CG-CD2 4.31Å; H275-L350 HydrophobicContact CB-CD1 4.35Å; D346-L350 WeakPolarHBondContact O-CB 3.22Å; D346-L350 PolarHBondContact O-N 3.47Å; T348-L350 PolarHBondContact O-N 3.25Å; L350-A353 PolarHBondContact O-N 2.9Å; L350-V354 HydrophobicContact CD2-CG2 4.09Å; L350-V354 VanDerWaalsContact O-CG2 3.27Å; L350-V354 WeakPolarHBondContact O-CG2 3.2Å; L350-V354 PolarHBondContact O-N 3.48Å |
| 351 | Y | 95.6 | Very high | 92.3 | Very high | 0 Ų | 0 | 4.4 Ų | 4.4 | 0% | 0 | 2% | 0.023 | C | C | . | . | H | α-helix | trans | -63.8 | -42.9 | 179.7 | 159.4 | -97.1 | 0 | 0 | 0 | 113.1 | Y264 V268 G347 T348 A349 A353 V354 A355 L394 I397 I414 D418 L421 | Y264-Y351 WeakPolarHBondContact OH-CD2 3.15Å; Y264-Y351 WeakPolarHBondContact OH-CE2 3.38Å; V268-Y351 HydrophobicContact CG1-CD2 3.99Å; V268-Y351 HydrophobicContact CG2-CD2 4.18Å; G347-Y351 WeakPolarHBondContact O-CB 3.3Å; G347-Y351 PolarHBondContact O-N 3.32Å; G347-Y351 VanDerWaalsContact O-N 3.14Å; T348-Y351 PolarHBondContact O-N 3.25Å; A349-Y351 VanDerWaalsContact C-N 3.33Å; A349-Y351 PolarHBondContact O-N 2.6Å; Y351-A353 VanDerWaalsContact C-N 3.34Å; Y351-A353 PolarHBondContact O-N 3.17Å; Y351-V354 PolarHBondContact O-N 3.23Å; Y351-A355 WeakPolarHBondContact O-CB 3.39Å; Y351-A355 PolarHBondContact O-N 3.46Å; Y351-L394 WeakPolarHBondContact OH-CD2 3.38Å; Y351-I397 HydrophobicContact CD1-CD1 4.06Å; Y351-I397 HydrophobicContact CD1-CG1 4.49Å; Y351-I397 HydrophobicContact CE1-CD1 3.19Å; Y351-I397 HydrophobicContact CE1-CG1 3.98Å; Y351-I414 HydrophobicContact CE2-CG2 4.09Å; Y351-I414 WeakPolarHBondContact OH-CG2 3.22Å; Y351-D418 PolarHBondContact OH-OD1 3.28Å; Y351-L421 HydrophobicContact CD2-CD1 4.32Å; Y351-L421 HydrophobicContact CE2-CB 4.43Å; Y351-L421 HydrophobicContact CE2-CD1 4.02Å |
| 352 | E | 94.1 | Very high | 92.4 | Very high | 0 Ų | 0 | 4.4 Ų | 4.4 | 0% | 0 | 2% | 0.023 | C | C | . | . | H | α-helix | trans | -58.9 | -46.9 | 176 | -79.3 | 169.6 | -169 | 0 | 0 | 111.2 | T348 A349 V354 A355 S356 A379 A382 T396 I397 V400 | T348-E352 HydrophobicContact CG2-CG 4.39Å; T348-E352 VanDerWaalsContact CG2-OE1 3.22Å; T348-E352 WeakPolarHBondContact CG2-OE1 3.39Å; T348-E352 WeakPolarHBondContact O-CB 3.4Å; T348-E352 WeakPolarHBondContact O-CG 3.31Å; T348-E352 PolarHBondContact O-N 2.77Å; A349-E352 PolarHBondContact O-N 3.29Å; E352-V354 PolarHBondContact O-N 3.07Å; E352-A355 PolarHBondContact O-N 2.69Å; E352-S356 WeakPolarHBondContact O-CB 3.34Å; E352-S356 PolarHBondContact O-N 3.28Å; E352-S356 PolarHBondContact O-OG 2.83Å; E352-S356 VanDerWaalsContact O-OG 3.09Å; E352-A379 HydrophobicContact CB-CB 3.92Å; E352-A379 WeakPolarHBondContact OE2-CA 3.35Å; E352-A379 VanDerWaalsContact OE2-O 3.12Å; E352-A382 WeakPolarHBondContact OE2-CB 3.07Å; E352-T396 WeakPolarHBondContact OE1-CB 3.37Å; E352-T396 PolarHBondContact OE1-OG1 2.69Å; E352-I397 HydrophobicContact CB-CG1 4.38Å; E352-I397 HydrophobicContact CG-CG1 3.76Å; E352-V400 HydrophobicContact CB-CG2 4.33Å |
| 353 | A | 96.2 | Very high | 92.7 | Very high | 0 Ų | 0 | 5.6 Ų | 5.6 | 0% | 0 | 3% | 0.029 | C | C | . | . | H | α-helix | trans | -61.8 | -43.7 | 177.8 | 0 | 0 | 0 | 0 | 0 | 112 | V100 I104 A349 L350 Y351 I357 V375 A379 | V100-A353 HydrophobicContact CG1-CB 3.99Å; I104-A353 HydrophobicContact CD1-CB 4.4Å; I104-A353 HydrophobicContact CG1-CB 3.9Å; A349-A353 WeakPolarHBondContact O-CB 3.49Å; A349-A353 PolarHBondContact O-N 2.89Å; L350-A353 PolarHBondContact O-N 2.9Å; Y351-A353 VanDerWaalsContact C-N 3.34Å; Y351-A353 PolarHBondContact O-N 3.17Å; A353-I357 WeakPolarHBondContact O-CG1 3.45Å; A353-I357 PolarHBondContact O-N 3.48Å; A353-V375 HydrophobicContact CB-CG1 4.12Å; A353-A379 HydrophobicContact CB-CB 4.23Å |
| 354 | V | 97.2 | Very high | 92.9 | Very high | 0 Ų | 0 | 6.8 Ų | 6.8 | 0% | 0 | 5% | 0.049 | C | C | . | . | H | α-helix | trans | -65.1 | -44.9 | 176.3 | 175 | 0 | 0 | 0 | 0 | 111.1 | G103 V107 Y264 T267 V268 L350 Y351 E352 I357 F358 | G103-V354 WeakPolarHBondContact O-CG2 3.39Å; V107-V354 HydrophobicContact CB-CB 4.44Å; V107-V354 HydrophobicContact CB-CG1 4.1Å; V107-V354 HydrophobicContact CB-CG2 4.25Å; V107-V354 HydrophobicContact CG2-CG1 4.03Å; Y264-V354 HydrophobicContact CD2-CG1 4.17Å; Y264-V354 HydrophobicContact CE2-CG1 3.97Å; T267-V354 HydrophobicContact CG2-CG1 3.76Å; T267-V354 HydrophobicContact CG2-CG2 4.49Å; V268-V354 HydrophobicContact CG2-CB 4.08Å; V268-V354 HydrophobicContact CG2-CG1 3.57Å; L350-V354 HydrophobicContact CD2-CG2 4.09Å; L350-V354 VanDerWaalsContact O-CG2 3.27Å; L350-V354 WeakPolarHBondContact O-CG2 3.2Å; L350-V354 PolarHBondContact O-N 3.48Å; Y351-V354 PolarHBondContact O-N 3.23Å; E352-V354 PolarHBondContact O-N 3.07Å; V354-I357 PolarHBondContact O-N 3.36Å; V354-F358 WeakPolarHBondContact O-CB 3.16Å; V354-F358 PolarHBondContact O-N 3.44Å |
| 355 | A | 94.9 | Very high | 93.3 | Very high | 0 Ų | 0 | 9.8 Ų | 9.8 | 0% | 0 | 7% | 0.065 | C | C | . | . | H | α-helix | trans | -60.7 | -46.3 | 179.2 | 0 | 0 | 0 | 0 | 0 | 112.1 | Y264 Y351 E352 F358 I359 I397 I414 | Y264-A355 HydrophobicContact CE2-CB 4.33Å; Y351-A355 WeakPolarHBondContact O-CB 3.39Å; Y351-A355 PolarHBondContact O-N 3.46Å; E352-A355 PolarHBondContact O-N 2.69Å; A355-F358 WeakPolarHBondContact O-CB 3.5Å; A355-F358 PolarHBondContact O-N 3.35Å; A355-I359 WeakPolarHBondContact O-CG1 3.41Å; A355-I359 PolarHBondContact O-N 3.25Å; A355-I397 HydrophobicContact CB-CD1 3.68Å; A355-I397 HydrophobicContact CB-CG1 4.11Å; A355-I397 HydrophobicContact CB-CG2 4.5Å; A355-I414 HydrophobicContact CB-CD1 3.74Å |
| 356 | S | 94.4 | Very high | 93.4 | Very high | 0 Ų | 0 | 14.8 Ų | 14.8 | 0% | 0 | 10% | 0.1 | C | C | . | . | H | α-helix | trans | -66.3 | -43.1 | -179.7 | -62.4 | 0 | 0 | 0 | 0 | 112.3 | E352 F358 I359 A360 V400 L406 | E352-S356 WeakPolarHBondContact O-CB 3.34Å; E352-S356 PolarHBondContact O-N 3.28Å; E352-S356 PolarHBondContact O-OG 2.83Å; E352-S356 VanDerWaalsContact O-OG 3.09Å; S356-F358 VanDerWaalsContact C-N 3.35Å; S356-I359 PolarHBondContact O-N 2.87Å; S356-A360 PolarHBondContact O-N 3.45Å; S356-V400 WeakPolarHBondContact OG-CB 3.08Å; S356-V400 WeakPolarHBondContact OG-CG1 3.5Å; S356-L406 WeakPolarHBondContact O-CD1 3.41Å |
| 357 | I | 95.8 | Very high | 93.2 | Very high | 4 Ų | 4 | 16.4 Ų | 16.4 | 2% | 0.021 | 11% | 0.109 | C | C | . | . | H | α-helix | trans | -68.9 | -37.4 | 176.7 | -63.4 | 170.4 | 0 | 0 | 0 | 110.6 | I104 V107 L108 A353 V354 A360 Q361 L367 V372 V375 | I104-I357 HydrophobicContact CB-CD1 4.41Å; I104-I357 HydrophobicContact CG1-CD1 3.96Å; I104-I357 HydrophobicContact CG2-CD1 4.21Å; V107-I357 HydrophobicContact CB-CG2 4.48Å; V107-I357 HydrophobicContact CG1-CB 3.79Å; V107-I357 HydrophobicContact CG1-CD1 3.57Å; V107-I357 HydrophobicContact CG1-CG1 4.25Å; V107-I357 HydrophobicContact CG1-CG2 3.77Å; V107-I357 HydrophobicContact CG2-CB 4.04Å; V107-I357 HydrophobicContact CG2-CG2 3.88Å; L108-I357 HydrophobicContact CD2-CG2 4.15Å; A353-I357 WeakPolarHBondContact O-CG1 3.45Å; A353-I357 PolarHBondContact O-N 3.48Å; V354-I357 PolarHBondContact O-N 3.36Å; I357-A360 WeakPolarHBondContact O-CB 3.48Å; I357-A360 PolarHBondContact O-N 2.93Å; I357-Q361 HydrophobicContact CG2-CG 4.43Å; I357-Q361 VanDerWaalsContact O-CG 3.27Å; I357-Q361 WeakPolarHBondContact O-CG 3.23Å; I357-Q361 PolarHBondContact O-N 3.42Å; I357-L367 HydrophobicContact CG1-CD1 3.98Å; I357-V372 HydrophobicContact CD1-CG1 4.49Å; I357-V375 HydrophobicContact CG1-CG1 4.37Å |
| 358 | F | 95.1 | Very high | 93.2 | Very high | 1 Ų | 1 | 19.1 Ų | 19.1 | 0% | 0.004 | 13% | 0.128 | C | C | . | . | H | α-helix | trans | -59.7 | -45.2 | 173.2 | 168.9 | -108.2 | 0 | 0 | 0 | 112 | P112 L261 Y264 V354 A355 S356 A360 Q361 L362 I414 | P112-F358 HydrophobicContact CB-CD2 4.21Å; P112-F358 HydrophobicContact CG-CD2 4.06Å; L261-F358 HydrophobicContact CD2-CE1 4.09Å; L261-F358 HydrophobicContact CD2-CZ 3.61Å; Y264-F358 HydrophobicContact CD2-CB 3.86Å; Y264-F358 AromaticContact CD2-CD1 3.69Å; Y264-F358 HydrophobicContact CD2-CD1 3.69Å; Y264-F358 HydrophobicContact CD2-CD2 4.03Å; Y264-F358 HydrophobicContact CD2-CE1 4.22Å; Y264-F358 AromaticContact CD2-CG 3.57Å; Y264-F358 HydrophobicContact CD2-CG 3.57Å; Y264-F358 HydrophobicContact CE2-CB 4.19Å; Y264-F358 HydrophobicContact CE2-CD1 4.05Å; Y264-F358 HydrophobicContact CE2-CG 4.18Å; Y264-F358 HydrophobicContact CG-CD1 4.04Å; Y264-F358 HydrophobicContact CG-CD2 4.29Å; Y264-F358 HydrophobicContact CG-CE1 4.09Å; Y264-F358 HydrophobicContact CG-CE2 4.34Å; Y264-F358 HydrophobicContact CG-CG 4.14Å; Y264-F358 HydrophobicContact CG-CZ 4.24Å; V354-F358 WeakPolarHBondContact O-CB 3.16Å; V354-F358 PolarHBondContact O-N 3.44Å; A355-F358 WeakPolarHBondContact O-CB 3.5Å; A355-F358 PolarHBondContact O-N 3.35Å; S356-F358 VanDerWaalsContact C-N 3.35Å; F358-A360 VanDerWaalsContact C-N 3.34Å; F358-A360 PolarHBondContact O-N 3.49Å; F358-Q361 WeakPolarHBondContact O-CB 3.44Å; F358-Q361 PolarHBondContact O-N 3.48Å; F358-L362 HydrophobicContact CD1-CD1 4.02Å; F358-L362 HydrophobicContact CD1-CG 4.44Å; F358-L362 HydrophobicContact CD2-CG 4.36Å; F358-L362 HydrophobicContact CE1-CD1 3.38Å; F358-L362 HydrophobicContact CE1-CG 4.02Å; F358-L362 HydrophobicContact CE2-CD1 4.18Å; F358-L362 HydrophobicContact CE2-CD2 3.99Å; F358-L362 HydrophobicContact CE2-CG 3.93Å; F358-L362 HydrophobicContact CZ-CD1 3.48Å; F358-L362 VanDerWaalsContact CZ-CD1 3.48Å; F358-L362 HydrophobicContact CZ-CD2 3.87Å; F358-L362 HydrophobicContact CZ-CG 3.74Å; F358-L362 WeakPolarHBondContact O-CG 3.49Å; F358-L362 PolarHBondContact O-N 3.4Å; F358-I414 HydrophobicContact CD1-CD1 4.3Å; F358-I414 HydrophobicContact CD1-CG1 4.48Å; F358-I414 HydrophobicContact CE1-CG1 4.41Å |
| 359 | I | 91.6 | Very high | 93.2 | Very high | 0 Ų | 0 | 27 Ų | 27 | 0% | 0 | 16% | 0.162 | C | C | . | . | H | α-helix | trans | -63.6 | -39 | 175.9 | -74 | 170.7 | 0 | 0 | 0 | 111.6 | A355 S356 Q361 L362 N363 L401 P407 I411 I414 | A355-I359 WeakPolarHBondContact O-CG1 3.41Å; A355-I359 PolarHBondContact O-N 3.25Å; S356-I359 PolarHBondContact O-N 2.87Å; I359-Q361 VanDerWaalsContact C-N 3.35Å; I359-L362 PolarHBondContact O-N 2.9Å; I359-N363 PolarHBondContact O-N 2.94Å; I359-N363 VanDerWaalsContact O-N 3.16Å; I359-N363 PolarHBondContact O-ND2 3.35Å; I359-L401 HydrophobicContact CB-CD2 4.07Å; I359-L401 HydrophobicContact CD1-CD1 3.66Å; I359-L401 HydrophobicContact CD1-CD2 4.06Å; I359-L401 HydrophobicContact CD1-CG 4.46Å; I359-L401 HydrophobicContact CG2-CD2 3.95Å; I359-P407 WeakPolarHBondContact CG2-O 3.43Å; I359-I411 HydrophobicContact CD1-CG1 3.99Å; I359-I414 HydrophobicContact CD1-CD1 3.68Å; I359-I414 HydrophobicContact CG1-CD1 4.03Å |
| 360 | A | 93.4 | Very high | 93.1 | Very high | 1 Ų | 1 | 31.1 Ų | 31.1 | 1% | 0.008 | 19% | 0.189 | C | C | . | . | H | α-helix | trans | -59.9 | -46.7 | 173.5 | 0 | 0 | 0 | 0 | 0 | 111.4 | S356 I357 F358 N363 G364 I365 L367 L406 | S356-A360 PolarHBondContact O-N 3.45Å; I357-A360 WeakPolarHBondContact O-CB 3.48Å; I357-A360 PolarHBondContact O-N 2.93Å; F358-A360 VanDerWaalsContact C-N 3.34Å; F358-A360 PolarHBondContact O-N 3.49Å; A360-N363 CarbonylContact O-C 3.57Å; A360-N363 PolarHBondContact O-N 3.14Å; A360-N363 VanDerWaalsContact O-N 3.16Å; A360-G364 PolarHBondContact O-N 2.97Å; A360-I365 CarbonylContact C-O 3.59Å; A360-I365 HydrophobicContact CB-CB 4.37Å; A360-I365 PolarHBondContact O-N 3.44Å; A360-L367 HydrophobicContact CB-CD1 3.8Å; A360-L367 HydrophobicContact CB-CD2 4.2Å; A360-L367 HydrophobicContact CB-CG 3.82Å; A360-L406 HydrophobicContact CB-CD1 3.87Å; A360-L406 HydrophobicContact CB-CD2 3.7Å; A360-L406 HydrophobicContact CB-CG 4.46Å |
| 361 | Q | 93.5 | Very high | 92.9 | Very high | 29 Ų | 29 | 34.1 Ų | 34.1 | 14% | 0.136 | 20% | 0.203 | C | C | . | . | H | α-helix | trans | -61.7 | -43.6 | 177.3 | -71.4 | 170.7 | -5.6 | 0 | 0 | 112.2 | V107 G113 I357 F358 I359 N363 G364 | V107-Q361 PolarHBondContact O-NE2 3.1Å; G113-Q361 WeakPolarHBondContact O-CB 3.25Å; I357-Q361 HydrophobicContact CG2-CG 4.43Å; I357-Q361 VanDerWaalsContact O-CG 3.27Å; I357-Q361 WeakPolarHBondContact O-CG 3.23Å; I357-Q361 PolarHBondContact O-N 3.42Å; F358-Q361 WeakPolarHBondContact O-CB 3.44Å; F358-Q361 PolarHBondContact O-N 3.48Å; I359-Q361 VanDerWaalsContact C-N 3.35Å; Q361-N363 PolarHBondContact O-N 3.32Å; Q361-G364 PolarHBondContact O-N 2.92Å |
| 362 | L | 89.7 | Confident | 92.9 | Very high | 3 Ų | 3 | 35 Ų | 35 | 2% | 0.016 | 21% | 0.208 | C | C | . | . | H | α-helix | trans | -57 | -33.2 | 174.4 | -77.1 | -178.5 | 0 | 0 | 0 | 113 | D114 P115 I117 F358 I359 G364 D410 L413 | D114-L362 WeakPolarHBondContact O-CD2 3.37Å; P115-L362 WeakPolarHBondContact CA-O 3.35Å; I117-L362 HydrophobicContact CB-CD2 3.78Å; I117-L362 HydrophobicContact CD1-CD2 3.78Å; I117-L362 HydrophobicContact CG1-CD2 4.31Å; I117-L362 HydrophobicContact CG2-CD2 4.13Å; F358-L362 HydrophobicContact CD1-CD1 4.02Å; F358-L362 HydrophobicContact CD1-CG 4.44Å; F358-L362 HydrophobicContact CD2-CG 4.36Å; F358-L362 HydrophobicContact CE1-CD1 3.38Å; F358-L362 HydrophobicContact CE1-CG 4.02Å; F358-L362 HydrophobicContact CE2-CD1 4.18Å; F358-L362 HydrophobicContact CE2-CD2 3.99Å; F358-L362 HydrophobicContact CE2-CG 3.93Å; F358-L362 HydrophobicContact CZ-CD1 3.48Å; F358-L362 VanDerWaalsContact CZ-CD1 3.48Å; F358-L362 HydrophobicContact CZ-CD2 3.87Å; F358-L362 HydrophobicContact CZ-CG 3.74Å; F358-L362 WeakPolarHBondContact O-CG 3.49Å; F358-L362 PolarHBondContact O-N 3.4Å; I359-L362 PolarHBondContact O-N 2.9Å; L362-G364 VanDerWaalsContact C-N 3.34Å; L362-D410 HydrophobicContact CD1-CB 4.48Å; L362-L413 HydrophobicContact CD1-CD1 3.95Å |
| 363 | N | 88.1 | Confident | 93 | Very high | 36 Ų | 36 | 39.2 Ų | 39.2 | 19% | 0.193 | 23% | 0.23 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -91.6 | 5.5 | 179.3 | -75.5 | -82 | 0 | 0 | 0 | 113.3 | R118 I359 A360 Q361 I365 P407 D410 | R118-N363 PolarHBondContact NH1-OD1 3.24Å; I359-N363 PolarHBondContact O-N 2.94Å; I359-N363 VanDerWaalsContact O-N 3.16Å; I359-N363 PolarHBondContact O-ND2 3.35Å; A360-N363 CarbonylContact O-C 3.57Å; A360-N363 PolarHBondContact O-N 3.14Å; A360-N363 VanDerWaalsContact O-N 3.16Å; Q361-N363 PolarHBondContact O-N 3.32Å; N363-I365 HydrophobicContact CB-CD1 3.77Å; N363-I365 HydrophobicContact CB-CG1 3.87Å; N363-I365 PolarHBondContact O-N 3.19Å; N363-P407 HydrophobicContact CB-CG 4.33Å; N363-D410 PolarHBondContact ND2-OD2 3Å |
| 364 | G | 87.9 | Confident | 92.8 | Very high | 59 Ų | 59 | 42.2 Ų | 42.2 | 61% | 0.608 | 25% | 0.246 | S | C | * | . | T | Hydrogen-bonded Turn | trans | 64.3 | 19.1 | -175.4 | 0 | 0 | 0 | 0 | 0 | 113.4 | A360 Q361 L362 | A360-G364 PolarHBondContact O-N 2.97Å; Q361-G364 PolarHBondContact O-N 2.92Å; L362-G364 VanDerWaalsContact C-N 3.34Å |
| 365 | I | 90 | Very high | 92.7 | Very high | 63 Ų | 63 | 42.2 Ų | 42.2 | 32% | 0.323 | 25% | 0.246 | S | C | . | . | trans | -86.9 | 114.5 | 179.3 | -58.5 | 171.8 | 0 | 0 | 0 | 107.7 | A360 N363 L367 L406 P407 | A360-I365 CarbonylContact C-O 3.59Å; A360-I365 HydrophobicContact CB-CB 4.37Å; A360-I365 PolarHBondContact O-N 3.44Å; N363-I365 HydrophobicContact CB-CD1 3.77Å; N363-I365 HydrophobicContact CB-CG1 3.87Å; N363-I365 PolarHBondContact O-N 3.19Å; I365-L367 HydrophobicContact CG2-CD2 4.45Å; I365-L406 HydrophobicContact CB-CD2 4.3Å; I365-L406 HydrophobicContact CD1-CD2 3.8Å; I365-L406 HydrophobicContact CG2-CD2 3.98Å; I365-P407 HydrophobicContact CD1-CG 4.46Å | ||
| 366 | S | 89.7 | Confident | 92.6 | Very high | 111 Ų | 111 | 43.2 Ų | 43.2 | 78% | 0.776 | 25% | 0.253 | S | S | * | . | P | Polyproline II helix | trans | -80.1 | 124.3 | 170.6 | 54 | 0 | 0 | 0 | 0 | 109.8 | ||
| 367 | L | 90.9 | Very high | 92.5 | Very high | 34 Ų | 34 | 47.3 Ų | 47.3 | 18% | 0.178 | 27% | 0.274 | C | S | . | . | P | Polyproline II helix | trans | -87.1 | 125.3 | 175.6 | -65.1 | 177.1 | 0 | 0 | 0 | 109.8 | I357 A360 I365 Q371 V372 V375 V404 L406 | I357-L367 HydrophobicContact CG1-CD1 3.98Å; A360-L367 HydrophobicContact CB-CD1 3.8Å; A360-L367 HydrophobicContact CB-CD2 4.2Å; A360-L367 HydrophobicContact CB-CG 3.82Å; I365-L367 HydrophobicContact CG2-CD2 4.45Å; L367-Q371 HydrophobicContact CB-CB 4.29Å; L367-Q371 HydrophobicContact CD2-CB 4.1Å; L367-V372 HydrophobicContact CB-CG2 3.88Å; L367-V375 HydrophobicContact CD1-CG2 4.42Å; L367-V404 HydrophobicContact CD2-CG1 3.96Å; L367-L406 HydrophobicContact CD1-CD1 4.47Å; L367-L406 HydrophobicContact CD2-CD1 4.34Å; L367-L406 HydrophobicContact CD2-CD2 4.16Å |
| 368 | S | 93.7 | Very high | 92.2 | Very high | 57 Ų | 57 | 47.7 Ų | 47.7 | 40% | 0.399 | 28% | 0.276 | S | S | . | . | P | Polyproline II helix | trans | -67.1 | 159.7 | 169.7 | 64.3 | 0 | 0 | 0 | 0 | 111.2 | Q371 V372 | S368-Q371 WeakPolarHBondContact O-CB 3.16Å; S368-Q371 PolarHBondContact O-N 3.25Å; S368-Q371 WeakPolarHBondContact OG-CG 3.11Å; S368-Q371 PolarHBondContact OG-OE1 3.36Å; S368-V372 PolarHBondContact O-N 2.96Å |
| 369 | F | 93.3 | Very high | 92 | Very high | 169 Ų | 169 | 47.6 Ų | 47.6 | 74% | 0.741 | 28% | 0.276 | S | S | * | . | H | α-helix | trans | -53.7 | -44.4 | 178.2 | 175.7 | -97.4 | 0 | 0 | 0 | 113.6 | Q371 V372 L373 | F369-Q371 VanDerWaalsContact C-N 3.29Å; F369-Q371 PolarHBondContact O-N 3.34Å; F369-V372 PolarHBondContact O-N 2.88Å; F369-L373 PolarHBondContact O-N 3.48Å |
| 370 | P | 93.2 | Very high | 91.9 | Very high | 87 Ų | 87 | 48.9 Ų | 48.9 | 57% | 0.565 | 28% | 0.284 | S | S | * | . | H | α-helix | trans | -60.3 | -35.3 | 174.3 | -25.3 | 35.9 | 0 | 0 | 0 | 113.8 | L373 L374 | P370-L373 PolarHBondContact O-N 3.2Å; P370-L374 WeakPolarHBondContact O-CB 3.49Å; P370-L374 PolarHBondContact O-N 2.88Å |
| 371 | Q | 93.2 | Very high | 91.5 | Very high | 62 Ų | 62 | 53.1 Ų | 53.1 | 29% | 0.29 | 31% | 0.306 | S | S | . | . | H | α-helix | trans | -70.7 | -37.7 | 176.9 | -72.5 | 168.9 | -52.8 | 0 | 0 | 112 | L367 S368 F369 L373 L374 V375 V404 | L367-Q371 HydrophobicContact CB-CB 4.29Å; L367-Q371 HydrophobicContact CD2-CB 4.1Å; S368-Q371 WeakPolarHBondContact O-CB 3.16Å; S368-Q371 PolarHBondContact O-N 3.25Å; S368-Q371 WeakPolarHBondContact OG-CG 3.11Å; S368-Q371 PolarHBondContact OG-OE1 3.36Å; F369-Q371 VanDerWaalsContact C-N 3.29Å; F369-Q371 PolarHBondContact O-N 3.34Å; Q371-L373 VanDerWaalsContact C-N 3.33Å; Q371-L374 WeakPolarHBondContact O-CB 3.49Å; Q371-L374 PolarHBondContact O-N 2.88Å; Q371-V375 WeakPolarHBondContact O-CG2 3.42Å; Q371-V375 PolarHBondContact O-N 3.41Å; Q371-V404 HydrophobicContact CB-CG1 3.84Å; Q371-V404 HydrophobicContact CG-CG1 4.06Å |
| 372 | V | 96.2 | Very high | 91 | Very high | 18 Ų | 18 | 52 Ų | 52 | 11% | 0.109 | 30% | 0.301 | C | S | . | . | H | α-helix | trans | -63.9 | -40.7 | 173.4 | 175.5 | 0 | 0 | 0 | 0 | 110.9 | I104 L108 I357 L367 S368 F369 L374 V375 S376 | I104-V372 HydrophobicContact CD1-CG1 4.24Å; I104-V372 HydrophobicContact CG2-CG1 3.55Å; L108-V372 HydrophobicContact CD1-CG1 4.42Å; I357-V372 HydrophobicContact CD1-CG1 4.49Å; L367-V372 HydrophobicContact CB-CG2 3.88Å; S368-V372 PolarHBondContact O-N 2.96Å; F369-V372 PolarHBondContact O-N 2.88Å; V372-L374 VanDerWaalsContact C-N 3.3Å; V372-L374 PolarHBondContact O-N 3.48Å; V372-V375 WeakPolarHBondContact O-CB 3.12Å; V372-V375 PolarHBondContact O-N 3.19Å; V372-S376 PolarHBondContact O-N 3.15Å |
| 373 | L | 94.4 | Very high | 90.8 | Very high | 89 Ų | 89 | 51.9 Ų | 51.9 | 47% | 0.466 | 30% | 0.301 | S | S | . | . | H | α-helix | trans | -62.7 | -40 | 173.3 | -177.3 | 63 | 0 | 0 | 0 | 111.4 | F369 P370 Q371 S376 I377 | F369-L373 PolarHBondContact O-N 3.48Å; P370-L373 PolarHBondContact O-N 3.2Å; Q371-L373 VanDerWaalsContact C-N 3.33Å; L373-S376 WeakPolarHBondContact O-CB 3.3Å; L373-S376 PolarHBondContact O-N 3.45Å; L373-I377 HydrophobicContact CD1-CD1 4.32Å; L373-I377 HydrophobicContact CG-CD1 4.04Å; L373-I377 WeakPolarHBondContact O-CG1 3.49Å; L373-I377 PolarHBondContact O-N 3.48Å |
| 374 | L | 92.8 | Very high | 90.5 | Very high | 64 Ų | 64 | 52.3 Ų | 52.3 | 34% | 0.335 | 30% | 0.303 | S | S | . | . | H | α-helix | trans | -61.9 | -46.2 | 175.3 | -172.3 | 60.6 | 0 | 0 | 0 | 111.4 | P370 Q371 V372 S376 I377 T378 T403 V404 | P370-L374 WeakPolarHBondContact O-CB 3.49Å; P370-L374 PolarHBondContact O-N 2.88Å; Q371-L374 WeakPolarHBondContact O-CB 3.49Å; Q371-L374 PolarHBondContact O-N 2.88Å; V372-L374 VanDerWaalsContact C-N 3.3Å; V372-L374 PolarHBondContact O-N 3.48Å; L374-S376 VanDerWaalsContact C-N 3.27Å; L374-S376 PolarHBondContact O-N 2.78Å; L374-I377 PolarHBondContact O-N 3.36Å; L374-T378 HydrophobicContact CD1-CG2 4Å; L374-T378 HydrophobicContact CG-CG2 4.27Å; L374-T378 WeakPolarHBondContact O-CB 3.13Å; L374-T378 VanDerWaalsContact O-CG2 3.25Å; L374-T378 WeakPolarHBondContact O-CG2 3.37Å; L374-T378 PolarHBondContact O-N 2.8Å; L374-T378 PolarHBondContact O-OG1 3.01Å; L374-T403 HydrophobicContact CD1-CG2 3.98Å; L374-T403 HydrophobicContact CD2-CG2 4.09Å; L374-T403 HydrophobicContact CG-CG2 4.05Å; L374-V404 HydrophobicContact CB-CG2 4.21Å; L374-V404 HydrophobicContact CD2-CG2 3.95Å; L374-V404 HydrophobicContact CG-CG2 3.93Å |
| 375 | V | 94.2 | Very high | 89.4 | Confident | 0 Ų | 0 | 51.2 Ų | 51.2 | 0% | 0 | 29% | 0.292 | C | S | . | . | H | α-helix | trans | -53.9 | -45.2 | 171.5 | 170.2 | 0 | 0 | 0 | 0 | 110.8 | A353 I357 L367 Q371 V372 I377 T378 A379 V400 V404 | A353-V375 HydrophobicContact CB-CG1 4.12Å; I357-V375 HydrophobicContact CG1-CG1 4.37Å; L367-V375 HydrophobicContact CD1-CG2 4.42Å; Q371-V375 WeakPolarHBondContact O-CG2 3.42Å; Q371-V375 PolarHBondContact O-N 3.41Å; V372-V375 WeakPolarHBondContact O-CB 3.12Å; V372-V375 PolarHBondContact O-N 3.19Å; V375-I377 PolarHBondContact O-N 2.78Å; V375-T378 WeakPolarHBondContact CA-OG1 3.24Å; V375-T378 PolarHBondContact O-N 3.24Å; V375-T378 PolarHBondContact O-OG1 3.18Å; V375-A379 WeakPolarHBondContact O-CB 3.39Å; V375-A379 PolarHBondContact O-N 2.88Å; V375-V400 HydrophobicContact CB-CG1 4.37Å; V375-V400 HydrophobicContact CG1-CG1 3.92Å; V375-V400 HydrophobicContact CG2-CG1 4.39Å; V375-V404 HydrophobicContact CG2-CB 4.36Å; V375-V404 HydrophobicContact CG2-CG1 4.32Å; V375-V404 HydrophobicContact CG2-CG2 3.58Å |
| 376 | S | 94.3 | Very high | 88.4 | Confident | 20 Ų | 20 | 48.4 Ų | 48.4 | 14% | 0.14 | 28% | 0.278 | C | S | . | . | H | α-helix | trans | -60.5 | -46.9 | -179.7 | -173 | 0 | 0 | 0 | 0 | 112.4 | V100 V372 L373 L374 T380 | V100-S376 VanDerWaalsContact CG1-OG 3.23Å; V100-S376 WeakPolarHBondContact CG1-OG 3.27Å; V372-S376 PolarHBondContact O-N 3.15Å; L373-S376 WeakPolarHBondContact O-CB 3.3Å; L373-S376 PolarHBondContact O-N 3.45Å; L374-S376 VanDerWaalsContact C-N 3.27Å; L374-S376 PolarHBondContact O-N 2.78Å; S376-T380 WeakPolarHBondContact O-CB 3.4Å; S376-T380 PolarHBondContact O-N 2.91Å; S376-T380 VanDerWaalsContact O-N 3.15Å; S376-T380 PolarHBondContact O-OG1 3.28Å |
| 377 | I | 91.1 | Very high | 87.1 | Confident | 86 Ų | 86 | 44 Ų | 44 | 44% | 0.441 | 25% | 0.248 | S | C | . | . | H | α-helix | trans | -68.6 | -45.5 | -178.5 | -66.5 | 166.9 | 0 | 0 | 0 | 109.9 | L373 L374 V375 T380 L381 | L373-I377 HydrophobicContact CD1-CD1 4.32Å; L373-I377 HydrophobicContact CG-CD1 4.04Å; L373-I377 WeakPolarHBondContact O-CG1 3.49Å; L373-I377 PolarHBondContact O-N 3.48Å; L374-I377 PolarHBondContact O-N 3.36Å; V375-I377 PolarHBondContact O-N 2.78Å; I377-T380 PolarHBondContact O-N 3.28Å; I377-L381 HydrophobicContact CG2-CD1 3.98Å; I377-L381 WeakPolarHBondContact O-CG 3.37Å; I377-L381 PolarHBondContact O-N 2.72Å |
| 378 | T | 89.1 | Confident | 85.9 | Confident | 12 Ų | 12 | 42.9 Ų | 42.9 | 7% | 0.074 | 24% | 0.243 | C | C | . | . | H | α-helix | trans | -70.9 | -38.2 | -176.2 | 56.3 | 0 | 0 | 0 | 0 | 111.9 | L374 V375 T380 L381 A382 V400 T403 | L374-T378 HydrophobicContact CD1-CG2 4Å; L374-T378 HydrophobicContact CG-CG2 4.27Å; L374-T378 WeakPolarHBondContact O-CB 3.13Å; L374-T378 VanDerWaalsContact O-CG2 3.25Å; L374-T378 WeakPolarHBondContact O-CG2 3.37Å; L374-T378 PolarHBondContact O-N 2.8Å; L374-T378 PolarHBondContact O-OG1 3.01Å; V375-T378 WeakPolarHBondContact CA-OG1 3.24Å; V375-T378 PolarHBondContact O-N 3.24Å; V375-T378 PolarHBondContact O-OG1 3.18Å; T378-T380 VanDerWaalsContact C-N 3.35Å; T378-L381 PolarHBondContact O-N 3.31Å; T378-A382 WeakPolarHBondContact O-CB 3.15Å; T378-A382 PolarHBondContact O-N 2.75Å; T378-V400 WeakPolarHBondContact OG1-CG1 3.03Å; T378-T403 HydrophobicContact CG2-CG2 3.43Å; T378-T403 VanDerWaalsContact CG2-CG2 3.43Å |
| 379 | A | 91.4 | Very high | 84.2 | Confident | 0 Ų | 0 | 44 Ų | 44 | 0% | 0 | 25% | 0.247 | C | C | . | . | H | α-helix | trans | -63.8 | -40.3 | 172.5 | 0 | 0 | 0 | 0 | 0 | 111.7 | E352 A353 V375 L381 A382 S383 V400 | E352-A379 HydrophobicContact CB-CB 3.92Å; E352-A379 WeakPolarHBondContact OE2-CA 3.35Å; E352-A379 VanDerWaalsContact OE2-O 3.12Å; A353-A379 HydrophobicContact CB-CB 4.23Å; V375-A379 WeakPolarHBondContact O-CB 3.39Å; V375-A379 PolarHBondContact O-N 2.88Å; A379-L381 PolarHBondContact O-N 2.86Å; A379-A382 PolarHBondContact O-N 3.5Å; A379-S383 VanDerWaalsContact O-CB 3.31Å; A379-S383 WeakPolarHBondContact O-CB 3.45Å; A379-S383 PolarHBondContact O-N 3.44Å; A379-S383 PolarHBondContact O-OG 3.14Å; A379-V400 HydrophobicContact CB-CG2 4.08Å |
| 380 | T | 89.8 | Confident | 82.5 | Confident | 27 Ų | 27 | 39.2 Ų | 39.2 | 17% | 0.166 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -60.4 | -48.2 | 174.4 | -57 | 0 | 0 | 0 | 0 | 110.7 | T96 S376 I377 T378 S383 | T96-T380 HydrophobicContact CG2-CG2 3.92Å; S376-T380 WeakPolarHBondContact O-CB 3.4Å; S376-T380 PolarHBondContact O-N 2.91Å; S376-T380 VanDerWaalsContact O-N 3.15Å; S376-T380 PolarHBondContact O-OG1 3.28Å; I377-T380 PolarHBondContact O-N 3.28Å; T378-T380 VanDerWaalsContact C-N 3.35Å; T380-S383 PolarHBondContact O-OG 3.34Å |
| 381 | L | 84.8 | Confident | 80.8 | Confident | 90 Ų | 90 | 36.2 Ų | 36.2 | 47% | 0.471 | 22% | 0.218 | S | C | . | . | H | α-helix | trans | -68.5 | -40 | 179.6 | -68.8 | 173.9 | 0 | 0 | 0 | 113.1 | I377 T378 A379 S383 I384 | I377-L381 HydrophobicContact CG2-CD1 3.98Å; I377-L381 WeakPolarHBondContact O-CG 3.37Å; I377-L381 PolarHBondContact O-N 2.72Å; T378-L381 PolarHBondContact O-N 3.31Å; A379-L381 PolarHBondContact O-N 2.86Å; L381-S383 VanDerWaalsContact C-N 3.32Å; L381-S383 PolarHBondContact O-N 3.09Å; L381-I384 WeakPolarHBondContact O-CB 3.35Å; L381-I384 PolarHBondContact O-N 3.18Å |
| 382 | A | 82.9 | Confident | 79.4 | Confident | 5 Ų | 5 | 33.7 Ų | 33.7 | 4% | 0.041 | 21% | 0.208 | C | C | . | . | H | α-helix | trans | -65.1 | -37.7 | 179.5 | 0 | 0 | 0 | 0 | 0 | 111.3 | E352 T378 A379 I384 G385 A386 I399 V400 | E352-A382 WeakPolarHBondContact OE2-CB 3.07Å; T378-A382 WeakPolarHBondContact O-CB 3.15Å; T378-A382 PolarHBondContact O-N 2.75Å; A379-A382 PolarHBondContact O-N 3.5Å; A382-I384 VanDerWaalsContact C-N 3.26Å; A382-I384 PolarHBondContact O-N 2.49Å; A382-G385 CarbonylContact O-C 3.17Å; A382-G385 PolarHBondContact O-N 3.48Å; A382-A386 PolarHBondContact O-N 3.01Å; A382-A386 VanDerWaalsContact O-N 3.13Å; A382-I399 HydrophobicContact CB-CB 4.29Å; A382-I399 HydrophobicContact CB-CD1 4.02Å; A382-I399 HydrophobicContact CB-CG2 4.15Å; A382-V400 HydrophobicContact CB-CG2 4.15Å |
| 383 | S | 85.5 | Confident | 77.9 | Confident | 0 Ų | 0 | 32.9 Ų | 32.9 | 0% | 0 | 20% | 0.203 | C | C | . | . | H | α-helix | trans | -62.9 | -27.8 | 177.1 | 78.6 | 0 | 0 | 0 | 0 | 114.3 | A379 T380 L381 G385 A386 | A379-S383 VanDerWaalsContact O-CB 3.31Å; A379-S383 WeakPolarHBondContact O-CB 3.45Å; A379-S383 PolarHBondContact O-N 3.44Å; A379-S383 PolarHBondContact O-OG 3.14Å; T380-S383 PolarHBondContact O-OG 3.34Å; L381-S383 VanDerWaalsContact C-N 3.32Å; L381-S383 PolarHBondContact O-N 3.09Å; S383-G385 VanDerWaalsContact C-N 3.28Å; S383-G385 PolarHBondContact O-N 2.88Å; S383-A386 WeakPolarHBondContact O-CB 3.01Å; S383-A386 PolarHBondContact O-N 3.45Å |
| 384 | I | 81.7 | Confident | 76.9 | Confident | 45 Ų | 45 | 30 Ų | 30 | 23% | 0.231 | 19% | 0.188 | C | C | . | . | H | α-helix | trans | -68.3 | -31.3 | 174.6 | -62.5 | 173.6 | 0 | 0 | 0 | 111 | L139 I343 L381 A382 | L139-I384 HydrophobicContact CD2-CG2 3.79Å; I343-I384 HydrophobicContact CB-CG2 4.5Å; I343-I384 HydrophobicContact CG1-CG2 4.35Å; I343-I384 HydrophobicContact CG2-CB 4.49Å; I343-I384 HydrophobicContact CG2-CG1 4.17Å; I343-I384 HydrophobicContact CG2-CG2 3.98Å; L381-I384 WeakPolarHBondContact O-CB 3.35Å; L381-I384 PolarHBondContact O-N 3.18Å; A382-I384 VanDerWaalsContact C-N 3.26Å; A382-I384 PolarHBondContact O-N 2.49Å |
| 385 | G | 66.3 | Low | 75.9 | Confident | 37 Ų | 37 | 30.3 Ų | 30.3 | 38% | 0.381 | 19% | 0.189 | S | C | . | . | H | α-helix | trans | -92.8 | -3.9 | 178.7 | 0 | 0 | 0 | 0 | 0 | 114.5 | A382 S383 A387 | A382-G385 CarbonylContact O-C 3.17Å; A382-G385 PolarHBondContact O-N 3.48Å; S383-G385 VanDerWaalsContact C-N 3.28Å; S383-G385 PolarHBondContact O-N 2.88Å; G385-A387 PolarHBondContact O-N 3.48Å |
| 386 | A | 67.2 | Low | 75.2 | Confident | 3 Ų | 3 | 30.7 Ų | 30.7 | 3% | 0.025 | 19% | 0.192 | C | C | . | . | S | Bend | trans | -67 | 125.6 | 177 | 0 | 0 | 0 | 0 | 0 | 109.6 | M345 T348 A382 S383 T396 | M345-A386 HydrophobicContact CE-CB 4.26Å; M345-A386 WeakPolarHBondContact CE-O 3.47Å; M345-A386 HydrophobicContact SD-CB 3.57Å; M345-A386 VanDerWaalsContact SD-CB 3.57Å; T348-A386 HydrophobicContact CG2-CB 4.16Å; A382-A386 PolarHBondContact O-N 3.01Å; A382-A386 VanDerWaalsContact O-N 3.13Å; S383-A386 WeakPolarHBondContact O-CB 3.01Å; S383-A386 PolarHBondContact O-N 3.45Å; A386-T396 HydrophobicContact CB-CG2 3.98Å |
| 387 | A | 63.2 | Low | 74.8 | Confident | 19 Ų | 19 | 29.8 Ų | 29.8 | 16% | 0.157 | 19% | 0.185 | C | C | . | . | trans | -67.8 | 143.4 | 175.4 | 0 | 0 | 0 | 0 | 0 | 110.5 | G385 V389 A392 | G385-A387 PolarHBondContact O-N 3.48Å; A387-V389 HydrophobicContact CB-CG2 3.83Å; A387-V389 PolarHBondContact O-N 2.89Å; A387-A392 HydrophobicContact CB-CB 4.26Å; A387-A392 WeakPolarHBondContact O-CB 3.48Å | ||
| 388 | S | 65.4 | Low | 74.3 | Confident | 11 Ų | 11 | 26.8 Ų | 26.8 | 8% | 0.077 | 17% | 0.17 | C | C | . | . | S | Bend | trans | -73.5 | 27.8 | -177 | -35.5 | 0 | 0 | 0 | 0 | 114.9 | S311 A341 | S311-S388 PolarHBondContact OG-O 2.98Å; A341-S388 VanDerWaalsContact C-OG 3.26Å; A341-S388 VanDerWaalsContact O-CB 3.26Å; A341-S388 WeakPolarHBondContact O-CB 3.39Å; A341-S388 PolarHBondContact O-OG 2.84Å |
| 389 | V | 58.9 | Low | 73.9 | Confident | 80 Ų | 80 | 26.7 Ų | 26.7 | 49% | 0.485 | 17% | 0.169 | S | C | . | . | S | Bend | trans | -112.5 | 155.1 | -173.5 | -59.8 | 0 | 0 | 0 | 0 | 110.3 | A387 G391 A392 | A387-V389 HydrophobicContact CB-CG2 3.83Å; A387-V389 PolarHBondContact O-N 2.89Å; V389-G391 PolarHBondContact O-N 3.33Å; V389-A392 HydrophobicContact CG2-CB 4.13Å; V389-A392 WeakPolarHBondContact O-CB 2.95Å; V389-A392 PolarHBondContact O-N 3.11Å |
| 390 | P | 56.7 | Low | 73.7 | Confident | 68 Ų | 68 | 26.7 Ų | 26.7 | 44% | 0.442 | 17% | 0.169 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -56.1 | 139.6 | -179 | -23.8 | 33.8 | 0 | 0 | 0 | 112.4 | A310 A392 D422 | A310-P390 HydrophobicContact CB-CB 4.49Å; P390-A392 PolarHBondContact O-N 2.7Å; P390-D422 WeakPolarHBondContact CA-OD2 3.46Å |
| 391 | G | 58.5 | Low | 73.6 | Confident | 24 Ų | 24 | 25.4 Ų | 25.4 | 25% | 0.247 | 16% | 0.161 | C | C | . | . | T | Hydrogen-bonded Turn | trans | 72.5 | 4.1 | 177 | 0 | 0 | 0 | 0 | 0 | 115.9 | V389 G393 L394 D422 | V389-G391 PolarHBondContact O-N 3.33Å; G391-G393 PolarHBondContact O-N 3.23Å; G391-L394 PolarHBondContact O-N 3.21Å; G391-D422 PolarHBondContact N-OD2 3.06Å |
| 392 | A | 63.7 | Low | 73.6 | Confident | 9 Ų | 9 | 23.7 Ų | 23.7 | 7% | 0.074 | 15% | 0.152 | C | C | . | . | H | α-helix | trans | -60.6 | -29.5 | -178.7 | 0 | 0 | 0 | 0 | 0 | 113.8 | A387 V389 P390 L394 I395 T396 | A387-A392 HydrophobicContact CB-CB 4.26Å; A387-A392 WeakPolarHBondContact O-CB 3.48Å; V389-A392 HydrophobicContact CG2-CB 4.13Å; V389-A392 WeakPolarHBondContact O-CB 2.95Å; V389-A392 PolarHBondContact O-N 3.11Å; P390-A392 PolarHBondContact O-N 2.7Å; A392-L394 PolarHBondContact O-N 3.25Å; A392-I395 PolarHBondContact O-N 3.27Å; A392-T396 PolarHBondContact O-OG1 2.86Å |
| 393 | G | 63.5 | Low | 73.7 | Confident | 1 Ų | 1 | 25.7 Ų | 25.7 | 1% | 0.01 | 16% | 0.164 | C | C | . | . | H | α-helix | trans | -61.6 | -25.2 | -179.9 | 0 | 0 | 0 | 0 | 0 | 114.5 | G391 T396 I397 | G391-G393 PolarHBondContact O-N 3.23Å; G393-T396 WeakPolarHBondContact CA-OG1 3.43Å; G393-T396 PolarHBondContact O-N 2.87Å; G393-T396 PolarHBondContact O-OG1 3.33Å; G393-I397 WeakPolarHBondContact O-CG1 3.3Å; G393-I397 PolarHBondContact O-N 3.39Å; G393-I397 VanDerWaalsContact O-N 3.14Å |
| 394 | L | 73.5 | Confident | 73.8 | Confident | 28 Ų | 28 | 26.4 Ų | 26.4 | 15% | 0.147 | 17% | 0.168 | C | C | . | . | H | α-helix | trans | -69 | -36.7 | 179.3 | -70.2 | 166.1 | 0 | 0 | 0 | 112.3 | Y351 G391 A392 T396 I397 I414 I415 D418 | Y351-L394 WeakPolarHBondContact OH-CD2 3.38Å; G391-L394 PolarHBondContact O-N 3.21Å; A392-L394 PolarHBondContact O-N 3.25Å; L394-T396 VanDerWaalsContact C-N 3.31Å; L394-I397 HydrophobicContact CD2-CD1 4.45Å; L394-I414 HydrophobicContact CD2-CG2 4.06Å; L394-I415 HydrophobicContact CD1-CB 4.38Å; L394-I415 HydrophobicContact CD1-CG1 3.83Å; L394-I415 HydrophobicContact CD1-CG2 4.33Å; L394-I415 HydrophobicContact CD2-CG1 3.77Å; L394-I415 HydrophobicContact CG-CG1 4.35Å; L394-D418 HydrophobicContact CD1-CB 4.24Å; L394-D418 HydrophobicContact CD2-CB 4.15Å; L394-D418 HydrophobicContact CG-CB 4.39Å |
| 395 | I | 71.4 | Confident | 73.8 | Confident | 72 Ų | 72 | 27.3 Ų | 27.3 | 37% | 0.369 | 19% | 0.189 | S | C | . | . | H | α-helix | trans | -69.3 | -37 | 179.8 | -60.9 | 174.1 | 0 | 0 | 0 | 109.7 | A392 I398 | A392-I395 PolarHBondContact O-N 3.27Å; I395-I398 WeakPolarHBondContact O-CB 3.5Å; I395-I398 PolarHBondContact O-N 2.92Å |
| 396 | T | 80.7 | Confident | 74.8 | Confident | 8 Ų | 8 | 26 Ų | 26 | 5% | 0.049 | 17% | 0.173 | C | C | . | . | H | α-helix | trans | -79.7 | -22.3 | -177.4 | 47.7 | 0 | 0 | 0 | 0 | 113.2 | E352 A386 A392 G393 L394 I398 I399 | E352-T396 WeakPolarHBondContact OE1-CB 3.37Å; E352-T396 PolarHBondContact OE1-OG1 2.69Å; A386-T396 HydrophobicContact CB-CG2 3.98Å; A392-T396 PolarHBondContact O-OG1 2.86Å; G393-T396 WeakPolarHBondContact CA-OG1 3.43Å; G393-T396 PolarHBondContact O-N 2.87Å; G393-T396 PolarHBondContact O-OG1 3.33Å; L394-T396 VanDerWaalsContact C-N 3.31Å; T396-I398 VanDerWaalsContact C-N 3.26Å; T396-I398 PolarHBondContact O-N 2.96Å; T396-I399 HydrophobicContact CG2-CD1 4Å; T396-I399 VanDerWaalsContact O-CB 3.24Å; T396-I399 WeakPolarHBondContact O-CB 3.29Å; T396-I399 PolarHBondContact O-N 3.32Å |
| 397 | I | 84.8 | Confident | 75.6 | Confident | 0 Ų | 0 | 27.5 Ų | 27.5 | 0% | 0 | 18% | 0.183 | C | C | . | . | H | α-helix | trans | -57.7 | -39 | 168 | -72.3 | 165.1 | 0 | 0 | 0 | 111.9 | Y351 E352 A355 G393 L394 I399 V400 L401 I411 I414 | Y351-I397 HydrophobicContact CD1-CD1 4.06Å; Y351-I397 HydrophobicContact CD1-CG1 4.49Å; Y351-I397 HydrophobicContact CE1-CD1 3.19Å; Y351-I397 HydrophobicContact CE1-CG1 3.98Å; E352-I397 HydrophobicContact CB-CG1 4.38Å; E352-I397 HydrophobicContact CG-CG1 3.76Å; A355-I397 HydrophobicContact CB-CD1 3.68Å; A355-I397 HydrophobicContact CB-CG1 4.11Å; A355-I397 HydrophobicContact CB-CG2 4.5Å; G393-I397 WeakPolarHBondContact O-CG1 3.3Å; G393-I397 PolarHBondContact O-N 3.39Å; G393-I397 VanDerWaalsContact O-N 3.14Å; L394-I397 HydrophobicContact CD2-CD1 4.45Å; I397-I399 PolarHBondContact O-N 2.84Å; I397-V400 PolarHBondContact O-N 3.38Å; I397-L401 HydrophobicContact CG2-CD1 3.61Å; I397-L401 HydrophobicContact CG2-CG 3.9Å; I397-L401 WeakPolarHBondContact O-CG 3.4Å; I397-L401 PolarHBondContact O-N 3.36Å; I397-I411 HydrophobicContact CG2-CD1 4.49Å; I397-I411 HydrophobicContact CG2-CG1 4.45Å; I397-I414 HydrophobicContact CD1-CG2 4.46Å |
| 398 | I | 81 | Confident | 76.4 | Confident | 23 Ų | 23 | 27.5 Ų | 27.5 | 12% | 0.118 | 18% | 0.181 | C | C | . | . | H | α-helix | trans | -57.3 | -38.6 | -179.9 | -63.5 | 169.1 | 0 | 0 | 0 | 110.4 | V130 I395 T396 V400 L401 N402 T408 I411 | V130-I398 HydrophobicContact CB-CG2 4Å; I395-I398 WeakPolarHBondContact O-CB 3.5Å; I395-I398 PolarHBondContact O-N 2.92Å; T396-I398 VanDerWaalsContact C-N 3.26Å; T396-I398 PolarHBondContact O-N 2.96Å; I398-V400 VanDerWaalsContact C-N 3.35Å; I398-V400 PolarHBondContact O-N 3.29Å; I398-L401 PolarHBondContact O-N 2.81Å; I398-N402 WeakPolarHBondContact CG2-ND2 3.45Å; I398-N402 VanDerWaalsContact O-CB 3.27Å; I398-N402 WeakPolarHBondContact O-CB 3.44Å; I398-N402 VanDerWaalsContact O-CG 3.29Å; I398-N402 PolarHBondContact O-N 3.2Å; I398-T408 HydrophobicContact CG2-CG2 4.32Å; I398-I411 HydrophobicContact CD1-CD1 4.35Å; I398-I411 HydrophobicContact CG1-CD1 3.44Å; I398-I411 VanDerWaalsContact CG1-CD1 3.44Å |
| 399 | I | 80.4 | Confident | 77 | Confident | 11 Ų | 11 | 30.1 Ų | 30.1 | 6% | 0.056 | 19% | 0.194 | C | C | . | . | H | α-helix | trans | -57 | -51.2 | 176.7 | -61.2 | 165.1 | 0 | 0 | 0 | 110 | S132 T135 A382 T396 I397 T403 | S132-I399 PolarHBondContact OG-O 2.96Å; S132-I399 VanDerWaalsContact OG-O 3.13Å; T135-I399 HydrophobicContact CG2-CD1 3.6Å; T135-I399 HydrophobicContact CG2-CG1 3.69Å; T135-I399 VanDerWaalsContact OG1-CD1 3.24Å; T135-I399 WeakPolarHBondContact OG1-CD1 3.36Å; A382-I399 HydrophobicContact CB-CB 4.29Å; A382-I399 HydrophobicContact CB-CD1 4.02Å; A382-I399 HydrophobicContact CB-CG2 4.15Å; T396-I399 HydrophobicContact CG2-CD1 4Å; T396-I399 VanDerWaalsContact O-CB 3.24Å; T396-I399 WeakPolarHBondContact O-CB 3.29Å; T396-I399 PolarHBondContact O-N 3.32Å; I397-I399 PolarHBondContact O-N 2.84Å; I399-T403 PolarHBondContact O-N 3.4Å; I399-T403 PolarHBondContact O-OG1 3.01Å |
| 400 | V | 88.5 | Confident | 78.1 | Confident | 0 Ų | 0 | 26.8 Ų | 26.8 | 0% | 0 | 17% | 0.173 | C | C | . | . | H | α-helix | trans | -65.4 | -45.3 | -176 | -177.7 | 0 | 0 | 0 | 0 | 110.8 | E352 S356 V375 T378 A379 A382 I397 I398 T403 V404 | E352-V400 HydrophobicContact CB-CG2 4.33Å; S356-V400 WeakPolarHBondContact OG-CB 3.08Å; S356-V400 WeakPolarHBondContact OG-CG1 3.5Å; V375-V400 HydrophobicContact CB-CG1 4.37Å; V375-V400 HydrophobicContact CG1-CG1 3.92Å; V375-V400 HydrophobicContact CG2-CG1 4.39Å; T378-V400 WeakPolarHBondContact OG1-CG1 3.03Å; A379-V400 HydrophobicContact CB-CG2 4.08Å; A382-V400 HydrophobicContact CB-CG2 4.15Å; I397-V400 PolarHBondContact O-N 3.38Å; I398-V400 VanDerWaalsContact C-N 3.35Å; I398-V400 PolarHBondContact O-N 3.29Å; V400-T403 PolarHBondContact O-N 3.35Å; V400-V404 WeakPolarHBondContact O-CG2 3.43Å; V400-V404 PolarHBondContact O-N 3.22Å |
| 401 | L | 88.2 | Confident | 79.2 | Confident | 0 Ų | 0 | 23.9 Ų | 23.9 | 0% | 0 | 15% | 0.154 | C | C | . | . | H | α-helix | trans | -61.2 | -49.6 | 177.7 | -68.2 | 172.6 | 0 | 0 | 0 | 111.5 | I359 I397 I398 T403 V404 G405 L406 T408 I411 | I359-L401 HydrophobicContact CB-CD2 4.07Å; I359-L401 HydrophobicContact CD1-CD1 3.66Å; I359-L401 HydrophobicContact CD1-CD2 4.06Å; I359-L401 HydrophobicContact CD1-CG 4.46Å; I359-L401 HydrophobicContact CG2-CD2 3.95Å; I397-L401 HydrophobicContact CG2-CD1 3.61Å; I397-L401 HydrophobicContact CG2-CG 3.9Å; I397-L401 WeakPolarHBondContact O-CG 3.4Å; I397-L401 PolarHBondContact O-N 3.36Å; I398-L401 PolarHBondContact O-N 2.81Å; L401-T403 VanDerWaalsContact C-N 3.33Å; L401-T403 PolarHBondContact O-N 2.86Å; L401-V404 PolarHBondContact O-N 3.35Å; L401-G405 PolarHBondContact O-N 3.26Å; L401-L406 HydrophobicContact CB-CB 4.23Å; L401-L406 HydrophobicContact CD2-CB 3.65Å; L401-L406 HydrophobicContact CD2-CD1 3.84Å; L401-L406 HydrophobicContact CD2-CG 4.43Å; L401-L406 PolarHBondContact O-N 3.03Å; L401-T408 HydrophobicContact CB-CG2 4.03Å; L401-T408 HydrophobicContact CD1-CG2 4Å; L401-I411 HydrophobicContact CD1-CD1 3.65Å; L401-I411 HydrophobicContact CD1-CG1 3.71Å |
| 402 | N | 84.2 | Confident | 80.1 | Confident | 54 Ų | 54 | 24.4 Ų | 24.4 | 29% | 0.289 | 15% | 0.153 | S | C | . | . | H | α-helix | trans | -63.1 | -38.1 | 179.8 | -74.8 | -8.1 | 0 | 0 | 0 | 111.8 | V130 I398 V404 G405 T408 | V130-N402 PolarHBondContact O-ND2 3.27Å; I398-N402 WeakPolarHBondContact CG2-ND2 3.45Å; I398-N402 VanDerWaalsContact O-CB 3.27Å; I398-N402 WeakPolarHBondContact O-CB 3.44Å; I398-N402 VanDerWaalsContact O-CG 3.29Å; I398-N402 PolarHBondContact O-N 3.2Å; N402-V404 VanDerWaalsContact C-N 3.27Å; N402-V404 PolarHBondContact O-N 3.23Å; N402-G405 PolarHBondContact O-N 3.16Å; N402-T408 WeakPolarHBondContact OD1-CG2 3.39Å |
| 403 | T | 84.2 | Confident | 80.9 | Confident | 47 Ų | 47 | 24.1 Ų | 24.1 | 29% | 0.288 | 15% | 0.151 | S | C | . | . | H | α-helix | trans | -63.4 | -34.9 | 177.6 | -46.3 | 0 | 0 | 0 | 0 | 112.5 | S132 L374 T378 I399 V400 L401 | S132-T403 PolarHBondContact OG-OG1 2.68Å; L374-T403 HydrophobicContact CD1-CG2 3.98Å; L374-T403 HydrophobicContact CD2-CG2 4.09Å; L374-T403 HydrophobicContact CG-CG2 4.05Å; T378-T403 HydrophobicContact CG2-CG2 3.43Å; T378-T403 VanDerWaalsContact CG2-CG2 3.43Å; I399-T403 PolarHBondContact O-N 3.4Å; I399-T403 PolarHBondContact O-OG1 3.01Å; V400-T403 PolarHBondContact O-N 3.35Å; L401-T403 VanDerWaalsContact C-N 3.33Å; L401-T403 PolarHBondContact O-N 2.86Å |
| 404 | V | 87.2 | Confident | 81.9 | Confident | 14 Ų | 14 | 24 Ų | 24 | 9% | 0.085 | 15% | 0.15 | C | C | . | . | H | α-helix | trans | -92.8 | -6.3 | -178.4 | -172 | 0 | 0 | 0 | 0 | 112.1 | L367 Q371 L374 V375 V400 L401 N402 L406 | L367-V404 HydrophobicContact CD2-CG1 3.96Å; Q371-V404 HydrophobicContact CB-CG1 3.84Å; Q371-V404 HydrophobicContact CG-CG1 4.06Å; L374-V404 HydrophobicContact CB-CG2 4.21Å; L374-V404 HydrophobicContact CD2-CG2 3.95Å; L374-V404 HydrophobicContact CG-CG2 3.93Å; V375-V404 HydrophobicContact CG2-CB 4.36Å; V375-V404 HydrophobicContact CG2-CG1 4.32Å; V375-V404 HydrophobicContact CG2-CG2 3.58Å; V400-V404 WeakPolarHBondContact O-CG2 3.43Å; V400-V404 PolarHBondContact O-N 3.22Å; L401-V404 PolarHBondContact O-N 3.35Å; N402-V404 VanDerWaalsContact C-N 3.27Å; N402-V404 PolarHBondContact O-N 3.23Å; V404-L406 HydrophobicContact CB-CG 4.49Å; V404-L406 HydrophobicContact CG1-CD1 4.48Å; V404-L406 HydrophobicContact CG1-CG 4.45Å |
| 405 | G | 82.9 | Confident | 82.2 | Confident | 64 Ų | 64 | 27.1 Ų | 27.1 | 66% | 0.66 | 17% | 0.166 | S | C | * | . | T | Hydrogen-bonded Turn | trans | 76.6 | 32.1 | -179.8 | 0 | 0 | 0 | 0 | 0 | 113.5 | L401 N402 | L401-G405 PolarHBondContact O-N 3.26Å; N402-G405 PolarHBondContact O-N 3.16Å |
| 406 | L | 86.5 | Confident | 82.5 | Confident | 9 Ų | 9 | 26.3 Ų | 26.3 | 5% | 0.047 | 16% | 0.164 | C | C | . | . | trans | -92.7 | 147.4 | 177.6 | -69.9 | 172.8 | 0 | 0 | 0 | 111.4 | S356 A360 I365 L367 L401 V404 | S356-L406 WeakPolarHBondContact O-CD1 3.41Å; A360-L406 HydrophobicContact CB-CD1 3.87Å; A360-L406 HydrophobicContact CB-CD2 3.7Å; A360-L406 HydrophobicContact CB-CG 4.46Å; I365-L406 HydrophobicContact CB-CD2 4.3Å; I365-L406 HydrophobicContact CD1-CD2 3.8Å; I365-L406 HydrophobicContact CG2-CD2 3.98Å; L367-L406 HydrophobicContact CD1-CD1 4.47Å; L367-L406 HydrophobicContact CD2-CD1 4.34Å; L367-L406 HydrophobicContact CD2-CD2 4.16Å; L401-L406 HydrophobicContact CB-CB 4.23Å; L401-L406 HydrophobicContact CD2-CB 3.65Å; L401-L406 HydrophobicContact CD2-CD1 3.84Å; L401-L406 HydrophobicContact CD2-CG 4.43Å; L401-L406 PolarHBondContact O-N 3.03Å; V404-L406 HydrophobicContact CB-CG 4.49Å; V404-L406 HydrophobicContact CG1-CD1 4.48Å; V404-L406 HydrophobicContact CG1-CG 4.45Å | ||
| 407 | P | 83.9 | Confident | 82.6 | Confident | 36 Ų | 36 | 26.1 Ų | 26.1 | 23% | 0.234 | 16% | 0.163 | C | C | . | . | trans | -65.5 | 145.1 | 178.4 | 28.4 | -34.8 | 0 | 0 | 0 | 111.3 | I359 N363 I365 | I359-P407 WeakPolarHBondContact CG2-O 3.43Å; N363-P407 HydrophobicContact CB-CG 4.33Å; I365-P407 HydrophobicContact CD1-CG 4.46Å | ||
| 408 | T | 80.7 | Confident | 82.7 | Confident | 19 Ų | 19 | 26.4 Ų | 26.4 | 12% | 0.117 | 17% | 0.165 | C | C | . | . | trans | -102 | -9.5 | -178.6 | 53.9 | 0 | 0 | 0 | 0 | 113.1 | N127 I398 L401 N402 D410 I411 | N127-T408 WeakPolarHBondContact CB-OG1 3.4Å; N127-T408 VanDerWaalsContact ND2-CB 3.34Å; N127-T408 WeakPolarHBondContact ND2-CB 3.46Å; N127-T408 PolarHBondContact ND2-O 3.47Å; N127-T408 PolarHBondContact ND2-OG1 2.96Å; I398-T408 HydrophobicContact CG2-CG2 4.32Å; L401-T408 HydrophobicContact CB-CG2 4.03Å; L401-T408 HydrophobicContact CD1-CG2 4Å; N402-T408 WeakPolarHBondContact OD1-CG2 3.39Å; T408-D410 PolarHBondContact O-N 3.44Å; T408-D410 VanDerWaalsContact O-N 3.14Å; T408-I411 HydrophobicContact CG2-CD1 4.12Å; T408-I411 WeakPolarHBondContact O-CB 3.44Å; T408-I411 WeakPolarHBondContact O-CD1 3.44Å; T408-I411 WeakPolarHBondContact O-CG1 3.48Å; T408-I411 PolarHBondContact O-N 2.94Å; T408-I411 VanDerWaalsContact O-N 3.07Å | ||
| 409 | D | 77.9 | Confident | 82.8 | Confident | 66 Ų | 66 | 28.4 Ų | 28.4 | 35% | 0.353 | 17% | 0.171 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -57.2 | -33.9 | -174.4 | -56.6 | -25.3 | 0 | 0 | 0 | 113 | N127 I411 S412 | N127-D409 PolarHBondContact ND2-N 3.23Å; D409-I411 VanDerWaalsContact C-N 3.29Å; D409-I411 PolarHBondContact O-N 3.15Å; D409-S412 PolarHBondContact O-OG 3.31Å |
| 410 | D | 81 | Confident | 83.1 | Confident | 9 Ų | 9 | 30.7 Ų | 30.7 | 5% | 0.048 | 18% | 0.183 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -82.9 | -0.5 | -176.2 | -59.3 | -43.8 | 0 | 0 | 0 | 113.5 | R118 L362 N363 T408 S412 L413 | R118-D410 IonicContact NE-OD1 3.57Å; R118-D410 IonicContact NE-OD2 2.8Å; L362-D410 HydrophobicContact CD1-CB 4.48Å; N363-D410 PolarHBondContact ND2-OD2 3Å; T408-D410 PolarHBondContact O-N 3.44Å; T408-D410 VanDerWaalsContact O-N 3.14Å; D410-S412 PolarHBondContact O-N 2.93Å; D410-L413 HydrophobicContact CB-CD1 4.15Å; D410-L413 VanDerWaalsContact O-CB 3.31Å; D410-L413 WeakPolarHBondContact O-CB 3.44Å; D410-L413 WeakPolarHBondContact O-CG 3.25Å; D410-L413 PolarHBondContact O-N 3.35Å; D410-L413 VanDerWaalsContact O-N 3.14Å |
| 411 | I | 81.5 | Confident | 83.3 | Confident | 8 Ų | 8 | 30.7 Ų | 30.7 | 4% | 0.041 | 18% | 0.183 | C | C | . | . | H | α-helix | trans | -59.3 | -32.5 | 174.7 | -66.3 | 170.3 | 0 | 0 | 0 | 110.9 | I359 I397 I398 L401 T408 D409 L413 I414 I415 | I359-I411 HydrophobicContact CD1-CG1 3.99Å; I397-I411 HydrophobicContact CG2-CD1 4.49Å; I397-I411 HydrophobicContact CG2-CG1 4.45Å; I398-I411 HydrophobicContact CD1-CD1 4.35Å; I398-I411 HydrophobicContact CG1-CD1 3.44Å; I398-I411 VanDerWaalsContact CG1-CD1 3.44Å; L401-I411 HydrophobicContact CD1-CD1 3.65Å; L401-I411 HydrophobicContact CD1-CG1 3.71Å; T408-I411 HydrophobicContact CG2-CD1 4.12Å; T408-I411 WeakPolarHBondContact O-CB 3.44Å; T408-I411 WeakPolarHBondContact O-CD1 3.44Å; T408-I411 WeakPolarHBondContact O-CG1 3.48Å; T408-I411 PolarHBondContact O-N 2.94Å; T408-I411 VanDerWaalsContact O-N 3.07Å; D409-I411 VanDerWaalsContact C-N 3.29Å; D409-I411 PolarHBondContact O-N 3.15Å; I411-L413 PolarHBondContact O-N 2.99Å; I411-L413 VanDerWaalsContact O-N 3.14Å; I411-I414 WeakPolarHBondContact O-CA 3.27Å; I411-I414 WeakPolarHBondContact O-CB 3.48Å; I411-I414 PolarHBondContact O-N 3.35Å; I411-I415 HydrophobicContact CG2-CD1 4.28Å; I411-I415 HydrophobicContact CG2-CG1 4.2Å; I411-I415 WeakPolarHBondContact O-CG1 3.46Å; I411-I415 PolarHBondContact O-N 2.81Å |
| 412 | S | 77.4 | Confident | 83.4 | Confident | 34 Ų | 34 | 31.3 Ų | 31.3 | 24% | 0.238 | 19% | 0.186 | C | C | . | . | H | α-helix | trans | -53.9 | -32.3 | 177 | 60.6 | 0 | 0 | 0 | 0 | 113.3 | D409 D410 T416 | D409-S412 PolarHBondContact O-OG 3.31Å; D410-S412 PolarHBondContact O-N 2.93Å; S412-T416 PolarHBondContact O-OG1 2.82Å |
| 413 | L | 80.1 | Confident | 83.8 | Confident | 3 Ų | 3 | 30 Ų | 30 | 2% | 0.016 | 18% | 0.177 | C | C | . | . | H | α-helix | trans | -63.4 | -46.1 | 173.7 | -57.7 | 178.6 | 0 | 0 | 0 | 111.2 | W121 L261 L362 D410 I411 T416 | W121-L413 HydrophobicContact CB-CD2 3.57Å; W121-L413 HydrophobicContact CD2-CD2 3.18Å; W121-L413 HydrophobicContact CE3-CD2 3.4Å; W121-L413 HydrophobicContact CG-CD2 3.28Å; W121-L413 HydrophobicContact CZ2-CD2 4.48Å; W121-L413 HydrophobicContact CZ3-CD2 4.13Å; L261-L413 HydrophobicContact CD1-CB 4.16Å; L261-L413 WeakPolarHBondContact CD1-O 3.46Å; L261-L413 HydrophobicContact CD2-CB 4.36Å; L362-L413 HydrophobicContact CD1-CD1 3.95Å; D410-L413 HydrophobicContact CB-CD1 4.15Å; D410-L413 VanDerWaalsContact O-CB 3.31Å; D410-L413 WeakPolarHBondContact O-CB 3.44Å; D410-L413 WeakPolarHBondContact O-CG 3.25Å; D410-L413 PolarHBondContact O-N 3.35Å; D410-L413 VanDerWaalsContact O-N 3.14Å; I411-L413 PolarHBondContact O-N 2.99Å; I411-L413 VanDerWaalsContact O-N 3.14Å; L413-T416 WeakPolarHBondContact O-CB 3.24Å; L413-T416 PolarHBondContact O-N 3.01Å |
| 414 | I | 84.5 | Confident | 84.3 | Confident | 0 Ų | 0 | 30.3 Ų | 30.3 | 0% | 0 | 18% | 0.177 | C | C | . | . | H | α-helix | trans | -66 | -39.9 | -178.4 | -60.5 | -177.8 | 0 | 0 | 0 | 110.8 | Y264 Y351 A355 F358 I359 L394 I397 I411 T416 V417 D418 | Y264-I414 HydrophobicContact CE1-CG1 4.27Å; Y264-I414 HydrophobicContact CE1-CG2 4.08Å; Y264-I414 WeakPolarHBondContact OH-CG2 3.3Å; Y351-I414 HydrophobicContact CE2-CG2 4.09Å; Y351-I414 WeakPolarHBondContact OH-CG2 3.22Å; A355-I414 HydrophobicContact CB-CD1 3.74Å; F358-I414 HydrophobicContact CD1-CD1 4.3Å; F358-I414 HydrophobicContact CD1-CG1 4.48Å; F358-I414 HydrophobicContact CE1-CG1 4.41Å; I359-I414 HydrophobicContact CD1-CD1 3.68Å; I359-I414 HydrophobicContact CG1-CD1 4.03Å; L394-I414 HydrophobicContact CD2-CG2 4.06Å; I397-I414 HydrophobicContact CD1-CG2 4.46Å; I411-I414 WeakPolarHBondContact O-CA 3.27Å; I411-I414 WeakPolarHBondContact O-CB 3.48Å; I411-I414 PolarHBondContact O-N 3.35Å; I414-T416 PolarHBondContact O-N 3.18Å; I414-T416 VanDerWaalsContact O-N 3.14Å; I414-V417 VanDerWaalsContact O-CG2 3.3Å; I414-V417 WeakPolarHBondContact O-CG2 3.42Å; I414-V417 PolarHBondContact O-N 3.27Å; I414-D418 WeakPolarHBondContact O-CB 3.49Å; I414-D418 PolarHBondContact O-N 3.41Å |
| 415 | I | 80.4 | Confident | 84.7 | Confident | 92 Ų | 92 | 29.7 Ų | 29.7 | 47% | 0.472 | 17% | 0.173 | S | C | . | . | H | α-helix | trans | -53.2 | -37.8 | 177.9 | -63.1 | 178.4 | 0 | 0 | 0 | 111.3 | L394 I411 V417 D418 | L394-I415 HydrophobicContact CD1-CB 4.38Å; L394-I415 HydrophobicContact CD1-CG1 3.83Å; L394-I415 HydrophobicContact CD1-CG2 4.33Å; L394-I415 HydrophobicContact CD2-CG1 3.77Å; L394-I415 HydrophobicContact CG-CG1 4.35Å; I411-I415 HydrophobicContact CG2-CD1 4.28Å; I411-I415 HydrophobicContact CG2-CG1 4.2Å; I411-I415 WeakPolarHBondContact O-CG1 3.46Å; I411-I415 PolarHBondContact O-N 2.81Å; I415-V417 VanDerWaalsContact C-N 3.25Å; I415-V417 PolarHBondContact O-N 2.69Å; I415-D418 PolarHBondContact O-N 3.24Å |
| 416 | T | 77.2 | Confident | 85.1 | Confident | 56 Ų | 56 | 27 Ų | 27 | 34% | 0.344 | 14% | 0.143 | S | C | . | . | H | α-helix | trans | -64.6 | -28.8 | -176.8 | -50.7 | 0 | 0 | 0 | 0 | 112.8 | T257 S412 L413 I414 | T257-T416 HydrophobicContact CG2-CG2 3.52Å; S412-T416 PolarHBondContact O-OG1 2.82Å; L413-T416 WeakPolarHBondContact O-CB 3.24Å; L413-T416 PolarHBondContact O-N 3.01Å; I414-T416 PolarHBondContact O-N 3.18Å; I414-T416 VanDerWaalsContact O-N 3.14Å |
| 417 | V | 83.3 | Confident | 85.5 | Confident | 4 Ų | 4 | 27.4 Ų | 27.4 | 2% | 0.024 | 15% | 0.147 | C | C | . | . | H | α-helix | trans | -106.3 | -11.9 | -179.7 | -60.7 | 0 | 0 | 0 | 0 | 113.5 | T257 L261 Y264 M265 I414 I415 W419 L420 L421 | T257-V417 HydrophobicContact CG2-CG1 3.38Å; L261-V417 HydrophobicContact CB-CG1 4.11Å; L261-V417 HydrophobicContact CD1-CG1 3.8Å; L261-V417 HydrophobicContact CD1-CG2 4.34Å; Y264-V417 HydrophobicContact CD1-CG2 4.09Å; Y264-V417 HydrophobicContact CE1-CG2 3.88Å; M265-V417 HydrophobicContact CE-CB 4.36Å; M265-V417 HydrophobicContact CG-CB 3.84Å; M265-V417 HydrophobicContact CG-CG1 4.02Å; M265-V417 HydrophobicContact CG-CG2 4.01Å; M265-V417 HydrophobicContact SD-CB 3.77Å; M265-V417 HydrophobicContact SD-CG1 3.5Å; M265-V417 WeakPolarHBondContact SD-CG1 3.45Å; I414-V417 VanDerWaalsContact O-CG2 3.3Å; I414-V417 WeakPolarHBondContact O-CG2 3.42Å; I414-V417 PolarHBondContact O-N 3.27Å; I415-V417 VanDerWaalsContact C-N 3.25Å; I415-V417 PolarHBondContact O-N 2.69Å; V417-W419 PolarHBondContact O-N 3.27Å; V417-L420 PolarHBondContact O-N 2.98Å; V417-L421 HydrophobicContact CG2-CD1 4.24Å |
| 418 | D | 86.4 | Confident | 86.1 | Confident | 5 Ų | 5 | 26 Ų | 26 | 3% | 0.027 | 14% | 0.138 | C | C | . | . | H | α-helix | trans | -61.9 | -29.7 | -173.2 | -170.4 | 58.4 | 0 | 0 | 0 | 112.8 | Y351 L394 I414 I415 L420 L421 D422 R425 | Y351-D418 PolarHBondContact OH-OD1 3.28Å; L394-D418 HydrophobicContact CD1-CB 4.24Å; L394-D418 HydrophobicContact CD2-CB 4.15Å; L394-D418 HydrophobicContact CG-CB 4.39Å; I414-D418 WeakPolarHBondContact O-CB 3.49Å; I414-D418 PolarHBondContact O-N 3.41Å; I415-D418 PolarHBondContact O-N 3.24Å; D418-L420 PolarHBondContact O-N 2.85Å; D418-L421 PolarHBondContact O-N 3.4Å; D418-D422 WeakPolarHBondContact O-CB 3.41Å; D418-D422 PolarHBondContact O-N 2.97Å; D418-R425 IonicContact OD1-CZ 3.76Å; D418-R425 IonicContact OD1-NE 3.45Å; D418-R425 IonicContact OD1-NH2 3.29Å; D418-R425 PolarHBondContact OD1-NH2 3.28Å; D418-R425 IonicContact OD2-NH2 2.77Å; D418-R425 PolarHBondContact OD2-NH2 3.03Å |
| 419 | W | 83.7 | Confident | 86.8 | Confident | 65 Ų | 65 | 25.2 Ų | 25.2 | 25% | 0.246 | 13% | 0.133 | C | C | . | . | H | α-helix | trans | -52.3 | -31.4 | 179.5 | 74.9 | -92.8 | 0 | 0 | 0 | 113.8 | L248 I251 L254 V417 R423 | L248-W419 HydrophobicContact CD2-CH2 3.89Å; L248-W419 HydrophobicContact CD2-CZ3 4.33Å; I251-W419 HydrophobicContact CD1-CD2 3.7Å; I251-W419 HydrophobicContact CD1-CE3 4.03Å; I251-W419 HydrophobicContact CD1-CG 4.46Å; I251-W419 HydrophobicContact CD1-CH2 3.56Å; I251-W419 HydrophobicContact CD1-CZ2 3.18Å; I251-W419 HydrophobicContact CD1-CZ3 3.96Å; I251-W419 HydrophobicContact CG1-CD2 4.26Å; I251-W419 HydrophobicContact CG1-CZ2 4.34Å; L254-W419 HydrophobicContact CD1-CZ2 4.15Å; V417-W419 PolarHBondContact O-N 3.27Å; W419-R423 WeakPolarHBondContact O-CD 3.33Å; W419-R423 WeakPolarHBondContact O-CG 3.49Å; W419-R423 PolarHBondContact O-NE 3.4Å |
| 420 | L | 86.4 | Confident | 87.7 | Confident | 59 Ų | 59 | 22.2 Ų | 22.2 | 31% | 0.309 | 12% | 0.117 | S | C | . | . | H | α-helix | trans | -87.6 | -46.6 | 176.7 | 178.2 | 62.2 | 0 | 0 | 0 | 111 | M265 V417 D418 D422 R423 L424 | M265-L420 HydrophobicContact CE-CD2 3.74Å; V417-L420 PolarHBondContact O-N 2.98Å; D418-L420 PolarHBondContact O-N 2.85Å; L420-D422 VanDerWaalsContact C-N 3.34Å; L420-D422 PolarHBondContact O-N 3.45Å; L420-R423 WeakPolarHBondContact O-CB 3.49Å; L420-R423 PolarHBondContact O-N 3.13Å; L420-L424 PolarHBondContact O-N 3.29Å |
| 421 | L | 91.9 | Very high | 88.5 | Confident | 1 Ų | 1 | 21.8 Ų | 21.8 | 1% | 0.005 | 12% | 0.115 | C | C | . | . | H | α-helix | trans | -63.2 | -41.9 | -176.8 | -61.6 | 179.9 | 0 | 0 | 0 | 110.9 | Y264 V268 Y351 V417 D418 R423 L424 R425 | Y264-L421 HydrophobicContact CD1-CD1 4.45Å; Y264-L421 HydrophobicContact CE1-CD1 3.75Å; V268-L421 HydrophobicContact CB-CD1 4.16Å; V268-L421 HydrophobicContact CB-CD2 4.02Å; V268-L421 HydrophobicContact CG1-CB 4.44Å; V268-L421 HydrophobicContact CG1-CD1 4.17Å; V268-L421 HydrophobicContact CG1-CD2 3.92Å; V268-L421 HydrophobicContact CG1-CG 4.4Å; V268-L421 HydrophobicContact CG2-CD1 4.22Å; Y351-L421 HydrophobicContact CD2-CD1 4.32Å; Y351-L421 HydrophobicContact CE2-CB 4.43Å; Y351-L421 HydrophobicContact CE2-CD1 4.02Å; V417-L421 HydrophobicContact CG2-CD1 4.24Å; D418-L421 PolarHBondContact O-N 3.4Å; L421-R423 PolarHBondContact O-N 3.46Å; L421-L424 WeakPolarHBondContact O-CB 3.39Å; L421-L424 PolarHBondContact O-N 3.14Å; L421-R425 VanDerWaalsContact O-CG 3.27Å; L421-R425 WeakPolarHBondContact O-CG 3.48Å; L421-R425 PolarHBondContact O-N 3.31Å |
| 422 | D | 90.2 | Very high | 89.2 | Confident | 12 Ų | 12 | 21.4 Ų | 21.4 | 6% | 0.064 | 11% | 0.113 | C | C | . | . | H | α-helix | trans | -54.8 | -35.9 | 176.8 | -164.7 | 45.8 | 0 | 0 | 0 | 112.9 | P390 G391 D418 L420 R425 T426 | P390-D422 WeakPolarHBondContact CA-OD2 3.46Å; G391-D422 PolarHBondContact N-OD2 3.06Å; D418-D422 WeakPolarHBondContact O-CB 3.41Å; D418-D422 PolarHBondContact O-N 2.97Å; L420-D422 VanDerWaalsContact C-N 3.34Å; L420-D422 PolarHBondContact O-N 3.45Å; D422-R425 PolarHBondContact O-N 3.22Å; D422-R425 IonicContact OD1-CZ 3.74Å; D422-R425 IonicContact OD1-NE 3.83Å; D422-R425 IonicContact OD1-NH1 3.2Å; D422-R425 PolarHBondContact OD1-NH1 3.47Å; D422-R425 IonicContact OD1-NH2 3.98Å; D422-R425 PolarHBondContact OD1-NH2 3.38Å; D422-T426 WeakPolarHBondContact O-CB 3.46Å; D422-T426 PolarHBondContact O-N 2.9Å; D422-T426 PolarHBondContact O-OG1 3.44Å |
| 423 | R | 92 | Very high | 90.1 | Very high | 26 Ų | 26 | 20 Ų | 20 | 10% | 0.098 | 10% | 0.103 | C | C | . | . | H | α-helix | trans | -69.2 | -43.3 | 176.6 | -64.6 | 172.7 | 179.1 | -70.1 | -12.7 | 112.2 | N247 L307 G308 A310 W419 L420 L421 T426 C427 | N247-R423 VanDerWaalsContact CG-NH2 3.25Å; N247-R423 PolarHBondContact ND2-NH2 3.09Å; L307-R423 HydrophobicContact CD1-CB 4.08Å; L307-R423 WeakPolarHBondContact O-CD 3.38Å; L307-R423 PolarHBondContact O-NH1 3.42Å; G308-R423 VanDerWaalsContact C-NH1 3.27Å; G308-R423 PolarHBondContact O-NH1 3.25Å; A310-R423 HydrophobicContact CB-CG 3.75Å; W419-R423 WeakPolarHBondContact O-CD 3.33Å; W419-R423 WeakPolarHBondContact O-CG 3.49Å; W419-R423 PolarHBondContact O-NE 3.4Å; L420-R423 WeakPolarHBondContact O-CB 3.49Å; L420-R423 PolarHBondContact O-N 3.13Å; L421-R423 PolarHBondContact O-N 3.46Å; R423-T426 PolarHBondContact O-N 2.86Å; R423-C427 WeakPolarHBondContact O-CB 3.38Å; R423-C427 PolarHBondContact O-N 3.24Å |
| 424 | L | 94.8 | Very high | 90.9 | Very high | 55 Ų | 55 | 19.9 Ų | 19.9 | 29% | 0.288 | 10% | 0.102 | S | C | . | . | H | α-helix | trans | -63.9 | -46.1 | 175.6 | -60.5 | 179.1 | 0 | 0 | 0 | 109.7 | A269 L272 L307 L420 L421 T426 C427 V428 | A269-L424 HydrophobicContact CB-CD1 4.03Å; L272-L424 HydrophobicContact CD1-CB 3.61Å; L307-L424 HydrophobicContact CD1-CD2 4.36Å; L420-L424 PolarHBondContact O-N 3.29Å; L421-L424 WeakPolarHBondContact O-CB 3.39Å; L421-L424 PolarHBondContact O-N 3.14Å; L424-T426 PolarHBondContact O-N 2.73Å; L424-C427 WeakPolarHBondContact O-CB 3.43Å; L424-C427 PolarHBondContact O-N 2.76Å; L424-V428 WeakPolarHBondContact O-CG2 3.27Å; L424-V428 PolarHBondContact O-N 2.83Å |
| 425 | R | 95.2 | Very high | 91.5 | Very high | 1 Ų | 1 | 20 Ų | 20 | 0% | 0.004 | 10% | 0.102 | C | C | . | . | H | α-helix | trans | -55.5 | -50.7 | 175.8 | -67.3 | -174.6 | -65 | 117.4 | -10 | 111.2 | L272 G347 T348 D418 L421 D422 C427 V428 N429 | L272-R425 HydrophobicContact CD1-CG 3.72Å; L272-R425 HydrophobicContact CD2-CG 4.16Å; G347-R425 VanDerWaalsContact O-CD 3.29Å; G347-R425 WeakPolarHBondContact O-CD 3.46Å; G347-R425 WeakPolarHBondContact O-CG 3.17Å; T348-R425 PolarHBondContact OG1-NH1 2.94Å; D418-R425 IonicContact OD1-CZ 3.76Å; D418-R425 IonicContact OD1-NE 3.45Å; D418-R425 IonicContact OD1-NH2 3.29Å; D418-R425 PolarHBondContact OD1-NH2 3.28Å; D418-R425 IonicContact OD2-NH2 2.77Å; D418-R425 PolarHBondContact OD2-NH2 3.03Å; L421-R425 VanDerWaalsContact O-CG 3.27Å; L421-R425 WeakPolarHBondContact O-CG 3.48Å; L421-R425 PolarHBondContact O-N 3.31Å; D422-R425 PolarHBondContact O-N 3.22Å; D422-R425 IonicContact OD1-CZ 3.74Å; D422-R425 IonicContact OD1-NE 3.83Å; D422-R425 IonicContact OD1-NH1 3.2Å; D422-R425 PolarHBondContact OD1-NH1 3.47Å; D422-R425 IonicContact OD1-NH2 3.98Å; D422-R425 PolarHBondContact OD1-NH2 3.38Å; R425-C427 VanDerWaalsContact C-N 3.33Å; R425-C427 PolarHBondContact O-N 3.22Å; R425-V428 PolarHBondContact O-N 2.93Å; R425-N429 PolarHBondContact O-N 2.86Å; R425-N429 PolarHBondContact O-ND2 3.14Å; R425-N429 PolarHBondContact O-OD1 3.05Å |
| 426 | T | 93.2 | Very high | 92.3 | Very high | 6 Ų | 6 | 15.6 Ų | 15.6 | 4% | 0.037 | 8% | 0.08 | C | C | . | . | H | α-helix | trans | -57.6 | -45.2 | 177.8 | -59.6 | 0 | 0 | 0 | 0 | 111.7 | A306 A310 D422 R423 L424 V428 N429 V430 | A306-T426 HydrophobicContact CB-CG2 3.97Å; A310-T426 PolarHBondContact O-OG1 3.36Å; D422-T426 WeakPolarHBondContact O-CB 3.46Å; D422-T426 PolarHBondContact O-N 2.9Å; D422-T426 PolarHBondContact O-OG1 3.44Å; R423-T426 PolarHBondContact O-N 2.86Å; L424-T426 PolarHBondContact O-N 2.73Å; T426-V428 VanDerWaalsContact C-N 3.34Å; T426-V428 PolarHBondContact O-N 3.42Å; T426-N429 PolarHBondContact O-N 3.06Å; T426-V430 HydrophobicContact CG2-CG2 4.39Å; T426-V430 WeakPolarHBondContact O-CG2 3.46Å; T426-V430 PolarHBondContact O-N 2.91Å |
| 427 | C | 94.5 | Very high | 93.3 | Very high | 18 Ų | 18 | 12.9 Ų | 12.9 | 12% | 0.122 | 6% | 0.063 | C | C | . | . | H | α-helix | trans | -61.1 | -43.9 | 178.6 | -170.6 | 0 | 0 | 0 | 0 | 111.7 | R423 L424 R425 I431 | R423-C427 WeakPolarHBondContact O-CB 3.38Å; R423-C427 PolarHBondContact O-N 3.24Å; L424-C427 WeakPolarHBondContact O-CB 3.43Å; L424-C427 PolarHBondContact O-N 2.76Å; R425-C427 VanDerWaalsContact C-N 3.33Å; R425-C427 PolarHBondContact O-N 3.22Å; C427-I431 PolarHBondContact O-N 3.14Å; C427-I431 VanDerWaalsContact O-N 3.09Å |
| 428 | V | 96.7 | Very high | 93.9 | Very high | 6 Ų | 6 | 12.9 Ų | 12.9 | 4% | 0.036 | 6% | 0.064 | C | C | . | . | H | α-helix | trans | -62.1 | -45.7 | 175.3 | 176.1 | 0 | 0 | 0 | 0 | 111.4 | L272 F276 L280 L424 R425 T426 I431 G432 | L272-V428 HydrophobicContact CB-CG2 4.01Å; L272-V428 HydrophobicContact CD2-CB 4.39Å; L272-V428 HydrophobicContact CD2-CG2 4.1Å; F276-V428 HydrophobicContact CB-CG2 4.04Å; F276-V428 HydrophobicContact CD2-CG2 4.42Å; L280-V428 HydrophobicContact CD1-CG1 4.21Å; L424-V428 WeakPolarHBondContact O-CG2 3.27Å; L424-V428 PolarHBondContact O-N 2.83Å; R425-V428 PolarHBondContact O-N 2.93Å; T426-V428 VanDerWaalsContact C-N 3.34Å; T426-V428 PolarHBondContact O-N 3.42Å; V428-I431 PolarHBondContact O-N 3.18Å; V428-G432 PolarHBondContact O-N 3.46Å |
| 429 | N | 95.4 | Very high | 94.5 | Very high | 4 Ų | 4 | 12.9 Ų | 12.9 | 2% | 0.021 | 6% | 0.064 | C | C | . | . | H | α-helix | trans | -60.2 | -48.7 | 178.9 | -64.9 | -12.9 | 0 | 0 | 0 | 111.3 | D346 G347 R425 T426 I431 G432 D433 | D346-N429 PolarHBondContact N-OD1 2.79Å; G347-N429 WeakPolarHBondContact CA-OD1 3.29Å; G347-N429 PolarHBondContact N-OD1 2.99Å; R425-N429 PolarHBondContact O-N 2.86Å; R425-N429 PolarHBondContact O-ND2 3.14Å; R425-N429 PolarHBondContact O-OD1 3.05Å; T426-N429 PolarHBondContact O-N 3.06Å; N429-I431 VanDerWaalsContact C-N 3.3Å; N429-I431 PolarHBondContact O-N 3.18Å; N429-G432 WeakPolarHBondContact O-CA 3.12Å; N429-G432 PolarHBondContact O-N 2.97Å; N429-G432 VanDerWaalsContact O-N 3.13Å; N429-D433 PolarHBondContact O-N 2.99Å |
| 430 | V | 96 | Very high | 95.1 | Very high | 2 Ų | 2 | 9.8 Ų | 9.8 | 1% | 0.012 | 5% | 0.052 | C | C | . | . | H | α-helix | trans | -60.6 | -38.7 | 179.1 | 168.2 | 0 | 0 | 0 | 0 | 112.1 | A302 A306 T315 T319 T426 A434 | A302-V430 HydrophobicContact CB-CG1 4.23Å; A306-V430 HydrophobicContact CB-CB 4.38Å; A306-V430 HydrophobicContact CB-CG2 4.06Å; T315-V430 HydrophobicContact CG2-CG1 4.1Å; T315-V430 HydrophobicContact CG2-CG2 4.29Å; T319-V430 HydrophobicContact CG2-CG1 4.22Å; T319-V430 WeakPolarHBondContact OG1-CG1 3.45Å; T426-V430 HydrophobicContact CG2-CG2 4.39Å; T426-V430 WeakPolarHBondContact O-CG2 3.46Å; T426-V430 PolarHBondContact O-N 2.91Å; V430-A434 WeakPolarHBondContact O-CB 3.45Å; V430-A434 PolarHBondContact O-N 3.3Å; V430-A434 VanDerWaalsContact O-N 3.08Å |
| 431 | I | 97 | Very high | 95.5 | Very high | 1 Ų | 1 | 7.7 Ų | 7.7 | 1% | 0.005 | 5% | 0.045 | C | C | . | . | H | α-helix | trans | -75.4 | -34.5 | 175.9 | -70.5 | -53.2 | 0 | 0 | 0 | 112.3 | F276 L296 M299 M303 C427 V428 N429 D433 A434 Y435 | F276-I431 HydrophobicContact CD2-CB 4.41Å; F276-I431 HydrophobicContact CD2-CG2 4.3Å; F276-I431 HydrophobicContact CE2-CB 4.23Å; F276-I431 HydrophobicContact CE2-CG1 3.9Å; F276-I431 HydrophobicContact CE2-CG2 4.16Å; L296-I431 HydrophobicContact CD1-CD1 4Å; L296-I431 HydrophobicContact CD1-CG1 4.26Å; L296-I431 HydrophobicContact CD1-CG2 4.05Å; M299-I431 HydrophobicContact CB-CD1 3.6Å; M299-I431 HydrophobicContact CG-CD1 4.2Å; M303-I431 HydrophobicContact CG-CD1 3.49Å; M303-I431 VanDerWaalsContact CG-CD1 3.49Å; M303-I431 HydrophobicContact CG-CG1 3.57Å; M303-I431 HydrophobicContact SD-CD1 3.88Å; M303-I431 HydrophobicContact SD-CG1 3.76Å; C427-I431 PolarHBondContact O-N 3.14Å; C427-I431 VanDerWaalsContact O-N 3.09Å; V428-I431 PolarHBondContact O-N 3.18Å; N429-I431 VanDerWaalsContact C-N 3.3Å; N429-I431 PolarHBondContact O-N 3.18Å; I431-D433 VanDerWaalsContact C-N 3.33Å; I431-D433 PolarHBondContact O-N 2.89Å; I431-A434 PolarHBondContact O-N 3.35Å; I431-Y435 HydrophobicContact CG2-CD2 3.58Å; I431-Y435 HydrophobicContact CG2-CE2 3.46Å; I431-Y435 VanDerWaalsContact CG2-CE2 3.46Å; I431-Y435 WeakPolarHBondContact O-CD2 3.39Å; I431-Y435 PolarHBondContact O-N 3.27Å |
| 432 | G | 97 | Very high | 95.7 | Very high | 0 Ų | 0 | 11.2 Ų | 11.2 | 0% | 0 | 6% | 0.061 | C | C | . | . | H | α-helix | trans | -55.8 | -47.6 | 169.9 | 0 | 0 | 0 | 0 | 0 | 111.6 | Y91 V428 N429 Y435 G436 | Y91-G432 WeakPolarHBondContact CE1-O 3.24Å; Y91-G432 PolarHBondContact OH-O 2.89Å; V428-G432 PolarHBondContact O-N 3.46Å; N429-G432 WeakPolarHBondContact O-CA 3.12Å; N429-G432 PolarHBondContact O-N 2.97Å; N429-G432 VanDerWaalsContact O-N 3.13Å; G432-Y435 PolarHBondContact O-N 2.87Å; G432-G436 PolarHBondContact O-N 2.88Å |
| 433 | D | 96.3 | Very high | 95.9 | Very high | 5 Ų | 5 | 13.9 Ų | 13.9 | 3% | 0.027 | 8% | 0.075 | C | C | . | . | H | α-helix | trans | -63.6 | -41.2 | 175.7 | -69.6 | -16.8 | 0 | 0 | 0 | 112.5 | L337 G340 A341 N344 N429 I431 G436 A437 | L337-D433 HydrophobicContact CD2-CB 3.86Å; G340-D433 VanDerWaalsContact C-OD2 3.27Å; G340-D433 WeakPolarHBondContact CA-OD1 3.36Å; A341-D433 PolarHBondContact N-OD2 2.93Å; N344-D433 VanDerWaalsContact CB-OD1 3.3Å; N344-D433 WeakPolarHBondContact CB-OD1 3.36Å; N344-D433 PolarHBondContact ND2-OD1 3.46Å; N429-D433 PolarHBondContact O-N 2.99Å; I431-D433 VanDerWaalsContact C-N 3.33Å; I431-D433 PolarHBondContact O-N 2.89Å; D433-G436 PolarHBondContact O-N 3.06Å; D433-A437 PolarHBondContact O-N 3.2Å |
| 434 | A | 97.5 | Very high | 96 | Very high | 0 Ų | 0 | 12.7 Ų | 12.7 | 0% | 0 | 7% | 0.071 | C | C | . | . | H | α-helix | trans | -63.2 | -46.9 | 178.4 | 0 | 0 | 0 | 0 | 0 | 111.8 | F295 M299 L323 V430 I431 G436 A437 A438 | F295-A434 HydrophobicContact CE1-CB 4.11Å; F295-A434 HydrophobicContact CZ-CB 4.35Å; F295-A434 WeakPolarHBondContact CZ-O 3.34Å; M299-A434 HydrophobicContact CE-CB 3.58Å; M299-A434 HydrophobicContact CG-CB 4.3Å; M299-A434 HydrophobicContact SD-CB 4.12Å; L323-A434 HydrophobicContact CD1-CB 4.46Å; L323-A434 HydrophobicContact CD2-CB 4.09Å; V430-A434 WeakPolarHBondContact O-CB 3.45Å; V430-A434 PolarHBondContact O-N 3.3Å; V430-A434 VanDerWaalsContact O-N 3.08Å; I431-A434 PolarHBondContact O-N 3.35Å; A434-G436 VanDerWaalsContact C-N 3.33Å; A434-A437 PolarHBondContact O-N 2.99Å; A434-A438 PolarHBondContact O-N 3Å |
| 435 | Y | 97.5 | Very high | 95.7 | Very high | 1 Ų | 1 | 17.7 Ų | 17.7 | 0% | 0.004 | 9% | 0.086 | C | C | . | . | H | α-helix | trans | -63.4 | -40.9 | 172.9 | -79.4 | -53.9 | 0 | 0 | 0 | 111.4 | Y91 L280 P281 Y284 P292 F295 I431 G432 A437 A438 V439 | Y91-Y435 WeakPolarHBondContact OH-CB 3.41Å; L280-Y435 HydrophobicContact CB-CD2 3.84Å; L280-Y435 HydrophobicContact CB-CE2 4.13Å; P281-Y435 HydrophobicContact CG-CE2 4.26Å; Y284-Y435 HydrophobicContact CD1-CD1 4.33Å; Y284-Y435 HydrophobicContact CD1-CE1 4.08Å; Y284-Y435 AromaticContact CD2-CD1 3.39Å; Y284-Y435 HydrophobicContact CD2-CD1 3.39Å; Y284-Y435 AromaticContact CD2-CE1 3.94Å; Y284-Y435 HydrophobicContact CD2-CE1 3.94Å; Y284-Y435 HydrophobicContact CD2-CG 4.43Å; Y284-Y435 HydrophobicContact CE2-CD1 4.1Å; Y284-Y435 HydrophobicContact CE2-CE1 4.48Å; Y284-Y435 AromaticContact CG-CD1 3.5Å; Y284-Y435 HydrophobicContact CG-CD1 3.5Å; Y284-Y435 VanDerWaalsContact CG-CD1 3.5Å; Y284-Y435 AromaticContact CG-CE1 3.68Å; Y284-Y435 HydrophobicContact CG-CE1 3.68Å; P292-Y435 HydrophobicContact CB-CE1 4.07Å; P292-Y435 WeakPolarHBondContact CB-OH 3.34Å; P292-Y435 PolarHBondContact O-OH 2.89Å; F295-Y435 AromaticContact CD1-CD1 3.65Å; F295-Y435 HydrophobicContact CD1-CD1 3.65Å; F295-Y435 AromaticContact CD1-CE1 3.44Å; F295-Y435 HydrophobicContact CD1-CE1 3.44Å; F295-Y435 VanDerWaalsContact CD1-CE1 3.44Å; F295-Y435 AromaticContact CE1-CD1 3.72Å; F295-Y435 HydrophobicContact CE1-CD1 3.72Å; F295-Y435 AromaticContact CE1-CE1 3.99Å; F295-Y435 HydrophobicContact CE1-CE1 3.99Å; F295-Y435 HydrophobicContact CE1-CG 4.33Å; F295-Y435 HydrophobicContact CG-CE1 4.3Å; I431-Y435 HydrophobicContact CG2-CD2 3.58Å; I431-Y435 HydrophobicContact CG2-CE2 3.46Å; I431-Y435 VanDerWaalsContact CG2-CE2 3.46Å; I431-Y435 WeakPolarHBondContact O-CD2 3.39Å; I431-Y435 PolarHBondContact O-N 3.27Å; G432-Y435 PolarHBondContact O-N 2.87Å; Y435-A437 PolarHBondContact O-N 3.23Å; Y435-A438 PolarHBondContact O-N 3.24Å; Y435-A438 VanDerWaalsContact O-N 3.11Å; Y435-V439 WeakPolarHBondContact O-CB 3.35Å; Y435-V439 WeakPolarHBondContact O-CG2 3.47Å; Y435-V439 PolarHBondContact O-N 3.16Å |
| 436 | G | 96.8 | Very high | 95.2 | Very high | 0 Ų | 0 | 23.7 Ų | 23.7 | 0% | 0 | 12% | 0.118 | C | C | . | . | H | α-helix | trans | -56.6 | -49.1 | 176.2 | 0 | 0 | 0 | 0 | 0 | 112.2 | Y91 G432 D433 A434 A438 V439 V440 | Y91-G436 PolarHBondContact OH-N 2.91Å; G432-G436 PolarHBondContact O-N 2.88Å; D433-G436 PolarHBondContact O-N 3.06Å; A434-G436 VanDerWaalsContact C-N 3.33Å; G436-A438 VanDerWaalsContact C-N 3.27Å; G436-A438 PolarHBondContact O-N 3.23Å; G436-V439 PolarHBondContact O-N 3.16Å; G436-V440 WeakPolarHBondContact O-CB 3.31Å; G436-V440 WeakPolarHBondContact O-CG2 3.4Å; G436-V440 PolarHBondContact O-N 3.4Å |
| 437 | A | 96.8 | Very high | 94.6 | Very high | 0 Ų | 0 | 28 Ų | 28 | 0% | 0 | 14% | 0.136 | C | C | . | . | H | α-helix | trans | -59.2 | -38.2 | 176.1 | 0 | 0 | 0 | 0 | 0 | 112.4 | L323 V332 T333 V336 L337 D433 A434 Y435 G441 | L323-A437 HydrophobicContact CD1-CB 3.91Å; V332-A437 WeakPolarHBondContact CG1-O 3.35Å; T333-A437 HydrophobicContact CG2-CB 4.4Å; V336-A437 HydrophobicContact CB-CB 4.26Å; V336-A437 HydrophobicContact CG1-CB 4.05Å; L337-A437 HydrophobicContact CD2-CB 4.18Å; D433-A437 PolarHBondContact O-N 3.2Å; A434-A437 PolarHBondContact O-N 2.99Å; Y435-A437 PolarHBondContact O-N 3.23Å; A437-G441 PolarHBondContact O-N 2.93Å |
| 438 | A | 97.3 | Very high | 93.8 | Very high | 4 Ų | 4 | 27.7 Ų | 27.7 | 3% | 0.033 | 13% | 0.133 | C | C | . | . | H | α-helix | trans | -73.3 | -38.8 | 177.9 | 0 | 0 | 0 | 0 | 0 | 113 | Y284 F295 I328 A434 Y435 G436 H442 | Y284-A438 HydrophobicContact CD2-CB 4.29Å; Y284-A438 HydrophobicContact CE2-CB 3.71Å; F295-A438 HydrophobicContact CE2-CB 3.8Å; F295-A438 HydrophobicContact CZ-CB 3.79Å; I328-A438 HydrophobicContact CD1-CB 3.79Å; I328-A438 HydrophobicContact CG1-CB 4.31Å; A434-A438 PolarHBondContact O-N 3Å; Y435-A438 PolarHBondContact O-N 3.24Å; Y435-A438 VanDerWaalsContact O-N 3.11Å; G436-A438 VanDerWaalsContact C-N 3.27Å; G436-A438 PolarHBondContact O-N 3.23Å; A438-H442 WeakPolarHBondContact O-CB 3.15Å; A438-H442 PolarHBondContact O-N 2.91Å |
| 439 | V | 97.7 | Very high | 92.4 | Very high | 4 Ų | 4 | 32 Ų | 32 | 2% | 0.024 | 16% | 0.16 | C | C | . | . | H | α-helix | trans | -64.8 | -51.4 | 175.1 | 167.4 | 0 | 0 | 0 | 0 | 110.4 | Y91 Y284 V287 V288 Y435 G436 G441 H442 L443 | Y91-V439 HydrophobicContact CD2-CB 4.21Å; Y91-V439 HydrophobicContact CD2-CG1 3.98Å; Y91-V439 HydrophobicContact CD2-CG2 4.43Å; Y91-V439 HydrophobicContact CE2-CB 4.3Å; Y91-V439 HydrophobicContact CE2-CG1 4.47Å; Y91-V439 HydrophobicContact CE2-CG2 4.11Å; Y284-V439 HydrophobicContact CD2-CG2 4.21Å; V287-V439 HydrophobicContact CB-CG1 4.25Å; V287-V439 HydrophobicContact CG1-CG1 3.94Å; V287-V439 HydrophobicContact CG2-CG1 4.42Å; V288-V439 HydrophobicContact CG2-CB 4.48Å; V288-V439 HydrophobicContact CG2-CG2 3.91Å; Y435-V439 WeakPolarHBondContact O-CB 3.35Å; Y435-V439 WeakPolarHBondContact O-CG2 3.47Å; Y435-V439 PolarHBondContact O-N 3.16Å; G436-V439 PolarHBondContact O-N 3.16Å; V439-G441 VanDerWaalsContact C-N 3.31Å; V439-G441 PolarHBondContact O-N 2.73Å; V439-H442 WeakPolarHBondContact O-CB 3.35Å; V439-H442 PolarHBondContact O-N 2.89Å; V439-H442 VanDerWaalsContact O-N 3.1Å; V439-L443 HydrophobicContact CG1-CD1 3.96Å; V439-L443 WeakPolarHBondContact O-CG 3.47Å; V439-L443 PolarHBondContact O-N 2.93Å |
| 440 | V | 96.6 | Very high | 90.4 | Very high | 0 Ų | 0 | 36.9 Ų | 36.9 | 0% | 0 | 19% | 0.19 | C | C | . | . | H | α-helix | trans | -61.2 | -42.4 | 177.5 | 175 | 0 | 0 | 0 | 0 | 110.7 | I84 W87 A88 V332 V336 G436 H442 L443 C444 | I84-V440 HydrophobicContact CB-CG1 4.21Å; I84-V440 HydrophobicContact CG1-CG1 4.31Å; I84-V440 HydrophobicContact CG2-CG1 3.78Å; W87-V440 HydrophobicContact CB-CG1 4.17Å; W87-V440 HydrophobicContact CB-CG2 4.1Å; A88-V440 HydrophobicContact CB-CG2 4.13Å; V332-V440 HydrophobicContact CG1-CB 4.31Å; V332-V440 HydrophobicContact CG1-CG1 4.12Å; V336-V440 HydrophobicContact CG2-CB 4.29Å; V336-V440 HydrophobicContact CG2-CG1 4.04Å; G436-V440 WeakPolarHBondContact O-CB 3.31Å; G436-V440 WeakPolarHBondContact O-CG2 3.4Å; G436-V440 PolarHBondContact O-N 3.4Å; V440-H442 VanDerWaalsContact C-N 3.27Å; V440-H442 PolarHBondContact O-N 2.82Å; V440-L443 PolarHBondContact O-N 3.02Å; V440-C444 VanDerWaalsContact O-CB 3.31Å; V440-C444 WeakPolarHBondContact O-CB 2.88Å; V440-C444 PolarHBondContact O-N 3.02Å; V440-C444 PolarHBondContact O-SG 3.07Å; V440-C444 VanDerWaalsContact O-SG 3.35Å |
| 441 | G | 95.3 | Very high | 88.1 | Confident | 16 Ų | 16 | 38.6 Ų | 38.6 | 17% | 0.165 | 21% | 0.207 | C | C | . | . | H | α-helix | trans | -62.2 | -34 | 175.6 | 0 | 0 | 0 | 0 | 0 | 113.1 | A437 V439 R445 | A437-G441 PolarHBondContact O-N 2.93Å; V439-G441 VanDerWaalsContact C-N 3.31Å; V439-G441 PolarHBondContact O-N 2.73Å; G441-R445 PolarHBondContact O-N 3.02Å |
| 442 | H | 95.5 | Very high | 85.4 | Confident | 75 Ų | 75 | 40.7 Ų | 40.7 | 35% | 0.347 | 23% | 0.23 | S | C | . | . | H | α-helix | trans | -69.3 | -48.6 | 173.3 | -173.3 | 76.5 | 0 | 0 | 0 | 111.8 | V287 V288 A438 V439 V440 C444 R445 | V287-H442 PolarHBondContact O-CD2 2.66Å; V287-H442 PolarHBondContact O-NE2 3.27Å; V288-H442 HydrophobicContact CG1-CB 4.42Å; V288-H442 HydrophobicContact CG2-CB 3.97Å; A438-H442 WeakPolarHBondContact O-CB 3.15Å; A438-H442 PolarHBondContact O-N 2.91Å; V439-H442 WeakPolarHBondContact O-CB 3.35Å; V439-H442 PolarHBondContact O-N 2.89Å; V439-H442 VanDerWaalsContact O-N 3.1Å; V440-H442 VanDerWaalsContact C-N 3.27Å; V440-H442 PolarHBondContact O-N 2.82Å; H442-C444 VanDerWaalsContact C-N 3.28Å; H442-C444 PolarHBondContact O-N 3.18Å; H442-R445 WeakPolarHBondContact O-CB 3.17Å; H442-R445 PolarHBondContact O-N 3.42Å |
| 443 | L | 95.2 | Very high | 82.2 | Confident | 67 Ų | 67 | 49.6 Ų | 49.6 | 35% | 0.351 | 27% | 0.271 | S | S | . | . | H | α-helix | trans | -66 | -28.9 | -179.5 | -68.2 | 172.9 | 0 | 0 | 0 | 113.2 | W87 V287 V439 V440 | W87-L443 HydrophobicContact CB-CD1 4.45Å; W87-L443 HydrophobicContact CD2-CB 4.38Å; W87-L443 HydrophobicContact CD2-CD1 3.84Å; W87-L443 HydrophobicContact CE3-CD1 3.72Å; W87-L443 HydrophobicContact CG-CB 4.29Å; W87-L443 HydrophobicContact CG-CD1 4.18Å; W87-L443 HydrophobicContact CZ3-CD1 4.24Å; V287-L443 HydrophobicContact CG1-CD1 4.22Å; V287-L443 HydrophobicContact CG1-CD2 3.71Å; V287-L443 HydrophobicContact CG1-CG 3.87Å; V439-L443 HydrophobicContact CG1-CD1 3.96Å; V439-L443 WeakPolarHBondContact O-CG 3.47Å; V439-L443 PolarHBondContact O-N 2.93Å; V440-L443 PolarHBondContact O-N 3.02Å |
| 444 | C | 92.9 | Very high | 79.2 | Confident | 1 Ų | 1 | 54.5 Ų | 54.5 | 1% | 0.007 | 31% | 0.306 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -96.8 | 4.8 | 179.8 | -62.5 | 0 | 0 | 0 | 0 | 113.8 | I84 W87 V440 H442 D446 K447 L448 | I84-C444 HydrophobicContact CG1-CB 4.08Å; W87-C444 VanDerWaalsContact CD1-SG 3.55Å; V440-C444 VanDerWaalsContact O-CB 3.31Å; V440-C444 WeakPolarHBondContact O-CB 2.88Å; V440-C444 PolarHBondContact O-N 3.02Å; V440-C444 PolarHBondContact O-SG 3.07Å; V440-C444 VanDerWaalsContact O-SG 3.35Å; H442-C444 VanDerWaalsContact C-N 3.28Å; H442-C444 PolarHBondContact O-N 3.18Å; C444-D446 VanDerWaalsContact C-N 3.31Å; C444-D446 PolarHBondContact O-N 3.14Å; C444-K447 PolarHBondContact O-N 2.84Å; C444-L448 HydrophobicContact CB-CD1 4.25Å; C444-L448 HydrophobicContact CB-CG 4.47Å; C444-L448 WeakPolarHBondContact O-CG 3.28Å; C444-L448 PolarHBondContact O-N 3.39Å; C444-L448 VanDerWaalsContact O-N 3.16Å |
| 445 | R | 88.7 | Confident | 75.9 | Confident | 161 Ų | 161 | 61.2 Ų | 61.2 | 61% | 0.608 | 34% | 0.34 | S | S | * | . | H | α-helix | trans | -52.5 | -46.1 | -170.8 | -176.1 | 178.8 | 175.9 | -173.9 | -3.8 | 113.1 | G441 H442 K447 L448 T449 | G441-R445 PolarHBondContact O-N 3.02Å; H442-R445 WeakPolarHBondContact O-CB 3.17Å; H442-R445 PolarHBondContact O-N 3.42Å; R445-K447 VanDerWaalsContact C-N 3.26Å; R445-K447 PolarHBondContact O-N 3.42Å; R445-L448 PolarHBondContact O-N 3.14Å; R445-L448 VanDerWaalsContact O-N 3.11Å; R445-T449 PolarHBondContact O-N 3.24Å; R445-T449 PolarHBondContact O-OG1 3.25Å |
| 446 | D | 85.2 | Confident | 72.6 | Confident | 126 Ų | 126 | 65.4 Ų | 65.4 | 67% | 0.674 | 38% | 0.375 | S | S | * | . | H | α-helix | trans | -66.7 | -29.2 | -176.6 | -57.8 | -28 | 0 | 0 | 0 | 112.6 | C444 T449 T450 | C444-D446 VanDerWaalsContact C-N 3.31Å; C444-D446 PolarHBondContact O-N 3.14Å; D446-T449 PolarHBondContact O-OG1 2.74Å; D446-T450 PolarHBondContact O-OG1 3.27Å |
| 447 | K | 81.5 | Confident | 69.3 | Low | 96 Ų | 96 | 74.5 Ų | 74.5 | 42% | 0.417 | 41% | 0.414 | S | S | . | . | H | α-helix | trans | -82.7 | -15.3 | 177.4 | -59.3 | -175.6 | -177.2 | 179.6 | 0 | 112.9 | S80 S83 C444 R445 | S80-K447 PolarHBondContact OG-O 2.8Å; S83-K447 PolarHBondContact OG-NZ 3.19Å; C444-K447 PolarHBondContact O-N 2.84Å; R445-K447 VanDerWaalsContact C-N 3.26Å; R445-K447 PolarHBondContact O-N 3.42Å |
| 448 | L | 76.4 | Confident | 65.8 | Low | 13 Ų | 13 | 83.1 Ų | 83.1 | 7% | 0.068 | 45% | 0.454 | C | S | . | . | H | α-helix | trans | -88.5 | -25.8 | 177.7 | -68 | 166.1 | 0 | 0 | 0 | 112.3 | M76 I84 R331 V332 C444 R445 | M76-L448 HydrophobicContact CE-CD2 3.78Å; I84-L448 HydrophobicContact CD1-CD2 4.2Å; R331-L448 PolarHBondContact NH2-O 3.31Å; R331-L448 VanDerWaalsContact NH2-O 3.16Å; V332-L448 HydrophobicContact CG2-CD1 3.55Å; V332-L448 HydrophobicContact CG2-CD2 4.24Å; C444-L448 HydrophobicContact CB-CD1 4.25Å; C444-L448 HydrophobicContact CB-CG 4.47Å; C444-L448 WeakPolarHBondContact O-CG 3.28Å; C444-L448 PolarHBondContact O-N 3.39Å; C444-L448 VanDerWaalsContact O-N 3.16Å; R445-L448 PolarHBondContact O-N 3.14Å; R445-L448 VanDerWaalsContact O-N 3.11Å |
| 449 | T | 68.7 | Low | 62.4 | Low | 97 Ų | 97 | 85.7 Ų | 85.7 | 60% | 0.595 | 48% | 0.482 | S | S | * | . | H | α-helix | trans | -81.7 | -31.3 | 179.3 | 45.2 | 0 | 0 | 0 | 0 | 113.4 | R445 D446 G451 | R445-T449 PolarHBondContact O-N 3.24Å; R445-T449 PolarHBondContact O-OG1 3.25Å; D446-T449 PolarHBondContact O-OG1 2.74Å; T449-G451 PolarHBondContact O-N 3.1Å |
| 450 | T | 53.2 | Low | 58.9 | Low | 106 Ų | 106 | 90.8 Ų | 90.8 | 65% | 0.65 | 51% | 0.513 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -71.5 | -25.3 | -176.6 | 6.4 | 0 | 0 | 0 | 0 | 113.9 | D446 | D446-T450 PolarHBondContact O-OG1 3.27Š|
| 451 | G | 47.6 | Very low | 55.6 | Low | 37 Ų | 37 | 96 Ų | 96 | 38% | 0.381 | 56% | 0.556 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -87.5 | 1.2 | -178.7 | 0 | 0 | 0 | 0 | 0 | 115.6 | T449 H453 | T449-G451 PolarHBondContact O-N 3.1Å; G451-H453 PolarHBondContact O-N 3.26Å |
| 452 | G | 39.1 | Very low | 52.4 | Low | 46 Ų | 46 | 102.7 Ų | 102.7 | 47% | 0.474 | 58% | 0.583 | S | S | . | * | trans | -93.6 | 72.1 | -175.1 | 0 | 0 | 0 | 0 | 0 | 113.7 | S454 | G452-S454 PolarHBondContact O-N 3.23Š| ||
| 453 | H | 31.1 | Very low | 49.1 | Very low | 187 Ų | 187 | 106.1 Ų | 106.1 | 87% | 0.866 | 60% | 0.604 | S | S | * | * | trans | -69 | 86 | 149.6 | -87.1 | 68.9 | 0 | 0 | 0 | 106.8 | G451 I455 | G451-H453 PolarHBondContact O-N 3.26Å; H453-I455 PolarHBondContact O-N 3.06Å | ||
| 454 | S | 32.9 | Very low | 45.8 | Very low | 108 Ų | 108 | 106 Ų | 106 | 76% | 0.755 | 62% | 0.619 | S | S | * | * | trans | -58.2 | 105.2 | 177.1 | -70.2 | 0 | 0 | 0 | 0 | 109.8 | G452 A456 | G452-S454 PolarHBondContact O-N 3.23Å; S454-A456 PolarHBondContact O-N 3.5Å | ||
| 455 | I | 28.4 | Very low | 43.2 | Very low | 141 Ų | 141 | 111.2 Ų | 111.2 | 72% | 0.723 | 65% | 0.652 | S | S | * | * | trans | -63.8 | 98.7 | 150 | -60.6 | 175.2 | 0 | 0 | 0 | 104.7 | H453 F457 | H453-I455 PolarHBondContact O-N 3.06Å; I455-F457 VanDerWaalsContact C-N 3.32Å; I455-F457 HydrophobicContact CG2-CD2 4.28Å; I455-F457 HydrophobicContact CG2-CE2 4.39Å; I455-F457 PolarHBondContact O-N 3.5Å | ||
| 456 | A | 27.3 | Very low | 40.6 | Very low | 88 Ų | 88 | 107.1 Ų | 107.1 | 73% | 0.727 | 65% | 0.646 | S | S | * | * | trans | -62.1 | 93.9 | 175.9 | 0 | 0 | 0 | 0 | 0 | 108.9 | S454 H458 | S454-A456 PolarHBondContact O-N 3.5Å; A456-H458 VanDerWaalsContact C-N 3.32Å; A456-H458 PolarHBondContact O-N 3.29Å | ||
| 457 | F | 27.1 | Very low | 38.1 | Very low | 191 Ų | 191 | 106.2 Ų | 106.2 | 84% | 0.838 | 64% | 0.64 | S | S | * | * | trans | -70.2 | 95.1 | 164.4 | -101.2 | -88.5 | 0 | 0 | 0 | 107.6 | I455 G459 | I455-F457 VanDerWaalsContact C-N 3.32Å; I455-F457 HydrophobicContact CG2-CD2 4.28Å; I455-F457 HydrophobicContact CG2-CE2 4.39Å; I455-F457 PolarHBondContact O-N 3.5Å; F457-G459 PolarHBondContact O-N 3.04Å | ||
| 458 | H | 23.8 | Very low | 35.6 | Very low | 181 Ų | 181 | 109.8 Ų | 109.8 | 84% | 0.838 | 66% | 0.66 | S | S | * | * | trans | -73.7 | 58.9 | 165.4 | -148.7 | -63.3 | 0 | 0 | 0 | 109 | A456 T460 | A456-H458 VanDerWaalsContact C-N 3.32Å; A456-H458 PolarHBondContact O-N 3.29Å; H458-T460 PolarHBondContact O-N 3.01Å | ||
| 459 | G | 25.7 | Very low | 33.4 | Very low | 59 Ų | 59 | 116.9 Ų | 116.9 | 61% | 0.608 | 70% | 0.695 | S | S | * | * | trans | -84.7 | 104.3 | 171 | 0 | 0 | 0 | 0 | 0 | 108.1 | F457 A461 | F457-G459 PolarHBondContact O-N 3.04Å; G459-A461 PolarHBondContact O-N 3.28Å | ||
| 460 | T | 25.7 | Very low | 32 | Very low | 110 Ų | 110 | 113.5 Ų | 113.5 | 68% | 0.675 | 68% | 0.676 | S | S | * | * | trans | -40.5 | 121.4 | 173 | 41.6 | 0 | 0 | 0 | 0 | 111 | H458 E462 | H458-T460 PolarHBondContact O-N 3.01Å; T460-E462 PolarHBondContact O-N 3.01Å | ||
| 461 | A | 27.4 | Very low | 31.1 | Very low | 109 Ų | 109 | 112.4 Ų | 112.4 | 90% | 0.901 | 67% | 0.669 | S | S | * | * | trans | -68 | 74 | 174.3 | 0 | 0 | 0 | 0 | 0 | 110 | G459 | G459-A461 PolarHBondContact O-N 3.28Š| ||
| 462 | E | 26.6 | Very low | 30.4 | Very low | 158 Ų | 158 | 120 Ų | 120 | 74% | 0.738 | 69% | 0.686 | S | S | * | * | trans | -83.6 | 114.1 | 164.7 | -76.5 | -170.2 | 152.4 | 0 | 0 | 108.8 | T460 | T460-E462 PolarHBondContact O-N 3.01Š| ||
| 463 | N | 27.1 | Very low | 30.5 | Very low | 147 Ų | 147 | 120.6 Ų | 120.6 | 79% | 0.786 | 68% | 0.684 | S | S | * | * | S | Bend | trans | 70.4 | 51.7 | 152.9 | -57.5 | -22.4 | 0 | 0 | 0 | 118.8 | P465 | N463-P465 WeakPolarHBondContact O-CD 3.45Š|
| 464 | G | 26.6 | Very low | 30.9 | Very low | 65 Ų | 65 | 117.4 Ų | 117.4 | 67% | 0.67 | 67% | 0.672 | S | S | * | * | trans | -107.5 | 58.1 | 158 | 0 | 0 | 0 | 0 | 0 | 115.1 | T466 | G464-T466 PolarHBondContact O-N 3.06Š| ||
| 465 | P | 37.4 | Very low | 31.3 | Very low | 109 Ų | 109 | 116 Ų | 116 | 71% | 0.708 | 66% | 0.658 | S | S | * | * | trans | -74.5 | 112.2 | 163.2 | 32.3 | -26.8 | 0 | 0 | 0 | 105.7 | N463 | N463-P465 WeakPolarHBondContact O-CD 3.45Š| ||
| 466 | T | 33.8 | Very low | 31.9 | Very low | 76 Ų | 76 | 114 Ų | 114 | 47% | 0.466 | 65% | 0.649 | S | S | . | * | S | Bend | -170.9 | -8.3 | 102.4 | -63 | 0 | 0 | 0 | 0 | 111.8 | G464 | G464-T466 PolarHBondContact O-N 3.06Š| |
| 467 | I | 32.2 | Very low | 32.6 | Very low | 107 Ų | 107 | 113.3 Ų | 113.3 | 55% | 0.549 | 64% | 0.644 | S | S | . | * | S | Bend | trans | -90 | -28.2 | -179.5 | -60.8 | 178.8 | 0 | 0 | 0 | 112.3 | M469 A470 | I467-M469 PolarHBondContact O-N 3.12Å; I467-A470 PolarHBondContact O-N 3.22Å |
| 468 | M | 29.1 | Very low | 32.9 | Very low | 170 Ų | 170 | 111.4 Ų | 111.4 | 84% | 0.837 | 64% | 0.642 | S | S | * | * | H | α-helix | trans | -69.5 | -26.8 | -176.8 | -85.9 | -113.8 | -138.3 | 0 | 0 | 114.7 | ||
| 469 | M | 31 | Very low | 33.6 | Very low | 163 Ų | 163 | 108 Ų | 108 | 80% | 0.803 | 64% | 0.635 | S | S | * | * | H | α-helix | trans | -89.8 | -12 | -179.3 | -69.3 | -161.9 | -173.1 | 0 | 0 | 114.2 | I467 V471 | I467-M469 PolarHBondContact O-N 3.12Å; M469-V471 PolarHBondContact O-N 3.28Å |
| 470 | A | 38.2 | Very low | 33.8 | Very low | 25 Ų | 25 | 115.8 Ų | 115.8 | 21% | 0.207 | 65% | 0.646 | C | S | . | * | H | α-helix | trans | -75.1 | -23 | -178.2 | 0 | 0 | 0 | 0 | 0 | 113.9 | I467 | I467-A470 PolarHBondContact O-N 3.22Å |
| 471 | V | 35 | Very low | 34.1 | Very low | 83 Ų | 83 | 119 Ų | 119 | 50% | 0.503 | 66% | 0.659 | S | S | . | * | H | α-helix | trans | -93.8 | -26.5 | -177.7 | -179 | 0 | 0 | 0 | 0 | 112.7 | M469 T475 | M469-V471 PolarHBondContact O-N 3.28Å; V471-T475 PolarHBondContact O-OG1 2.92Å |
| 472 | R | 34 | Very low | 34.3 | Very low | 196 Ų | 196 | 116.9 Ų | 116.9 | 74% | 0.74 | 65% | 0.648 | S | S | * | * | H | α-helix | trans | -77.2 | -37.4 | 179 | -91.2 | -176.1 | 172.7 | 175.9 | -2.3 | 113.4 | I474 T475 D476 | R472-I474 VanDerWaalsContact C-N 3.28Å; R472-I474 PolarHBondContact O-N 3.18Å; R472-T475 PolarHBondContact O-N 3.39Å; R472-T475 PolarHBondContact O-OG1 3.33Å; R472-D476 PolarHBondContact O-N 3.24Å |
| 473 | S | 40.6 | Very low | 34.6 | Very low | 60 Ų | 60 | 118.4 Ų | 118.4 | 42% | 0.42 | 66% | 0.655 | S | S | . | * | H | α-helix | trans | -71.3 | -18 | -173.3 | 67.1 | 0 | 0 | 0 | 0 | 114.8 | ||
| 474 | I | 38.7 | Very low | 35.2 | Very low | 119 Ų | 119 | 117.5 Ų | 117.5 | 61% | 0.61 | 66% | 0.657 | S | S | * | * | H | α-helix | trans | -90.6 | -26.4 | 178.6 | -60.9 | 177.3 | 0 | 0 | 0 | 112 | R472 | R472-I474 VanDerWaalsContact C-N 3.28Å; R472-I474 PolarHBondContact O-N 3.18Å |
| 475 | T | 40.9 | Very low | 35.9 | Very low | 78 Ų | 78 | 120.1 Ų | 120.1 | 48% | 0.479 | 66% | 0.66 | S | S | . | * | H | α-helix | trans | -77.8 | -32.2 | 174.3 | 33.9 | 0 | 0 | 0 | 0 | 113 | V471 R472 A477 | V471-T475 PolarHBondContact O-OG1 2.92Å; R472-T475 PolarHBondContact O-N 3.39Å; R472-T475 PolarHBondContact O-OG1 3.33Å; T475-A477 VanDerWaalsContact C-N 3.35Å |
| 476 | D | 42.9 | Very low | 35.8 | Very low | 99 Ų | 99 | 123 Ų | 123 | 53% | 0.529 | 67% | 0.67 | S | S | . | * | G | 310 helix | trans | -81.6 | -17.1 | -176.3 | -63.7 | -10.9 | 0 | 0 | 0 | 112.6 | R472 | R472-D476 PolarHBondContact O-N 3.24Š|
| 477 | A | 40.6 | Very low | 36.1 | Very low | 75 Ų | 75 | 126 Ų | 126 | 62% | 0.62 | 68% | 0.683 | S | S | * | * | G | 310 helix | trans | -77.5 | -18.5 | 177.2 | 0 | 0 | 0 | 0 | 0 | 113.9 | T475 | T475-A477 VanDerWaalsContact C-N 3.35Š|
| 478 | N | 34.7 | Very low | 36.3 | Very low | 150 Ų | 150 | 128.2 Ų | 128.2 | 80% | 0.802 | 73% | 0.732 | S | S | * | * | G | 310 helix | trans | -102.3 | 4 | -177.5 | -92.7 | 9.3 | 0 | 0 | 0 | 114.9 | ||
| 479 | T | 36.6 | Very low | 36.6 | Very low | 111 Ų | 111 | 126.1 Ų | 126.1 | 68% | 0.681 | 73% | 0.727 | S | S | * | * | S | Bend | trans | -115.3 | 8.7 | -179.1 | 46.5 | 0 | 0 | 0 | 0 | 114.9 | ||
| 480 | R | 31.4 | Very low | 36.9 | Very low | 221 Ų | 221 | 124.2 Ų | 124.2 | 83% | 0.834 | 72% | 0.723 | S | S | * | * | S | Bend | trans | -110.8 | 19 | -177.7 | -78 | -167.8 | -179.9 | -171.9 | 0.8 | 116.9 | ||
| 481 | N | 32.4 | Very low | 36.9 | Very low | 177 Ų | 177 | 129.7 Ų | 129.7 | 95% | 0.947 | 75% | 0.751 | S | S | * | * | S | Bend | trans | -109.1 | 29.1 | 177.9 | -88.1 | 10.9 | 0 | 0 | 0 | 114.8 | ||
| 482 | G | 30.5 | Very low | 37 | Very low | 66 Ų | 66 | 132.4 Ų | 132.4 | 68% | 0.68 | 77% | 0.766 | S | S | * | * | trans | -155.2 | 75.5 | 178.5 | 0 | 0 | 0 | 0 | 0 | 113.3 | ||||
| 483 | Q | 33 | Very low | 37.2 | Very low | 190 Ų | 190 | 128.4 Ų | 128.4 | 89% | 0.888 | 77% | 0.768 | S | S | * | * | trans | -145.6 | 112.9 | 156.1 | -111.1 | 173.3 | -39.1 | 0 | 0 | 108.3 | ||||
| 484 | P | 39.8 | Very low | 36.9 | Very low | 127 Ų | 127 | 133 Ų | 133 | 83% | 0.825 | 79% | 0.791 | S | S | * | * | trans | -72.9 | 140.5 | 177.8 | 30.5 | -30.7 | 0 | 0 | 0 | 109.7 | D486 | P484-D486 PolarHBondContact O-N 2.99Š| ||
| 485 | T | 40.6 | Very low | 36.8 | Very low | 120 Ų | 120 | 134 Ų | 134 | 74% | 0.736 | 80% | 0.804 | S | S | * | * | trans | -70.8 | 110.7 | 175.2 | 44.6 | 0 | 0 | 0 | 0 | 109.4 | D487 | T485-D487 PolarHBondContact O-N 2.71Š| ||
| 486 | D | 37 | Very low | 36.5 | Very low | 171 Ų | 171 | 138.3 Ų | 138.3 | 91% | 0.914 | 83% | 0.829 | S | S | * | * | trans | -71.3 | 96.1 | 159.2 | -100.8 | -21.4 | 0 | 0 | 0 | 107.1 | P484 | P484-D486 PolarHBondContact O-N 2.99Š| ||
| 487 | D | 38.6 | Very low | 35.9 | Very low | 138 Ų | 138 | 141.6 Ų | 141.6 | 74% | 0.738 | 85% | 0.854 | S | S | * | * | trans | -79.7 | 136.6 | 157.3 | -74.9 | -36 | 0 | 0 | 0 | 107.5 | T485 | T485-D487 PolarHBondContact O-N 2.71Š| ||
| 488 | G | 36.4 | Very low | 35.5 | Very low | 153 Ų | 153 | 147.6 Ų | 147.6 | 100% | 1.577 | 88% | 0.875 | S | S | * | * | trans | -68 | 0 | 179.7 | 0 | 0 | 0 | 0 | 0 | 114.6 |
Retrieved 488 of 488 residues in 154.8 ms
(Link to these results)