| 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 | 44.8 | Very low | 53.8 | Low | 226 Ų | 226 | 113.5 Ų | 113.5 | 100% | 1.113 | 61% | 0.612 | S | S | * | * | 0 | 107 | 0 | -76 | 173.1 | 169.8 | 0 | 0 | 107 | |||||
| 2 | G | 51.9 | Low | 54.5 | Low | 46 Ų | 46 | 110.3 Ų | 110.3 | 47% | 0.474 | 60% | 0.599 | S | S | . | * | trans | -78.6 | 150.8 | -155 | 0 | 0 | 0 | 0 | 0 | 114.5 | N4 Q5 | G2-N4 PolarHBondContact O-N 3.37Å; G2-Q5 PolarHBondContact O-N 2.77Å | ||
| 3 | T | 54.4 | Low | 54.9 | Low | 106 Ų | 106 | 111 Ų | 111 | 65% | 0.65 | 60% | 0.596 | S | S | * | * | H | α-helix | trans | -40.3 | -30.7 | 173.4 | 46.2 | 0 | 0 | 0 | 0 | 114.7 | Q5 V6 Q7 | T3-Q5 PolarHBondContact O-N 3.12Å; T3-V6 PolarHBondContact O-N 2.94Å; T3-Q7 PolarHBondContact O-N 3.16Å |
| 4 | N | 54.3 | Low | 55.4 | Low | 111 Ų | 111 | 111.9 Ų | 111.9 | 59% | 0.594 | 59% | 0.592 | S | S | * | * | H | α-helix | trans | -63 | -34.2 | 175.6 | -66.4 | -3.8 | 0 | 0 | 0 | 113.7 | G2 Q8 | G2-N4 PolarHBondContact O-N 3.37Å; N4-Q8 WeakPolarHBondContact O-CG 3.48Å; N4-Q8 PolarHBondContact O-N 3.23Å |
| 5 | Q | 51.3 | Low | 56.2 | Low | 112 Ų | 112 | 113.7 Ų | 113.7 | 52% | 0.523 | 59% | 0.593 | S | S | . | * | H | α-helix | trans | -71.7 | -41.2 | 173.6 | -75.2 | -173.6 | -22.5 | 0 | 0 | 110.9 | G2 T3 Q7 Q8 I9 | G2-Q5 PolarHBondContact O-N 2.77Å; T3-Q5 PolarHBondContact O-N 3.12Å; Q5-Q7 VanDerWaalsContact C-N 3.34Å; Q5-Q7 PolarHBondContact O-N 3.1Å; Q5-Q8 PolarHBondContact O-N 3.13Å; Q5-Q8 VanDerWaalsContact O-N 3.13Å; Q5-I9 HydrophobicContact CB-CD1 4.43Å; Q5-I9 WeakPolarHBondContact O-CB 3.45Å; Q5-I9 VanDerWaalsContact O-CD1 3.31Å; Q5-I9 WeakPolarHBondContact O-CD1 3.4Å; Q5-I9 WeakPolarHBondContact O-CG1 3.31Å; Q5-I9 PolarHBondContact O-N 3.42Å |
| 6 | V | 52.9 | Low | 57 | Low | 93 Ų | 93 | 114.6 Ų | 114.6 | 56% | 0.564 | 59% | 0.591 | S | S | * | * | H | α-helix | trans | -62.1 | -42.3 | 176.8 | -179.4 | 0 | 0 | 0 | 0 | 111 | T3 Q8 I9 L10 | T3-V6 PolarHBondContact O-N 2.94Å; V6-Q8 VanDerWaalsContact C-N 3.28Å; V6-Q8 PolarHBondContact O-N 3.22Å; V6-I9 PolarHBondContact O-N 3.04Å; V6-L10 WeakPolarHBondContact O-CB 3.35Å; V6-L10 PolarHBondContact O-N 3.44Å |
| 7 | Q | 53.7 | Low | 58 | Low | 139 Ų | 139 | 110.4 Ų | 110.4 | 65% | 0.65 | 57% | 0.571 | S | S | * | * | H | α-helix | trans | -67 | -23.4 | 175.4 | -81.9 | -179.6 | -27.8 | 0 | 0 | 114 | T3 Q5 P11 | T3-Q7 PolarHBondContact O-N 3.16Å; Q5-Q7 VanDerWaalsContact C-N 3.34Å; Q5-Q7 PolarHBondContact O-N 3.1Å; Q7-P11 WeakPolarHBondContact O-CD 3.29Å; Q7-P11 VanDerWaalsContact O-CG 3.28Å; Q7-P11 WeakPolarHBondContact O-CG 3.48Å |
| 8 | Q | 54.2 | Low | 59.4 | Low | 138 Ų | 138 | 106.5 Ų | 106.5 | 65% | 0.645 | 56% | 0.555 | S | S | * | * | H | α-helix | trans | -86.8 | -30.7 | 173 | -73.9 | 178.7 | -7 | 0 | 0 | 112.7 | N4 Q5 V6 P11 V12 | N4-Q8 WeakPolarHBondContact O-CG 3.48Å; N4-Q8 PolarHBondContact O-N 3.23Å; Q5-Q8 PolarHBondContact O-N 3.13Å; Q5-Q8 VanDerWaalsContact O-N 3.13Å; V6-Q8 VanDerWaalsContact C-N 3.28Å; V6-Q8 PolarHBondContact O-N 3.22Å; Q8-P11 WeakPolarHBondContact O-CD 3.25Å; Q8-P11 VanDerWaalsContact O-CG 3.31Å; Q8-P11 WeakPolarHBondContact O-CG 3.35Å; Q8-V12 WeakPolarHBondContact O-CG2 3.34Å |
| 9 | I | 57.6 | Low | 60.8 | Low | 96 Ų | 96 | 104.6 Ų | 104.6 | 49% | 0.492 | 54% | 0.544 | S | S | . | . | H | α-helix | trans | -71.7 | -42.4 | 177.6 | -66.8 | 159.9 | 0 | 0 | 0 | 110.9 | Q5 V6 V12 Q13 | Q5-I9 HydrophobicContact CB-CD1 4.43Å; Q5-I9 WeakPolarHBondContact O-CB 3.45Å; Q5-I9 VanDerWaalsContact O-CD1 3.31Å; Q5-I9 WeakPolarHBondContact O-CD1 3.4Å; Q5-I9 WeakPolarHBondContact O-CG1 3.31Å; Q5-I9 PolarHBondContact O-N 3.42Å; V6-I9 PolarHBondContact O-N 3.04Å; I9-V12 PolarHBondContact O-N 3.44Å; I9-V12 VanDerWaalsContact O-N 3.17Å; I9-Q13 PolarHBondContact O-N 3.33Å |
| 10 | L | 55.1 | Low | 62 | Low | 122 Ų | 122 | 99.7 Ų | 99.7 | 64% | 0.639 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -55.1 | -49.6 | -179.3 | -155.7 | 83.1 | 0 | 0 | 0 | 113.9 | V6 V12 Q13 F14 | V6-L10 WeakPolarHBondContact O-CB 3.35Å; V6-L10 PolarHBondContact O-N 3.44Å; L10-V12 VanDerWaalsContact C-N 3.31Å; L10-V12 PolarHBondContact O-N 3.5Å; L10-Q13 PolarHBondContact O-N 2.89Å; L10-F14 WeakPolarHBondContact O-CB 3.31Å; L10-F14 PolarHBondContact O-N 3.39Å |
| 11 | P | 61.3 | Low | 63.3 | Low | 59 Ų | 59 | 96.6 Ų | 96.6 | 38% | 0.383 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -68.4 | -29.6 | 178.5 | 26 | -34.8 | 0 | 0 | 0 | 112.6 | Q7 Q8 K15 | Q7-P11 WeakPolarHBondContact O-CD 3.29Å; Q7-P11 VanDerWaalsContact O-CG 3.28Å; Q7-P11 WeakPolarHBondContact O-CG 3.48Å; Q8-P11 WeakPolarHBondContact O-CD 3.25Å; Q8-P11 VanDerWaalsContact O-CG 3.31Å; Q8-P11 WeakPolarHBondContact O-CG 3.35Å; P11-K15 VanDerWaalsContact O-CB 3.28Å; P11-K15 WeakPolarHBondContact O-CB 3.39Å; P11-K15 WeakPolarHBondContact O-CG 3.47Å; P11-K15 PolarHBondContact O-N 3.05Å |
| 12 | V | 62.4 | Low | 65.6 | Low | 76 Ų | 76 | 91.1 Ų | 91.1 | 46% | 0.461 | 48% | 0.477 | S | S | . | . | H | α-helix | trans | -71 | -43.7 | 176.5 | 175.6 | 0 | 0 | 0 | 0 | 110.6 | Q8 I9 L10 K16 | Q8-V12 WeakPolarHBondContact O-CG2 3.34Å; I9-V12 PolarHBondContact O-N 3.44Å; I9-V12 VanDerWaalsContact O-N 3.17Å; L10-V12 VanDerWaalsContact C-N 3.31Å; L10-V12 PolarHBondContact O-N 3.5Å; V12-K16 HydrophobicContact CG1-CD 4.33Å; V12-K16 VanDerWaalsContact O-CG 3.29Å; V12-K16 WeakPolarHBondContact O-CG 3.27Å; V12-K16 PolarHBondContact O-N 3.06Å; V12-K16 VanDerWaalsContact O-N 3.14Å |
| 13 | Q | 60.1 | Low | 67.6 | Low | 119 Ų | 119 | 90 Ų | 90 | 56% | 0.556 | 46% | 0.462 | S | S | * | . | H | α-helix | trans | -72.1 | -41.1 | 179.4 | -159.6 | 169.7 | -1.1 | 0 | 0 | 111.6 | I9 L10 K15 K16 T17 | I9-Q13 PolarHBondContact O-N 3.33Å; L10-Q13 PolarHBondContact O-N 2.89Å; Q13-K15 PolarHBondContact O-N 2.85Å; Q13-K16 PolarHBondContact O-N 3.35Å; Q13-K16 VanDerWaalsContact O-N 3.13Å; Q13-T17 PolarHBondContact O-N 2.91Å; Q13-T17 PolarHBondContact O-OG1 3.4Å |
| 14 | F | 62 | Low | 69.5 | Low | 124 Ų | 124 | 85 Ų | 85 | 54% | 0.544 | 43% | 0.432 | S | S | . | . | H | α-helix | trans | -58 | -46.1 | 173.2 | -175.3 | -94.4 | 0 | 0 | 0 | 111.9 | L10 K16 T17 C18 | L10-F14 WeakPolarHBondContact O-CB 3.31Å; L10-F14 PolarHBondContact O-N 3.39Å; F14-K16 VanDerWaalsContact C-N 3.3Å; F14-K16 PolarHBondContact O-N 3.31Å; F14-T17 PolarHBondContact O-N 3.43Å; F14-C18 HydrophobicContact CD1-CB 4.5Å; F14-C18 HydrophobicContact CD2-CB 4.15Å; F14-C18 VanDerWaalsContact CD2-SG 3.54Å; F14-C18 HydrophobicContact CE1-CB 4.29Å; F14-C18 HydrophobicContact CE2-CB 3.92Å; F14-C18 VanDerWaalsContact CE2-SG 3.52Å; F14-C18 HydrophobicContact CG-CB 4.43Å; F14-C18 HydrophobicContact CZ-CB 3.99Å; F14-C18 WeakPolarHBondContact O-CB 3.22Å; F14-C18 PolarHBondContact O-N 3.03Å |
| 15 | K | 66.3 | Low | 71.4 | Confident | 138 Ų | 138 | 80.8 Ų | 80.8 | 60% | 0.6 | 41% | 0.408 | S | S | * | . | H | α-helix | trans | -62.3 | -35.2 | 175.9 | -77.9 | 178.4 | 178.8 | -176.5 | 0 | 112.8 | P11 Q13 I19 | P11-K15 VanDerWaalsContact O-CB 3.28Å; P11-K15 WeakPolarHBondContact O-CB 3.39Å; P11-K15 WeakPolarHBondContact O-CG 3.47Å; P11-K15 PolarHBondContact O-N 3.05Å; Q13-K15 PolarHBondContact O-N 2.85Å; K15-I19 HydrophobicContact CB-CD1 4.03Å; K15-I19 HydrophobicContact CG-CD1 3.92Å; K15-I19 WeakPolarHBondContact O-CB 3.27Å |
| 16 | K | 69.2 | Low | 73.5 | Confident | 129 Ų | 129 | 79.5 Ų | 79.5 | 56% | 0.561 | 41% | 0.405 | S | S | * | . | H | α-helix | trans | -74.5 | -37.1 | 179.8 | -75.8 | 177.9 | 179.4 | -172.6 | 0 | 112.8 | V12 Q13 F14 P20 | V12-K16 HydrophobicContact CG1-CD 4.33Å; V12-K16 VanDerWaalsContact O-CG 3.29Å; V12-K16 WeakPolarHBondContact O-CG 3.27Å; V12-K16 PolarHBondContact O-N 3.06Å; V12-K16 VanDerWaalsContact O-N 3.14Å; Q13-K16 PolarHBondContact O-N 3.35Å; Q13-K16 VanDerWaalsContact O-N 3.13Å; F14-K16 VanDerWaalsContact C-N 3.3Å; F14-K16 PolarHBondContact O-N 3.31Å; K16-P20 WeakPolarHBondContact O-CD 3.17Å; K16-P20 WeakPolarHBondContact O-CG 3.36Å |
| 17 | T | 73.8 | Confident | 75.7 | Confident | 43 Ų | 43 | 75.1 Ų | 75.1 | 26% | 0.264 | 38% | 0.378 | S | S | . | . | H | α-helix | trans | -98.9 | -44.2 | -172.3 | -51.4 | 0 | 0 | 0 | 0 | 113.2 | Q13 F14 I21 N393 | Q13-T17 PolarHBondContact O-N 2.91Å; Q13-T17 PolarHBondContact O-OG1 3.4Å; F14-T17 PolarHBondContact O-N 3.43Å; T17-I21 HydrophobicContact CG2-CD1 4.37Å; T17-I21 WeakPolarHBondContact O-CD1 3.33Å; T17-I21 WeakPolarHBondContact O-CG1 3.34Å; T17-N393 WeakPolarHBondContact CA-ND2 3.38Å; T17-N393 PolarHBondContact O-ND2 3Å |
| 18 | C | 83.2 | Confident | 77.7 | Confident | 40 Ų | 40 | 68.5 Ų | 68.5 | 27% | 0.27 | 35% | 0.347 | S | S | . | . | H | α-helix | trans | -81.4 | -38.1 | -172 | -63.7 | 0 | 0 | 0 | 0 | 113.3 | F14 I21 I22 | F14-C18 HydrophobicContact CD1-CB 4.5Å; F14-C18 HydrophobicContact CD2-CB 4.15Å; F14-C18 VanDerWaalsContact CD2-SG 3.54Å; F14-C18 HydrophobicContact CE1-CB 4.29Å; F14-C18 HydrophobicContact CE2-CB 3.92Å; F14-C18 VanDerWaalsContact CE2-SG 3.52Å; F14-C18 HydrophobicContact CG-CB 4.43Å; F14-C18 HydrophobicContact CZ-CB 3.99Å; F14-C18 WeakPolarHBondContact O-CB 3.22Å; F14-C18 PolarHBondContact O-N 3.03Å; C18-I21 PolarHBondContact O-N 3.08Å; C18-I22 HydrophobicContact CB-CD1 4.37Å; C18-I22 VanDerWaalsContact O-CG1 3.3Å; C18-I22 WeakPolarHBondContact O-CG1 3.39Å; C18-I22 PolarHBondContact O-N 3.26Å |
| 19 | I | 85.9 | Confident | 79.7 | Confident | 70 Ų | 70 | 64.6 Ų | 64.6 | 36% | 0.359 | 33% | 0.33 | S | S | . | . | H | α-helix | trans | -60 | -49.2 | -177.2 | -65.3 | 176.1 | 0 | 0 | 0 | 111.8 | K15 I21 I22 S23 | K15-I19 HydrophobicContact CB-CD1 4.03Å; K15-I19 HydrophobicContact CG-CD1 3.92Å; K15-I19 WeakPolarHBondContact O-CB 3.27Å; I19-I21 VanDerWaalsContact C-N 3.32Å; I19-I21 PolarHBondContact O-N 3.45Å; I19-I22 PolarHBondContact O-N 3.38Å; I19-S23 WeakPolarHBondContact O-CB 3.24Å; I19-S23 PolarHBondContact O-N 3.39Å; I19-S23 PolarHBondContact O-OG 2.93Å |
| 20 | P | 86 | Confident | 81.7 | Confident | 6 Ų | 6 | 60.7 Ų | 60.7 | 4% | 0.039 | 31% | 0.31 | C | S | . | . | H | α-helix | trans | -56.4 | -44 | 176.8 | -29.6 | 38.7 | 0 | 0 | 0 | 113.3 | K16 S23 G24 L350 | K16-P20 WeakPolarHBondContact O-CD 3.17Å; K16-P20 WeakPolarHBondContact O-CG 3.36Å; P20-S23 WeakPolarHBondContact CA-OG 3.25Å; P20-S23 PolarHBondContact O-N 2.86Å; P20-S23 PolarHBondContact O-OG 3.27Å; P20-G24 PolarHBondContact O-N 3.03Å; P20-L350 HydrophobicContact CB-CD2 3.9Å |
| 21 | I | 89.3 | Confident | 83.6 | Confident | 35 Ų | 35 | 56.8 Ų | 56.8 | 18% | 0.179 | 29% | 0.289 | C | S | . | . | H | α-helix | trans | -63.9 | -51 | -179 | -61.2 | 173.6 | 0 | 0 | 0 | 110 | T17 C18 I19 S23 G24 Q25 V389 | T17-I21 HydrophobicContact CG2-CD1 4.37Å; T17-I21 WeakPolarHBondContact O-CD1 3.33Å; T17-I21 WeakPolarHBondContact O-CG1 3.34Å; C18-I21 PolarHBondContact O-N 3.08Å; I19-I21 VanDerWaalsContact C-N 3.32Å; I19-I21 PolarHBondContact O-N 3.45Å; I21-S23 VanDerWaalsContact C-N 3.3Å; I21-S23 PolarHBondContact O-N 2.97Å; I21-G24 PolarHBondContact O-N 3.48Å; I21-G24 VanDerWaalsContact O-N 3.13Å; I21-Q25 WeakPolarHBondContact O-CG 3.49Å; I21-Q25 PolarHBondContact O-N 3.4Å; I21-V389 HydrophobicContact CG1-CG1 4.19Å |
| 22 | I | 92.6 | Very high | 85.2 | Confident | 111 Ų | 111 | 54 Ų | 54 | 57% | 0.569 | 27% | 0.271 | S | S | * | . | H | α-helix | trans | -58.7 | -43.7 | 178.4 | -66.2 | 165.5 | 0 | 0 | 0 | 110.7 | C18 I19 G24 Q25 L26 | C18-I22 HydrophobicContact CB-CD1 4.37Å; C18-I22 VanDerWaalsContact O-CG1 3.3Å; C18-I22 WeakPolarHBondContact O-CG1 3.39Å; C18-I22 PolarHBondContact O-N 3.26Å; I19-I22 PolarHBondContact O-N 3.38Å; I22-G24 VanDerWaalsContact C-N 3.34Å; I22-G24 PolarHBondContact O-N 3.1Å; I22-Q25 PolarHBondContact O-N 2.89Å; I22-L26 PolarHBondContact O-N 3.29Å |
| 23 | S | 92.9 | Very high | 86.8 | Confident | 24 Ų | 24 | 53.1 Ų | 53.1 | 17% | 0.168 | 26% | 0.264 | C | S | . | . | H | α-helix | trans | -67.6 | -34.6 | 178.5 | 64.6 | 0 | 0 | 0 | 0 | 112.9 | I19 P20 I21 L26 L27 V342 | I19-S23 WeakPolarHBondContact O-CB 3.24Å; I19-S23 PolarHBondContact O-N 3.39Å; I19-S23 PolarHBondContact O-OG 2.93Å; P20-S23 WeakPolarHBondContact CA-OG 3.25Å; P20-S23 PolarHBondContact O-N 2.86Å; P20-S23 PolarHBondContact O-OG 3.27Å; I21-S23 VanDerWaalsContact C-N 3.3Å; I21-S23 PolarHBondContact O-N 2.97Å; S23-L26 PolarHBondContact O-N 3.48Å; S23-L27 WeakPolarHBondContact O-CG 3.3Å; S23-L27 PolarHBondContact O-N 2.88Å; S23-L27 VanDerWaalsContact O-N 3.1Å; S23-V342 WeakPolarHBondContact OG-CG1 3.29Å |
| 24 | G | 94.5 | Very high | 88.5 | Confident | 1 Ų | 1 | 48.1 Ų | 48.1 | 1% | 0.01 | 24% | 0.241 | C | C | . | . | H | α-helix | trans | -65.7 | -39.1 | 172.3 | 0 | 0 | 0 | 0 | 0 | 112.4 | P20 I21 I22 L26 L27 S28 S354 | P20-G24 PolarHBondContact O-N 3.03Å; I21-G24 PolarHBondContact O-N 3.48Å; I21-G24 VanDerWaalsContact O-N 3.13Å; I22-G24 VanDerWaalsContact C-N 3.34Å; I22-G24 PolarHBondContact O-N 3.1Å; G24-L26 VanDerWaalsContact C-N 3.35Å; G24-L27 PolarHBondContact O-N 3.26Å; G24-S28 PolarHBondContact O-N 2.97Å; G24-S28 PolarHBondContact O-OG 2.85Å; G24-S354 VanDerWaalsContact CA-OG 3.31Å; G24-S354 WeakPolarHBondContact CA-OG 3.37Å |
| 25 | Q | 95.1 | Very high | 90 | Very high | 21 Ų | 21 | 42.8 Ų | 42.8 | 10% | 0.098 | 22% | 0.22 | C | C | . | . | H | α-helix | trans | -65.8 | -36.7 | 174 | -63 | -48.2 | -72.1 | 0 | 0 | 112.4 | I21 I22 L27 S28 I29 T357 Y361 L386 | I21-Q25 WeakPolarHBondContact O-CG 3.49Å; I21-Q25 PolarHBondContact O-N 3.4Å; I22-Q25 PolarHBondContact O-N 2.89Å; Q25-L27 VanDerWaalsContact C-N 3.34Å; Q25-S28 WeakPolarHBondContact CA-OG 3.07Å; Q25-S28 PolarHBondContact O-N 2.88Å; Q25-S28 PolarHBondContact O-OG 3.42Å; Q25-I29 VanDerWaalsContact O-CG1 3.32Å; Q25-I29 WeakPolarHBondContact O-CG1 3.23Å; Q25-I29 PolarHBondContact O-N 2.93Å; Q25-T357 PolarHBondContact NE2-OG1 3.16Å; Q25-T357 PolarHBondContact OE1-OG1 3.28Å; Q25-Y361 PolarHBondContact OE1-OH 2.71Å; Q25-L386 HydrophobicContact CG-CD2 4.25Å |
| 26 | L | 96.3 | Very high | 91.2 | Very high | 85 Ų | 85 | 37 Ų | 37 | 45% | 0.445 | 20% | 0.196 | S | C | . | . | H | α-helix | trans | -62.7 | -43.1 | 173.5 | 179.2 | 61.5 | 0 | 0 | 0 | 111.4 | I22 S23 G24 L30 L338 | I22-L26 PolarHBondContact O-N 3.29Å; S23-L26 PolarHBondContact O-N 3.48Å; G24-L26 VanDerWaalsContact C-N 3.35Å; L26-L30 WeakPolarHBondContact O-CG 3.36Å; L26-L30 PolarHBondContact O-N 3.1Å; L26-L338 HydrophobicContact CD2-CD1 3.7Å; L26-L338 HydrophobicContact CG-CD1 4.15Å |
| 27 | L | 97.5 | Very high | 92.4 | Very high | 1 Ų | 1 | 31.5 Ų | 31.5 | 1% | 0.005 | 17% | 0.173 | C | C | . | . | H | α-helix | trans | -63.7 | -41.3 | 175.4 | -67.2 | -179.6 | 0 | 0 | 0 | 111.8 | S23 G24 Q25 L30 I31 L335 L338 M339 V342 V351 L355 | S23-L27 WeakPolarHBondContact O-CG 3.3Å; S23-L27 PolarHBondContact O-N 2.88Å; S23-L27 VanDerWaalsContact O-N 3.1Å; G24-L27 PolarHBondContact O-N 3.26Å; Q25-L27 VanDerWaalsContact C-N 3.34Å; L27-L30 WeakPolarHBondContact O-CB 3.11Å; L27-L30 PolarHBondContact O-N 2.84Å; L27-I31 PolarHBondContact O-N 3.27Å; L27-L335 HydrophobicContact CD2-CG 4.45Å; L27-L338 HydrophobicContact CD2-CB 3.65Å; L27-M339 HydrophobicContact CD1-CE 4.09Å; L27-M339 HydrophobicContact CD1-SD 3.87Å; L27-V342 HydrophobicContact CD1-CB 3.82Å; L27-V342 HydrophobicContact CD1-CG1 4.06Å; L27-V342 HydrophobicContact CD1-CG2 3.62Å; L27-V342 HydrophobicContact CG-CG2 4.07Å; L27-V351 HydrophobicContact CD1-CG1 4.05Å; L27-L355 HydrophobicContact CB-CD2 3.82Å |
| 28 | S | 96.9 | Very high | 93.4 | Very high | 0 Ų | 0 | 29.9 Ų | 29.9 | 0% | 0 | 16% | 0.163 | C | C | . | . | H | α-helix | trans | -68.7 | -34.2 | -178.7 | 67.3 | 0 | 0 | 0 | 0 | 113 | G24 Q25 L30 I31 G32 S354 T357 S358 Y361 | G24-S28 PolarHBondContact O-N 2.97Å; G24-S28 PolarHBondContact O-OG 2.85Å; Q25-S28 WeakPolarHBondContact CA-OG 3.07Å; Q25-S28 PolarHBondContact O-N 2.88Å; Q25-S28 PolarHBondContact O-OG 3.42Å; S28-L30 VanDerWaalsContact C-N 3.33Å; S28-L30 PolarHBondContact O-N 2.85Å; S28-I31 PolarHBondContact O-N 3.45Å; S28-G32 PolarHBondContact O-N 3.42Å; S28-S354 WeakPolarHBondContact CB-O 3.11Å; S28-T357 WeakPolarHBondContact CB-OG1 3.43Å; S28-T357 PolarHBondContact OG-OG1 3.49Å; S28-S358 WeakPolarHBondContact O-CA 3.09Å; S28-S358 WeakPolarHBondContact O-CB 3.15Å; S28-Y361 WeakPolarHBondContact OG-CD2 3.41Å; S28-Y361 WeakPolarHBondContact OG-CE2 3.35Å |
| 29 | I | 96.7 | Very high | 93.7 | Very high | 57 Ų | 57 | 28.8 Ų | 28.8 | 29% | 0.292 | 16% | 0.158 | S | C | . | . | H | α-helix | trans | -60.5 | -44.2 | 169.7 | -67.8 | 165.1 | 0 | 0 | 0 | 110.7 | Q25 G32 L33 Y361 | Q25-I29 VanDerWaalsContact O-CG1 3.32Å; Q25-I29 WeakPolarHBondContact O-CG1 3.23Å; Q25-I29 PolarHBondContact O-N 2.93Å; I29-G32 PolarHBondContact O-N 3.03Å; I29-L33 HydrophobicContact CG2-CD1 4.47Å; I29-L33 WeakPolarHBondContact O-CG 3.37Å; I29-L33 PolarHBondContact O-N 2.91Å; I29-Y361 HydrophobicContact CD1-CE1 4.22Å; I29-Y361 HydrophobicContact CG1-CD1 3.86Å; I29-Y361 HydrophobicContact CG1-CD2 3.76Å; I29-Y361 HydrophobicContact CG1-CE1 3.79Å; I29-Y361 HydrophobicContact CG1-CE2 3.69Å; I29-Y361 HydrophobicContact CG1-CG 3.85Å |
| 30 | L | 97.6 | Very high | 93.9 | Very high | 13 Ų | 13 | 26.1 Ų | 26.1 | 7% | 0.068 | 15% | 0.145 | C | C | . | . | H | α-helix | trans | -63.8 | -41 | 178.3 | -67.1 | 167.5 | 0 | 0 | 0 | 111.8 | L26 L27 S28 L33 T34 L334 L335 L338 | L26-L30 WeakPolarHBondContact O-CG 3.36Å; L26-L30 PolarHBondContact O-N 3.1Å; L27-L30 WeakPolarHBondContact O-CB 3.11Å; L27-L30 PolarHBondContact O-N 2.84Å; S28-L30 VanDerWaalsContact C-N 3.33Å; S28-L30 PolarHBondContact O-N 2.85Å; L30-L33 PolarHBondContact O-N 3.49Å; L30-T34 WeakPolarHBondContact O-CG2 3.4Å; L30-T34 PolarHBondContact O-N 3.31Å; L30-L334 HydrophobicContact CD1-CB 3.85Å; L30-L334 HydrophobicContact CD2-CB 3.99Å; L30-L334 HydrophobicContact CD2-CD1 4.07Å; L30-L335 HydrophobicContact CB-CB 4.16Å; L30-L335 HydrophobicContact CB-CD1 4.23Å; L30-L335 HydrophobicContact CD1-CB 4.31Å; L30-L338 HydrophobicContact CD1-CD1 3.94Å |
| 31 | I | 95.9 | Very high | 94.1 | Very high | 40 Ų | 40 | 26.1 Ų | 26.1 | 21% | 0.205 | 15% | 0.145 | C | C | . | . | H | α-helix | trans | -62.7 | -45.6 | 172.2 | -65.2 | -170.3 | 0 | 0 | 0 | 111 | L27 S28 L33 T34 A35 L335 L355 S358 | L27-I31 PolarHBondContact O-N 3.27Å; S28-I31 PolarHBondContact O-N 3.45Å; I31-L33 VanDerWaalsContact C-N 3.25Å; I31-L33 PolarHBondContact O-N 2.97Å; I31-T34 WeakPolarHBondContact O-CA 3.33Å; I31-T34 WeakPolarHBondContact O-CB 3.49Å; I31-T34 PolarHBondContact O-N 2.87Å; I31-T34 PolarHBondContact O-OG1 2.67Å; I31-A35 PolarHBondContact O-N 3.47Å; I31-L335 HydrophobicContact CB-CD1 4.29Å; I31-L335 HydrophobicContact CD1-CD1 3.85Å; I31-L335 HydrophobicContact CG1-CD1 3.08Å; I31-L355 HydrophobicContact CD1-CB 4.07Å; I31-L355 HydrophobicContact CD1-CD1 3.49Å; I31-L355 VanDerWaalsContact CD1-CD1 3.49Å; I31-L355 HydrophobicContact CD1-CD2 3.43Å; I31-L355 VanDerWaalsContact CD1-CD2 3.43Å; I31-L355 HydrophobicContact CD1-CG 3.78Å; I31-L355 HydrophobicContact CG1-CD2 4.28Å; I31-S358 WeakPolarHBondContact CG2-OG 3.36Å |
| 32 | G | 94.9 | Very high | 94.2 | Very high | 0 Ų | 0 | 25 Ų | 25 | 0% | 0 | 14% | 0.14 | C | C | . | . | H | α-helix | trans | -57.1 | -40.4 | 179 | 0 | 0 | 0 | 0 | 0 | 112.1 | S28 I29 T34 A35 I36 | S28-G32 PolarHBondContact O-N 3.42Å; I29-G32 PolarHBondContact O-N 3.03Å; G32-T34 VanDerWaalsContact C-N 3.34Å; G32-T34 PolarHBondContact O-N 3.08Å; G32-A35 PolarHBondContact O-N 2.94Å; G32-I36 WeakPolarHBondContact O-CD1 3.38Å; G32-I36 VanDerWaalsContact O-CG1 3.26Å; G32-I36 WeakPolarHBondContact O-CG1 3.2Å; G32-I36 PolarHBondContact O-N 3.46Å; G32-I36 VanDerWaalsContact O-N 3.09Å |
| 33 | L | 95.1 | Very high | 93.8 | Very high | 59 Ų | 59 | 25.7 Ų | 25.7 | 31% | 0.309 | 14% | 0.135 | S | C | . | . | H | α-helix | trans | -60.9 | -40 | 173.9 | -71.8 | 171.8 | 0 | 0 | 0 | 112.8 | I29 L30 I31 C37 | I29-L33 HydrophobicContact CG2-CD1 4.47Å; I29-L33 WeakPolarHBondContact O-CG 3.37Å; I29-L33 PolarHBondContact O-N 2.91Å; L30-L33 PolarHBondContact O-N 3.49Å; I31-L33 VanDerWaalsContact C-N 3.25Å; I31-L33 PolarHBondContact O-N 2.97Å; L33-C37 PolarHBondContact O-N 2.85Å; L33-C37 PolarHBondContact O-SG 2.83Å |
| 34 | T | 95.7 | Very high | 93.4 | Very high | 13 Ų | 13 | 27.3 Ų | 27.3 | 8% | 0.08 | 14% | 0.138 | C | C | . | . | H | α-helix | trans | -67.4 | -38.3 | 177 | 67 | 0 | 0 | 0 | 0 | 112.3 | L30 I31 G32 C37 N38 Y328 M332 | L30-T34 WeakPolarHBondContact O-CG2 3.4Å; L30-T34 PolarHBondContact O-N 3.31Å; I31-T34 WeakPolarHBondContact O-CA 3.33Å; I31-T34 WeakPolarHBondContact O-CB 3.49Å; I31-T34 PolarHBondContact O-N 2.87Å; I31-T34 PolarHBondContact O-OG1 2.67Å; G32-T34 VanDerWaalsContact C-N 3.34Å; G32-T34 PolarHBondContact O-N 3.08Å; T34-C37 PolarHBondContact O-N 3.39Å; T34-N38 PolarHBondContact O-N 3.5Å; T34-N38 PolarHBondContact O-ND2 3.36Å; T34-Y328 HydrophobicContact CG2-CD2 4.05Å; T34-Y328 HydrophobicContact CG2-CE2 4.08Å; T34-M332 HydrophobicContact CG2-CG 3.67Å; T34-M332 HydrophobicContact CG2-SD 3.8Å |
| 35 | A | 94.2 | Very high | 93 | Very high | 12 Ų | 12 | 33.4 Ų | 33.4 | 10% | 0.099 | 17% | 0.171 | C | C | . | . | H | α-helix | trans | -63 | -43.6 | 177 | 0 | 0 | 0 | 0 | 0 | 111.7 | I31 G32 N38 G39 Y157 A362 | I31-A35 PolarHBondContact O-N 3.47Å; G32-A35 PolarHBondContact O-N 2.94Å; A35-N38 PolarHBondContact O-N 3.24Å; A35-G39 PolarHBondContact O-N 3.45Å; A35-Y157 WeakPolarHBondContact CA-OH 3.22Å; A35-Y157 VanDerWaalsContact CB-OH 3.27Å; A35-Y157 WeakPolarHBondContact CB-OH 3.43Å; A35-A362 HydrophobicContact CB-CB 4.14Å |
| 36 | I | 92.3 | Very high | 92.7 | Very high | 17 Ų | 17 | 33.1 Ų | 33.1 | 9% | 0.087 | 17% | 0.17 | C | C | . | . | H | α-helix | trans | -64.7 | -46.2 | 176.2 | -59.7 | 154.5 | 0 | 0 | 0 | 110.7 | G32 N38 G39 V40 A362 M365 I369 | G32-I36 WeakPolarHBondContact O-CD1 3.38Å; G32-I36 VanDerWaalsContact O-CG1 3.26Å; G32-I36 WeakPolarHBondContact O-CG1 3.2Å; G32-I36 PolarHBondContact O-N 3.46Å; G32-I36 VanDerWaalsContact O-N 3.09Å; I36-N38 VanDerWaalsContact C-N 3.31Å; I36-N38 PolarHBondContact O-N 3.46Å; I36-G39 PolarHBondContact O-N 2.91Å; I36-V40 HydrophobicContact CG2-CG2 4.29Å; I36-V40 WeakPolarHBondContact O-CG2 3.39Å; I36-V40 PolarHBondContact O-N 3.28Å; I36-A362 HydrophobicContact CG1-CB 4.28Å; I36-M365 HydrophobicContact CD1-CB 3.2Å; I36-M365 HydrophobicContact CD1-CG 3.95Å; I36-M365 HydrophobicContact CG1-CB 4.39Å; I36-I369 HydrophobicContact CG2-CD1 4.25Å |
| 37 | C | 94.3 | Very high | 92.5 | Very high | 14 Ų | 14 | 31.2 Ų | 31.2 | 10% | 0.095 | 16% | 0.16 | C | C | . | . | H | α-helix | trans | -55.8 | -49.8 | 177.9 | -68.5 | 0 | 0 | 0 | 0 | 110.2 | L33 T34 G39 V40 L41 C324 Y328 | L33-C37 PolarHBondContact O-N 2.85Å; L33-C37 PolarHBondContact O-SG 2.83Å; T34-C37 PolarHBondContact O-N 3.39Å; C37-G39 PolarHBondContact O-N 3.32Å; C37-V40 PolarHBondContact O-N 2.67Å; C37-L41 WeakPolarHBondContact O-CD1 3.45Å; C37-L41 PolarHBondContact O-N 2.9Å; C37-C324 HydrophobicContact CB-CB 4.14Å; C37-Y328 HydrophobicContact CB-CD2 4.18Å |
| 38 | N | 94.2 | Very high | 92.4 | Very high | 9 Ų | 9 | 31.6 Ų | 31.6 | 5% | 0.048 | 16% | 0.162 | C | C | . | . | H | α-helix | trans | -63.4 | -40.5 | 177.2 | -74.8 | -26.1 | 0 | 0 | 0 | 113.2 | T34 A35 I36 V40 L41 S42 Y157 Y328 | T34-N38 PolarHBondContact O-N 3.5Å; T34-N38 PolarHBondContact O-ND2 3.36Å; A35-N38 PolarHBondContact O-N 3.24Å; I36-N38 VanDerWaalsContact C-N 3.31Å; I36-N38 PolarHBondContact O-N 3.46Å; N38-V40 VanDerWaalsContact C-N 3.33Å; N38-V40 PolarHBondContact O-N 3.12Å; N38-L41 PolarHBondContact O-N 3.49Å; N38-S42 VanDerWaalsContact O-CB 3.31Å; N38-S42 WeakPolarHBondContact O-CB 3.44Å; N38-S42 PolarHBondContact O-N 3.16Å; N38-Y157 HydrophobicContact CB-CD1 3.92Å; N38-Y157 HydrophobicContact CB-CD2 3.74Å; N38-Y157 HydrophobicContact CB-CE1 4.06Å; N38-Y157 HydrophobicContact CB-CE2 3.92Å; N38-Y157 HydrophobicContact CB-CG 3.76Å; N38-Y328 WeakPolarHBondContact ND2-CE2 3.31Å |
| 39 | G | 90.7 | Very high | 92.3 | Very high | 16 Ų | 16 | 31.9 Ų | 31.9 | 17% | 0.165 | 16% | 0.164 | C | C | . | . | H | α-helix | trans | -59.7 | -43 | 175.4 | 0 | 0 | 0 | 0 | 0 | 112.1 | A35 I36 C37 S42 R43 | A35-G39 PolarHBondContact O-N 3.45Å; I36-G39 PolarHBondContact O-N 2.91Å; C37-G39 PolarHBondContact O-N 3.32Å; G39-S42 PolarHBondContact O-N 3.2Å; G39-R43 WeakPolarHBondContact O-CG 3.5Å; G39-R43 PolarHBondContact O-N 3.38Å; G39-R43 VanDerWaalsContact O-N 3.16Å |
| 40 | V | 89.2 | Confident | 92.3 | Very high | 15 Ų | 15 | 29.4 Ų | 29.4 | 9% | 0.091 | 15% | 0.151 | C | C | . | . | H | α-helix | trans | -67.7 | -46.4 | 176 | 175.2 | 0 | 0 | 0 | 0 | 111.4 | I36 C37 N38 S42 R43 Y44 F370 | I36-V40 HydrophobicContact CG2-CG2 4.29Å; I36-V40 WeakPolarHBondContact O-CG2 3.39Å; I36-V40 PolarHBondContact O-N 3.28Å; C37-V40 PolarHBondContact O-N 2.67Å; N38-V40 VanDerWaalsContact C-N 3.33Å; N38-V40 PolarHBondContact O-N 3.12Å; V40-S42 VanDerWaalsContact C-N 3.28Å; V40-S42 PolarHBondContact O-N 3.45Å; V40-R43 WeakPolarHBondContact O-CB 3.46Å; V40-R43 PolarHBondContact O-N 3.01Å; V40-Y44 HydrophobicContact CG1-CD2 4.08Å; V40-Y44 HydrophobicContact CG1-CE2 3.77Å; V40-Y44 WeakPolarHBondContact O-CD2 3.49Å; V40-Y44 PolarHBondContact O-N 3.11Å; V40-F370 HydrophobicContact CG2-CE2 3.9Å; V40-F370 HydrophobicContact CG2-CZ 3.6Å |
| 41 | L | 91.2 | Very high | 92.2 | Very high | 5 Ų | 5 | 29.6 Ų | 29.6 | 3% | 0.026 | 16% | 0.155 | C | C | . | . | H | α-helix | trans | -58.7 | -41.4 | 176.1 | -90.9 | 84.8 | 0 | 0 | 0 | 111.8 | C37 N38 R43 Y44 N45 I46 I52 C324 F325 | C37-L41 WeakPolarHBondContact O-CD1 3.45Å; C37-L41 PolarHBondContact O-N 2.9Å; N38-L41 PolarHBondContact O-N 3.49Å; L41-R43 VanDerWaalsContact C-N 3.35Å; L41-R43 PolarHBondContact O-N 3.01Å; L41-Y44 CarbonylContact O-C 3.59Å; L41-Y44 WeakPolarHBondContact O-CA 3.36Å; L41-Y44 PolarHBondContact O-N 3.33Å; L41-N45 PolarHBondContact O-N 2.84Å; L41-I46 HydrophobicContact CB-CB 4.29Å; L41-I46 HydrophobicContact CD2-CB 4.41Å; L41-I46 HydrophobicContact CD2-CG2 3.87Å; L41-I46 HydrophobicContact CG-CB 4.43Å; L41-I46 HydrophobicContact CG-CG2 4.39Å; L41-I46 PolarHBondContact O-N 2.84Å; L41-I52 HydrophobicContact CD2-CD1 3.88Å; L41-C324 HydrophobicContact CD1-CB 3.17Å; L41-F325 HydrophobicContact CD2-CD2 4.1Å; L41-F325 HydrophobicContact CD2-CE1 4.41Å; L41-F325 HydrophobicContact CD2-CE2 3.5Å; L41-F325 VanDerWaalsContact CD2-CE2 3.5Å; L41-F325 HydrophobicContact CD2-CZ 3.66Å; L41-F325 HydrophobicContact CG-CE2 4.37Å |
| 42 | S | 89.7 | Confident | 92.2 | Very high | 11 Ų | 11 | 27.8 Ų | 27.8 | 8% | 0.077 | 15% | 0.146 | C | C | . | . | H | α-helix | trans | -62.7 | -39.3 | 178.3 | -178.7 | 0 | 0 | 0 | 0 | 112.1 | N38 G39 V40 Y44 N45 Y157 Q242 | N38-S42 VanDerWaalsContact O-CB 3.31Å; N38-S42 WeakPolarHBondContact O-CB 3.44Å; N38-S42 PolarHBondContact O-N 3.16Å; G39-S42 PolarHBondContact O-N 3.2Å; V40-S42 VanDerWaalsContact C-N 3.28Å; V40-S42 PolarHBondContact O-N 3.45Å; S42-Y44 PolarHBondContact O-N 3.19Å; S42-N45 WeakPolarHBondContact O-CA 3.47Å; S42-N45 PolarHBondContact O-N 2.84Å; S42-Y157 WeakPolarHBondContact CB-O 3.45Å; S42-Y157 PolarHBondContact OG-O 2.94Å; S42-Q242 PolarHBondContact O-NE2 3.24Å |
| 43 | R | 84.6 | Confident | 92.3 | Very high | 126 Ų | 126 | 28 Ų | 28 | 48% | 0.475 | 15% | 0.146 | S | C | . | . | H | α-helix | trans | -60 | -28.7 | 172.7 | -71.2 | 177.5 | -179.5 | 176.1 | 3.9 | 113 | G39 V40 L41 N45 | G39-R43 WeakPolarHBondContact O-CG 3.5Å; G39-R43 PolarHBondContact O-N 3.38Å; G39-R43 VanDerWaalsContact O-N 3.16Å; V40-R43 WeakPolarHBondContact O-CB 3.46Å; V40-R43 PolarHBondContact O-N 3.01Å; L41-R43 VanDerWaalsContact C-N 3.35Å; L41-R43 PolarHBondContact O-N 3.01Å; R43-N45 VanDerWaalsContact C-N 3.28Å |
| 44 | Y | 85.3 | Confident | 92.5 | Very high | 58 Ų | 58 | 27.8 Ų | 27.8 | 23% | 0.227 | 14% | 0.143 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -87.2 | 9.3 | 173.2 | -69.1 | -69.9 | 0 | 0 | 0 | 113.5 | V40 L41 S42 I46 M316 D317 K320 V321 | V40-Y44 HydrophobicContact CG1-CD2 4.08Å; V40-Y44 HydrophobicContact CG1-CE2 3.77Å; V40-Y44 WeakPolarHBondContact O-CD2 3.49Å; V40-Y44 PolarHBondContact O-N 3.11Å; L41-Y44 CarbonylContact O-C 3.59Å; L41-Y44 WeakPolarHBondContact O-CA 3.36Å; L41-Y44 PolarHBondContact O-N 3.33Å; S42-Y44 PolarHBondContact O-N 3.19Å; Y44-I46 PolarHBondContact O-N 3.41Å; Y44-M316 HydrophobicContact CD1-SD 3.53Å; Y44-M316 VanDerWaalsContact CD1-SD 3.53Å; Y44-M316 HydrophobicContact CE1-SD 3.96Å; Y44-D317 PolarHBondContact OH-OD2 2.95Å; Y44-D317 VanDerWaalsContact OH-OD2 3.06Å; Y44-K320 WeakPolarHBondContact OH-CD 3.49Å; Y44-V321 HydrophobicContact CD2-CG2 4.32Å |
| 45 | N | 85.8 | Confident | 92.6 | Very high | 129 Ų | 129 | 29.3 Ų | 29.3 | 69% | 0.69 | 15% | 0.153 | S | C | * | . | T | Hydrogen-bonded Turn | trans | 54.8 | 30.6 | -173.4 | -66.1 | -46.2 | 0 | 0 | 0 | 113.3 | L41 S42 R43 Q242 | L41-N45 PolarHBondContact O-N 2.84Å; S42-N45 WeakPolarHBondContact O-CA 3.47Å; S42-N45 PolarHBondContact O-N 2.84Å; R43-N45 VanDerWaalsContact C-N 3.28Å; N45-Q242 PolarHBondContact OD1-NE2 2.88Å |
| 46 | I | 89.4 | Confident | 92.7 | Very high | 15 Ų | 15 | 28.7 Ų | 28.7 | 8% | 0.077 | 15% | 0.148 | C | C | . | . | trans | -96.9 | 107.4 | 175.6 | -60.6 | 175.1 | 0 | 0 | 0 | 108.3 | L41 Y44 L48 I309 V321 F325 | L41-I46 HydrophobicContact CB-CB 4.29Å; L41-I46 HydrophobicContact CD2-CB 4.41Å; L41-I46 HydrophobicContact CD2-CG2 3.87Å; L41-I46 HydrophobicContact CG-CB 4.43Å; L41-I46 HydrophobicContact CG-CG2 4.39Å; L41-I46 PolarHBondContact O-N 2.84Å; Y44-I46 PolarHBondContact O-N 3.41Å; I46-L48 HydrophobicContact CG2-CD1 4.27Å; I46-L48 HydrophobicContact CG2-CG 4.26Å; I46-I309 HydrophobicContact CD1-CG2 4.48Å; I46-I309 HydrophobicContact CG1-CD1 4.33Å; I46-I309 HydrophobicContact CG2-CD1 3.81Å; I46-V321 HydrophobicContact CD1-CB 4.43Å; I46-V321 HydrophobicContact CD1-CG1 3.6Å; I46-V321 HydrophobicContact CD1-CG2 3.9Å; I46-F325 HydrophobicContact CG2-CE2 4.29Å; I46-F325 HydrophobicContact CG2-CZ 4.26Å | ||
| 47 | N | 91.2 | Very high | 93 | Very high | 45 Ų | 45 | 27.9 Ų | 27.9 | 24% | 0.241 | 14% | 0.144 | C | C | . | . | trans | -118.1 | 96.6 | 173.1 | -170.7 | 22 | 0 | 0 | 0 | 109.7 | P49 A158 | N47-P49 VanDerWaalsContact C-CD 3.43Å; N47-P49 WeakPolarHBondContact OD1-CD 3.24Å; N47-A158 HydrophobicContact CB-CB 3.77Å; N47-A158 VanDerWaalsContact CG-CB 3.49Å; N47-A158 VanDerWaalsContact ND2-CB 3.34Å; N47-A158 WeakPolarHBondContact ND2-CB 3Å | ||
| 48 | L | 94.6 | Very high | 93.2 | Very high | 10 Ų | 10 | 31.5 Ų | 31.5 | 5% | 0.052 | 16% | 0.158 | C | C | . | . | trans | -127.7 | 65.1 | 179.2 | -70.9 | 179.4 | 0 | 0 | 0 | 110.6 | I46 L50 A51 I52 E302 I306 I309 F325 | I46-L48 HydrophobicContact CG2-CD1 4.27Å; I46-L48 HydrophobicContact CG2-CG 4.26Å; L48-L50 VanDerWaalsContact C-N 3.25Å; L48-L50 PolarHBondContact O-N 3.16Å; L48-A51 HydrophobicContact CB-CB 4.17Å; L48-A51 PolarHBondContact O-N 3.31Å; L48-I52 WeakPolarHBondContact O-CB 3.16Å; L48-I52 VanDerWaalsContact O-CG2 3.24Å; L48-I52 WeakPolarHBondContact O-CG2 3.38Å; L48-I52 PolarHBondContact O-N 3.3Å; L48-E302 HydrophobicContact CD2-CB 4.01Å; L48-E302 HydrophobicContact CD2-CG 4.16Å; L48-I306 HydrophobicContact CD1-CG1 3.91Å; L48-I306 HydrophobicContact CD2-CG1 3.89Å; L48-I309 HydrophobicContact CD1-CD1 3.53Å; L48-I309 HydrophobicContact CD2-CD1 4.36Å; L48-I309 HydrophobicContact CG-CD1 3.92Å; L48-F325 HydrophobicContact CB-CZ 4.4Å; L48-F325 HydrophobicContact CD1-CZ 3.96Å | ||
| 49 | P | 95.9 | Very high | 93.4 | Very high | 6 Ų | 6 | 33.4 Ų | 33.4 | 4% | 0.039 | 17% | 0.168 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -61.6 | -28.2 | -171.2 | 26.3 | -37.3 | 0 | 0 | 0 | 113.9 | N47 N53 W151 V154 T155 E302 | N47-P49 VanDerWaalsContact C-CD 3.43Å; N47-P49 WeakPolarHBondContact OD1-CD 3.24Å; P49-N53 PolarHBondContact O-ND2 2.81Å; P49-W151 HydrophobicContact CB-CG 4.47Å; P49-V154 HydrophobicContact CB-CB 3.81Å; P49-V154 HydrophobicContact CB-CG1 3.83Å; P49-T155 WeakPolarHBondContact CB-OG1 3.34Å; P49-T155 VanDerWaalsContact CG-OG1 3.3Å; P49-T155 WeakPolarHBondContact CG-OG1 3.33Å; P49-E302 WeakPolarHBondContact CD-OE1 3.36Å; P49-E302 VanDerWaalsContact CG-OE1 3.23Å; P49-E302 WeakPolarHBondContact CG-OE1 3.24Å; P49-E302 VanDerWaalsContact N-OE1 3.16Å |
| 50 | L | 96.2 | Very high | 93.8 | Very high | 4 Ų | 4 | 32.7 Ų | 32.7 | 2% | 0.021 | 16% | 0.161 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -90.5 | -45.9 | -179.1 | -58.1 | 156.3 | 0 | 0 | 0 | 110.7 | L48 I52 N53 F54 W151 Y297 T298 L301 E302 | L48-L50 VanDerWaalsContact C-N 3.25Å; L48-L50 PolarHBondContact O-N 3.16Å; L50-I52 VanDerWaalsContact C-N 3.33Å; L50-I52 PolarHBondContact O-N 3.35Å; L50-N53 PolarHBondContact O-N 3.31Å; L50-N53 VanDerWaalsContact O-N 3.15Å; L50-F54 PolarHBondContact O-N 2.94Å; L50-W151 HydrophobicContact CD2-CB 4.23Å; L50-W151 HydrophobicContact CD2-CG 4.24Å; L50-Y297 HydrophobicContact CD2-CD2 3.9Å; L50-Y297 HydrophobicContact CD2-CG 4.41Å; L50-T298 VanDerWaalsContact C-OG1 3.22Å; L50-T298 VanDerWaalsContact CB-OG1 3.28Å; L50-T298 WeakPolarHBondContact CB-OG1 3.29Å; L50-T298 PolarHBondContact O-OG1 3.03Å; L50-L301 HydrophobicContact CD1-CB 4.31Å; L50-L301 HydrophobicContact CD1-CD1 4.01Å; L50-E302 WeakPolarHBondContact CB-OE1 3.18Å; L50-E302 HydrophobicContact CD1-CG 4.24Å; L50-E302 WeakPolarHBondContact CD1-OE1 3.37Å; L50-E302 WeakPolarHBondContact CG-OE1 3.29Å; L50-E302 PolarHBondContact N-OE1 3.23Å; L50-E302 PolarHBondContact N-OE2 2.6Å |
| 51 | A | 95.8 | Very high | 94.2 | Very high | 18 Ų | 18 | 34.3 Ų | 34.3 | 15% | 0.149 | 17% | 0.167 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -64.2 | -36.1 | -179 | 0 | 0 | 0 | 0 | 0 | 112.6 | L48 N53 P55 T298 E302 I306 | L48-A51 HydrophobicContact CB-CB 4.17Å; L48-A51 PolarHBondContact O-N 3.31Å; A51-N53 VanDerWaalsContact C-N 3.27Å; A51-N53 PolarHBondContact O-N 3.03Å; A51-P55 VanDerWaalsContact O-CD 3.23Å; A51-P55 WeakPolarHBondContact O-CD 3.38Å; A51-T298 HydrophobicContact CB-CG2 3.73Å; A51-T298 PolarHBondContact N-OG1 3.08Å; A51-E302 VanDerWaalsContact CB-OE2 3.28Å; A51-E302 WeakPolarHBondContact CB-OE2 3.12Å; A51-E302 PolarHBondContact N-OE2 3.34Å; A51-I306 HydrophobicContact CB-CD1 3.95Å; A51-I306 HydrophobicContact CB-CG1 4.48Å |
| 52 | I | 96.2 | Very high | 94.6 | Very high | 2 Ų | 2 | 37.7 Ų | 37.7 | 1% | 0.01 | 19% | 0.185 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -69.6 | -27.5 | 177 | -155.9 | 178.2 | 0 | 0 | 0 | 112.3 | L41 L48 L50 V154 F325 Y328 | L41-I52 HydrophobicContact CD2-CD1 3.88Å; L48-I52 WeakPolarHBondContact O-CB 3.16Å; L48-I52 VanDerWaalsContact O-CG2 3.24Å; L48-I52 WeakPolarHBondContact O-CG2 3.38Å; L48-I52 PolarHBondContact O-N 3.3Å; L50-I52 VanDerWaalsContact C-N 3.33Å; L50-I52 PolarHBondContact O-N 3.35Å; I52-V154 HydrophobicContact CG2-CG1 4.11Å; I52-F325 HydrophobicContact CB-CD1 4.2Å; I52-F325 HydrophobicContact CB-CE1 3.83Å; I52-F325 HydrophobicContact CD1-CD1 4.36Å; I52-F325 HydrophobicContact CD1-CE1 4.33Å; I52-F325 HydrophobicContact CG1-CD1 3.69Å; I52-F325 HydrophobicContact CG1-CE1 3.76Å; I52-Y328 HydrophobicContact CB-CD1 4.4Å; I52-Y328 HydrophobicContact CB-CE1 4.39Å; I52-Y328 HydrophobicContact CD1-CD1 3.8Å; I52-Y328 HydrophobicContact CD1-CD2 3.84Å; I52-Y328 HydrophobicContact CD1-CE1 4.24Å; I52-Y328 HydrophobicContact CD1-CE2 4.32Å; I52-Y328 HydrophobicContact CD1-CG 3.56Å; I52-Y328 HydrophobicContact CG1-CD1 3.49Å; I52-Y328 VanDerWaalsContact CG1-CD1 3.49Å; I52-Y328 HydrophobicContact CG1-CD2 4.46Å; I52-Y328 HydrophobicContact CG1-CE1 3.92Å; I52-Y328 HydrophobicContact CG1-CG 3.78Å; I52-Y328 HydrophobicContact CG2-CD1 4.38Å; I52-Y328 HydrophobicContact CG2-CE1 3.91Å; I52-Y328 WeakPolarHBondContact O-CD1 3.42Å |
| 53 | N | 97.6 | Very high | 95 | Very high | 3 Ų | 3 | 43.1 Ų | 43.1 | 2% | 0.016 | 21% | 0.207 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -88.9 | -26.8 | -178.9 | -82.1 | -49.8 | 0 | 0 | 0 | 113.7 | P49 L50 A51 P55 H56 Y57 N150 Y328 | P49-N53 PolarHBondContact O-ND2 2.81Å; L50-N53 PolarHBondContact O-N 3.31Å; L50-N53 VanDerWaalsContact O-N 3.15Å; A51-N53 VanDerWaalsContact C-N 3.27Å; A51-N53 PolarHBondContact O-N 3.03Å; N53-P55 VanDerWaalsContact C-CD 3.48Å; N53-H56 PolarHBondContact O-CE1 3.35Å; N53-H56 PolarHBondContact O-N 2.86Å; N53-H56 PolarHBondContact O-ND1 2.85Å; N53-H56 PolarHBondContact OD1-CE1 2.92Å; N53-Y57 HydrophobicContact CB-CD2 4.48Å; N53-Y57 HydrophobicContact CB-CE2 4.17Å; N53-Y57 VanDerWaalsContact O-CD2 3.29Å; N53-Y57 WeakPolarHBondContact O-CD2 3.37Å; N53-N150 PolarHBondContact OD1-OD1 3.41Å; N53-Y328 VanDerWaalsContact OD1-CE1 3.31Å; N53-Y328 WeakPolarHBondContact OD1-CE1 3.38Å; N53-Y328 PolarHBondContact OD1-OH 3.49Å |
| 54 | F | 97.9 | Very high | 95.6 | Very high | 56 Ų | 56 | 40 Ų | 40 | 25% | 0.246 | 20% | 0.195 | C | C | . | . | H | α-helix | trans | -51.6 | -46.5 | 179.1 | 169.3 | -100.8 | 0 | 0 | 0 | 114.5 | L50 H56 Y57 F58 L295 | L50-F54 PolarHBondContact O-N 2.94Å; F54-H56 PolarHBondContact O-N 3.24Å; F54-Y57 PolarHBondContact O-N 3.27Å; F54-F58 HydrophobicContact CE1-CB 4.36Å; F54-F58 HydrophobicContact CE2-CB 4.19Å; F54-F58 HydrophobicContact CZ-CB 4.01Å; F54-F58 HydrophobicContact CZ-CD2 4.23Å; F54-F58 HydrophobicContact CZ-CG 4.12Å; F54-F58 WeakPolarHBondContact O-CB 3.3Å; F54-F58 PolarHBondContact O-N 2.86Å; F54-L295 HydrophobicContact CD2-CB 4Å; F54-L295 HydrophobicContact CD2-CD1 4.41Å; F54-L295 HydrophobicContact CE2-CB 3.79Å; F54-L295 HydrophobicContact CE2-CD1 3.98Å; F54-L295 HydrophobicContact CE2-CD2 4.46Å; F54-L295 HydrophobicContact CE2-CG 4.3Å; F54-L295 HydrophobicContact CZ-CD1 4.2Å |
| 55 | P | 98.1 | Very high | 96.1 | Very high | 44 Ų | 44 | 37.2 Ų | 37.2 | 29% | 0.286 | 19% | 0.185 | S | C | . | . | H | α-helix | trans | -58.7 | -43.5 | -174.8 | -27.8 | 35.7 | 0 | 0 | 0 | 114.2 | A51 N53 F58 L59 A329 | A51-P55 VanDerWaalsContact O-CD 3.23Å; A51-P55 WeakPolarHBondContact O-CD 3.38Å; N53-P55 VanDerWaalsContact C-CD 3.48Å; P55-F58 PolarHBondContact O-N 3.31Å; P55-L59 WeakPolarHBondContact O-CB 3.48Å; P55-L59 WeakPolarHBondContact O-CG 3.29Å; P55-L59 PolarHBondContact O-N 3.41Å; P55-A329 HydrophobicContact CB-CB 3.91Å; P55-A329 HydrophobicContact CG-CB 4.47Å |
| 56 | H | 97.5 | Very high | 96.7 | Very high | 0 Ų | 0 | 33.7 Ų | 33.7 | 0% | 0 | 17% | 0.168 | C | C | . | . | H | α-helix | trans | -71.7 | -37.9 | -176.2 | 76.2 | -95.2 | 0 | 0 | 0 | 111.4 | N53 F54 L59 L60 M332 F333 | N53-H56 PolarHBondContact O-CE1 3.35Å; N53-H56 PolarHBondContact O-N 2.86Å; N53-H56 PolarHBondContact O-ND1 2.85Å; N53-H56 PolarHBondContact OD1-CE1 2.92Å; F54-H56 PolarHBondContact O-N 3.24Å; H56-L59 PolarHBondContact O-N 2.99Å; H56-L60 WeakPolarHBondContact O-CG 3.34Å; H56-L60 PolarHBondContact O-N 2.91Å; H56-M332 HydrophobicContact CB-CB 3.76Å; H56-F333 HydrophobicContact CB-CB 4.11Å |
| 57 | Y | 98.4 | Very high | 97.1 | Very high | 0 Ų | 0 | 36.2 Ų | 36.2 | 0% | 0 | 19% | 0.185 | C | C | . | . | H | α-helix | trans | -63.1 | -43.2 | 173.1 | -70.8 | -55.5 | 0 | 0 | 0 | 112.2 | N53 F54 L59 L60 F61 D146 V147 N150 A290 T294 Y336 | N53-Y57 HydrophobicContact CB-CD2 4.48Å; N53-Y57 HydrophobicContact CB-CE2 4.17Å; N53-Y57 VanDerWaalsContact O-CD2 3.29Å; N53-Y57 WeakPolarHBondContact O-CD2 3.37Å; F54-Y57 PolarHBondContact O-N 3.27Å; Y57-L59 VanDerWaalsContact C-N 3.35Å; Y57-L60 HydrophobicContact CD1-CD1 4.43Å; Y57-L60 WeakPolarHBondContact O-CB 3.33Å; Y57-L60 PolarHBondContact O-N 3.4Å; Y57-F61 PolarHBondContact O-N 3.26Å; Y57-F61 VanDerWaalsContact O-N 3.09Å; Y57-D146 WeakPolarHBondContact CE1-OD2 3.12Å; Y57-D146 PolarHBondContact OH-O 2.91Å; Y57-D146 PolarHBondContact OH-OD2 3.3Å; Y57-V147 HydrophobicContact CE2-CG2 3.82Å; Y57-V147 WeakPolarHBondContact OH-CA 3.39Å; Y57-V147 PolarHBondContact OH-N 3.48Å; Y57-N150 PolarHBondContact OH-ND2 3.48Å; Y57-A290 HydrophobicContact CD1-CB 3.35Å; Y57-A290 HydrophobicContact CD2-CB 4.15Å; Y57-A290 HydrophobicContact CE1-CB 3.59Å; Y57-A290 HydrophobicContact CE2-CB 4.34Å; Y57-A290 HydrophobicContact CG-CB 3.64Å; Y57-T294 HydrophobicContact CD2-CG2 3.67Å; Y57-T294 HydrophobicContact CE2-CG2 3.71Å; Y57-Y336 HydrophobicContact CE1-CD1 4.4Å; Y57-Y336 AromaticContact CE1-CE1 3.83Å; Y57-Y336 HydrophobicContact CE1-CE1 3.83Å |
| 58 | F | 98.5 | Very high | 97.2 | Very high | 89 Ų | 89 | 35.7 Ų | 35.7 | 39% | 0.39 | 18% | 0.18 | S | C | . | . | H | α-helix | trans | -63.3 | -41.9 | 175.6 | -178.1 | -105.5 | 0 | 0 | 0 | 111.6 | F54 P55 L60 F61 L62 | F54-F58 HydrophobicContact CE1-CB 4.36Å; F54-F58 HydrophobicContact CE2-CB 4.19Å; F54-F58 HydrophobicContact CZ-CB 4.01Å; F54-F58 HydrophobicContact CZ-CD2 4.23Å; F54-F58 HydrophobicContact CZ-CG 4.12Å; F54-F58 WeakPolarHBondContact O-CB 3.3Å; F54-F58 PolarHBondContact O-N 2.86Å; P55-F58 PolarHBondContact O-N 3.31Å; F58-L60 PolarHBondContact O-N 2.86Å; F58-F61 PolarHBondContact O-N 3.25Å; F58-L62 WeakPolarHBondContact O-CB 3.49Å; F58-L62 PolarHBondContact O-N 2.91Å |
| 59 | L | 98.6 | Very high | 97.1 | Very high | 49 Ų | 49 | 38.4 Ų | 38.4 | 26% | 0.257 | 19% | 0.191 | S | C | . | . | H | α-helix | trans | -62.8 | -39.3 | 175 | -74 | 167.3 | 0 | 0 | 0 | 112.1 | P55 H56 Y57 F61 L62 F63 F333 | P55-L59 WeakPolarHBondContact O-CB 3.48Å; P55-L59 WeakPolarHBondContact O-CG 3.29Å; P55-L59 PolarHBondContact O-N 3.41Å; H56-L59 PolarHBondContact O-N 2.99Å; Y57-L59 VanDerWaalsContact C-N 3.35Å; L59-F61 VanDerWaalsContact C-N 3.35Å; L59-F61 PolarHBondContact O-N 3.09Å; L59-L62 HydrophobicContact CD2-CD2 4.5Å; L59-L62 PolarHBondContact O-N 3.38Å; L59-F63 HydrophobicContact CD2-CD2 4.19Å; L59-F63 HydrophobicContact CD2-CE2 3.82Å; L59-F63 WeakPolarHBondContact O-CB 3.18Å; L59-F63 WeakPolarHBondContact O-CD2 3.36Å; L59-F63 PolarHBondContact O-N 2.89Å; L59-F333 HydrophobicContact CB-CD2 3.48Å; L59-F333 VanDerWaalsContact CB-CD2 3.48Å; L59-F333 HydrophobicContact CB-CE2 3.76Å; L59-F333 HydrophobicContact CB-CG 4.18Å; L59-F333 HydrophobicContact CD1-CB 4.3Å; L59-F333 HydrophobicContact CD1-CD2 4.41Å; L59-F333 HydrophobicContact CD1-CG 4.28Å |
| 60 | L | 98.4 | Very high | 97 | Very high | 2 Ų | 2 | 41.3 Ų | 41.3 | 1% | 0.01 | 21% | 0.212 | C | C | . | . | H | α-helix | trans | -60 | -45.5 | 173.5 | -70.5 | 172.4 | 0 | 0 | 0 | 111.6 | H56 Y57 F58 Y64 G65 L283 F333 Y336 | H56-L60 WeakPolarHBondContact O-CG 3.34Å; H56-L60 PolarHBondContact O-N 2.91Å; Y57-L60 HydrophobicContact CD1-CD1 4.43Å; Y57-L60 WeakPolarHBondContact O-CB 3.33Å; Y57-L60 PolarHBondContact O-N 3.4Å; F58-L60 PolarHBondContact O-N 2.86Å; L60-Y64 HydrophobicContact CD2-CD2 4.1Å; L60-Y64 HydrophobicContact CD2-CE2 4.1Å; L60-Y64 WeakPolarHBondContact O-CB 3.24Å; L60-Y64 PolarHBondContact O-N 2.9Å; L60-G65 PolarHBondContact O-N 3.22Å; L60-L283 HydrophobicContact CD2-CD2 4.17Å; L60-F333 HydrophobicContact CD2-CD2 4.09Å; L60-F333 HydrophobicContact CD2-CE2 4.11Å; L60-F333 HydrophobicContact CG-CD2 4.34Å; L60-Y336 HydrophobicContact CD1-CD1 3.71Å; L60-Y336 HydrophobicContact CD1-CG 4.02Å |
| 61 | F | 98.2 | Very high | 96.8 | Very high | 48 Ų | 48 | 47.4 Ų | 47.4 | 21% | 0.211 | 24% | 0.239 | C | C | . | . | I | π-helix | trans | -61.2 | -45.5 | 174.3 | 172.3 | -120.4 | 0 | 0 | 0 | 111.6 | Y57 F58 L59 G65 V66 F69 L288 | Y57-F61 PolarHBondContact O-N 3.26Å; Y57-F61 VanDerWaalsContact O-N 3.09Å; F58-F61 PolarHBondContact O-N 3.25Å; L59-F61 VanDerWaalsContact C-N 3.35Å; L59-F61 PolarHBondContact O-N 3.09Å; F61-G65 CarbonylContact O-C 3.4Å; F61-G65 WeakPolarHBondContact O-CA 3.25Å; F61-G65 PolarHBondContact O-N 3.28Å; F61-V66 HydrophobicContact CD1-CG2 4.48Å; F61-V66 HydrophobicContact CE1-CG2 3.98Å; F61-V66 HydrophobicContact CE2-CG2 4.2Å; F61-V66 HydrophobicContact CZ-CG2 3.82Å; F61-V66 PolarHBondContact O-N 3.18Å; F61-F69 HydrophobicContact CE2-CD2 4.04Å; F61-F69 HydrophobicContact CE2-CE2 4.15Å; F61-L288 HydrophobicContact CD2-CB 3.61Å; F61-L288 HydrophobicContact CD2-CD1 4.01Å; F61-L288 HydrophobicContact CD2-CG 4.18Å; F61-L288 HydrophobicContact CE2-CB 4.07Å; F61-L288 HydrophobicContact CE2-CD1 3.54Å; F61-L288 HydrophobicContact CE2-CG 4.18Å; F61-L288 HydrophobicContact CG-CB 4.19Å; F61-L288 HydrophobicContact CZ-CD1 4.05Å |
| 62 | L | 98.2 | Very high | 96.5 | Very high | 77 Ų | 77 | 49 Ų | 49 | 40% | 0.403 | 24% | 0.244 | S | C | . | . | I | π-helix | trans | -63.1 | -45.6 | -178.2 | -173.7 | 66.7 | 0 | 0 | 0 | 112.3 | F58 L59 V66 | F58-L62 WeakPolarHBondContact O-CB 3.49Å; F58-L62 PolarHBondContact O-N 2.91Å; L59-L62 HydrophobicContact CD2-CD2 4.5Å; L59-L62 PolarHBondContact O-N 3.38Å; L62-V66 HydrophobicContact CD1-CG2 4.41Å |
| 63 | F | 98 | Very high | 96.1 | Very high | 124 Ų | 124 | 53.9 Ų | 53.9 | 54% | 0.544 | 27% | 0.27 | S | S | . | . | I | π-helix | trans | -85.2 | -30.5 | -174.7 | -82.4 | -89.3 | 0 | 0 | 0 | 114 | L59 P67 F333 | L59-F63 HydrophobicContact CD2-CD2 4.19Å; L59-F63 HydrophobicContact CD2-CE2 3.82Å; L59-F63 WeakPolarHBondContact O-CB 3.18Å; L59-F63 WeakPolarHBondContact O-CD2 3.36Å; L59-F63 PolarHBondContact O-N 2.89Å; F63-P67 WeakPolarHBondContact O-CG 3.48Å; F63-F333 HydrophobicContact CB-CE2 4.39Å; F63-F333 HydrophobicContact CB-CZ 4.23Å; F63-F333 HydrophobicContact CD2-CE2 4.21Å; F63-F333 AromaticContact CD2-CZ 3.95Å; F63-F333 HydrophobicContact CD2-CZ 3.95Å; F63-F333 HydrophobicContact CG-CE2 4.49Å; F63-F333 HydrophobicContact CG-CZ 4.04Å |
| 64 | Y | 97.7 | Very high | 95.8 | Very high | 60 Ų | 60 | 61.4 Ų | 61.4 | 24% | 0.235 | 30% | 0.299 | C | S | . | . | I | π-helix | trans | -111.6 | -43.7 | -178.3 | -63.4 | -82.8 | 0 | 0 | 0 | 112.7 | L60 Y68 L283 F333 S337 | L60-Y64 HydrophobicContact CD2-CD2 4.1Å; L60-Y64 HydrophobicContact CD2-CE2 4.1Å; L60-Y64 WeakPolarHBondContact O-CB 3.24Å; L60-Y64 PolarHBondContact O-N 2.9Å; Y64-Y68 WeakPolarHBondContact O-CB 3.37Å; Y64-Y68 PolarHBondContact O-N 3.5Å; Y64-L283 HydrophobicContact CD1-CB 4.4Å; Y64-L283 HydrophobicContact CD1-CD1 3.91Å; Y64-L283 HydrophobicContact CD2-CB 4.14Å; Y64-L283 HydrophobicContact CD2-CD1 3.98Å; Y64-L283 HydrophobicContact CE1-CD1 3.83Å; Y64-L283 HydrophobicContact CE2-CD1 3.9Å; Y64-L283 HydrophobicContact CG-CB 3.89Å; Y64-L283 HydrophobicContact CG-CD1 3.98Å; Y64-F333 HydrophobicContact CE2-CE2 4.47Å; Y64-S337 WeakPolarHBondContact OH-CB 3.26Å |
| 65 | G | 96.8 | Very high | 95.4 | Very high | 0 Ų | 0 | 65.2 Ų | 65.2 | 0% | 0 | 32% | 0.316 | C | S | . | . | I | π-helix | trans | -68 | -53.3 | -178 | 0 | 0 | 0 | 0 | 0 | 113.1 | L60 F61 Y68 F69 | L60-G65 PolarHBondContact O-N 3.22Å; F61-G65 CarbonylContact O-C 3.4Å; F61-G65 WeakPolarHBondContact O-CA 3.25Å; F61-G65 PolarHBondContact O-N 3.28Å; G65-Y68 PolarHBondContact O-N 3.23Å; G65-Y68 VanDerWaalsContact O-N 3.16Å; G65-F69 WeakPolarHBondContact O-CD2 3.42Å; G65-F69 PolarHBondContact O-N 2.94Å |
| 66 | V | 97.4 | Very high | 94.7 | Very high | 55 Ų | 55 | 68.2 Ų | 68.2 | 33% | 0.333 | 32% | 0.324 | S | S | . | . | H | α-helix | trans | -57.5 | -49.3 | -177.5 | 173.5 | 0 | 0 | 0 | 0 | 111.6 | F61 L62 Y68 S70 | F61-V66 HydrophobicContact CD1-CG2 4.48Å; F61-V66 HydrophobicContact CE1-CG2 3.98Å; F61-V66 HydrophobicContact CE2-CG2 4.2Å; F61-V66 HydrophobicContact CZ-CG2 3.82Å; F61-V66 PolarHBondContact O-N 3.18Å; L62-V66 HydrophobicContact CD1-CG2 4.41Å; V66-Y68 PolarHBondContact O-N 3.13Å; V66-S70 WeakPolarHBondContact O-CB 3.32Å; V66-S70 PolarHBondContact O-N 3.26Å; V66-S70 PolarHBondContact O-OG 2.69Å |
| 67 | P | 97.2 | Very high | 94.2 | Very high | 69 Ų | 69 | 72.9 Ų | 72.9 | 45% | 0.448 | 35% | 0.349 | S | S | . | . | H | α-helix | trans | -62.1 | -41.3 | 175.1 | -25.7 | 37 | 0 | 0 | 0 | 113.5 | F63 F71 | F63-P67 WeakPolarHBondContact O-CG 3.48Å; P67-F71 VanDerWaalsContact O-CB 3.27Å; P67-F71 WeakPolarHBondContact O-CB 3.44Å; P67-F71 PolarHBondContact O-N 2.86Å |
| 68 | Y | 93.4 | Very high | 93.6 | Very high | 34 Ų | 34 | 75 Ų | 75 | 13% | 0.133 | 36% | 0.363 | C | S | . | . | H | α-helix | trans | -62.6 | -51 | 179.5 | 174.7 | -96.2 | 0 | 0 | 0 | 112.4 | Y64 G65 V66 F71 N72 V280 E281 | Y64-Y68 WeakPolarHBondContact O-CB 3.37Å; Y64-Y68 PolarHBondContact O-N 3.5Å; G65-Y68 PolarHBondContact O-N 3.23Å; G65-Y68 VanDerWaalsContact O-N 3.16Å; V66-Y68 PolarHBondContact O-N 3.13Å; Y68-F71 PolarHBondContact O-N 3.4Å; Y68-N72 WeakPolarHBondContact CE1-ND2 3.18Å; Y68-N72 WeakPolarHBondContact CE2-ND2 3.27Å; Y68-N72 WeakPolarHBondContact O-CB 3.03Å; Y68-N72 PolarHBondContact O-N 2.83Å; Y68-N72 PolarHBondContact O-ND2 2.95Å; Y68-N72 PolarHBondContact OH-ND2 3.33Å; Y68-V280 HydrophobicContact CD2-CG1 4.19Å; Y68-V280 HydrophobicContact CG-CG1 4.5Å; Y68-E281 HydrophobicContact CD2-CB 4.38Å; Y68-E281 HydrophobicContact CE1-CB 4.47Å; Y68-E281 HydrophobicContact CE1-CG 4.18Å; Y68-E281 HydrophobicContact CE2-CB 3.64Å; Y68-E281 HydrophobicContact CE2-CG 4.06Å; Y68-E281 VanDerWaalsContact OH-CG 3.25Å; Y68-E281 WeakPolarHBondContact OH-CG 3.23Å; Y68-E281 PolarHBondContact OH-OE2 2.8Å |
| 69 | F | 92.8 | Very high | 92.7 | Very high | 66 Ų | 66 | 76.1 Ų | 76.1 | 29% | 0.289 | 37% | 0.37 | S | S | . | . | H | α-helix | trans | -67.5 | -38.5 | 179.2 | -69.7 | -62.4 | 0 | 0 | 0 | 111.5 | F61 G65 N72 L73 L288 | F61-F69 HydrophobicContact CE2-CD2 4.04Å; F61-F69 HydrophobicContact CE2-CE2 4.15Å; G65-F69 WeakPolarHBondContact O-CD2 3.42Å; G65-F69 PolarHBondContact O-N 2.94Å; F69-N72 PolarHBondContact O-N 3.46Å; F69-L73 VanDerWaalsContact O-CB 3.22Å; F69-L73 WeakPolarHBondContact O-CB 3.23Å; F69-L73 PolarHBondContact O-N 3.41Å; F69-L288 HydrophobicContact CE2-CD1 3.93Å; F69-L288 HydrophobicContact CZ-CD1 4.41Å |
| 70 | S | 94 | Very high | 91.8 | Very high | 67 Ų | 67 | 77 Ų | 77 | 47% | 0.469 | 38% | 0.38 | S | S | . | . | H | α-helix | trans | -63.1 | -44.7 | 176.2 | -59.6 | 0 | 0 | 0 | 0 | 111.8 | V66 L73 Y74 | V66-S70 WeakPolarHBondContact O-CB 3.32Å; V66-S70 PolarHBondContact O-N 3.26Å; V66-S70 PolarHBondContact O-OG 2.69Å; S70-L73 PolarHBondContact O-N 3.32Å; S70-Y74 VanDerWaalsContact O-CB 3.31Å; S70-Y74 WeakPolarHBondContact O-CB 3.4Å; S70-Y74 PolarHBondContact O-N 3.31Å |
| 71 | F | 92.8 | Very high | 90.8 | Very high | 133 Ų | 133 | 81.4 Ų | 81.4 | 58% | 0.583 | 40% | 0.404 | S | S | * | . | H | α-helix | trans | -62.9 | -44.3 | 177 | 179 | -101.6 | 0 | 0 | 0 | 112.1 | P67 Y68 Y74 K75 | P67-F71 VanDerWaalsContact O-CB 3.27Å; P67-F71 WeakPolarHBondContact O-CB 3.44Å; P67-F71 PolarHBondContact O-N 2.86Å; Y68-F71 PolarHBondContact O-N 3.4Å; F71-Y74 PolarHBondContact O-N 2.98Å; F71-K75 WeakPolarHBondContact O-CB 3.47Å; F71-K75 PolarHBondContact O-N 3Å |
| 72 | N | 88.4 | Confident | 89.8 | Confident | 50 Ų | 50 | 83.7 Ų | 83.7 | 27% | 0.267 | 42% | 0.418 | S | S | . | . | H | α-helix | trans | -67.5 | -38.8 | 177.8 | -76.7 | -28 | 0 | 0 | 0 | 112.6 | Y68 F69 K75 K76 | Y68-N72 WeakPolarHBondContact CE1-ND2 3.18Å; Y68-N72 WeakPolarHBondContact CE2-ND2 3.27Å; Y68-N72 WeakPolarHBondContact O-CB 3.03Å; Y68-N72 PolarHBondContact O-N 2.83Å; Y68-N72 PolarHBondContact O-ND2 2.95Å; Y68-N72 PolarHBondContact OH-ND2 3.33Å; F69-N72 PolarHBondContact O-N 3.46Å; N72-K75 PolarHBondContact O-N 3.44Å; N72-K76 WeakPolarHBondContact O-CB 3.41Å; N72-K76 PolarHBondContact O-N 3.45Å |
| 73 | L | 88.9 | Confident | 88.5 | Confident | 106 Ų | 106 | 82.2 Ų | 82.2 | 56% | 0.555 | 41% | 0.414 | S | S | * | . | H | α-helix | trans | -64 | -46.7 | 174.7 | -176.8 | 64.4 | 0 | 0 | 0 | 110.9 | F69 S70 K75 K76 L77 | F69-L73 VanDerWaalsContact O-CB 3.22Å; F69-L73 WeakPolarHBondContact O-CB 3.23Å; F69-L73 PolarHBondContact O-N 3.41Å; S70-L73 PolarHBondContact O-N 3.32Å; L73-K75 PolarHBondContact O-N 2.91Å; L73-K76 PolarHBondContact O-N 3.47Å; L73-L77 HydrophobicContact CD1-CD1 4.4Å; L73-L77 HydrophobicContact CG-CD1 4.1Å; L73-L77 WeakPolarHBondContact O-CG 3.13Å; L73-L77 PolarHBondContact O-N 3.41Å |
| 74 | Y | 91 | Very high | 87.1 | Confident | 160 Ų | 160 | 79.2 Ų | 79.2 | 63% | 0.627 | 41% | 0.406 | S | S | * | . | H | α-helix | trans | -58.2 | -47.8 | 175.7 | 173.5 | -100 | 0 | 0 | 0 | 111.9 | S70 F71 K76 L77 S78 | S70-Y74 VanDerWaalsContact O-CB 3.31Å; S70-Y74 WeakPolarHBondContact O-CB 3.4Å; S70-Y74 PolarHBondContact O-N 3.31Å; F71-Y74 PolarHBondContact O-N 2.98Å; Y74-K76 VanDerWaalsContact C-N 3.32Å; Y74-K76 PolarHBondContact O-N 3.48Å; Y74-L77 PolarHBondContact O-N 3.29Å; Y74-S78 WeakPolarHBondContact O-CB 3.29Å; Y74-S78 PolarHBondContact O-N 3.02Å |
| 75 | K | 88.3 | Confident | 85.7 | Confident | 136 Ų | 136 | 81.5 Ų | 81.5 | 59% | 0.591 | 42% | 0.422 | S | S | * | . | H | α-helix | trans | -60 | -41.5 | 178.1 | -173.9 | 178.8 | 179.6 | -179.6 | 0 | 112 | F71 N72 L73 H79 | F71-K75 WeakPolarHBondContact O-CB 3.47Å; F71-K75 PolarHBondContact O-N 3Å; N72-K75 PolarHBondContact O-N 3.44Å; L73-K75 PolarHBondContact O-N 2.91Å; K75-H79 PolarHBondContact O-N 3.48Å; K75-H79 VanDerWaalsContact O-N 3.08Å |
| 76 | K | 83.7 | Confident | 83.9 | Confident | 107 Ų | 107 | 86.2 Ų | 86.2 | 47% | 0.465 | 46% | 0.456 | S | S | . | . | H | α-helix | trans | -64.5 | -46.6 | 177.1 | -173.4 | 176.6 | -179.5 | -178.5 | 0 | 111.7 | N72 L73 Y74 H79 S80 | N72-K76 WeakPolarHBondContact O-CB 3.41Å; N72-K76 PolarHBondContact O-N 3.45Å; L73-K76 PolarHBondContact O-N 3.47Å; Y74-K76 VanDerWaalsContact C-N 3.32Å; Y74-K76 PolarHBondContact O-N 3.48Å; K76-H79 PolarHBondContact O-N 3.44Å; K76-S80 PolarHBondContact O-N 3.34Å; K76-S80 VanDerWaalsContact O-N 3.1Å |
| 77 | L | 87.4 | Confident | 81.9 | Confident | 99 Ų | 99 | 92.6 Ų | 92.6 | 52% | 0.518 | 47% | 0.474 | S | S | . | . | H | α-helix | trans | -64 | -43 | 178.2 | -69.7 | 171.5 | 0 | 0 | 0 | 111.8 | L73 Y74 H79 S80 N81 | L73-L77 HydrophobicContact CD1-CD1 4.4Å; L73-L77 HydrophobicContact CG-CD1 4.1Å; L73-L77 WeakPolarHBondContact O-CG 3.13Å; L73-L77 PolarHBondContact O-N 3.41Å; Y74-L77 PolarHBondContact O-N 3.29Å; L77-H79 PolarHBondContact O-N 3.12Å; L77-S80 PolarHBondContact O-N 2.98Å; L77-N81 PolarHBondContact O-N 2.87Å |
| 78 | S | 86 | Confident | 79.7 | Confident | 43 Ų | 43 | 95.5 Ų | 95.5 | 30% | 0.301 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -61.4 | -41.5 | 177 | 177.7 | 0 | 0 | 0 | 0 | 112.3 | Y74 N81 N82 | Y74-S78 WeakPolarHBondContact O-CB 3.29Å; Y74-S78 PolarHBondContact O-N 3.02Å; S78-N81 PolarHBondContact O-N 2.96Å; S78-N82 PolarHBondContact O-N 3Å |
| 79 | H | 79 | Confident | 77.5 | Confident | 114 Ų | 114 | 101.2 Ų | 101.2 | 53% | 0.528 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -67.2 | -37.3 | 177.1 | -164.4 | 67.2 | 0 | 0 | 0 | 112.6 | K75 K76 L77 S83 | K75-H79 PolarHBondContact O-N 3.48Å; K75-H79 VanDerWaalsContact O-N 3.08Å; K76-H79 PolarHBondContact O-N 3.44Å; L77-H79 PolarHBondContact O-N 3.12Å; H79-S83 WeakPolarHBondContact O-CB 3.34Å; H79-S83 PolarHBondContact O-N 3.21Å; H79-S83 PolarHBondContact O-OG 3.33Å |
| 80 | S | 79.6 | Confident | 75.2 | Confident | 67 Ų | 67 | 103.2 Ų | 103.2 | 47% | 0.469 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -64.9 | -43.3 | 174.1 | -169.4 | 0 | 0 | 0 | 0 | 111.9 | K76 L77 S83 T84 | K76-S80 PolarHBondContact O-N 3.34Å; K76-S80 VanDerWaalsContact O-N 3.1Å; L77-S80 PolarHBondContact O-N 2.98Å; S80-S83 PolarHBondContact O-N 2.72Å; S80-T84 WeakPolarHBondContact O-CG2 3.28Å; S80-T84 PolarHBondContact O-N 2.98Å; S80-T84 PolarHBondContact O-OG1 3.47Å |
| 81 | N | 78.4 | Confident | 72.8 | Confident | 95 Ų | 95 | 108.2 Ų | 108.2 | 51% | 0.508 | 55% | 0.552 | S | S | . | * | H | α-helix | trans | -64.7 | -41.6 | 177.3 | -76.3 | 1.7 | 0 | 0 | 0 | 112.4 | L77 S78 S83 T84 N85 | L77-N81 PolarHBondContact O-N 2.87Å; S78-N81 PolarHBondContact O-N 2.96Å; N81-S83 PolarHBondContact O-N 3.42Å; N81-T84 WeakPolarHBondContact CA-OG1 3.16Å; N81-T84 PolarHBondContact O-N 2.77Å; N81-T84 PolarHBondContact O-OG1 2.69Å; N81-N85 PolarHBondContact O-N 3.45Å |
| 82 | N | 77.5 | Confident | 70 | Confident | 96 Ų | 96 | 105.7 Ų | 105.7 | 51% | 0.513 | 55% | 0.551 | S | S | . | * | H | α-helix | trans | -66.1 | -39.1 | 175.9 | -71.3 | -8 | 0 | 0 | 0 | 112 | S78 T84 N85 S86 | S78-N82 PolarHBondContact O-N 3Å; N82-T84 VanDerWaalsContact C-N 3.31Å; N82-T84 PolarHBondContact O-N 2.98Å; N82-N85 PolarHBondContact O-N 2.97Å; N82-S86 PolarHBondContact O-N 3.46Å; N82-S86 VanDerWaalsContact O-N 3.13Å; N82-S86 PolarHBondContact O-OG 3.36Å |
| 83 | S | 70.4 | Confident | 67.6 | Low | 45 Ų | 45 | 110.5 Ų | 110.5 | 32% | 0.315 | 58% | 0.577 | S | S | . | * | H | α-helix | trans | -65.9 | -32.3 | 177.9 | -60.1 | 0 | 0 | 0 | 0 | 113.2 | H79 S80 N81 | H79-S83 WeakPolarHBondContact O-CB 3.34Å; H79-S83 PolarHBondContact O-N 3.21Å; H79-S83 PolarHBondContact O-OG 3.33Å; S80-S83 PolarHBondContact O-N 2.72Å; N81-S83 PolarHBondContact O-N 3.42Å |
| 84 | T | 67.8 | Low | 65.3 | Low | 62 Ų | 62 | 111.9 Ų | 111.9 | 38% | 0.38 | 59% | 0.59 | S | S | . | * | H | α-helix | trans | -77.7 | -40.1 | 176.8 | 46.3 | 0 | 0 | 0 | 0 | 111.7 | S80 N81 N82 S86 R87 N88 | S80-T84 WeakPolarHBondContact O-CG2 3.28Å; S80-T84 PolarHBondContact O-N 2.98Å; S80-T84 PolarHBondContact O-OG1 3.47Å; N81-T84 WeakPolarHBondContact CA-OG1 3.16Å; N81-T84 PolarHBondContact O-N 2.77Å; N81-T84 PolarHBondContact O-OG1 2.69Å; N82-T84 VanDerWaalsContact C-N 3.31Å; N82-T84 PolarHBondContact O-N 2.98Å; T84-S86 PolarHBondContact O-N 3.29Å; T84-R87 PolarHBondContact O-N 2.97Å; T84-R87 VanDerWaalsContact O-N 3.1Å; T84-N88 PolarHBondContact O-N 2.95Å |
| 85 | N | 68.4 | Low | 62.5 | Low | 107 Ų | 107 | 112.3 Ų | 112.3 | 57% | 0.572 | 60% | 0.602 | S | S | * | * | H | α-helix | trans | -61.3 | -40.7 | 175 | -74.4 | -11.9 | 0 | 0 | 0 | 112.6 | N81 N82 R87 N88 | N81-N85 PolarHBondContact O-N 3.45Å; N82-N85 PolarHBondContact O-N 2.97Å; N85-R87 PolarHBondContact O-N 3.34Å; N85-N88 PolarHBondContact O-N 3.02Å; N85-N88 VanDerWaalsContact O-N 3.16Å |
| 86 | S | 60.2 | Low | 59.7 | Low | 100 Ų | 100 | 112.8 Ų | 112.8 | 70% | 0.699 | 61% | 0.612 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -65.9 | -17.2 | 175.2 | -62 | 0 | 0 | 0 | 0 | 114.5 | N82 T84 | N82-S86 PolarHBondContact O-N 3.46Å; N82-S86 VanDerWaalsContact O-N 3.13Å; N82-S86 PolarHBondContact O-OG 3.36Å; T84-S86 PolarHBondContact O-N 3.29Å |
| 87 | R | 54.1 | Low | 57.1 | Low | 189 Ų | 189 | 117.2 Ų | 117.2 | 71% | 0.713 | 63% | 0.627 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -87.4 | -19.6 | 173.7 | -72.2 | -173.8 | -159 | 171.1 | 5.5 | 113.6 | T84 N85 | T84-R87 PolarHBondContact O-N 2.97Å; T84-R87 VanDerWaalsContact O-N 3.1Å; N85-R87 PolarHBondContact O-N 3.34Å |
| 88 | N | 51.6 | Low | 54.5 | Low | 129 Ų | 129 | 119.4 Ų | 119.4 | 69% | 0.69 | 64% | 0.639 | S | S | * | * | S | Bend | trans | -94.1 | 2 | -175.7 | -70.6 | -9.7 | 0 | 0 | 0 | 113.3 | T84 N85 | T84-N88 PolarHBondContact O-N 2.95Å; N85-N88 PolarHBondContact O-N 3.02Å; N85-N88 VanDerWaalsContact O-N 3.16Å |
| 89 | E | 47.9 | Very low | 51.9 | Low | 154 Ų | 154 | 122.7 Ų | 122.7 | 72% | 0.72 | 66% | 0.657 | S | S | * | * | S | Bend | trans | -66.3 | 128.8 | 166.9 | -71.6 | -156.4 | 165.2 | 0 | 0 | 109.5 | I91 | E89-I91 PolarHBondContact O-N 2.8Å; E89-I91 VanDerWaalsContact O-N 3.12Å |
| 90 | P | 43.2 | Very low | 49.5 | Very low | 109 Ų | 109 | 123.9 Ų | 123.9 | 71% | 0.708 | 67% | 0.667 | S | S | * | * | trans | -61.3 | 119 | -175.3 | 22.4 | -30.9 | 0 | 0 | 0 | 110.1 | S92 | P90-S92 PolarHBondContact O-N 3.42Š| ||
| 91 | I | 43.5 | Very low | 47.2 | Very low | 171 Ų | 171 | 127.2 Ų | 127.2 | 88% | 0.877 | 68% | 0.68 | S | S | * | * | trans | -69.2 | 74.8 | 171.9 | -53.9 | 167.9 | 0 | 0 | 0 | 107.5 | E89 | E89-I91 PolarHBondContact O-N 2.8Å; E89-I91 VanDerWaalsContact O-N 3.12Å | ||
| 92 | S | 35.1 | Very low | 44.8 | Very low | 80 Ų | 80 | 133.1 Ų | 133.1 | 56% | 0.559 | 70% | 0.695 | S | S | * | * | trans | -113.8 | 112.4 | 168.9 | 56.3 | 0 | 0 | 0 | 0 | 108.1 | P90 | P90-S92 PolarHBondContact O-N 3.42Š| ||
| 93 | N | 38 | Very low | 42.4 | Very low | 151 Ų | 151 | 134.4 Ų | 134.4 | 81% | 0.807 | 71% | 0.707 | S | S | * | * | S | Bend | trans | 106.6 | 32.1 | 148.7 | -51.1 | -19.1 | 0 | 0 | 0 | 121.1 | ||
| 94 | T | 40.8 | Very low | 40.3 | Very low | 135 Ų | 135 | 139.1 Ų | 139.1 | 83% | 0.828 | 73% | 0.727 | S | S | * | * | trans | -133.3 | 58.8 | 166.9 | 56.3 | 0 | 0 | 0 | 0 | 113.7 | ||||
| 95 | L | 32.8 | Very low | 38.3 | Very low | 170 Ų | 170 | 141.8 Ų | 141.8 | 89% | 0.89 | 74% | 0.743 | S | S | * | * | trans | -127.4 | 80.3 | 156.7 | -89.1 | 164.4 | 0 | 0 | 0 | 106.9 | ||||
| 96 | N | 28.5 | Very low | 36.2 | Very low | 146 Ų | 146 | 143.8 Ų | 143.8 | 78% | 0.781 | 75% | 0.754 | S | S | * | * | trans | -159.9 | 139.7 | 167.3 | -112.7 | -11.8 | 0 | 0 | 0 | 112.3 | ||||
| 97 | Y | 29.9 | Very low | 34.5 | Very low | 200 Ų | 200 | 150.4 Ų | 150.4 | 78% | 0.784 | 77% | 0.765 | S | S | * | * | trans | 91.7 | 93.9 | 172.4 | -70.2 | -86.9 | 0 | 0 | 0 | 116.8 | ||||
| 98 | N | 31.5 | Very low | 33.2 | Very low | 144 Ų | 144 | 148.1 Ų | 148.1 | 77% | 0.77 | 77% | 0.767 | S | S | * | * | 76.9 | 109.9 | 69.5 | -79.7 | -12.1 | 0 | 0 | 0 | 115.5 | |||||
| 99 | T | 31.1 | Very low | 32 | Very low | 113 Ų | 113 | 146.4 Ų | 146.4 | 69% | 0.693 | 77% | 0.765 | S | S | * | * | trans | -40.4 | 144 | 159 | 48.2 | 0 | 0 | 0 | 0 | 116.8 | ||||
| 100 | N | 29.2 | Very low | 31 | Very low | 138 Ų | 138 | 146.2 Ų | 146.2 | 74% | 0.738 | 77% | 0.769 | S | S | * | * | trans | 119.4 | 123.6 | 141.3 | -62.6 | -30.3 | 0 | 0 | 0 | 117.3 | ||||
| 101 | N | 31.5 | Very low | 30.1 | Very low | 138 Ų | 138 | 145.5 Ų | 145.5 | 74% | 0.738 | 77% | 0.767 | S | S | * | * | trans | 110.7 | 105.4 | 146.2 | -62.6 | -28.2 | 0 | 0 | 0 | 119.9 | ||||
| 102 | R | 28.2 | Very low | 29.5 | Very low | 219 Ų | 219 | 144.6 Ų | 144.6 | 83% | 0.826 | 76% | 0.762 | S | S | * | * | 60.9 | 125.2 | 125.5 | -65.9 | -176.3 | -171.5 | 177.9 | 2.6 | 121.3 | |||||
| 103 | T | 26.1 | Very low | 29.1 | Very low | 123 Ų | 123 | 147.7 Ų | 147.7 | 76% | 0.755 | 77% | 0.771 | S | S | * | * | trans | 82.7 | 120.9 | 136.1 | 49 | 0 | 0 | 0 | 0 | 122.3 | ||||
| 104 | I | 27 | Very low | 28.7 | Very low | 144 Ų | 144 | 147.1 Ų | 147.1 | 74% | 0.738 | 77% | 0.768 | S | S | * | * | trans | 95.4 | 107.8 | 138.9 | -66.4 | 164.4 | 0 | 0 | 0 | 119.7 | ||||
| 105 | T | 25 | Very low | 28 | Very low | 118 Ų | 118 | 148.7 Ų | 148.7 | 72% | 0.724 | 77% | 0.771 | S | S | * | * | trans | 69.5 | 136.2 | 143.5 | 60 | 0 | 0 | 0 | 0 | 123.2 | ||||
| 106 | N | 24.7 | Very low | 28 | Very low | 148 Ų | 148 | 148.6 Ų | 148.6 | 79% | 0.791 | 77% | 0.766 | S | S | * | * | trans | 76.9 | 84.8 | 159.4 | -60.7 | -10.7 | 0 | 0 | 0 | 117.4 | N108 | N106-N108 VanDerWaalsContact C-N 3.26Å; N106-N108 PolarHBondContact O-N 3.44Å | ||
| 107 | Y | 25 | Very low | 28.3 | Very low | 239 Ų | 239 | 149.7 Ų | 149.7 | 94% | 0.937 | 77% | 0.767 | S | S | * | * | trans | -69.6 | 81.3 | 161.9 | -97.2 | -91.6 | 0 | 0 | 0 | 110.4 | ||||
| 108 | N | 26.3 | Very low | 28.5 | Very low | 142 Ų | 142 | 146.8 Ų | 146.8 | 76% | 0.759 | 76% | 0.763 | S | S | * | * | trans | -95.1 | 119.5 | 152.5 | -89 | -11.6 | 0 | 0 | 0 | 107.9 | N106 | N106-N108 VanDerWaalsContact C-N 3.26Å; N106-N108 PolarHBondContact O-N 3.44Å | ||
| 109 | S | 25.8 | Very low | 28.8 | Very low | 92 Ų | 92 | 146 Ų | 146 | 64% | 0.643 | 76% | 0.758 | S | S | * | * | S | Bend | trans | 44.9 | 118.5 | 144.1 | 59.1 | 0 | 0 | 0 | 0 | 119.2 | ||
| 110 | N | 26.8 | Very low | 29.2 | Very low | 150 Ų | 150 | 146.2 Ų | 146.2 | 80% | 0.802 | 75% | 0.754 | S | S | * | * | trans | 88.2 | 80.2 | 147.1 | -51.4 | -16.6 | 0 | 0 | 0 | 117.6 | ||||
| 111 | S | 25.6 | Very low | 29.9 | Very low | 95 Ų | 95 | 143.8 Ų | 143.8 | 66% | 0.664 | 74% | 0.739 | S | S | * | * | trans | -142.1 | 100.8 | 148.9 | 56.2 | 0 | 0 | 0 | 0 | 105.1 | ||||
| 112 | I | 29.7 | Very low | 30.8 | Very low | 152 Ų | 152 | 139.9 Ų | 139.9 | 78% | 0.779 | 72% | 0.722 | S | S | * | * | 37.4 | 119.9 | 66 | -48 | 177.3 | 0 | 0 | 0 | 109.4 | |||||
| 113 | I | 27.7 | Very low | 32 | Very low | 145 Ų | 145 | 134 Ų | 134 | 74% | 0.744 | 71% | 0.707 | S | S | * | * | trans | 96.6 | 89.8 | -160.7 | -52.8 | 154.2 | 0 | 0 | 0 | 107.6 | ||||
| 114 | D | 28.8 | Very low | 33.4 | Very low | 138 Ų | 138 | 131.7 Ų | 131.7 | 74% | 0.738 | 70% | 0.696 | S | S | * | * | -140 | 102 | 54.8 | -63 | -48 | 0 | 0 | 0 | 112.3 | |||||
| 115 | N | 27.1 | Very low | 35.1 | Very low | 168 Ų | 168 | 129.8 Ų | 129.8 | 90% | 0.898 | 68% | 0.684 | S | S | * | * | trans | -106.1 | 53.6 | 158.9 | -82.3 | -19 | 0 | 0 | 0 | 108.6 | Q117 | N115-Q117 PolarHBondContact O-N 2.58Š| ||
| 116 | E | 32.1 | Very low | 37.1 | Very low | 168 Ų | 168 | 131.4 Ų | 131.4 | 79% | 0.785 | 68% | 0.676 | S | S | * | * | trans | -82.7 | 91.9 | 163.5 | -97 | -174.9 | 169.1 | 0 | 0 | 109.3 | I118 | E116-I118 PolarHBondContact O-N 2.72Š| ||
| 117 | Q | 35.7 | Very low | 39.5 | Very low | 169 Ų | 169 | 128 Ų | 128 | 79% | 0.79 | 66% | 0.658 | S | S | * | * | trans | 36.7 | 85.6 | 136.3 | -66.2 | -177.9 | -15.4 | 0 | 0 | 116.8 | N115 | N115-Q117 PolarHBondContact O-N 2.58Š| ||
| 118 | I | 33.8 | Very low | 41.9 | Very low | 139 Ų | 139 | 121.9 Ų | 121.9 | 71% | 0.713 | 64% | 0.637 | S | S | * | * | trans | -126.2 | 70.9 | 144.4 | -55 | -177.3 | 0 | 0 | 0 | 107.7 | E116 I120 | E116-I118 PolarHBondContact O-N 2.72Å; I118-I120 HydrophobicContact CG2-CB 3.97Å; I118-I120 HydrophobicContact CG2-CD1 3.25Å; I118-I120 HydrophobicContact CG2-CG1 3.39Å; I118-I120 PolarHBondContact O-N 3.49Å | ||
| 119 | I | 37.8 | Very low | 44.2 | Very low | 127 Ų | 127 | 119.4 Ų | 119.4 | 65% | 0.651 | 62% | 0.623 | S | S | * | * | trans | -75.2 | 67.5 | 163.7 | -56.2 | 179.9 | 0 | 0 | 0 | 107.2 | I121 | I119-I121 VanDerWaalsContact C-N 3.35Å; I119-I121 HydrophobicContact CG2-CD1 3.47Å; I119-I121 VanDerWaalsContact CG2-CD1 3.47Å; I119-I121 HydrophobicContact CG2-CG1 3.65Å; I119-I121 PolarHBondContact O-N 3.31Å | ||
| 120 | I | 38.6 | Very low | 46.6 | Very low | 119 Ų | 119 | 121.7 Ų | 121.7 | 61% | 0.61 | 62% | 0.617 | S | S | * | * | trans | -88.7 | 82.8 | 163.8 | -65.4 | 174.1 | 0 | 0 | 0 | 105.2 | I118 P122 | I118-I120 HydrophobicContact CG2-CB 3.97Å; I118-I120 HydrophobicContact CG2-CD1 3.25Å; I118-I120 HydrophobicContact CG2-CG1 3.39Å; I118-I120 PolarHBondContact O-N 3.49Å; I120-P122 HydrophobicContact CG2-CG 3.58Å; I120-P122 VanDerWaalsContact O-CD 3.31Å; I120-P122 WeakPolarHBondContact O-CD 3.35Å | ||
| 121 | I | 44.4 | Very low | 49.2 | Very low | 86 Ų | 86 | 117.4 Ų | 117.4 | 44% | 0.441 | 60% | 0.596 | S | S | . | * | trans | -98.2 | 35.7 | 169.7 | -46.8 | 172.8 | 0 | 0 | 0 | 113.4 | I119 N123 | I119-I121 VanDerWaalsContact C-N 3.35Å; I119-I121 HydrophobicContact CG2-CD1 3.47Å; I119-I121 VanDerWaalsContact CG2-CD1 3.47Å; I119-I121 HydrophobicContact CG2-CG1 3.65Å; I119-I121 PolarHBondContact O-N 3.31Å; I121-N123 VanDerWaalsContact C-N 3.32Å | ||
| 122 | P | 49.8 | Very low | 51.8 | Low | 57 Ų | 57 | 115.5 Ų | 115.5 | 37% | 0.37 | 58% | 0.578 | S | S | . | * | H | α-helix | trans | -77 | -19.6 | 162.8 | 30.5 | -27.4 | 0 | 0 | 0 | 112.3 | I120 | I120-P122 HydrophobicContact CG2-CG 3.58Å; I120-P122 VanDerWaalsContact O-CD 3.31Å; I120-P122 WeakPolarHBondContact O-CD 3.35Å |
| 123 | N | 53.6 | Low | 54.4 | Low | 94 Ų | 94 | 114 Ų | 114 | 50% | 0.503 | 57% | 0.572 | S | S | . | * | H | α-helix | trans | -76.6 | -28.7 | 179.4 | -85.2 | 5.3 | 0 | 0 | 0 | 113.4 | I121 R126 N127 | I121-N123 VanDerWaalsContact C-N 3.32Å; N123-R126 PolarHBondContact OD1-NH2 2.99Å; N123-N127 VanDerWaalsContact O-CB 3.25Å; N123-N127 WeakPolarHBondContact O-CB 3.23Å; N123-N127 PolarHBondContact O-N 3.27Å; N123-N127 VanDerWaalsContact O-N 3.1Å; N123-N127 PolarHBondContact O-ND2 3Å |
| 124 | S | 57.1 | Low | 57.2 | Low | 75 Ų | 75 | 109.8 Ų | 109.8 | 52% | 0.524 | 55% | 0.55 | S | S | . | . | H | α-helix | trans | -69.2 | -43.1 | 177.8 | -173.8 | 0 | 0 | 0 | 0 | 111.8 | N127 F128 | S124-N127 PolarHBondContact O-N 3.17Å; S124-F128 VanDerWaalsContact O-CB 3.29Å; S124-F128 WeakPolarHBondContact O-CB 3.21Å; S124-F128 PolarHBondContact O-N 2.98Å |
| 125 | E | 61.6 | Low | 60.1 | Low | 105 Ų | 105 | 106 Ų | 106 | 49% | 0.491 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -64.9 | -46.3 | 179.8 | -66.2 | -158.4 | 133 | 0 | 0 | 112.6 | N127 F128 I129 | E125-N127 VanDerWaalsContact C-N 3.34Å; E125-N127 PolarHBondContact O-N 3.21Å; E125-F128 PolarHBondContact O-N 3.35Å; E125-I129 WeakPolarHBondContact O-CG1 3.49Å; E125-I129 PolarHBondContact O-N 2.76Å |
| 126 | R | 68 | Low | 63.1 | Low | 151 Ų | 151 | 101.9 Ų | 101.9 | 57% | 0.57 | 50% | 0.499 | S | S | * | . | H | α-helix | trans | -61.8 | -42.9 | 176.7 | -76.3 | -169.4 | -69.1 | -119.4 | 0.1 | 111.8 | N123 R130 | N123-R126 PolarHBondContact OD1-NH2 2.99Å; R126-R130 VanDerWaalsContact O-CB 3.27Å; R126-R130 WeakPolarHBondContact O-CB 3.41Å; R126-R130 PolarHBondContact O-N 3.27Å |
| 127 | N | 74.4 | Confident | 66 | Low | 77 Ų | 77 | 97.6 Ų | 97.6 | 41% | 0.412 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -64.3 | -41.7 | 176.4 | -73.9 | -14.3 | 0 | 0 | 0 | 111.3 | N123 S124 E125 R130 T131 | N123-N127 VanDerWaalsContact O-CB 3.25Å; N123-N127 WeakPolarHBondContact O-CB 3.23Å; N123-N127 PolarHBondContact O-N 3.27Å; N123-N127 VanDerWaalsContact O-N 3.1Å; N123-N127 PolarHBondContact O-ND2 3Å; S124-N127 PolarHBondContact O-N 3.17Å; E125-N127 VanDerWaalsContact C-N 3.34Å; E125-N127 PolarHBondContact O-N 3.21Å; N127-R130 PolarHBondContact O-N 3.06Å; N127-T131 WeakPolarHBondContact O-CB 3.35Å; N127-T131 PolarHBondContact O-N 3.46Å; N127-T131 PolarHBondContact O-OG1 3.45Å |
| 128 | F | 74.4 | Confident | 68.8 | Low | 110 Ų | 110 | 92.6 Ų | 92.6 | 48% | 0.482 | 46% | 0.464 | S | S | . | . | H | α-helix | trans | -63 | -49.5 | 177.1 | 179.1 | -98.5 | 0 | 0 | 0 | 112.4 | S124 E125 R130 T131 L132 | S124-F128 VanDerWaalsContact O-CB 3.29Å; S124-F128 WeakPolarHBondContact O-CB 3.21Å; S124-F128 PolarHBondContact O-N 2.98Å; E125-F128 PolarHBondContact O-N 3.35Å; F128-R130 VanDerWaalsContact C-N 3.34Å; F128-R130 PolarHBondContact O-N 2.79Å; F128-T131 PolarHBondContact O-N 3.47Å; F128-L132 HydrophobicContact CE1-CD2 4.28Å; F128-L132 WeakPolarHBondContact O-CB 3.31Å; F128-L132 PolarHBondContact O-N 2.96Å |
| 129 | I | 74.8 | Confident | 71.7 | Confident | 91 Ų | 91 | 86 Ų | 86 | 47% | 0.467 | 43% | 0.43 | S | S | . | . | H | α-helix | trans | -61.7 | -44.2 | 178.7 | -67.4 | 169.9 | 0 | 0 | 0 | 110.3 | E125 L132 L133 | E125-I129 WeakPolarHBondContact O-CG1 3.49Å; E125-I129 PolarHBondContact O-N 2.76Å; I129-L132 PolarHBondContact O-N 3.3Å; I129-L133 WeakPolarHBondContact O-CB 3.36Å; I129-L133 PolarHBondContact O-N 3.49Å |
| 130 | R | 77.8 | Confident | 74.5 | Confident | 140 Ų | 140 | 82.1 Ų | 82.1 | 53% | 0.528 | 41% | 0.414 | S | S | . | . | H | α-helix | trans | -60.8 | -47.1 | 177.2 | -174.4 | 176.8 | 65.3 | 178.9 | -0.2 | 111.3 | R126 N127 F128 L132 L133 I134 | R126-R130 VanDerWaalsContact O-CB 3.27Å; R126-R130 WeakPolarHBondContact O-CB 3.41Å; R126-R130 PolarHBondContact O-N 3.27Å; N127-R130 PolarHBondContact O-N 3.06Å; F128-R130 VanDerWaalsContact C-N 3.34Å; F128-R130 PolarHBondContact O-N 2.79Å; R130-L132 VanDerWaalsContact C-N 3.34Å; R130-L132 PolarHBondContact O-N 3.43Å; R130-L133 PolarHBondContact O-N 2.83Å; R130-I134 HydrophobicContact CG-CD1 4.13Å; R130-I134 WeakPolarHBondContact O-CG1 3.37Å; R130-I134 PolarHBondContact O-N 3.38Å; R130-I134 VanDerWaalsContact O-N 3.08Å |
| 131 | T | 80.6 | Confident | 77.2 | Confident | 59 Ų | 59 | 81 Ų | 81 | 36% | 0.362 | 41% | 0.408 | S | S | . | . | H | α-helix | trans | -61.7 | -41.9 | 176.8 | -63.3 | 0 | 0 | 0 | 0 | 111.6 | N127 F128 I134 R135 | N127-T131 WeakPolarHBondContact O-CB 3.35Å; N127-T131 PolarHBondContact O-N 3.46Å; N127-T131 PolarHBondContact O-OG1 3.45Å; F128-T131 PolarHBondContact O-N 3.47Å; T131-I134 PolarHBondContact O-N 3.19Å; T131-R135 VanDerWaalsContact O-CG 3.3Å; T131-R135 WeakPolarHBondContact O-CG 3.23Å; T131-R135 PolarHBondContact O-N 3.05Å; T131-R135 VanDerWaalsContact O-N 3.12Å |
| 132 | L | 79.2 | Confident | 79.7 | Confident | 55 Ų | 55 | 77 Ų | 77 | 29% | 0.288 | 39% | 0.388 | S | S | . | . | H | α-helix | trans | -65.9 | -40.9 | 178.2 | -172.8 | 66.1 | 0 | 0 | 0 | 111.9 | F128 I129 R130 I134 R135 F136 | F128-L132 HydrophobicContact CE1-CD2 4.28Å; F128-L132 WeakPolarHBondContact O-CB 3.31Å; F128-L132 PolarHBondContact O-N 2.96Å; I129-L132 PolarHBondContact O-N 3.3Å; R130-L132 VanDerWaalsContact C-N 3.34Å; R130-L132 PolarHBondContact O-N 3.43Å; L132-I134 PolarHBondContact O-N 2.99Å; L132-R135 WeakPolarHBondContact O-CB 3.26Å; L132-R135 PolarHBondContact O-N 3.33Å; L132-F136 WeakPolarHBondContact O-CB 3.39Å; L132-F136 PolarHBondContact O-N 3.06Å |
| 133 | L | 85.1 | Confident | 82 | Confident | 122 Ų | 122 | 74.3 Ų | 74.3 | 64% | 0.639 | 37% | 0.371 | S | S | * | . | H | α-helix | trans | -65.3 | -39.3 | 179 | -170.7 | 144.1 | 0 | 0 | 0 | 112 | I129 R130 F136 S137 | I129-L133 WeakPolarHBondContact O-CB 3.36Å; I129-L133 PolarHBondContact O-N 3.49Å; R130-L133 PolarHBondContact O-N 2.83Å; L133-F136 PolarHBondContact O-N 3.14Å; L133-S137 PolarHBondContact O-N 3.45Å |
| 134 | I | 86.3 | Confident | 84.1 | Confident | 55 Ų | 55 | 74.4 Ų | 74.4 | 28% | 0.282 | 37% | 0.367 | S | S | . | . | H | α-helix | trans | -62.9 | -44.4 | 173.5 | -68 | 164.3 | 0 | 0 | 0 | 110.7 | R130 T131 L132 F136 S137 F138 E413 | R130-I134 HydrophobicContact CG-CD1 4.13Å; R130-I134 WeakPolarHBondContact O-CG1 3.37Å; R130-I134 PolarHBondContact O-N 3.38Å; R130-I134 VanDerWaalsContact O-N 3.08Å; T131-I134 PolarHBondContact O-N 3.19Å; L132-I134 PolarHBondContact O-N 2.99Å; I134-F136 VanDerWaalsContact C-N 3.33Å; I134-F136 PolarHBondContact O-N 3.49Å; I134-S137 WeakPolarHBondContact O-CB 3.39Å; I134-S137 PolarHBondContact O-N 2.93Å; I134-F138 HydrophobicContact CG2-CD2 4.25Å; I134-F138 HydrophobicContact CG2-CE2 3.82Å; I134-F138 VanDerWaalsContact O-CD2 3.22Å; I134-F138 WeakPolarHBondContact O-CD2 3.37Å; I134-F138 PolarHBondContact O-N 3.4Å; I134-E413 WeakPolarHBondContact CD1-OE2 3.21Å |
| 135 | R | 90.4 | Very high | 86 | Confident | 60 Ų | 60 | 72.2 Ų | 72.2 | 23% | 0.226 | 35% | 0.349 | C | S | . | . | H | α-helix | trans | -61.9 | -43.1 | 175.6 | -67.4 | 177.3 | -161.4 | -176.7 | 3.7 | 111.6 | T131 L132 S137 F138 Y139 Y277 E281 | T131-R135 VanDerWaalsContact O-CG 3.3Å; T131-R135 WeakPolarHBondContact O-CG 3.23Å; T131-R135 PolarHBondContact O-N 3.05Å; T131-R135 VanDerWaalsContact O-N 3.12Å; L132-R135 WeakPolarHBondContact O-CB 3.26Å; L132-R135 PolarHBondContact O-N 3.33Å; R135-S137 VanDerWaalsContact C-N 3.26Å; R135-S137 PolarHBondContact O-N 3.35Å; R135-F138 WeakPolarHBondContact O-CB 3.39Å; R135-F138 PolarHBondContact O-N 3.46Å; R135-F138 VanDerWaalsContact O-N 3.08Å; R135-Y139 HydrophobicContact CB-CD2 4.35Å; R135-Y139 HydrophobicContact CB-CE2 3.85Å; R135-Y139 WeakPolarHBondContact O-CD2 3.26Å; R135-Y139 PolarHBondContact O-N 2.83Å; R135-Y277 HydrophobicContact CG-CD1 4.3Å; R135-Y277 HydrophobicContact CG-CD2 4.33Å; R135-Y277 HydrophobicContact CG-CE1 3.89Å; R135-Y277 HydrophobicContact CG-CE2 3.89Å; R135-E281 VanDerWaalsContact CD-OE1 3.23Å; R135-E281 WeakPolarHBondContact CD-OE1 3.4Å; R135-E281 IonicContact CZ-OE1 3.85Å; R135-E281 IonicContact NE-OE1 3.99Å; R135-E281 IonicContact NH1-OE1 2.9Å; R135-E281 PolarHBondContact NH1-OE1 3.25Å; R135-E281 IonicContact NH1-OE2 3.52Å |
| 136 | F | 90.4 | Very high | 87.7 | Confident | 81 Ų | 81 | 67.4 Ų | 67.4 | 36% | 0.355 | 33% | 0.326 | S | S | . | . | H | α-helix | trans | -60.7 | -36.2 | 178.6 | -160.4 | -94.9 | 0 | 0 | 0 | 112 | L132 L133 I134 Y139 S140 L288 I289 | L132-F136 WeakPolarHBondContact O-CB 3.39Å; L132-F136 PolarHBondContact O-N 3.06Å; L133-F136 PolarHBondContact O-N 3.14Å; I134-F136 VanDerWaalsContact C-N 3.33Å; I134-F136 PolarHBondContact O-N 3.49Å; F136-Y139 PolarHBondContact O-N 3.26Å; F136-S140 WeakPolarHBondContact O-CB 3.33Å; F136-S140 PolarHBondContact O-N 3.09Å; F136-L288 HydrophobicContact CE2-CD2 4.37Å; F136-L288 HydrophobicContact CZ-CD2 4.06Å; F136-I289 HydrophobicContact CD1-CD1 4.11Å; F136-I289 HydrophobicContact CD2-CD1 4.18Å; F136-I289 HydrophobicContact CE1-CD1 3.67Å; F136-I289 HydrophobicContact CE1-CG1 3.97Å; F136-I289 HydrophobicContact CE2-CD1 3.75Å; F136-I289 HydrophobicContact CE2-CG1 3.97Å; F136-I289 HydrophobicContact CG-CD1 4.36Å; F136-I289 HydrophobicContact CZ-CD1 3.48Å; F136-I289 VanDerWaalsContact CZ-CD1 3.48Å; F136-I289 HydrophobicContact CZ-CG1 3.47Å; F136-I289 VanDerWaalsContact CZ-CG1 3.47Å |
| 137 | S | 92.3 | Very high | 89.2 | Confident | 77 Ų | 77 | 60.3 Ų | 60.3 | 54% | 0.538 | 30% | 0.3 | S | S | . | . | H | α-helix | trans | -60.6 | -45 | 172.3 | -175.9 | 0 | 0 | 0 | 0 | 112.2 | L133 I134 R135 S140 L141 | L133-S137 PolarHBondContact O-N 3.45Å; I134-S137 WeakPolarHBondContact O-CB 3.39Å; I134-S137 PolarHBondContact O-N 2.93Å; R135-S137 VanDerWaalsContact C-N 3.26Å; R135-S137 PolarHBondContact O-N 3.35Å; S137-S140 PolarHBondContact O-N 2.95Å; S137-L141 PolarHBondContact O-N 2.99Å |
| 138 | F | 93.5 | Very high | 90.3 | Very high | 65 Ų | 65 | 59 Ų | 59 | 29% | 0.285 | 29% | 0.291 | S | S | . | . | H | α-helix | trans | -64.8 | -41.8 | 175 | -71.6 | -68.6 | 0 | 0 | 0 | 112.8 | I134 R135 S140 L141 I142 L273 F410 | I134-F138 HydrophobicContact CG2-CD2 4.25Å; I134-F138 HydrophobicContact CG2-CE2 3.82Å; I134-F138 VanDerWaalsContact O-CD2 3.22Å; I134-F138 WeakPolarHBondContact O-CD2 3.37Å; I134-F138 PolarHBondContact O-N 3.4Å; R135-F138 WeakPolarHBondContact O-CB 3.39Å; R135-F138 PolarHBondContact O-N 3.46Å; R135-F138 VanDerWaalsContact O-N 3.08Å; F138-S140 VanDerWaalsContact C-N 3.31Å; F138-S140 PolarHBondContact O-N 2.79Å; F138-L141 PolarHBondContact O-N 2.83Å; F138-I142 PolarHBondContact O-N 3.3Å; F138-I142 VanDerWaalsContact O-N 3.12Å; F138-L273 HydrophobicContact CB-CD1 3.9Å; F138-L273 HydrophobicContact CB-CD2 4.16Å; F138-F410 AromaticContact CE1-CE1 3.9Å; F138-F410 HydrophobicContact CE1-CE1 3.9Å; F138-F410 HydrophobicContact CZ-CD1 4.47Å; F138-F410 HydrophobicContact CZ-CE1 4.05Å |
| 139 | Y | 95.7 | Very high | 91.4 | Very high | 1 Ų | 1 | 53.8 Ų | 53.8 | 0% | 0.004 | 27% | 0.268 | C | S | . | . | H | α-helix | trans | -63.8 | -37.6 | 175.1 | -62.2 | -45.3 | 0 | 0 | 0 | 112 | R135 F136 I142 A143 L273 Y277 E281 F282 C285 V286 | R135-Y139 HydrophobicContact CB-CD2 4.35Å; R135-Y139 HydrophobicContact CB-CE2 3.85Å; R135-Y139 WeakPolarHBondContact O-CD2 3.26Å; R135-Y139 PolarHBondContact O-N 2.83Å; F136-Y139 PolarHBondContact O-N 3.26Å; Y139-I142 PolarHBondContact O-N 3.38Å; Y139-A143 VanDerWaalsContact O-CB 3.24Å; Y139-A143 WeakPolarHBondContact O-CB 3.47Å; Y139-A143 PolarHBondContact O-N 3.49Å; Y139-L273 HydrophobicContact CD1-CD1 3.53Å; Y139-L273 HydrophobicContact CE1-CB 4.2Å; Y139-L273 HydrophobicContact CE1-CD1 3.61Å; Y139-L273 HydrophobicContact CE1-CG 4.49Å; Y139-Y277 WeakPolarHBondContact OH-CB 3.38Å; Y139-Y277 WeakPolarHBondContact OH-CD2 3.31Å; Y139-E281 HydrophobicContact CE2-CG 4.11Å; Y139-E281 PolarHBondContact OH-OE1 3.04Å; Y139-F282 AromaticContact CD1-CD2 3.99Å; Y139-F282 HydrophobicContact CD1-CD2 3.99Å; Y139-F282 HydrophobicContact CE1-CB 4.22Å; Y139-F282 AromaticContact CE1-CD2 3.83Å; Y139-F282 HydrophobicContact CE1-CD2 3.83Å; Y139-F282 HydrophobicContact CE1-CG 4.5Å; Y139-C285 HydrophobicContact CD2-CB 3.41Å; Y139-C285 VanDerWaalsContact CD2-CB 3.41Å; Y139-C285 HydrophobicContact CE2-CB 3.99Å; Y139-C285 HydrophobicContact CG-CB 3.73Å; Y139-V286 HydrophobicContact CD1-CG2 4.1Å; Y139-V286 HydrophobicContact CG-CG2 4.48Å |
| 140 | S | 96.1 | Very high | 92.5 | Very high | 45 Ų | 45 | 49.5 Ų | 49.5 | 32% | 0.315 | 25% | 0.247 | S | C | . | . | H | α-helix | trans | -64.4 | -40.5 | 176.6 | -168.9 | 0 | 0 | 0 | 0 | 112.1 | F136 S137 F138 F144 | F136-S140 WeakPolarHBondContact O-CB 3.33Å; F136-S140 PolarHBondContact O-N 3.09Å; S137-S140 PolarHBondContact O-N 2.95Å; F138-S140 VanDerWaalsContact C-N 3.31Å; F138-S140 PolarHBondContact O-N 2.79Å; S140-F144 WeakPolarHBondContact O-CB 3.21Å; S140-F144 PolarHBondContact O-N 3.26Å |
| 141 | L | 96 | Very high | 93.4 | Very high | 94 Ų | 94 | 46.8 Ų | 46.8 | 49% | 0.492 | 24% | 0.236 | S | C | . | . | H | α-helix | trans | -65.3 | -44.8 | 177.7 | -178.4 | 139.3 | 0 | 0 | 0 | 111.5 | S137 F138 F144 I145 L269 | S137-L141 PolarHBondContact O-N 2.99Å; F138-L141 PolarHBondContact O-N 2.83Å; L141-F144 PolarHBondContact O-N 2.91Å; L141-I145 HydrophobicContact CD2-CD1 3.58Å; L141-I145 HydrophobicContact CG-CD1 4.18Å; L141-I145 VanDerWaalsContact O-CG1 3.31Å; L141-I145 WeakPolarHBondContact O-CG1 3.3Å; L141-I145 PolarHBondContact O-N 2.95Å; L141-L269 HydrophobicContact CD2-CD1 4.03Å |
| 142 | I | 96.3 | Very high | 94.2 | Very high | 4 Ų | 4 | 44 Ų | 44 | 2% | 0.021 | 22% | 0.219 | C | C | . | . | H | α-helix | trans | -65.7 | -46 | 176.2 | -65.1 | -179.4 | 0 | 0 | 0 | 110.9 | F138 Y139 F144 I145 D146 L269 L273 F282 | F138-I142 PolarHBondContact O-N 3.3Å; F138-I142 VanDerWaalsContact O-N 3.12Å; Y139-I142 PolarHBondContact O-N 3.38Å; I142-F144 PolarHBondContact O-N 3.07Å; I142-I145 PolarHBondContact O-N 2.88Å; I142-D146 VanDerWaalsContact O-CB 3.23Å; I142-D146 WeakPolarHBondContact O-CB 3.32Å; I142-D146 PolarHBondContact O-N 2.85Å; I142-L269 HydrophobicContact CD1-CB 3.51Å; I142-L269 HydrophobicContact CG1-CB 3.79Å; I142-L269 HydrophobicContact CG1-CD1 4.13Å; I142-L273 HydrophobicContact CD1-CD1 3.25Å; I142-L273 HydrophobicContact CD1-CG 3.8Å; I142-L273 HydrophobicContact CG1-CD1 4.29Å; I142-F282 HydrophobicContact CD1-CE2 4.14Å; I142-F282 HydrophobicContact CG2-CE2 4.33Å; I142-F282 HydrophobicContact CG2-CZ 4.41Å |
| 143 | A | 97.9 | Very high | 95 | Very high | 0 Ų | 0 | 42.1 Ų | 42.1 | 0% | 0 | 21% | 0.209 | C | C | . | . | H | α-helix | trans | -56.8 | -41.5 | 177.8 | 0 | 0 | 0 | 0 | 0 | 111.6 | Y139 D146 V147 V286 I289 A290 | Y139-A143 VanDerWaalsContact O-CB 3.24Å; Y139-A143 WeakPolarHBondContact O-CB 3.47Å; Y139-A143 PolarHBondContact O-N 3.49Å; A143-D146 PolarHBondContact O-N 3.14Å; A143-V147 WeakPolarHBondContact O-CB 3.5Å; A143-V147 WeakPolarHBondContact O-CG2 3.25Å; A143-V147 PolarHBondContact O-N 2.94Å; A143-V286 HydrophobicContact CB-CG1 4.11Å; A143-I289 HydrophobicContact CB-CB 3.88Å; A143-I289 HydrophobicContact CB-CG2 3.78Å; A143-A290 HydrophobicContact CB-CB 4.17Å |
| 144 | F | 97.6 | Very high | 95.6 | Very high | 96 Ų | 96 | 36.6 Ų | 36.6 | 42% | 0.421 | 18% | 0.181 | S | C | . | . | H | α-helix | trans | -63.1 | -50.3 | 175.7 | -177.5 | -93.7 | 0 | 0 | 0 | 112.2 | S140 L141 I142 D146 V147 H148 I293 | S140-F144 WeakPolarHBondContact O-CB 3.21Å; S140-F144 PolarHBondContact O-N 3.26Å; L141-F144 PolarHBondContact O-N 2.91Å; I142-F144 PolarHBondContact O-N 3.07Å; F144-D146 VanDerWaalsContact C-N 3.28Å; F144-D146 PolarHBondContact O-N 3.22Å; F144-V147 PolarHBondContact O-N 3.09Å; F144-H148 AromaticContact CD1-CD2 3.93Å; F144-H148 AromaticContact CD2-CD2 3.86Å; F144-H148 AromaticContact CD2-NE2 3.98Å; F144-H148 AromaticContact CE1-CD2 3.6Å; F144-H148 AromaticContact CE1-NE2 3.95Å; F144-H148 AromaticContact CE2-CD2 3.53Å; F144-H148 AromaticContact CE2-NE2 3.26Å; F144-H148 VanDerWaalsContact CE2-NE2 3.26Å; F144-H148 WeakPolarHBondContact CE2-NE2 3.35Å; F144-H148 AromaticContact CZ-CD2 3.39Å; F144-H148 WeakPolarHBondContact CZ-CD2 3.4Å; F144-H148 AromaticContact CZ-NE2 3.23Å; F144-H148 WeakPolarHBondContact CZ-NE2 3.49Å; F144-H148 PolarHBondContact O-CD2 3.34Å; F144-H148 VanDerWaalsContact O-CD2 3.26Å; F144-H148 PolarHBondContact O-N 3.38Å; F144-H148 VanDerWaalsContact O-N 3.08Å; F144-I293 HydrophobicContact CB-CD1 4.49Å |
| 145 | I | 97.7 | Very high | 96 | Very high | 28 Ų | 28 | 34.4 Ų | 34.4 | 14% | 0.144 | 17% | 0.17 | C | C | . | . | H | α-helix | trans | -58.4 | -44.3 | 177.9 | -68.3 | 167.4 | 0 | 0 | 0 | 110.6 | L141 I142 H148 A149 S262 L265 L269 | L141-I145 HydrophobicContact CD2-CD1 3.58Å; L141-I145 HydrophobicContact CG-CD1 4.18Å; L141-I145 VanDerWaalsContact O-CG1 3.31Å; L141-I145 WeakPolarHBondContact O-CG1 3.3Å; L141-I145 PolarHBondContact O-N 2.95Å; I142-I145 PolarHBondContact O-N 2.88Å; I145-H148 PolarHBondContact O-N 2.97Å; I145-A149 WeakPolarHBondContact O-CB 3.3Å; I145-A149 PolarHBondContact O-N 3.49Å; I145-S262 WeakPolarHBondContact CG2-O 3.3Å; I145-L265 HydrophobicContact CD1-CD2 4.03Å; I145-L269 HydrophobicContact CD1-CD1 4.09Å |
| 146 | D | 97.8 | Very high | 96.3 | Very high | 4 Ų | 4 | 31.5 Ų | 31.5 | 2% | 0.021 | 16% | 0.159 | C | C | . | . | H | α-helix | trans | -68 | -44 | -176.3 | -166.2 | 82.2 | 0 | 0 | 0 | 112.6 | Y57 I142 A143 F144 H148 A149 N150 S266 Y336 | Y57-D146 WeakPolarHBondContact CE1-OD2 3.12Å; Y57-D146 PolarHBondContact OH-O 2.91Å; Y57-D146 PolarHBondContact OH-OD2 3.3Å; I142-D146 VanDerWaalsContact O-CB 3.23Å; I142-D146 WeakPolarHBondContact O-CB 3.32Å; I142-D146 PolarHBondContact O-N 2.85Å; A143-D146 PolarHBondContact O-N 3.14Å; F144-D146 VanDerWaalsContact C-N 3.28Å; F144-D146 PolarHBondContact O-N 3.22Å; D146-H148 VanDerWaalsContact C-N 3.3Å; D146-H148 PolarHBondContact O-N 3.07Å; D146-A149 WeakPolarHBondContact O-CB 3.04Å; D146-A149 PolarHBondContact O-N 2.91Å; D146-N150 WeakPolarHBondContact O-CB 3.4Å; D146-N150 PolarHBondContact O-N 3.38Å; D146-N150 PolarHBondContact O-ND2 3.49Å; D146-N150 PolarHBondContact OD2-ND2 2.87Å; D146-S266 PolarHBondContact OD1-OG 2.99Å; D146-S266 VanDerWaalsContact OD1-OG 3.06Å; D146-Y336 VanDerWaalsContact CG-OH 3.28Å; D146-Y336 PolarHBondContact OD1-OH 3.44Å; D146-Y336 WeakPolarHBondContact OD2-CE1 3.47Å; D146-Y336 PolarHBondContact OD2-OH 2.84Å |
| 147 | V | 98.1 | Very high | 96.5 | Very high | 3 Ų | 3 | 28.5 Ų | 28.5 | 2% | 0.018 | 15% | 0.145 | C | C | . | . | H | α-helix | trans | -60.4 | -42.5 | 174.2 | 168.6 | 0 | 0 | 0 | 0 | 111 | Y57 A143 F144 W151 A290 I293 T294 | Y57-V147 HydrophobicContact CE2-CG2 3.82Å; Y57-V147 WeakPolarHBondContact OH-CA 3.39Å; Y57-V147 PolarHBondContact OH-N 3.48Å; A143-V147 WeakPolarHBondContact O-CB 3.5Å; A143-V147 WeakPolarHBondContact O-CG2 3.25Å; A143-V147 PolarHBondContact O-N 2.94Å; F144-V147 PolarHBondContact O-N 3.09Å; V147-W151 VanDerWaalsContact O-CB 3.3Å; V147-W151 WeakPolarHBondContact O-CB 3.35Å; V147-W151 PolarHBondContact O-N 3.49Å; V147-A290 HydrophobicContact CG2-CB 3.69Å; V147-I293 HydrophobicContact CG1-CG2 3.99Å; V147-T294 HydrophobicContact CB-CG2 4.28Å; V147-T294 HydrophobicContact CG1-CG2 3.58Å; V147-T294 HydrophobicContact CG2-CG2 3.69Å |
| 148 | H | 97.4 | Very high | 96.5 | Very high | 50 Ų | 50 | 26 Ų | 26 | 23% | 0.231 | 13% | 0.129 | C | C | . | . | H | α-helix | trans | -69.9 | -34.7 | 177.2 | -83.6 | -76.9 | 0 | 0 | 0 | 112.7 | F144 I145 D146 W151 S152 Y297 | F144-H148 AromaticContact CD1-CD2 3.93Å; F144-H148 AromaticContact CD2-CD2 3.86Å; F144-H148 AromaticContact CD2-NE2 3.98Å; F144-H148 AromaticContact CE1-CD2 3.6Å; F144-H148 AromaticContact CE1-NE2 3.95Å; F144-H148 AromaticContact CE2-CD2 3.53Å; F144-H148 AromaticContact CE2-NE2 3.26Å; F144-H148 VanDerWaalsContact CE2-NE2 3.26Å; F144-H148 WeakPolarHBondContact CE2-NE2 3.35Å; F144-H148 AromaticContact CZ-CD2 3.39Å; F144-H148 WeakPolarHBondContact CZ-CD2 3.4Å; F144-H148 AromaticContact CZ-NE2 3.23Å; F144-H148 WeakPolarHBondContact CZ-NE2 3.49Å; F144-H148 PolarHBondContact O-CD2 3.34Å; F144-H148 VanDerWaalsContact O-CD2 3.26Å; F144-H148 PolarHBondContact O-N 3.38Å; F144-H148 VanDerWaalsContact O-N 3.08Å; I145-H148 PolarHBondContact O-N 2.97Å; D146-H148 VanDerWaalsContact C-N 3.3Å; D146-H148 PolarHBondContact O-N 3.07Å; H148-W151 PolarHBondContact O-N 2.81Å; H148-S152 VanDerWaalsContact O-CB 3.24Å; H148-S152 WeakPolarHBondContact O-CB 3.38Å; H148-S152 PolarHBondContact O-N 2.75Å; H148-Y297 AromaticContact CE1-CE2 3.93Å; H148-Y297 AromaticContact NE2-CE2 3.72Å; H148-Y297 PolarHBondContact NE2-OH 3.37Å |
| 149 | A | 98 | Very high | 96.5 | Very high | 0 Ų | 0 | 26.5 Ų | 26.5 | 0% | 0 | 13% | 0.13 | C | C | . | . | H | α-helix | trans | -62.3 | -49.3 | 174.1 | 0 | 0 | 0 | 0 | 0 | 111.3 | I145 D146 S152 I153 Y263 | I145-A149 WeakPolarHBondContact O-CB 3.3Å; I145-A149 PolarHBondContact O-N 3.49Å; D146-A149 WeakPolarHBondContact O-CB 3.04Å; D146-A149 PolarHBondContact O-N 2.91Å; A149-S152 PolarHBondContact O-N 3.15Å; A149-I153 PolarHBondContact O-N 2.66Å; A149-Y263 HydrophobicContact CB-CD1 3.77Å; A149-Y263 HydrophobicContact CB-CD2 3.85Å; A149-Y263 HydrophobicContact CB-CE1 3.82Å; A149-Y263 HydrophobicContact CB-CE2 3.91Å; A149-Y263 HydrophobicContact CB-CG 3.79Å |
| 150 | N | 97.6 | Very high | 96.3 | Very high | 1 Ų | 1 | 26.8 Ų | 26.8 | 1% | 0.005 | 13% | 0.131 | C | C | . | . | H | α-helix | trans | -57.3 | -51.2 | 174 | -95.5 | -56.9 | 0 | 0 | 0 | 112.3 | N53 Y57 D146 S152 I153 V154 Y263 M332 Y336 | N53-N150 PolarHBondContact OD1-OD1 3.41Å; Y57-N150 PolarHBondContact OH-ND2 3.48Å; D146-N150 WeakPolarHBondContact O-CB 3.4Å; D146-N150 PolarHBondContact O-N 3.38Å; D146-N150 PolarHBondContact O-ND2 3.49Å; D146-N150 PolarHBondContact OD2-ND2 2.87Å; N150-S152 VanDerWaalsContact C-N 3.28Å; N150-S152 PolarHBondContact O-N 3.48Å; N150-I153 PolarHBondContact O-N 3.43Å; N150-V154 WeakPolarHBondContact O-CB 3.44Å; N150-V154 VanDerWaalsContact O-CG2 3.26Å; N150-V154 WeakPolarHBondContact O-CG2 3.49Å; N150-V154 PolarHBondContact O-N 3.1Å; N150-Y263 VanDerWaalsContact CA-OH 3.3Å; N150-Y263 WeakPolarHBondContact CA-OH 3.36Å; N150-Y263 PolarHBondContact OD1-OH 3.46Å; N150-M332 WeakPolarHBondContact OD1-CE 3.46Å; N150-Y336 PolarHBondContact ND2-OH 3.04Å |
| 151 | W | 97.4 | Very high | 95.9 | Very high | 83 Ų | 83 | 27.3 Ų | 27.3 | 31% | 0.314 | 14% | 0.135 | S | C | . | . | H | α-helix | trans | -56.6 | -45.4 | 177.6 | 171 | 76.8 | 0 | 0 | 0 | 111.4 | P49 L50 V147 H148 T155 L255 | P49-W151 HydrophobicContact CB-CG 4.47Å; L50-W151 HydrophobicContact CD2-CB 4.23Å; L50-W151 HydrophobicContact CD2-CG 4.24Å; V147-W151 VanDerWaalsContact O-CB 3.3Å; V147-W151 WeakPolarHBondContact O-CB 3.35Å; V147-W151 PolarHBondContact O-N 3.49Å; H148-W151 PolarHBondContact O-N 2.81Å; W151-T155 PolarHBondContact NE1-OG1 3.23Å; W151-T155 WeakPolarHBondContact O-CB 3.36Å; W151-T155 PolarHBondContact O-N 3.16Å; W151-T155 PolarHBondContact O-OG1 3.26Å; W151-L255 HydrophobicContact CH2-CD2 4.04Å; W151-L255 HydrophobicContact CZ3-CD2 3.96Å |
| 152 | S | 97.7 | Very high | 95.5 | Very high | 0 Ų | 0 | 25.8 Ų | 25.8 | 0% | 0 | 13% | 0.13 | C | C | . | . | H | α-helix | trans | -63.3 | -50.3 | -177.8 | -152.1 | 0 | 0 | 0 | 0 | 112.1 | H148 A149 N150 T155 A156 L255 | H148-S152 VanDerWaalsContact O-CB 3.24Å; H148-S152 WeakPolarHBondContact O-CB 3.38Å; H148-S152 PolarHBondContact O-N 2.75Å; A149-S152 PolarHBondContact O-N 3.15Å; N150-S152 VanDerWaalsContact C-N 3.28Å; N150-S152 PolarHBondContact O-N 3.48Å; S152-T155 PolarHBondContact O-N 3.06Å; S152-A156 WeakPolarHBondContact O-CB 3.28Å; S152-A156 PolarHBondContact O-N 3.41Å; S152-L255 WeakPolarHBondContact CB-O 3.43Å; S152-L255 VanDerWaalsContact OG-C 3.3Å; S152-L255 WeakPolarHBondContact OG-CA 3.24Å; S152-L255 PolarHBondContact OG-O 3.03Å |
| 153 | I | 96.7 | Very high | 95 | Very high | 15 Ų | 15 | 27.2 Ų | 27.2 | 8% | 0.077 | 14% | 0.139 | C | C | . | . | H | α-helix | trans | -65.6 | -45.9 | 179.5 | -66.7 | -48.4 | 0 | 0 | 0 | 111.5 | A149 N150 T155 A156 Y157 D169 V256 Y263 | A149-I153 PolarHBondContact O-N 2.66Å; N150-I153 PolarHBondContact O-N 3.43Å; I153-T155 VanDerWaalsContact C-N 3.33Å; I153-T155 PolarHBondContact O-N 2.92Å; I153-A156 WeakPolarHBondContact O-CB 3.06Å; I153-A156 PolarHBondContact O-N 2.77Å; I153-Y157 HydrophobicContact CG2-CE2 4.07Å; I153-Y157 VanDerWaalsContact O-CD2 3.29Å; I153-Y157 WeakPolarHBondContact O-CD2 3.48Å; I153-D169 VanDerWaalsContact CD1-OD1 3.32Å; I153-D169 WeakPolarHBondContact CD1-OD1 3.06Å; I153-V256 HydrophobicContact CD1-CB 4.41Å; I153-V256 HydrophobicContact CD1-CG1 4Å; I153-Y263 HydrophobicContact CB-CE2 4.14Å; I153-Y263 HydrophobicContact CG1-CD2 3.92Å; I153-Y263 HydrophobicContact CG1-CE2 3.48Å; I153-Y263 VanDerWaalsContact CG1-CE2 3.48Å |
| 154 | V | 96.6 | Very high | 94.6 | Very high | 7 Ų | 7 | 28.1 Ų | 28.1 | 4% | 0.042 | 15% | 0.145 | C | C | . | . | H | α-helix | trans | -65.1 | -40 | -179.5 | -179.3 | 0 | 0 | 0 | 0 | 111.1 | P49 I52 N150 A156 Y157 Y328 | P49-V154 HydrophobicContact CB-CB 3.81Å; P49-V154 HydrophobicContact CB-CG1 3.83Å; I52-V154 HydrophobicContact CG2-CG1 4.11Å; N150-V154 WeakPolarHBondContact O-CB 3.44Å; N150-V154 VanDerWaalsContact O-CG2 3.26Å; N150-V154 WeakPolarHBondContact O-CG2 3.49Å; N150-V154 PolarHBondContact O-N 3.1Å; V154-A156 VanDerWaalsContact C-N 3.29Å; V154-A156 PolarHBondContact O-N 2.87Å; V154-Y157 PolarHBondContact O-N 3.34Å; V154-Y328 WeakPolarHBondContact CG2-OH 3.37Å |
| 155 | T | 95.9 | Very high | 94.4 | Very high | 8 Ų | 8 | 23.5 Ų | 23.5 | 5% | 0.049 | 13% | 0.125 | C | C | . | . | H | α-helix | trans | -62.5 | -37.8 | 176.2 | -57 | 0 | 0 | 0 | 0 | 111.4 | P49 W151 S152 I153 Y157 A158 Y159 L255 | P49-T155 WeakPolarHBondContact CB-OG1 3.34Å; P49-T155 VanDerWaalsContact CG-OG1 3.3Å; P49-T155 WeakPolarHBondContact CG-OG1 3.33Å; W151-T155 PolarHBondContact NE1-OG1 3.23Å; W151-T155 WeakPolarHBondContact O-CB 3.36Å; W151-T155 PolarHBondContact O-N 3.16Å; W151-T155 PolarHBondContact O-OG1 3.26Å; S152-T155 PolarHBondContact O-N 3.06Å; I153-T155 VanDerWaalsContact C-N 3.33Å; I153-T155 PolarHBondContact O-N 2.92Å; T155-Y157 PolarHBondContact O-N 3.28Å; T155-A158 WeakPolarHBondContact O-CB 3.23Å; T155-A158 PolarHBondContact O-N 3.46Å; T155-Y159 HydrophobicContact CG2-CD2 3.96Å; T155-Y159 HydrophobicContact CG2-CE2 3.63Å; T155-Y159 VanDerWaalsContact O-CD2 3.27Å; T155-Y159 WeakPolarHBondContact O-CD2 3.33Å; T155-L255 HydrophobicContact CG2-CD1 3.55Å |
| 156 | A | 96.5 | Very high | 94.1 | Very high | 0 Ų | 0 | 22.6 Ų | 22.6 | 0% | 0 | 12% | 0.12 | C | C | . | . | H | α-helix | trans | -59.6 | -32 | -178.8 | 0 | 0 | 0 | 0 | 0 | 113.4 | S152 I153 V154 A158 Y159 T160 I165 L255 V256 | S152-A156 WeakPolarHBondContact O-CB 3.28Å; S152-A156 PolarHBondContact O-N 3.41Å; I153-A156 WeakPolarHBondContact O-CB 3.06Å; I153-A156 PolarHBondContact O-N 2.77Å; V154-A156 VanDerWaalsContact C-N 3.29Å; V154-A156 PolarHBondContact O-N 2.87Å; A156-A158 PolarHBondContact O-N 3.47Å; A156-Y159 PolarHBondContact O-N 3.42Å; A156-T160 HydrophobicContact CB-CG2 4.32Å; A156-T160 WeakPolarHBondContact O-CG2 3.49Å; A156-T160 PolarHBondContact O-N 3.26Å; A156-I165 HydrophobicContact CB-CD1 4.32Å; A156-I165 HydrophobicContact CB-CG1 4.4Å; A156-L255 HydrophobicContact CB-CB 4.1Å; A156-V256 HydrophobicContact CB-CG2 3.51Å |
| 157 | Y | 93.5 | Very high | 93.7 | Very high | 18 Ų | 18 | 24.5 Ų | 24.5 | 7% | 0.071 | 13% | 0.133 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -57.2 | -22.5 | 175.5 | -81.7 | -90.2 | 0 | 0 | 0 | 113.7 | A35 N38 S42 I153 V154 T155 V162 I165 | A35-Y157 WeakPolarHBondContact CA-OH 3.22Å; A35-Y157 VanDerWaalsContact CB-OH 3.27Å; A35-Y157 WeakPolarHBondContact CB-OH 3.43Å; N38-Y157 HydrophobicContact CB-CD1 3.92Å; N38-Y157 HydrophobicContact CB-CD2 3.74Å; N38-Y157 HydrophobicContact CB-CE1 4.06Å; N38-Y157 HydrophobicContact CB-CE2 3.92Å; N38-Y157 HydrophobicContact CB-CG 3.76Å; S42-Y157 WeakPolarHBondContact CB-O 3.45Å; S42-Y157 PolarHBondContact OG-O 2.94Å; I153-Y157 HydrophobicContact CG2-CE2 4.07Å; I153-Y157 VanDerWaalsContact O-CD2 3.29Å; I153-Y157 WeakPolarHBondContact O-CD2 3.48Å; V154-Y157 PolarHBondContact O-N 3.34Å; T155-Y157 PolarHBondContact O-N 3.28Å; Y157-V162 HydrophobicContact CD1-CG2 4.27Å; Y157-V162 HydrophobicContact CE1-CG2 4.08Å; Y157-I165 HydrophobicContact CD1-CD1 3.76Å; Y157-I165 HydrophobicContact CD2-CD1 3.7Å; Y157-I165 HydrophobicContact CE1-CD1 3.91Å; Y157-I165 HydrophobicContact CE2-CD1 3.82Å; Y157-I165 HydrophobicContact CE2-CG2 4.37Å; Y157-I165 HydrophobicContact CG-CD1 3.64Å |
| 158 | A | 93.1 | Very high | 93.5 | Very high | 25 Ų | 25 | 25.9 Ų | 25.9 | 21% | 0.207 | 14% | 0.141 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -91.2 | -4.5 | 178.7 | 0 | 0 | 0 | 0 | 0 | 114.2 | N47 T155 A156 F244 | N47-A158 HydrophobicContact CB-CB 3.77Å; N47-A158 VanDerWaalsContact CG-CB 3.49Å; N47-A158 VanDerWaalsContact ND2-CB 3.34Å; N47-A158 WeakPolarHBondContact ND2-CB 3Å; T155-A158 WeakPolarHBondContact O-CB 3.23Å; T155-A158 PolarHBondContact O-N 3.46Å; A156-A158 PolarHBondContact O-N 3.47Å; A158-F244 VanDerWaalsContact O-CE1 3.26Å; A158-F244 WeakPolarHBondContact O-CE1 3.46Å |
| 159 | Y | 92.5 | Very high | 93.2 | Very high | 75 Ų | 75 | 25.4 Ų | 25.4 | 29% | 0.294 | 14% | 0.14 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -131.3 | -19.5 | -172.2 | -65.1 | -71.2 | 0 | 0 | 0 | 114.2 | T155 A156 Q248 M249 F251 L255 | T155-Y159 HydrophobicContact CG2-CD2 3.96Å; T155-Y159 HydrophobicContact CG2-CE2 3.63Å; T155-Y159 VanDerWaalsContact O-CD2 3.27Å; T155-Y159 WeakPolarHBondContact O-CD2 3.33Å; A156-Y159 PolarHBondContact O-N 3.42Å; Y159-Q248 HydrophobicContact CD1-CB 4.27Å; Y159-Q248 HydrophobicContact CD1-CG 4.25Å; Y159-Q248 CarbonylContact O-C 3.56Å; Y159-Q248 VanDerWaalsContact O-C 3.27Å; Y159-M249 WeakPolarHBondContact O-CA 3.41Å; Y159-M249 PolarHBondContact O-N 3.09Å; Y159-F251 HydrophobicContact CD1-CD1 4.13Å; Y159-F251 AromaticContact CD2-CD1 3.89Å; Y159-F251 HydrophobicContact CD2-CD1 3.89Å; Y159-F251 AromaticContact CD2-CE1 3.85Å; Y159-F251 HydrophobicContact CD2-CE1 3.85Å; Y159-F251 HydrophobicContact CE1-CD1 4.44Å; Y159-F251 HydrophobicContact CE2-CD1 4.23Å; Y159-F251 AromaticContact CE2-CE1 3.83Å; Y159-F251 HydrophobicContact CE2-CE1 3.83Å; Y159-F251 AromaticContact CG-CD1 3.85Å; Y159-F251 HydrophobicContact CG-CD1 3.85Å; Y159-F251 HydrophobicContact CG-CE1 4.27Å; Y159-L255 HydrophobicContact CD2-CD1 4.32Å |
| 160 | T | 91.8 | Very high | 93 | Very high | 6 Ų | 6 | 26.3 Ų | 26.3 | 4% | 0.037 | 15% | 0.146 | C | C | . | . | S | Bend | trans | -137 | 168.6 | 177.7 | -166.5 | 0 | 0 | 0 | 0 | 111.7 | A156 S164 I165 D253 V256 | A156-T160 HydrophobicContact CB-CG2 4.32Å; A156-T160 WeakPolarHBondContact O-CG2 3.49Å; A156-T160 PolarHBondContact O-N 3.26Å; T160-S164 VanDerWaalsContact OG1-CB 3.24Å; T160-S164 WeakPolarHBondContact OG1-CB 3.3Å; T160-S164 PolarHBondContact OG1-OG 3.44Å; T160-I165 HydrophobicContact CG2-CD1 4.28Å; T160-I165 HydrophobicContact CG2-CG1 3.72Å; T160-D253 WeakPolarHBondContact CB-OD1 3.05Å; T160-D253 PolarHBondContact OG1-OD1 3.26Å; T160-V256 HydrophobicContact CG2-CG2 4.17Å |
| 161 | S | 88.4 | Confident | 92.9 | Very high | 56 Ų | 56 | 29 Ų | 29 | 39% | 0.392 | 16% | 0.159 | S | C | . | . | trans | -73.7 | 150.9 | -179.7 | 68.7 | 0 | 0 | 0 | 0 | 112 | T163 S164 I165 | S161-T163 PolarHBondContact O-N 3Å; S161-S164 WeakPolarHBondContact O-CB 3.49Å; S161-S164 PolarHBondContact O-N 3.27Å; S161-S164 WeakPolarHBondContact OG-CB 3.49Å; S161-S164 PolarHBondContact OG-N 3.14Å; S161-S164 VanDerWaalsContact OG-N 3.16Å; S161-I165 PolarHBondContact O-N 3.13Å; S161-I165 VanDerWaalsContact O-N 3.09Å | ||
| 162 | V | 87.2 | Confident | 92.7 | Very high | 63 Ų | 63 | 26 Ų | 26 | 38% | 0.382 | 15% | 0.151 | S | C | . | . | H | α-helix | trans | -56.1 | -40.6 | 174.9 | 179.2 | 0 | 0 | 0 | 0 | 111.2 | Y157 S164 I165 Q166 | Y157-V162 HydrophobicContact CD1-CG2 4.27Å; Y157-V162 HydrophobicContact CE1-CG2 4.08Å; V162-S164 VanDerWaalsContact C-N 3.31Å; V162-S164 PolarHBondContact O-N 2.97Å; V162-I165 WeakPolarHBondContact O-CB 3.26Å; V162-I165 PolarHBondContact O-N 2.93Å; V162-Q166 HydrophobicContact CG1-CG 4.44Å; V162-Q166 VanDerWaalsContact O-CG 3.3Å; V162-Q166 WeakPolarHBondContact O-CG 3.48Å; V162-Q166 PolarHBondContact O-N 3.45Å |
| 163 | T | 85.9 | Confident | 92.6 | Very high | 34 Ų | 34 | 26.3 Ų | 26.3 | 21% | 0.209 | 15% | 0.153 | C | C | . | . | H | α-helix | trans | -61.1 | -37.6 | 175.8 | -52.1 | 0 | 0 | 0 | 0 | 112.3 | S161 S167 I207 D210 | S161-T163 PolarHBondContact O-N 3Å; T163-S167 WeakPolarHBondContact O-CB 3.35Å; T163-S167 PolarHBondContact O-N 2.9Å; T163-S167 VanDerWaalsContact O-N 3.1Å; T163-I207 HydrophobicContact CG2-CB 4.4Å; T163-I207 HydrophobicContact CG2-CG1 4.42Å; T163-I207 HydrophobicContact CG2-CG2 3.74Å; T163-D210 HydrophobicContact CG2-CB 4.37Å; T163-D210 PolarHBondContact OG1-OD2 3.44Å |
| 164 | S | 89.9 | Confident | 92.5 | Very high | 18 Ų | 18 | 29.2 Ų | 29.2 | 13% | 0.126 | 17% | 0.173 | C | C | . | . | H | α-helix | trans | -64.5 | -46.2 | 174.2 | -170.1 | 0 | 0 | 0 | 0 | 111.2 | T160 S161 V162 Q166 S167 L168 D253 | T160-S164 VanDerWaalsContact OG1-CB 3.24Å; T160-S164 WeakPolarHBondContact OG1-CB 3.3Å; T160-S164 PolarHBondContact OG1-OG 3.44Å; S161-S164 WeakPolarHBondContact O-CB 3.49Å; S161-S164 PolarHBondContact O-N 3.27Å; S161-S164 WeakPolarHBondContact OG-CB 3.49Å; S161-S164 PolarHBondContact OG-N 3.14Å; S161-S164 VanDerWaalsContact OG-N 3.16Å; V162-S164 VanDerWaalsContact C-N 3.31Å; V162-S164 PolarHBondContact O-N 2.97Å; S164-Q166 PolarHBondContact O-N 3.43Å; S164-S167 PolarHBondContact O-N 3.49Å; S164-S167 VanDerWaalsContact O-N 3.15Å; S164-S167 PolarHBondContact O-OG 3.09Å; S164-L168 WeakPolarHBondContact O-CG 3.39Å; S164-L168 PolarHBondContact O-N 3.08Å; S164-D253 PolarHBondContact OG-OD1 2.99Å |
| 165 | I | 92.4 | Very high | 92.5 | Very high | 0 Ų | 0 | 29.9 Ų | 29.9 | 0% | 0 | 18% | 0.177 | C | C | . | . | H | α-helix | trans | -54.5 | -52.2 | 178.3 | -61.9 | 173.1 | 0 | 0 | 0 | 110.4 | A156 Y157 T160 S161 V162 S167 L168 D169 V256 | A156-I165 HydrophobicContact CB-CD1 4.32Å; A156-I165 HydrophobicContact CB-CG1 4.4Å; Y157-I165 HydrophobicContact CD1-CD1 3.76Å; Y157-I165 HydrophobicContact CD2-CD1 3.7Å; Y157-I165 HydrophobicContact CE1-CD1 3.91Å; Y157-I165 HydrophobicContact CE2-CD1 3.82Å; Y157-I165 HydrophobicContact CE2-CG2 4.37Å; Y157-I165 HydrophobicContact CG-CD1 3.64Å; T160-I165 HydrophobicContact CG2-CD1 4.28Å; T160-I165 HydrophobicContact CG2-CG1 3.72Å; S161-I165 PolarHBondContact O-N 3.13Å; S161-I165 VanDerWaalsContact O-N 3.09Å; V162-I165 WeakPolarHBondContact O-CB 3.26Å; V162-I165 PolarHBondContact O-N 2.93Å; I165-S167 VanDerWaalsContact C-N 3.33Å; I165-S167 PolarHBondContact O-N 2.96Å; I165-L168 PolarHBondContact O-N 3.42Å; I165-D169 VanDerWaalsContact CG2-OD2 3.28Å; I165-D169 WeakPolarHBondContact CG2-OD2 3.39Å; I165-D169 VanDerWaalsContact O-CB 3.24Å; I165-D169 WeakPolarHBondContact O-CB 3.22Å; I165-D169 PolarHBondContact O-N 3.38Å; I165-V256 HydrophobicContact CB-CG2 4.23Å; I165-V256 HydrophobicContact CG1-CG2 3.75Å; I165-V256 HydrophobicContact CG2-CG1 4.42Å; I165-V256 HydrophobicContact CG2-CG2 4.37Å |
| 166 | Q | 90.8 | Very high | 92.5 | Very high | 8 Ų | 8 | 29.5 Ų | 29.5 | 4% | 0.037 | 18% | 0.175 | C | C | . | . | H | α-helix | trans | -59.2 | -42 | 179 | -65.3 | 172.5 | -24.9 | 0 | 0 | 112.7 | V162 S164 C170 D359 | V162-Q166 HydrophobicContact CG1-CG 4.44Å; V162-Q166 VanDerWaalsContact O-CG 3.3Å; V162-Q166 WeakPolarHBondContact O-CG 3.48Å; V162-Q166 PolarHBondContact O-N 3.45Å; S164-Q166 PolarHBondContact O-N 3.43Å; Q166-C170 PolarHBondContact O-SG 2.83Å; Q166-D359 HydrophobicContact CG-CB 4.25Å; Q166-D359 WeakPolarHBondContact CG-OD1 3.24Å |
| 167 | S | 90.6 | Very high | 92.5 | Very high | 44 Ų | 44 | 30.8 Ų | 30.8 | 31% | 0.308 | 18% | 0.183 | S | C | . | . | H | α-helix | trans | -66.3 | -42.6 | -179.7 | 77.5 | 0 | 0 | 0 | 0 | 112.9 | T163 S164 I165 C170 I207 | T163-S167 WeakPolarHBondContact O-CB 3.35Å; T163-S167 PolarHBondContact O-N 2.9Å; T163-S167 VanDerWaalsContact O-N 3.1Å; S164-S167 PolarHBondContact O-N 3.49Å; S164-S167 VanDerWaalsContact O-N 3.15Å; S164-S167 PolarHBondContact O-OG 3.09Å; I165-S167 VanDerWaalsContact C-N 3.33Å; I165-S167 PolarHBondContact O-N 2.96Å; S167-C170 WeakPolarHBondContact O-CB 3.31Å; S167-I207 VanDerWaalsContact CA-CD1 3.49Å; S167-I207 VanDerWaalsContact CB-CD1 3.46Å |
| 168 | L | 93.3 | Very high | 92.5 | Very high | 33 Ų | 33 | 34.7 Ų | 34.7 | 17% | 0.173 | 20% | 0.204 | C | C | . | . | H | α-helix | trans | -81.3 | -28.4 | -176.8 | -68.2 | 173.6 | 0 | 0 | 0 | 111.4 | S164 I165 C170 I171 D253 V256 I257 | S164-L168 WeakPolarHBondContact O-CG 3.39Å; S164-L168 PolarHBondContact O-N 3.08Å; I165-L168 PolarHBondContact O-N 3.42Å; L168-C170 PolarHBondContact O-N 3.23Å; L168-C170 VanDerWaalsContact O-N 3.15Å; L168-I171 HydrophobicContact CD2-CD1 4.15Å; L168-I171 WeakPolarHBondContact O-CB 3.28Å; L168-I171 VanDerWaalsContact O-CG1 3.3Å; L168-I171 WeakPolarHBondContact O-CG1 3.31Å; L168-I171 PolarHBondContact O-N 2.84Å; L168-D253 HydrophobicContact CD1-CB 3.57Å; L168-V256 HydrophobicContact CB-CB 3.95Å; L168-V256 HydrophobicContact CB-CG1 3.45Å; L168-V256 VanDerWaalsContact CB-CG1 3.45Å; L168-V256 HydrophobicContact CD1-CB 4.14Å; L168-I257 HydrophobicContact CD1-CG1 4.47Å; L168-I257 HydrophobicContact CD2-CD1 4.41Å; L168-I257 HydrophobicContact CD2-CG1 4.22Å |
| 169 | D | 92.1 | Very high | 92.5 | Very high | 39 Ų | 39 | 34.2 Ų | 34.2 | 21% | 0.209 | 20% | 0.199 | C | C | . | . | H | α-helix | trans | -60.8 | -22.7 | 173.7 | -80.1 | -21.9 | 0 | 0 | 0 | 112.7 | I153 I165 I171 S172 V256 | I153-D169 VanDerWaalsContact CD1-OD1 3.32Å; I153-D169 WeakPolarHBondContact CD1-OD1 3.06Å; I165-D169 VanDerWaalsContact CG2-OD2 3.28Å; I165-D169 WeakPolarHBondContact CG2-OD2 3.39Å; I165-D169 VanDerWaalsContact O-CB 3.24Å; I165-D169 WeakPolarHBondContact O-CB 3.22Å; I165-D169 PolarHBondContact O-N 3.38Å; D169-I171 PolarHBondContact O-N 3.26Å; D169-I171 VanDerWaalsContact O-N 3.15Å; D169-S172 WeakPolarHBondContact O-CB 3.42Å; D169-S172 PolarHBondContact O-N 2.78Å; D169-S172 PolarHBondContact O-OG 2.92Å; D169-V256 WeakPolarHBondContact OD1-CG1 3.19Å |
| 170 | C | 93 | Very high | 92.6 | Very high | 20 Ų | 20 | 30.6 Ų | 30.6 | 14% | 0.135 | 19% | 0.185 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -60.4 | -20.6 | 171.6 | -68.6 | 0 | 0 | 0 | 0 | 113.5 | Q166 S167 L168 S172 I173 P174 L200 | Q166-C170 PolarHBondContact O-SG 2.83Å; S167-C170 WeakPolarHBondContact O-CB 3.31Å; L168-C170 PolarHBondContact O-N 3.23Å; L168-C170 VanDerWaalsContact O-N 3.15Å; C170-S172 PolarHBondContact O-N 3.4Å; C170-I173 WeakPolarHBondContact O-CB 3.24Å; C170-I173 PolarHBondContact O-N 2.7Å; C170-P174 VanDerWaalsContact O-CD 3.29Å; C170-P174 WeakPolarHBondContact O-CD 3.43Å; C170-L200 HydrophobicContact CB-CD2 4.24Å |
| 171 | I | 94.7 | Very high | 92.5 | Very high | 56 Ų | 56 | 37 Ų | 37 | 29% | 0.287 | 21% | 0.209 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -62.7 | -21.3 | 173.3 | -66.5 | 169.2 | 0 | 0 | 0 | 111.7 | L168 D169 I173 P174 T175 I257 A260 I261 | L168-I171 HydrophobicContact CD2-CD1 4.15Å; L168-I171 WeakPolarHBondContact O-CB 3.28Å; L168-I171 VanDerWaalsContact O-CG1 3.3Å; L168-I171 WeakPolarHBondContact O-CG1 3.31Å; L168-I171 PolarHBondContact O-N 2.84Å; D169-I171 PolarHBondContact O-N 3.26Å; D169-I171 VanDerWaalsContact O-N 3.15Å; I171-I173 PolarHBondContact O-N 2.82Å; I171-P174 WeakPolarHBondContact O-CD 3.13Å; I171-T175 PolarHBondContact O-N 2.82Å; I171-T175 PolarHBondContact O-OG1 3.42Å; I171-I257 HydrophobicContact CD1-CG1 3.91Å; I171-A260 HydrophobicContact CB-CB 4.34Å; I171-I261 HydrophobicContact CG2-CG1 4.08Å |
| 172 | S | 94.5 | Very high | 92.5 | Very high | 21 Ų | 21 | 40.5 Ų | 40.5 | 15% | 0.147 | 22% | 0.218 | C | C | . | . | H | α-helix | trans | -56.8 | -33.5 | 171.5 | 67.6 | 0 | 0 | 0 | 0 | 111.8 | D169 C170 T175 V176 A260 | D169-S172 WeakPolarHBondContact O-CB 3.42Å; D169-S172 PolarHBondContact O-N 2.78Å; D169-S172 PolarHBondContact O-OG 2.92Å; C170-S172 PolarHBondContact O-N 3.4Å; S172-T175 WeakPolarHBondContact O-CB 3.49Å; S172-T175 PolarHBondContact O-N 3.39Å; S172-V176 WeakPolarHBondContact O-CB 3.21Å; S172-V176 WeakPolarHBondContact O-CG2 3.36Å; S172-V176 PolarHBondContact O-N 3.43Å; S172-A260 WeakPolarHBondContact CA-O 3.39Å; S172-A260 WeakPolarHBondContact CB-O 3.31Å |
| 173 | I | 95.2 | Very high | 92.4 | Very high | 6 Ų | 6 | 40.9 Ų | 40.9 | 3% | 0.031 | 21% | 0.214 | C | C | . | . | H | α-helix | trans | -65.1 | -57.2 | -177.4 | -64.1 | 162.5 | 0 | 0 | 0 | 111.7 | C170 I171 T175 V176 V177 I196 L200 L353 | C170-I173 WeakPolarHBondContact O-CB 3.24Å; C170-I173 PolarHBondContact O-N 2.7Å; I171-I173 PolarHBondContact O-N 2.82Å; I173-T175 PolarHBondContact O-N 3.48Å; I173-V176 PolarHBondContact O-N 3.06Å; I173-V176 VanDerWaalsContact O-N 3.17Å; I173-V177 WeakPolarHBondContact O-CG2 3.21Å; I173-V177 PolarHBondContact O-N 3.04Å; I173-I196 HydrophobicContact CG2-CG2 3.82Å; I173-L200 HydrophobicContact CD1-CD2 3.64Å; I173-L200 HydrophobicContact CD1-CG 4.4Å; I173-L353 HydrophobicContact CD1-CD2 3.91Å; I173-L353 HydrophobicContact CG1-CD2 4.12Å; I173-L353 HydrophobicContact CG2-CD2 3.95Å |
| 174 | P | 95.2 | Very high | 92.4 | Very high | 77 Ų | 77 | 40.1 Ų | 40.1 | 50% | 0.5 | 21% | 0.209 | S | C | . | . | H | α-helix | trans | -52.7 | -43 | 171 | -27.7 | 32.8 | 0 | 0 | 0 | 113.2 | C170 I171 V176 V177 L178 | C170-P174 VanDerWaalsContact O-CD 3.29Å; C170-P174 WeakPolarHBondContact O-CD 3.43Å; I171-P174 WeakPolarHBondContact O-CD 3.13Å; P174-V176 VanDerWaalsContact C-N 3.27Å; P174-V176 PolarHBondContact O-N 3.27Å; P174-V177 PolarHBondContact O-N 3.2Å; P174-L178 VanDerWaalsContact O-CB 3.31Å; P174-L178 WeakPolarHBondContact O-CB 3.36Å; P174-L178 PolarHBondContact O-N 3.31Å |
| 175 | T | 96 | Very high | 92.2 | Very high | 20 Ų | 20 | 40.6 Ų | 40.6 | 12% | 0.123 | 21% | 0.213 | C | C | . | . | H | α-helix | trans | -58.1 | -41.9 | 179.8 | -58.4 | 0 | 0 | 0 | 0 | 111.6 | I171 S172 I173 S179 I261 | I171-T175 PolarHBondContact O-N 2.82Å; I171-T175 PolarHBondContact O-OG1 3.42Å; S172-T175 WeakPolarHBondContact O-CB 3.49Å; S172-T175 PolarHBondContact O-N 3.39Å; I173-T175 PolarHBondContact O-N 3.48Å; T175-S179 WeakPolarHBondContact O-CB 2.85Å; T175-S179 PolarHBondContact O-N 3.19Å; T175-S179 PolarHBondContact O-OG 3.21Å; T175-I261 HydrophobicContact CG2-CB 4.47Å; T175-I261 HydrophobicContact CG2-CG2 4.13Å; T175-I261 WeakPolarHBondContact CG2-O 3.47Å |
| 176 | V | 96.5 | Very high | 91.7 | Very high | 1 Ų | 1 | 41.2 Ų | 41.2 | 1% | 0.006 | 22% | 0.215 | C | C | . | . | H | α-helix | trans | -77.6 | -37.1 | -177.3 | 176.5 | 0 | 0 | 0 | 0 | 111.8 | S172 I173 P174 L178 S180 G264 V268 A348 V349 N352 | S172-V176 WeakPolarHBondContact O-CB 3.21Å; S172-V176 WeakPolarHBondContact O-CG2 3.36Å; S172-V176 PolarHBondContact O-N 3.43Å; I173-V176 PolarHBondContact O-N 3.06Å; I173-V176 VanDerWaalsContact O-N 3.17Å; P174-V176 VanDerWaalsContact C-N 3.27Å; P174-V176 PolarHBondContact O-N 3.27Å; V176-L178 VanDerWaalsContact C-N 3.34Å; V176-S180 WeakPolarHBondContact O-CB 3.28Å; V176-S180 PolarHBondContact O-N 2.88Å; V176-S180 PolarHBondContact O-OG 3.13Å; V176-G264 VanDerWaalsContact CG2-O 3.22Å; V176-G264 WeakPolarHBondContact CG2-O 3.43Å; V176-V268 HydrophobicContact CB-CG2 4.33Å; V176-V268 HydrophobicContact CG1-CG2 3.75Å; V176-V268 HydrophobicContact CG2-CG2 4.48Å; V176-A348 HydrophobicContact CG1-CB 3.83Å; V176-V349 HydrophobicContact CG1-CB 4.3Å; V176-V349 HydrophobicContact CG1-CG2 3.75Å; V176-N352 WeakPolarHBondContact CG2-ND2 3.42Å |
| 177 | V | 95.2 | Very high | 91.3 | Very high | 27 Ų | 27 | 48.8 Ų | 48.8 | 16% | 0.164 | 24% | 0.243 | C | C | . | . | H | α-helix | trans | -60.2 | -48.1 | 173.3 | 171.4 | 0 | 0 | 0 | 0 | 109.9 | I173 P174 Y181 Y188 I196 V349 | I173-V177 WeakPolarHBondContact O-CG2 3.21Å; I173-V177 PolarHBondContact O-N 3.04Å; P174-V177 PolarHBondContact O-N 3.2Å; V177-Y181 PolarHBondContact O-N 3.37Å; V177-Y188 HydrophobicContact CG1-CD2 4.32Å; V177-Y188 HydrophobicContact CG1-CE2 3.79Å; V177-Y188 PolarHBondContact O-OH 2.94Å; V177-I196 HydrophobicContact CG2-CD1 3.8Å; V177-V349 HydrophobicContact CG2-CG1 4Å; V177-V349 HydrophobicContact CG2-CG2 4.21Å |
| 178 | L | 94.5 | Very high | 91.1 | Very high | 99 Ų | 99 | 48 Ų | 48 | 52% | 0.518 | 23% | 0.234 | S | C | . | . | H | α-helix | trans | -67.7 | -46.7 | 179.8 | -172.9 | 62.6 | 0 | 0 | 0 | 112 | P174 V176 S180 Y181 F182 | P174-L178 VanDerWaalsContact O-CB 3.31Å; P174-L178 WeakPolarHBondContact O-CB 3.36Å; P174-L178 PolarHBondContact O-N 3.31Å; V176-L178 VanDerWaalsContact C-N 3.34Å; L178-S180 PolarHBondContact O-N 3.3Å; L178-Y181 WeakPolarHBondContact O-CB 3.35Å; L178-Y181 PolarHBondContact O-N 3.45Å; L178-F182 HydrophobicContact CD1-CD2 4.07Å; L178-F182 HydrophobicContact CD1-CE2 3.46Å; L178-F182 VanDerWaalsContact CD1-CE2 3.46Å; L178-F182 HydrophobicContact CD1-CZ 4.3Å; L178-F182 HydrophobicContact CD2-CE2 4.36Å; L178-F182 HydrophobicContact CG-CD2 4Å; L178-F182 HydrophobicContact CG-CE2 3.69Å; L178-F182 WeakPolarHBondContact O-CD2 3.31Å; L178-F182 PolarHBondContact O-N 3.45Å; L178-F182 VanDerWaalsContact O-N 3.08Å |
| 179 | S | 93.7 | Very high | 90.8 | Very high | 15 Ų | 15 | 48.6 Ų | 48.6 | 11% | 0.105 | 24% | 0.244 | C | C | . | . | H | α-helix | trans | -65.4 | -39.6 | 178.5 | -62.7 | 0 | 0 | 0 | 0 | 111.4 | T175 Y181 F182 F183 | T175-S179 WeakPolarHBondContact O-CB 2.85Å; T175-S179 PolarHBondContact O-N 3.19Å; T175-S179 PolarHBondContact O-OG 3.21Å; S179-Y181 VanDerWaalsContact C-N 3.29Å; S179-Y181 PolarHBondContact O-N 2.71Å; S179-F182 PolarHBondContact O-N 2.78Å; S179-F183 WeakPolarHBondContact O-CB 3.13Å; S179-F183 VanDerWaalsContact O-CD2 3.31Å; S179-F183 WeakPolarHBondContact O-CD2 3.31Å; S179-F183 PolarHBondContact O-N 3.08Å |
| 180 | S | 93.2 | Very high | 90.7 | Very high | 0 Ų | 0 | 56.6 Ų | 56.6 | 0% | 0 | 27% | 0.271 | C | S | . | . | I | π-helix | trans | -65.7 | -33.3 | 175.2 | -62.8 | 0 | 0 | 0 | 0 | 111.9 | V176 L178 L184 S185 Y186 Y188 V268 | V176-S180 WeakPolarHBondContact O-CB 3.28Å; V176-S180 PolarHBondContact O-N 2.88Å; V176-S180 PolarHBondContact O-OG 3.13Å; L178-S180 PolarHBondContact O-N 3.3Å; S180-L184 CarbonylContact O-C 3.59Å; S180-L184 WeakPolarHBondContact O-CA 3.48Å; S180-L184 VanDerWaalsContact O-CB 3.31Å; S180-L184 WeakPolarHBondContact O-CB 3.17Å; S180-L184 PolarHBondContact O-N 3.06Å; S180-S185 PolarHBondContact O-N 3.42Å; S180-Y186 PolarHBondContact O-N 2.9Å; S180-Y188 WeakPolarHBondContact CB-OH 3.36Å; S180-V268 WeakPolarHBondContact OG-CG2 3.43Å |
| 181 | Y | 89.6 | Confident | 90.5 | Very high | 139 Ų | 139 | 58.8 Ų | 58.8 | 55% | 0.545 | 28% | 0.281 | S | S | . | . | I | π-helix | trans | -62.3 | -46.4 | 171.3 | 176.1 | -98.7 | 0 | 0 | 0 | 111.3 | V177 L178 S179 S185 | V177-Y181 PolarHBondContact O-N 3.37Å; L178-Y181 WeakPolarHBondContact O-CB 3.35Å; L178-Y181 PolarHBondContact O-N 3.45Å; S179-Y181 VanDerWaalsContact C-N 3.29Å; S179-Y181 PolarHBondContact O-N 2.71Å; Y181-S185 VanDerWaalsContact O-CA 3.28Å; Y181-S185 WeakPolarHBondContact O-CA 3.28Å; Y181-S185 PolarHBondContact O-N 3.39Å |
| 182 | F | 88.4 | Confident | 90.4 | Very high | 130 Ų | 130 | 56.2 Ų | 56.2 | 57% | 0.57 | 27% | 0.268 | S | S | * | . | I | π-helix | trans | -73.8 | -48.5 | -178.6 | -74.2 | -63.2 | 0 | 0 | 0 | 114.4 | L178 S179 | L178-F182 HydrophobicContact CD1-CD2 4.07Å; L178-F182 HydrophobicContact CD1-CE2 3.46Å; L178-F182 VanDerWaalsContact CD1-CE2 3.46Å; L178-F182 HydrophobicContact CD1-CZ 4.3Å; L178-F182 HydrophobicContact CD2-CE2 4.36Å; L178-F182 HydrophobicContact CG-CD2 4Å; L178-F182 HydrophobicContact CG-CE2 3.69Å; L178-F182 WeakPolarHBondContact O-CD2 3.31Å; L178-F182 PolarHBondContact O-N 3.45Å; L178-F182 VanDerWaalsContact O-N 3.08Å; S179-F182 PolarHBondContact O-N 2.78Å |
| 183 | F | 86.8 | Confident | 90.4 | Very high | 71 Ų | 71 | 60 Ų | 60 | 31% | 0.311 | 28% | 0.28 | S | S | . | . | I | π-helix | trans | -88.6 | -36.4 | -172.2 | -68.2 | -76.2 | 0 | 0 | 0 | 113.5 | S179 L265 V268 L269 F410 | S179-F183 WeakPolarHBondContact O-CB 3.13Å; S179-F183 VanDerWaalsContact O-CD2 3.31Å; S179-F183 WeakPolarHBondContact O-CD2 3.31Å; S179-F183 PolarHBondContact O-N 3.08Å; F183-L265 HydrophobicContact CD2-CD1 4.37Å; F183-L265 HydrophobicContact CE2-CD1 3.68Å; F183-L265 HydrophobicContact CZ-CD1 4.33Å; F183-V268 HydrophobicContact CB-CG1 3.99Å; F183-V268 HydrophobicContact CD2-CG1 4.34Å; F183-L269 HydrophobicContact CD1-CD2 3.98Å; F183-L269 HydrophobicContact CD2-CD2 4.42Å; F183-L269 HydrophobicContact CE1-CD2 4Å; F183-L269 HydrophobicContact CE2-CD2 4.46Å; F183-L269 HydrophobicContact CG-CD2 4.2Å; F183-L269 HydrophobicContact CZ-CD2 4.26Å; F183-F410 HydrophobicContact CE1-CE2 4.42Å |
| 184 | L | 85.7 | Confident | 90.4 | Very high | 18 Ų | 18 | 64.1 Ų | 64.1 | 9% | 0.094 | 30% | 0.301 | C | S | . | . | I | π-helix | trans | -103.4 | -9.7 | -177.1 | -62.9 | 163.9 | 0 | 0 | 0 | 113.2 | S180 Y186 V268 Q271 Y272 | S180-L184 CarbonylContact O-C 3.59Å; S180-L184 WeakPolarHBondContact O-CA 3.48Å; S180-L184 VanDerWaalsContact O-CB 3.31Å; S180-L184 WeakPolarHBondContact O-CB 3.17Å; S180-L184 PolarHBondContact O-N 3.06Å; L184-Y186 VanDerWaalsContact C-N 3.26Å; L184-Y186 HydrophobicContact CB-CD1 3.8Å; L184-Y186 HydrophobicContact CB-CE1 3.78Å; L184-Y186 HydrophobicContact CB-CG 4.24Å; L184-Y186 HydrophobicContact CD1-CE1 4.37Å; L184-Y186 HydrophobicContact CD1-CE2 4.06Å; L184-Y186 PolarHBondContact O-N 3.44Å; L184-V268 HydrophobicContact CD1-CG1 3.89Å; L184-V268 HydrophobicContact CG-CG1 4.2Å; L184-Q271 VanDerWaalsContact CD1-OE1 3.3Å; L184-Y272 HydrophobicContact CD2-CD2 4.35Å |
| 185 | S | 84.1 | Confident | 90.4 | Very high | 29 Ų | 29 | 60.5 Ų | 60.5 | 20% | 0.203 | 28% | 0.277 | C | S | . | . | trans | 56.9 | 37.5 | -179.6 | -54.2 | 0 | 0 | 0 | 0 | 113.5 | S180 Y181 T400 | S180-S185 PolarHBondContact O-N 3.42Å; Y181-S185 VanDerWaalsContact O-CA 3.28Å; Y181-S185 WeakPolarHBondContact O-CA 3.28Å; Y181-S185 PolarHBondContact O-N 3.39Å; S185-T400 WeakPolarHBondContact O-CB 3.49Å; S185-T400 PolarHBondContact O-N 3.46Å; S185-T400 VanDerWaalsContact O-N 3.09Å; S185-T400 PolarHBondContact O-OG1 3.46Å | ||
| 186 | Y | 82.6 | Confident | 90.4 | Very high | 13 Ų | 13 | 60.3 Ų | 60.3 | 5% | 0.051 | 28% | 0.275 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -69.4 | 136.8 | 176.8 | -77.5 | -0.2 | 0 | 0 | 0 | 112.3 | S180 L184 Y188 Q271 P397 I399 | S180-Y186 PolarHBondContact O-N 2.9Å; L184-Y186 VanDerWaalsContact C-N 3.26Å; L184-Y186 HydrophobicContact CB-CD1 3.8Å; L184-Y186 HydrophobicContact CB-CE1 3.78Å; L184-Y186 HydrophobicContact CB-CG 4.24Å; L184-Y186 HydrophobicContact CD1-CE1 4.37Å; L184-Y186 HydrophobicContact CD1-CE2 4.06Å; L184-Y186 PolarHBondContact O-N 3.44Å; Y186-Y188 HydrophobicContact CD2-CE1 4.28Å; Y186-Q271 PolarHBondContact OH-NE2 2.95Å; Y186-P397 HydrophobicContact CD2-CB 3.88Å; Y186-P397 HydrophobicContact CD2-CG 4.39Å; Y186-P397 HydrophobicContact CE2-CB 4.25Å; Y186-P397 HydrophobicContact CG-CB 4.03Å; Y186-I399 HydrophobicContact CD1-CG1 4.1Å; Y186-I399 HydrophobicContact CE1-CD1 4.19Å; Y186-I399 HydrophobicContact CE1-CG1 3.72Å |
| 187 | R | 82.3 | Confident | 90.4 | Very high | 166 Ų | 166 | 65 Ų | 65 | 63% | 0.626 | 30% | 0.3 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -106.4 | 126.3 | 165.1 | -73.2 | -178 | -178.9 | -155.4 | -0.6 | 110 | V398 T400 | R187-V398 PolarHBondContact N-O 3.5Å; R187-V398 PolarHBondContact O-N 3.09Å; R187-T400 WeakPolarHBondContact CG-OG1 3.08Å; R187-T400 PolarHBondContact NE-OG1 2.76Å |
| 188 | Y | 87.3 | Confident | 90.4 | Very high | 28 Ų | 28 | 65 Ų | 65 | 11% | 0.11 | 30% | 0.3 | C | S | . | . | trans | -97 | 121.8 | 179.6 | -58.1 | -73.8 | 0 | 0 | 0 | 110.6 | V177 S180 Y186 H192 V349 F392 P397 | V177-Y188 HydrophobicContact CG1-CD2 4.32Å; V177-Y188 HydrophobicContact CG1-CE2 3.79Å; V177-Y188 PolarHBondContact O-OH 2.94Å; S180-Y188 WeakPolarHBondContact CB-OH 3.36Å; Y186-Y188 HydrophobicContact CD2-CE1 4.28Å; Y188-H192 HydrophobicContact CD1-CB 4.08Å; Y188-V349 HydrophobicContact CE1-CG2 4.13Å; Y188-V349 WeakPolarHBondContact OH-CG2 3.21Å; Y188-F392 HydrophobicContact CE1-CZ 4.33Å; Y188-P397 HydrophobicContact CD1-CB 4.39Å; Y188-P397 HydrophobicContact CD1-CG 4.39Å; Y188-P397 HydrophobicContact CE1-CB 4.29Å; Y188-P397 HydrophobicContact CE1-CG 4.22Å | ||
| 189 | A | 86.8 | Confident | 90.4 | Very high | 46 Ų | 46 | 60.2 Ų | 60.2 | 38% | 0.38 | 28% | 0.276 | S | S | . | . | trans | -69.3 | 161.4 | 160.8 | 0 | 0 | 0 | 0 | 0 | 111.9 | N191 H192 | A189-N191 PolarHBondContact O-N 2.93Å; A189-H192 PolarHBondContact N-ND1 3.17Å; A189-H192 WeakPolarHBondContact O-CB 3.29Å; A189-H192 PolarHBondContact O-N 3.41Å; A189-H192 PolarHBondContact O-ND1 3.42Å; A189-H192 VanDerWaalsContact O-ND1 3.12Å | ||
| 190 | W | 88.9 | Confident | 90.5 | Very high | 206 Ų | 206 | 62.1 Ų | 62.1 | 78% | 0.78 | 28% | 0.284 | S | S | * | . | H | α-helix | trans | -51.8 | -37.4 | 178.8 | -74.3 | 104.2 | 0 | 0 | 0 | 114.3 | H192 Y193 I194 | W190-H192 PolarHBondContact O-N 3.14Å; W190-Y193 PolarHBondContact O-N 2.92Å; W190-Y193 VanDerWaalsContact O-N 3.07Å; W190-I194 WeakPolarHBondContact O-CG1 3.36Å; W190-I194 PolarHBondContact O-N 3.36Å |
| 191 | N | 89.7 | Confident | 90.6 | Very high | 66 Ų | 66 | 67 Ų | 67 | 35% | 0.353 | 31% | 0.309 | S | S | . | . | H | α-helix | trans | -57.7 | -34.6 | 178.9 | -59.3 | 18.4 | 0 | 0 | 0 | 112.4 | A189 I194 G195 N395 | A189-N191 PolarHBondContact O-N 2.93Å; N191-I194 PolarHBondContact O-N 3.39Å; N191-G195 PolarHBondContact O-N 3.38Å; N191-N395 PolarHBondContact ND2-ND2 2.71Å |
| 192 | H | 93 | Very high | 90.8 | Very high | 3 Ų | 3 | 60.3 Ų | 60.3 | 1% | 0.014 | 28% | 0.283 | C | S | . | . | H | α-helix | trans | -67.2 | -42.9 | 177.6 | -55.7 | 113.9 | 0 | 0 | 0 | 111.4 | Y188 A189 W190 G195 I196 F392 N395 | Y188-H192 HydrophobicContact CD1-CB 4.08Å; A189-H192 PolarHBondContact N-ND1 3.17Å; A189-H192 WeakPolarHBondContact O-CB 3.29Å; A189-H192 PolarHBondContact O-N 3.41Å; A189-H192 PolarHBondContact O-ND1 3.42Å; A189-H192 VanDerWaalsContact O-ND1 3.12Å; W190-H192 PolarHBondContact O-N 3.14Å; H192-G195 PolarHBondContact O-N 3.03Å; H192-I196 WeakPolarHBondContact O-CD1 3.39Å; H192-I196 VanDerWaalsContact O-CG1 3.26Å; H192-I196 WeakPolarHBondContact O-CG1 3.39Å; H192-I196 PolarHBondContact O-N 3.36Å; H192-F392 HydrophobicContact CB-CD2 3.74Å; H192-F392 HydrophobicContact CB-CE2 3.57Å; H192-F392 HydrophobicContact CB-CZ 4.33Å; H192-F392 AromaticContact CD2-CD2 3.92Å; H192-F392 AromaticContact CD2-CE1 3.89Å; H192-F392 AromaticContact CD2-CE2 3.75Å; H192-F392 AromaticContact CD2-CZ 3.74Å; H192-F392 AromaticContact CG-CE2 3.97Å; H192-N395 PolarHBondContact NE2-O 2.77Å |
| 193 | Y | 94.2 | Very high | 91.1 | Very high | 100 Ų | 100 | 54.2 Ų | 54.2 | 39% | 0.392 | 26% | 0.257 | S | S | . | . | H | α-helix | trans | -65 | -40.9 | 177.9 | -65.8 | -70.4 | 0 | 0 | 0 | 111.6 | W190 G195 I196 I197 | W190-Y193 PolarHBondContact O-N 2.92Å; W190-Y193 VanDerWaalsContact O-N 3.07Å; Y193-G195 VanDerWaalsContact C-N 3.35Å; Y193-G195 PolarHBondContact O-N 3.37Å; Y193-I196 PolarHBondContact O-N 2.89Å; Y193-I197 VanDerWaalsContact O-CG1 3.29Å; Y193-I197 WeakPolarHBondContact O-CG1 3.43Å; Y193-I197 PolarHBondContact O-N 2.82Å |
| 194 | I | 94.8 | Very high | 91.4 | Very high | 93 Ų | 93 | 54.4 Ų | 54.4 | 48% | 0.477 | 26% | 0.264 | S | S | . | . | H | α-helix | trans | -60.9 | -45.2 | 174.3 | -63.5 | 168.8 | 0 | 0 | 0 | 110.5 | W190 N191 I197 S198 L391 | W190-I194 WeakPolarHBondContact O-CG1 3.36Å; W190-I194 PolarHBondContact O-N 3.36Å; N191-I194 PolarHBondContact O-N 3.39Å; I194-I197 PolarHBondContact O-N 3.35Å; I194-S198 WeakPolarHBondContact O-CB 3.37Å; I194-S198 PolarHBondContact O-N 3.18Å; I194-L391 HydrophobicContact CG2-CD1 4.21Å |
| 195 | G | 94.8 | Very high | 91.7 | Very high | 0 Ų | 0 | 54.5 Ų | 54.5 | 0% | 0 | 27% | 0.269 | C | S | . | . | H | α-helix | trans | -60.8 | -44.4 | 176.5 | 0 | 0 | 0 | 0 | 0 | 113.1 | N191 H192 Y193 S198 C199 G388 | N191-G195 PolarHBondContact O-N 3.38Å; H192-G195 PolarHBondContact O-N 3.03Å; Y193-G195 VanDerWaalsContact C-N 3.35Å; Y193-G195 PolarHBondContact O-N 3.37Å; G195-S198 PolarHBondContact O-N 2.96Å; G195-C199 PolarHBondContact O-N 3.13Å; G195-C199 PolarHBondContact O-SG 2.83Å; G195-G388 VanDerWaalsContact CA-O 3.31Å; G195-G388 WeakPolarHBondContact CA-O 3.12Å |
| 196 | I | 95.8 | Very high | 92 | Very high | 16 Ų | 16 | 53.3 Ų | 53.3 | 8% | 0.082 | 26% | 0.26 | C | S | . | . | H | α-helix | trans | -60.1 | -50 | 176.2 | -70.2 | 160.7 | 0 | 0 | 0 | 110.9 | I173 V177 H192 Y193 S198 C199 L200 V349 L353 F392 | I173-I196 HydrophobicContact CG2-CG2 3.82Å; V177-I196 HydrophobicContact CG2-CD1 3.8Å; H192-I196 WeakPolarHBondContact O-CD1 3.39Å; H192-I196 VanDerWaalsContact O-CG1 3.26Å; H192-I196 WeakPolarHBondContact O-CG1 3.39Å; H192-I196 PolarHBondContact O-N 3.36Å; Y193-I196 PolarHBondContact O-N 2.89Å; I196-S198 VanDerWaalsContact C-N 3.33Å; I196-S198 PolarHBondContact O-N 3.37Å; I196-C199 PolarHBondContact O-N 2.87Å; I196-L200 HydrophobicContact CG2-CD1 4.03Å; I196-L200 WeakPolarHBondContact O-CG 3.5Å; I196-L200 PolarHBondContact O-N 2.93Å; I196-V349 HydrophobicContact CD1-CG1 4.39Å; I196-L353 HydrophobicContact CB-CD2 4.49Å; I196-L353 HydrophobicContact CG1-CD1 3.88Å; I196-L353 HydrophobicContact CG1-CD2 4.15Å; I196-F392 HydrophobicContact CD1-CD2 4.47Å; I196-F392 HydrophobicContact CD1-CE2 4.1Å; I196-F392 HydrophobicContact CG1-CD2 4.13Å; I196-F392 HydrophobicContact CG1-CE2 4.19Å |
| 197 | I | 96.2 | Very high | 92.3 | Very high | 101 Ų | 101 | 54.6 Ų | 54.6 | 52% | 0.518 | 27% | 0.267 | S | S | . | . | H | α-helix | trans | -61.9 | -42.9 | -179.6 | -68.7 | 166.5 | 0 | 0 | 0 | 110.6 | Y193 I194 C199 L200 I201 | Y193-I197 VanDerWaalsContact O-CG1 3.29Å; Y193-I197 WeakPolarHBondContact O-CG1 3.43Å; Y193-I197 PolarHBondContact O-N 2.82Å; I194-I197 PolarHBondContact O-N 3.35Å; I197-C199 VanDerWaalsContact C-N 3.32Å; I197-C199 PolarHBondContact O-N 3.46Å; I197-L200 PolarHBondContact O-N 2.69Å; I197-I201 HydrophobicContact CG2-CD1 3.91Å; I197-I201 HydrophobicContact CG2-CG1 4.46Å; I197-I201 WeakPolarHBondContact O-CG1 3.43Å; I197-I201 PolarHBondContact O-N 2.97Å |
| 198 | S | 95.7 | Very high | 92.6 | Very high | 25 Ų | 25 | 50.8 Ų | 50.8 | 18% | 0.175 | 26% | 0.259 | C | S | . | . | H | α-helix | trans | -58 | -43.7 | 175.4 | -172.7 | 0 | 0 | 0 | 0 | 111.8 | I194 G195 I196 I201 G202 I384 | I194-S198 WeakPolarHBondContact O-CB 3.37Å; I194-S198 PolarHBondContact O-N 3.18Å; G195-S198 PolarHBondContact O-N 2.96Å; I196-S198 VanDerWaalsContact C-N 3.33Å; I196-S198 PolarHBondContact O-N 3.37Å; S198-I201 PolarHBondContact O-N 3.47Å; S198-G202 PolarHBondContact O-N 3.24Å; S198-G202 VanDerWaalsContact O-N 3.14Å; S198-I384 VanDerWaalsContact O-CG2 3.26Å; S198-I384 WeakPolarHBondContact O-CG2 3.44Å; S198-I384 PolarHBondContact OG-O 3.15Å |
| 199 | C | 95.8 | Very high | 92.7 | Very high | 0 Ų | 0 | 49.7 Ų | 49.7 | 0% | 0 | 26% | 0.255 | C | S | . | . | H | α-helix | trans | -63.5 | -45.8 | 176.8 | -63.5 | 0 | 0 | 0 | 0 | 111.6 | G195 I196 I197 I201 G202 A203 L353 L356 | G195-C199 PolarHBondContact O-N 3.13Å; G195-C199 PolarHBondContact O-SG 2.83Å; I196-C199 PolarHBondContact O-N 2.87Å; I197-C199 VanDerWaalsContact C-N 3.32Å; I197-C199 PolarHBondContact O-N 3.46Å; C199-I201 VanDerWaalsContact C-N 3.31Å; C199-I201 PolarHBondContact O-N 3.32Å; C199-G202 CarbonylContact O-C 3.6Å; C199-G202 WeakPolarHBondContact O-CA 3.25Å; C199-G202 PolarHBondContact O-N 3.18Å; C199-A203 PolarHBondContact O-N 3.28Å; C199-L353 HydrophobicContact CB-CD2 3.83Å; C199-L356 HydrophobicContact CB-CD2 4.01Å; C199-L356 WeakPolarHBondContact O-CD2 3.33Å |
| 200 | L | 95.1 | Very high | 92.6 | Very high | 55 Ų | 55 | 48.6 Ų | 48.6 | 29% | 0.288 | 24% | 0.243 | S | C | . | . | H | α-helix | trans | -62.7 | -35.7 | 179 | -69.7 | 173 | 0 | 0 | 0 | 112.8 | C170 I173 I196 I197 G202 A203 T204 | C170-L200 HydrophobicContact CB-CD2 4.24Å; I173-L200 HydrophobicContact CD1-CD2 3.64Å; I173-L200 HydrophobicContact CD1-CG 4.4Å; I196-L200 HydrophobicContact CG2-CD1 4.03Å; I196-L200 WeakPolarHBondContact O-CG 3.5Å; I196-L200 PolarHBondContact O-N 2.93Å; I197-L200 PolarHBondContact O-N 2.69Å; L200-G202 VanDerWaalsContact C-N 3.33Å; L200-A203 WeakPolarHBondContact O-CB 3.23Å; L200-A203 PolarHBondContact O-N 3.36Å; L200-T204 WeakPolarHBondContact O-CB 3.42Å; L200-T204 PolarHBondContact O-N 3.1Å; L200-T204 PolarHBondContact O-OG1 3.02Å |
| 201 | I | 95.1 | Very high | 92.3 | Very high | 101 Ų | 101 | 46.7 Ų | 46.7 | 52% | 0.518 | 24% | 0.237 | S | C | . | . | H | α-helix | trans | -61.9 | -44.3 | 172.1 | -70.3 | 166.7 | 0 | 0 | 0 | 110.1 | I197 S198 C199 T204 G205 | I197-I201 HydrophobicContact CG2-CD1 3.91Å; I197-I201 HydrophobicContact CG2-CG1 4.46Å; I197-I201 WeakPolarHBondContact O-CG1 3.43Å; I197-I201 PolarHBondContact O-N 2.97Å; S198-I201 PolarHBondContact O-N 3.47Å; C199-I201 VanDerWaalsContact C-N 3.31Å; C199-I201 PolarHBondContact O-N 3.32Å; I201-T204 PolarHBondContact O-N 2.86Å; I201-G205 PolarHBondContact O-N 3.46Å |
| 202 | G | 94.8 | Very high | 92.1 | Very high | 0 Ų | 0 | 50.8 Ų | 50.8 | 0% | 0 | 25% | 0.252 | C | S | . | . | H | α-helix | trans | -60.3 | -47.9 | 175 | 0 | 0 | 0 | 0 | 0 | 113 | S198 C199 L200 T204 G205 M206 | S198-G202 PolarHBondContact O-N 3.24Å; S198-G202 VanDerWaalsContact O-N 3.14Å; C199-G202 CarbonylContact O-C 3.6Å; C199-G202 WeakPolarHBondContact O-CA 3.25Å; C199-G202 PolarHBondContact O-N 3.18Å; L200-G202 VanDerWaalsContact C-N 3.33Å; G202-T204 PolarHBondContact O-N 2.96Å; G202-G205 PolarHBondContact O-N 3.27Å; G202-M206 WeakPolarHBondContact O-CG 3.43Å; G202-M206 PolarHBondContact O-N 3.1Å; G202-M206 VanDerWaalsContact O-N 3.16Å |
| 203 | A | 93.6 | Very high | 91.3 | Very high | 2 Ų | 2 | 53 Ų | 53 | 2% | 0.017 | 26% | 0.263 | C | S | . | . | H | α-helix | trans | -53.4 | -53.1 | 174.7 | 0 | 0 | 0 | 0 | 0 | 111.8 | C199 L200 G205 M206 I207 L356 | C199-A203 PolarHBondContact O-N 3.28Å; L200-A203 WeakPolarHBondContact O-CB 3.23Å; L200-A203 PolarHBondContact O-N 3.36Å; A203-G205 VanDerWaalsContact C-N 3.29Å; A203-G205 PolarHBondContact O-N 2.84Å; A203-M206 WeakPolarHBondContact O-CB 3.4Å; A203-M206 PolarHBondContact O-N 3.13Å; A203-M206 VanDerWaalsContact O-N 3.13Å; A203-I207 PolarHBondContact O-N 2.84Å; A203-L356 HydrophobicContact CB-CD1 3.43Å; A203-L356 VanDerWaalsContact CB-CD1 3.43Å; A203-L356 HydrophobicContact CB-CD2 3.58Å; A203-L356 HydrophobicContact CB-CG 4Å |
| 204 | T | 92.5 | Very high | 90 | Very high | 75 Ų | 75 | 54.4 Ų | 54.4 | 46% | 0.46 | 27% | 0.273 | S | S | . | . | H | α-helix | trans | -64.1 | -38.1 | -176.4 | -51.5 | 0 | 0 | 0 | 0 | 110.7 | L200 I201 G202 M206 I207 L208 | L200-T204 WeakPolarHBondContact O-CB 3.42Å; L200-T204 PolarHBondContact O-N 3.1Å; L200-T204 PolarHBondContact O-OG1 3.02Å; I201-T204 PolarHBondContact O-N 2.86Å; G202-T204 PolarHBondContact O-N 2.96Å; T204-M206 VanDerWaalsContact C-N 3.3Å; T204-M206 PolarHBondContact O-N 3.37Å; T204-I207 PolarHBondContact O-N 3.08Å; T204-L208 HydrophobicContact CG2-CD1 4.15Å; T204-L208 WeakPolarHBondContact O-CB 3.45Å; T204-L208 WeakPolarHBondContact O-CG 3.39Å; T204-L208 PolarHBondContact O-N 3.18Å |
| 205 | G | 92.6 | Very high | 88.1 | Confident | 19 Ų | 19 | 54.5 Ų | 54.5 | 20% | 0.196 | 28% | 0.28 | C | S | . | . | H | α-helix | trans | -61.2 | -34.8 | 175.3 | 0 | 0 | 0 | 0 | 0 | 113.5 | I201 G202 A203 T209 | I201-G205 PolarHBondContact O-N 3.46Å; G202-G205 PolarHBondContact O-N 3.27Å; A203-G205 VanDerWaalsContact C-N 3.29Å; A203-G205 PolarHBondContact O-N 2.84Å; G205-T209 PolarHBondContact O-N 3.32Å; G205-T209 PolarHBondContact O-OG1 3.44Å |
| 206 | M | 90.2 | Very high | 85.6 | Confident | 4 Ų | 4 | 59 Ų | 59 | 2% | 0.02 | 31% | 0.312 | C | S | . | . | H | α-helix | trans | -67.5 | -47.6 | 175.5 | -65.2 | 173.1 | 53.3 | 0 | 0 | 112 | G202 A203 T204 L208 T209 D210 D359 V360 C381 I385 | G202-M206 WeakPolarHBondContact O-CG 3.43Å; G202-M206 PolarHBondContact O-N 3.1Å; G202-M206 VanDerWaalsContact O-N 3.16Å; A203-M206 WeakPolarHBondContact O-CB 3.4Å; A203-M206 PolarHBondContact O-N 3.13Å; A203-M206 VanDerWaalsContact O-N 3.13Å; T204-M206 VanDerWaalsContact C-N 3.3Å; T204-M206 PolarHBondContact O-N 3.37Å; M206-L208 VanDerWaalsContact C-N 3.27Å; M206-L208 PolarHBondContact O-N 3.01Å; M206-T209 WeakPolarHBondContact O-CA 3.47Å; M206-T209 VanDerWaalsContact O-CB 3.25Å; M206-T209 WeakPolarHBondContact O-CB 3.42Å; M206-T209 PolarHBondContact O-N 3.36Å; M206-D210 PolarHBondContact O-N 3.23Å; M206-D359 VanDerWaalsContact CE-C 3.49Å; M206-D359 HydrophobicContact CE-CB 3.44Å; M206-D359 VanDerWaalsContact CE-CB 3.44Å; M206-D359 HydrophobicContact SD-CB 4.38Å; M206-V360 HydrophobicContact CE-CB 4.18Å; M206-V360 HydrophobicContact CE-CG2 3.45Å; M206-V360 VanDerWaalsContact CE-CG2 3.45Å; M206-V360 HydrophobicContact CG-CG2 4.39Å; M206-V360 HydrophobicContact SD-CG2 3.24Å; M206-V360 WeakPolarHBondContact SD-CG2 3.34Å; M206-C381 HydrophobicContact CG-CB 3.42Å; M206-C381 VanDerWaalsContact CG-CB 3.42Å; M206-C381 HydrophobicContact SD-CB 4.41Å; M206-I385 HydrophobicContact SD-CD1 3.96Å |
| 207 | I | 89.2 | Confident | 82.9 | Confident | 40 Ų | 40 | 65.4 Ų | 65.4 | 21% | 0.205 | 35% | 0.346 | C | S | . | . | H | α-helix | trans | -60.1 | -41.2 | 178.2 | -66.9 | 151.7 | 0 | 0 | 0 | 110.7 | T163 S167 A203 T204 T209 D210 Y211 | T163-I207 HydrophobicContact CG2-CB 4.4Å; T163-I207 HydrophobicContact CG2-CG1 4.42Å; T163-I207 HydrophobicContact CG2-CG2 3.74Å; S167-I207 VanDerWaalsContact CA-CD1 3.49Å; S167-I207 VanDerWaalsContact CB-CD1 3.46Å; A203-I207 PolarHBondContact O-N 2.84Å; T204-I207 PolarHBondContact O-N 3.08Å; I207-T209 VanDerWaalsContact C-N 3.29Å; I207-T209 PolarHBondContact O-N 2.94Å; I207-D210 PolarHBondContact O-N 3Å; I207-Y211 PolarHBondContact O-N 2.97Å; I207-Y211 VanDerWaalsContact O-N 3.14Å |
| 208 | L | 89 | Confident | 80.4 | Confident | 87 Ų | 87 | 69.1 Ų | 69.1 | 46% | 0.455 | 36% | 0.361 | S | S | . | . | H | α-helix | trans | -62.2 | -38.4 | 173.9 | -74 | 166.7 | 0 | 0 | 0 | 111.7 | T204 M206 Y211 F212 | T204-L208 HydrophobicContact CG2-CD1 4.15Å; T204-L208 WeakPolarHBondContact O-CB 3.45Å; T204-L208 WeakPolarHBondContact O-CG 3.39Å; T204-L208 PolarHBondContact O-N 3.18Å; M206-L208 VanDerWaalsContact C-N 3.27Å; M206-L208 PolarHBondContact O-N 3.01Å; L208-Y211 PolarHBondContact O-N 3.25Å; L208-F212 HydrophobicContact CB-CE2 4.27Å; L208-F212 WeakPolarHBondContact O-CD2 2.97Å; L208-F212 PolarHBondContact O-N 3.47Å |
| 209 | T | 89 | Confident | 77.8 | Confident | 5 Ų | 5 | 73.5 Ų | 73.5 | 3% | 0.031 | 38% | 0.383 | C | S | . | . | H | α-helix | trans | -62.1 | -44.9 | 176.9 | -58.8 | 0 | 0 | 0 | 0 | 111.3 | G205 M206 I207 Y211 F212 I213 H375 L377 Y378 | G205-T209 PolarHBondContact O-N 3.32Å; G205-T209 PolarHBondContact O-OG1 3.44Å; M206-T209 WeakPolarHBondContact O-CA 3.47Å; M206-T209 VanDerWaalsContact O-CB 3.25Å; M206-T209 WeakPolarHBondContact O-CB 3.42Å; M206-T209 PolarHBondContact O-N 3.36Å; I207-T209 VanDerWaalsContact C-N 3.29Å; I207-T209 PolarHBondContact O-N 2.94Å; T209-Y211 VanDerWaalsContact C-N 3.31Å; T209-Y211 PolarHBondContact O-N 2.95Å; T209-F212 PolarHBondContact O-N 3.18Å; T209-I213 HydrophobicContact CG2-CD1 3.74Å; T209-I213 HydrophobicContact CG2-CG1 4.43Å; T209-I213 WeakPolarHBondContact O-CG1 3.23Å; T209-I213 PolarHBondContact O-N 2.92Å; T209-H375 HydrophobicContact CG2-CB 4.36Å; T209-L377 HydrophobicContact CG2-CB 3.76Å; T209-L377 HydrophobicContact CG2-CD1 4.16Å; T209-L377 WeakPolarHBondContact OG1-CB 3.14Å; T209-Y378 HydrophobicContact CG2-CD1 4.21Å; T209-Y378 HydrophobicContact CG2-CD2 4.25Å; T209-Y378 HydrophobicContact CG2-CE1 3.83Å; T209-Y378 HydrophobicContact CG2-CE2 3.87Å; T209-Y378 HydrophobicContact CG2-CG 4.41Å |
| 210 | D | 84.3 | Confident | 75.3 | Confident | 23 Ų | 23 | 81.1 Ų | 81.1 | 12% | 0.123 | 42% | 0.422 | C | S | . | . | H | α-helix | trans | -58 | -44.5 | 175.2 | -70.6 | 0 | 0 | 0 | 0 | 111.7 | T163 M206 I207 F212 I213 Q214 Y378 | T163-D210 HydrophobicContact CG2-CB 4.37Å; T163-D210 PolarHBondContact OG1-OD2 3.44Å; M206-D210 PolarHBondContact O-N 3.23Å; I207-D210 PolarHBondContact O-N 3Å; D210-F212 VanDerWaalsContact C-N 3.32Å; D210-F212 PolarHBondContact O-N 2.75Å; D210-I213 PolarHBondContact O-N 3.43Å; D210-Q214 PolarHBondContact O-N 3.47Å; D210-Q214 VanDerWaalsContact O-N 3.15Å; D210-Y378 VanDerWaalsContact OD1-CE1 3.23Å; D210-Y378 WeakPolarHBondContact OD1-CE1 3.3Å; D210-Y378 VanDerWaalsContact OD1-CZ 3.25Å; D210-Y378 PolarHBondContact OD1-OH 3.35Å |
| 211 | Y | 83.3 | Confident | 72.8 | Confident | 165 Ų | 165 | 83.3 Ų | 83.3 | 65% | 0.647 | 44% | 0.437 | S | S | * | . | H | α-helix | trans | -62.4 | -38.1 | 178.4 | -179.1 | -97.6 | 0 | 0 | 0 | 112.3 | I207 L208 T209 | I207-Y211 PolarHBondContact O-N 2.97Å; I207-Y211 VanDerWaalsContact O-N 3.14Å; L208-Y211 PolarHBondContact O-N 3.25Å; T209-Y211 VanDerWaalsContact C-N 3.31Å; T209-Y211 PolarHBondContact O-N 2.95Å |
| 212 | F | 84.6 | Confident | 70.2 | Confident | 152 Ų | 152 | 85.9 Ų | 85.9 | 67% | 0.667 | 45% | 0.447 | S | S | * | . | H | α-helix | trans | -75 | -26.6 | 176.6 | -72.4 | -60.8 | 0 | 0 | 0 | 113.9 | L208 T209 D210 | L208-F212 HydrophobicContact CB-CE2 4.27Å; L208-F212 WeakPolarHBondContact O-CD2 2.97Å; L208-F212 PolarHBondContact O-N 3.47Å; T209-F212 PolarHBondContact O-N 3.18Å; D210-F212 VanDerWaalsContact C-N 3.32Å; D210-F212 PolarHBondContact O-N 2.75Å |
| 213 | I | 76.8 | Confident | 67.9 | Low | 50 Ų | 50 | 94 Ų | 94 | 26% | 0.256 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -78.2 | -30.1 | 178.4 | -70.7 | 167.1 | 0 | 0 | 0 | 111.7 | T209 D210 P215 H375 Y378 | T209-I213 HydrophobicContact CG2-CD1 3.74Å; T209-I213 HydrophobicContact CG2-CG1 4.43Å; T209-I213 WeakPolarHBondContact O-CG1 3.23Å; T209-I213 PolarHBondContact O-N 2.92Å; D210-I213 PolarHBondContact O-N 3.43Å; I213-P215 WeakPolarHBondContact O-CD 3.37Å; I213-H375 HydrophobicContact CD1-CB 3.62Å; I213-H375 HydrophobicContact CG1-CB 4.3Å; I213-Y378 HydrophobicContact CD1-CE2 3.64Å; I213-Y378 WeakPolarHBondContact CD1-OH 3.23Å |
| 214 | Q | 65.7 | Low | 65.8 | Low | 129 Ų | 129 | 99.3 Ų | 99.3 | 60% | 0.603 | 51% | 0.512 | S | S | * | . | S | Bend | trans | -55.3 | 112.9 | 176.8 | -79.2 | 179.9 | 44.3 | 0 | 0 | 109.8 | D210 S216 | D210-Q214 PolarHBondContact O-N 3.47Å; D210-Q214 VanDerWaalsContact O-N 3.15Å; Q214-S216 PolarHBondContact O-N 2.62Å |
| 215 | P | 55.4 | Low | 64.5 | Low | 95 Ų | 95 | 101.3 Ų | 101.3 | 62% | 0.617 | 52% | 0.52 | S | S | * | . | trans | -66 | 128.5 | -179.9 | 25.5 | -31.1 | 0 | 0 | 0 | 108.1 | I213 N217 | I213-P215 WeakPolarHBondContact O-CD 3.37Å; P215-N217 PolarHBondContact O-N 3.46Å | ||
| 216 | S | 43.3 | Very low | 63.6 | Low | 96 Ų | 96 | 105.4 Ų | 105.4 | 67% | 0.671 | 54% | 0.541 | S | S | * | . | trans | -61.2 | 76.6 | 162.5 | 45.5 | 0 | 0 | 0 | 0 | 109.2 | Q214 Q218 N219 | Q214-S216 PolarHBondContact O-N 2.62Å; S216-Q218 PolarHBondContact O-N 3.02Å; S216-N219 PolarHBondContact O-N 2.97Å | ||
| 217 | N | 39.3 | Very low | 62.6 | Low | 150 Ų | 150 | 108.8 Ų | 108.8 | 80% | 0.802 | 57% | 0.565 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -70.1 | 36.7 | 174.6 | -93.3 | -0.5 | 0 | 0 | 0 | 112.2 | P215 | P215-N217 PolarHBondContact O-N 3.46Š|
| 218 | Q | 43.2 | Very low | 61.5 | Low | 178 Ų | 178 | 111.2 Ų | 111.2 | 83% | 0.832 | 58% | 0.576 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -110.7 | -10.4 | 168 | -77.3 | -164.9 | -32 | 0 | 0 | 113.9 | S216 | S216-Q218 PolarHBondContact O-N 3.02Š|
| 219 | N | 41.1 | Very low | 60.4 | Low | 118 Ų | 118 | 110.1 Ų | 110.1 | 63% | 0.631 | 57% | 0.57 | S | S | * | * | S | Bend | trans | -106.9 | 7.8 | -167 | -68.7 | 1.3 | 0 | 0 | 0 | 116.5 | S216 | S216-N219 PolarHBondContact O-N 2.97Š|
| 220 | I | 42.4 | Very low | 59.5 | Low | 159 Ų | 159 | 117.5 Ų | 117.5 | 82% | 0.815 | 60% | 0.598 | S | S | * | * | trans | -133.1 | 60.4 | 169.7 | -41.4 | 177.4 | 0 | 0 | 0 | 110.9 | ||||
| 221 | V | 43 | Very low | 58.9 | Low | 101 Ų | 101 | 122.1 Ų | 122.1 | 61% | 0.612 | 62% | 0.622 | S | S | * | * | trans | -117.8 | 65.5 | 141.1 | -172.7 | 0 | 0 | 0 | 0 | 106.6 | I229 | V221-I229 HydrophobicContact CG1-CD1 4.49Å; V221-I229 HydrophobicContact CG1-CG1 4.15Å | ||
| 222 | H | 40.3 | Very low | 58.2 | Low | 155 Ų | 155 | 117.8 Ų | 117.8 | 72% | 0.718 | 61% | 0.611 | S | S | * | * | trans | -75.6 | 119.1 | 156.4 | -91.1 | -82.8 | 0 | 0 | 0 | 107.4 | ||||
| 223 | H | 47.6 | Very low | 57.4 | Low | 172 Ų | 172 | 115.7 Ų | 115.7 | 80% | 0.796 | 60% | 0.603 | S | S | * | * | S | Bend | trans | 47.9 | 87 | 164.8 | -78.5 | -79.1 | 0 | 0 | 0 | 117 | ||
| 224 | N | 50.1 | Low | 56.9 | Low | 113 Ų | 113 | 118.6 Ų | 118.6 | 60% | 0.604 | 62% | 0.618 | S | S | * | * | trans | -147.2 | 154.9 | 140.6 | -84.4 | -28.4 | 0 | 0 | 0 | 108.8 | E228 | N224-E228 WeakPolarHBondContact CB-OE2 3.15Š| ||
| 225 | N | 64.4 | Low | 56.8 | Low | 117 Ų | 117 | 119.3 Ų | 119.3 | 63% | 0.626 | 62% | 0.617 | S | S | * | * | trans | -42.8 | 141 | -164 | -62.2 | -37.1 | 0 | 0 | 0 | 114.2 | S227 E228 | N225-S227 PolarHBondContact O-N 3.36Å; N225-E228 PolarHBondContact O-N 3.28Å | ||
| 226 | T | 72.7 | Confident | 56.8 | Low | 104 Ų | 104 | 118.5 Ų | 118.5 | 64% | 0.638 | 61% | 0.607 | S | S | * | * | H | α-helix | trans | -47 | -31.4 | -178 | 26.3 | 0 | 0 | 0 | 0 | 114.4 | I229 Y230 | T226-I229 WeakPolarHBondContact O-CB 3.43Å; T226-I229 PolarHBondContact O-N 2.89Å; T226-Y230 WeakPolarHBondContact O-CD2 3.46Å; T226-Y230 PolarHBondContact O-N 3.18Å |
| 227 | S | 69.2 | Low | 57.2 | Low | 75 Ų | 75 | 119.6 Ų | 119.6 | 52% | 0.524 | 61% | 0.605 | S | S | . | * | H | α-helix | trans | -65.6 | -37.8 | 175.9 | 49.3 | 0 | 0 | 0 | 0 | 114.1 | N225 I229 Y230 L231 | N225-S227 PolarHBondContact O-N 3.36Å; S227-I229 VanDerWaalsContact C-N 3.31Å; S227-Y230 PolarHBondContact O-N 3.42Å; S227-L231 WeakPolarHBondContact O-CG 3.49Å; S227-L231 PolarHBondContact O-N 2.79Å; S227-L231 VanDerWaalsContact O-N 3.09Å |
| 228 | E | 67.6 | Low | 57.8 | Low | 91 Ų | 91 | 116.1 Ų | 116.1 | 43% | 0.425 | 59% | 0.589 | S | S | . | * | H | α-helix | trans | -70.6 | -29.1 | 175.2 | -70.8 | -176.7 | -180 | 0 | 0 | 111.5 | N224 N225 L231 N232 | N224-E228 WeakPolarHBondContact CB-OE2 3.15Å; N225-E228 PolarHBondContact O-N 3.28Å; E228-L231 PolarHBondContact O-N 2.98Å; E228-N232 WeakPolarHBondContact O-CB 3.44Å; E228-N232 PolarHBondContact O-N 3.3Å; E228-N232 PolarHBondContact O-ND2 3.17Å |
| 229 | I | 66 | Low | 58.2 | Low | 64 Ų | 64 | 111.5 Ų | 111.5 | 33% | 0.328 | 57% | 0.573 | S | S | . | * | H | α-helix | trans | -64.5 | -47.8 | 174.8 | -59.5 | 177.5 | 0 | 0 | 0 | 110.5 | V221 T226 S227 N232 Q233 | V221-I229 HydrophobicContact CG1-CD1 4.49Å; V221-I229 HydrophobicContact CG1-CG1 4.15Å; T226-I229 WeakPolarHBondContact O-CB 3.43Å; T226-I229 PolarHBondContact O-N 2.89Å; S227-I229 VanDerWaalsContact C-N 3.31Å; I229-N232 PolarHBondContact O-N 2.9Å; I229-Q233 HydrophobicContact CG2-CG 4.47Å; I229-Q233 VanDerWaalsContact O-CB 3.27Å; I229-Q233 WeakPolarHBondContact O-CB 3.33Å; I229-Q233 WeakPolarHBondContact O-CG 3.31Å; I229-Q233 PolarHBondContact O-N 3.32Å |
| 230 | Y | 68.7 | Low | 58.5 | Low | 160 Ų | 160 | 110.9 Ų | 110.9 | 63% | 0.627 | 57% | 0.57 | S | S | * | * | H | α-helix | trans | -65.2 | -42.3 | 177.6 | -71.3 | -73.9 | 0 | 0 | 0 | 111.7 | T226 S227 Q233 L234 | T226-Y230 WeakPolarHBondContact O-CD2 3.46Å; T226-Y230 PolarHBondContact O-N 3.18Å; S227-Y230 PolarHBondContact O-N 3.42Å; Y230-Q233 PolarHBondContact O-N 3.3Å; Y230-L234 WeakPolarHBondContact O-CB 3.35Å; Y230-L234 PolarHBondContact O-N 2.58Å |
| 231 | L | 73.3 | Confident | 58.8 | Low | 120 Ų | 120 | 109.2 Ų | 109.2 | 63% | 0.628 | 56% | 0.563 | S | S | * | * | H | α-helix | trans | -68.1 | -39.2 | 177.6 | -71.9 | 179.2 | 0 | 0 | 0 | 112.2 | S227 E228 L234 Y235 | S227-L231 WeakPolarHBondContact O-CG 3.49Å; S227-L231 PolarHBondContact O-N 2.79Å; S227-L231 VanDerWaalsContact O-N 3.09Å; E228-L231 PolarHBondContact O-N 2.98Å; L231-L234 PolarHBondContact O-N 3.49Å; L231-Y235 WeakPolarHBondContact O-CA 3.28Å; L231-Y235 WeakPolarHBondContact O-CB 3.33Å; L231-Y235 PolarHBondContact O-N 3.38Å |
| 232 | N | 67.1 | Low | 59.4 | Low | 75 Ų | 75 | 107.7 Ų | 107.7 | 40% | 0.401 | 55% | 0.549 | S | S | . | . | H | α-helix | trans | -70.8 | -36.8 | 175.1 | -75.5 | -28.6 | 0 | 0 | 0 | 111.5 | E228 I229 N236 | E228-N232 WeakPolarHBondContact O-CB 3.44Å; E228-N232 PolarHBondContact O-N 3.3Å; E228-N232 PolarHBondContact O-ND2 3.17Å; I229-N232 PolarHBondContact O-N 2.9Å; N232-N236 WeakPolarHBondContact O-CA 3.43Å; N232-N236 WeakPolarHBondContact O-CB 3.26Å; N232-N236 PolarHBondContact O-N 2.78Å; N232-N236 PolarHBondContact O-ND2 3.09Å |
| 233 | Q | 68.8 | Low | 60.6 | Low | 107 Ų | 107 | 107.9 Ų | 107.9 | 50% | 0.5 | 55% | 0.554 | S | S | . | * | H | α-helix | trans | -65.7 | -44.3 | 171.4 | -82.3 | -176.3 | -35.4 | 0 | 0 | 111.1 | I229 Y230 N236 N237 | I229-Q233 HydrophobicContact CG2-CG 4.47Å; I229-Q233 VanDerWaalsContact O-CB 3.27Å; I229-Q233 WeakPolarHBondContact O-CB 3.33Å; I229-Q233 WeakPolarHBondContact O-CG 3.31Å; I229-Q233 PolarHBondContact O-N 3.32Å; Y230-Q233 PolarHBondContact O-N 3.3Å; Q233-N236 PolarHBondContact O-N 3.48Å; Q233-N237 WeakPolarHBondContact O-CB 3.41Å; Q233-N237 PolarHBondContact O-N 3.4Å; Q233-N237 PolarHBondContact O-ND2 3.34Å; Q233-N237 PolarHBondContact O-OD1 2.99Å |
| 234 | L | 66.6 | Low | 61.8 | Low | 112 Ų | 112 | 101.4 Ų | 101.4 | 59% | 0.586 | 52% | 0.524 | S | S | * | . | H | α-helix | trans | -66.7 | -45.4 | 178.9 | -157.3 | 150.6 | 0 | 0 | 0 | 109.8 | Y230 L231 N237 T238 | Y230-L234 WeakPolarHBondContact O-CB 3.35Å; Y230-L234 PolarHBondContact O-N 2.58Å; L231-L234 PolarHBondContact O-N 3.49Å; L234-N237 CarbonylContact O-C 3.6Å; L234-N237 PolarHBondContact O-N 2.91Å; L234-T238 VanDerWaalsContact O-CB 3.3Å; L234-T238 WeakPolarHBondContact O-CB 3.3Å; L234-T238 PolarHBondContact O-N 2.92Å; L234-T238 PolarHBondContact O-OG1 3.06Å |
| 235 | Y | 63.5 | Low | 63.4 | Low | 144 Ų | 144 | 99.4 Ų | 99.4 | 57% | 0.565 | 52% | 0.516 | S | S | * | . | H | α-helix | trans | -61 | -48.7 | 173.6 | -178.3 | -101.1 | 0 | 0 | 0 | 111.9 | L231 N237 T238 V239 | L231-Y235 WeakPolarHBondContact O-CA 3.28Å; L231-Y235 WeakPolarHBondContact O-CB 3.33Å; L231-Y235 PolarHBondContact O-N 3.38Å; Y235-N237 VanDerWaalsContact C-N 3.33Å; Y235-N237 PolarHBondContact O-N 3.03Å; Y235-T238 CarbonylContact O-C 3.57Å; Y235-T238 PolarHBondContact O-N 3.49Å; Y235-T238 VanDerWaalsContact O-N 3.13Å; Y235-V239 HydrophobicContact CD1-CG2 4.1Å; Y235-V239 HydrophobicContact CD2-CG2 3.9Å; Y235-V239 HydrophobicContact CE1-CG2 3.87Å; Y235-V239 HydrophobicContact CE2-CG2 3.65Å; Y235-V239 HydrophobicContact CG-CG2 4.12Å; Y235-V239 VanDerWaalsContact O-CB 3.24Å; Y235-V239 WeakPolarHBondContact O-CB 2.95Å; Y235-V239 WeakPolarHBondContact O-CG2 3.33Å; Y235-V239 PolarHBondContact O-N 3.04Å |
| 236 | N | 53.9 | Low | 64.5 | Low | 77 Ų | 77 | 97.3 Ų | 97.3 | 41% | 0.412 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -63.1 | -38.9 | 176.3 | -70.8 | -23.5 | 0 | 0 | 0 | 111.4 | N232 Q233 T238 N240 | N232-N236 WeakPolarHBondContact O-CA 3.43Å; N232-N236 WeakPolarHBondContact O-CB 3.26Å; N232-N236 PolarHBondContact O-N 2.78Å; N232-N236 PolarHBondContact O-ND2 3.09Å; Q233-N236 PolarHBondContact O-N 3.48Å; N236-T238 VanDerWaalsContact C-N 3.34Å; N236-N240 WeakPolarHBondContact O-CB 3.43Å; N236-N240 PolarHBondContact O-N 2.91Å; N236-N240 PolarHBondContact O-ND2 2.83Å; N236-N240 VanDerWaalsContact O-ND2 3.1Å |
| 237 | N | 53.2 | Low | 65.3 | Low | 120 Ų | 120 | 99.9 Ų | 99.9 | 64% | 0.642 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -69.3 | -31.8 | 174.8 | -69.1 | -12 | 0 | 0 | 0 | 112.2 | Q233 L234 Y235 | Q233-N237 WeakPolarHBondContact O-CB 3.41Å; Q233-N237 PolarHBondContact O-N 3.4Å; Q233-N237 PolarHBondContact O-ND2 3.34Å; Q233-N237 PolarHBondContact O-OD1 2.99Å; L234-N237 CarbonylContact O-C 3.6Å; L234-N237 PolarHBondContact O-N 2.91Å; Y235-N237 VanDerWaalsContact C-N 3.33Å; Y235-N237 PolarHBondContact O-N 3.03Å |
| 238 | T | 52 | Low | 66.3 | Low | 76 Ų | 76 | 100 Ų | 100 | 47% | 0.466 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -81.7 | -31.2 | 178.7 | -45.3 | 0 | 0 | 0 | 0 | 111.9 | L234 Y235 N236 N241 | L234-T238 VanDerWaalsContact O-CB 3.3Å; L234-T238 WeakPolarHBondContact O-CB 3.3Å; L234-T238 PolarHBondContact O-N 2.92Å; L234-T238 PolarHBondContact O-OG1 3.06Å; Y235-T238 CarbonylContact O-C 3.57Å; Y235-T238 PolarHBondContact O-N 3.49Å; Y235-T238 VanDerWaalsContact O-N 3.13Å; N236-T238 VanDerWaalsContact C-N 3.34Å; T238-N241 PolarHBondContact O-ND2 2.93Å; T238-N241 PolarHBondContact O-OD1 3.37Å |
| 239 | V | 50.3 | Low | 67.4 | Low | 81 Ų | 81 | 99.2 Ų | 99.2 | 49% | 0.491 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -86.4 | -35.9 | -178 | 172.1 | 0 | 0 | 0 | 0 | 111.5 | Y235 N241 | Y235-V239 HydrophobicContact CD1-CG2 4.1Å; Y235-V239 HydrophobicContact CD2-CG2 3.9Å; Y235-V239 HydrophobicContact CE1-CG2 3.87Å; Y235-V239 HydrophobicContact CE2-CG2 3.65Å; Y235-V239 HydrophobicContact CG-CG2 4.12Å; Y235-V239 VanDerWaalsContact O-CB 3.24Å; Y235-V239 WeakPolarHBondContact O-CB 2.95Å; Y235-V239 WeakPolarHBondContact O-CG2 3.33Å; Y235-V239 PolarHBondContact O-N 3.04Å; V239-N241 PolarHBondContact O-N 2.93Å |
| 240 | N | 49 | Very low | 68.7 | Low | 106 Ų | 106 | 101.8 Ų | 101.8 | 57% | 0.567 | 52% | 0.522 | S | S | * | . | S | Bend | trans | -80.4 | 39.4 | 178.3 | -61.8 | -25 | 0 | 0 | 0 | 112.6 | N236 Q242 L243 | N236-N240 WeakPolarHBondContact O-CB 3.43Å; N236-N240 PolarHBondContact O-N 2.91Å; N236-N240 PolarHBondContact O-ND2 2.83Å; N236-N240 VanDerWaalsContact O-ND2 3.1Å; N240-Q242 PolarHBondContact O-N 2.91Å; N240-L243 PolarHBondContact O-N 3.43Å |
| 241 | N | 47.5 | Very low | 70 | Confident | 123 Ų | 123 | 98.5 Ų | 98.5 | 66% | 0.658 | 51% | 0.512 | S | S | * | . | trans | -62.3 | 25.3 | -169.7 | -106 | -9.9 | 0 | 0 | 0 | 116.8 | T238 V239 | T238-N241 PolarHBondContact O-ND2 2.93Å; T238-N241 PolarHBondContact O-OD1 3.37Å; V239-N241 PolarHBondContact O-N 2.93Å | ||
| 242 | Q | 56.5 | Low | 71.1 | Confident | 69 Ų | 69 | 92.8 Ų | 92.8 | 32% | 0.322 | 48% | 0.482 | S | S | . | . | trans | -128.3 | 43.5 | 163.7 | -66 | -164.4 | -32.9 | 0 | 0 | 111.5 | S42 N45 N240 F244 | S42-Q242 PolarHBondContact O-NE2 3.24Å; N45-Q242 PolarHBondContact OD1-NE2 2.88Å; N240-Q242 PolarHBondContact O-N 2.91Å; Q242-F244 VanDerWaalsContact C-N 3.31Å; Q242-F244 PolarHBondContact O-N 3Å | ||
| 243 | L | 64.6 | Low | 72.4 | Confident | 159 Ų | 159 | 91.4 Ų | 91.4 | 83% | 0.832 | 47% | 0.474 | S | S | * | . | trans | -71.7 | 92.7 | 162.8 | -167.7 | 78.8 | 0 | 0 | 0 | 108.1 | N240 T245 | N240-L243 PolarHBondContact O-N 3.43Å; L243-T245 PolarHBondContact O-N 2.87Å | ||
| 244 | F | 72.8 | Confident | 73.8 | Confident | 36 Ų | 36 | 92.1 Ų | 92.1 | 16% | 0.158 | 48% | 0.476 | C | S | . | . | trans | -58.5 | 135.8 | 173.1 | -58.9 | -67 | 0 | 0 | 0 | 109.7 | A158 Q242 Q248 M249 | A158-F244 VanDerWaalsContact O-CE1 3.26Å; A158-F244 WeakPolarHBondContact O-CE1 3.46Å; Q242-F244 VanDerWaalsContact C-N 3.31Å; Q242-F244 PolarHBondContact O-N 3Å; F244-Q248 HydrophobicContact CB-CB 4.35Å; F244-M249 HydrophobicContact CB-CE 3.74Å; F244-M249 HydrophobicContact CB-CG 3.57Å; F244-M249 HydrophobicContact CB-SD 4.47Å; F244-M249 HydrophobicContact CD2-CE 4.37Å; F244-M249 HydrophobicContact CG-CG 4.49Å | ||
| 245 | T | 84.3 | Confident | 75.3 | Confident | 72 Ų | 72 | 87 Ų | 87 | 44% | 0.442 | 45% | 0.449 | S | S | . | . | trans | -67.3 | 154.5 | 170.3 | 70.1 | 0 | 0 | 0 | 0 | 109.3 | L243 E247 Q248 M249 | L243-T245 PolarHBondContact O-N 2.87Å; T245-E247 PolarHBondContact O-N 2.87Å; T245-E247 VanDerWaalsContact O-N 3.16Å; T245-Q248 WeakPolarHBondContact O-CB 3.42Å; T245-Q248 PolarHBondContact O-N 3Å; T245-Q248 VanDerWaalsContact OG1-CG 3.29Å; T245-Q248 WeakPolarHBondContact OG1-CG 3.28Å; T245-Q248 PolarHBondContact OG1-N 3.49Å; T245-M249 WeakPolarHBondContact O-CG 3.43Å; T245-M249 PolarHBondContact O-N 3.28Å | ||
| 246 | A | 87.3 | Confident | 76.9 | Confident | 73 Ų | 73 | 80.1 Ų | 80.1 | 60% | 0.603 | 42% | 0.422 | S | S | * | . | H | α-helix | trans | -55.6 | -35 | 177 | 0 | 0 | 0 | 0 | 0 | 112.3 | M249 I250 | A246-M249 PolarHBondContact O-N 2.96Å; A246-I250 WeakPolarHBondContact O-CD1 3.3Å; A246-I250 WeakPolarHBondContact O-CG1 3.17Å; A246-I250 PolarHBondContact O-N 3.28Å |
| 247 | E | 89.6 | Confident | 79 | Confident | 157 Ų | 157 | 79.2 Ų | 79.2 | 73% | 0.734 | 42% | 0.417 | S | S | * | . | H | α-helix | trans | -64.7 | -44.2 | 175.2 | -174.7 | -179.1 | 179.8 | 0 | 0 | 112.4 | T245 I250 F251 | T245-E247 PolarHBondContact O-N 2.87Å; T245-E247 VanDerWaalsContact O-N 3.16Å; E247-I250 PolarHBondContact O-N 2.85Å; E247-F251 PolarHBondContact O-N 3.08Å |
| 248 | Q | 90.4 | Very high | 81.1 | Confident | 78 Ų | 78 | 76.5 Ų | 76.5 | 36% | 0.364 | 40% | 0.401 | S | S | . | . | H | α-helix | trans | -62.9 | -45 | 175.6 | -72.9 | 169 | -20.9 | 0 | 0 | 111.2 | Y159 F244 T245 I250 F251 G252 | Y159-Q248 HydrophobicContact CD1-CB 4.27Å; Y159-Q248 HydrophobicContact CD1-CG 4.25Å; Y159-Q248 CarbonylContact O-C 3.56Å; Y159-Q248 VanDerWaalsContact O-C 3.27Å; F244-Q248 HydrophobicContact CB-CB 4.35Å; T245-Q248 WeakPolarHBondContact O-CB 3.42Å; T245-Q248 PolarHBondContact O-N 3Å; T245-Q248 VanDerWaalsContact OG1-CG 3.29Å; T245-Q248 WeakPolarHBondContact OG1-CG 3.28Å; T245-Q248 PolarHBondContact OG1-N 3.49Å; Q248-I250 PolarHBondContact O-N 3.34Å; Q248-F251 PolarHBondContact O-N 2.68Å; Q248-G252 PolarHBondContact O-N 2.89Å |
| 249 | M | 90.4 | Very high | 83.3 | Confident | 74 Ų | 74 | 72.9 Ų | 72.9 | 37% | 0.365 | 38% | 0.379 | S | S | . | . | H | α-helix | trans | -58.2 | -48 | 177.6 | -67.8 | -177.3 | 173.3 | 0 | 0 | 111.3 | Y159 F244 T245 A246 F251 G252 D253 | Y159-M249 WeakPolarHBondContact O-CA 3.41Å; Y159-M249 PolarHBondContact O-N 3.09Å; F244-M249 HydrophobicContact CB-CE 3.74Å; F244-M249 HydrophobicContact CB-CG 3.57Å; F244-M249 HydrophobicContact CB-SD 4.47Å; F244-M249 HydrophobicContact CD2-CE 4.37Å; F244-M249 HydrophobicContact CG-CG 4.49Å; T245-M249 WeakPolarHBondContact O-CG 3.43Å; T245-M249 PolarHBondContact O-N 3.28Å; A246-M249 PolarHBondContact O-N 2.96Å; M249-F251 VanDerWaalsContact C-N 3.31Å; M249-F251 PolarHBondContact O-N 3.13Å; M249-G252 PolarHBondContact O-N 3.44Å; M249-D253 WeakPolarHBondContact O-CB 3.43Å; M249-D253 PolarHBondContact O-N 3.14Å |
| 250 | I | 94.2 | Very high | 85.5 | Confident | 118 Ų | 118 | 69 Ų | 69 | 61% | 0.605 | 36% | 0.356 | S | S | * | . | H | α-helix | trans | -60.5 | -41.8 | 177.9 | -69.1 | 164.6 | 0 | 0 | 0 | 111.3 | A246 E247 Q248 D253 F254 | A246-I250 WeakPolarHBondContact O-CD1 3.3Å; A246-I250 WeakPolarHBondContact O-CG1 3.17Å; A246-I250 PolarHBondContact O-N 3.28Å; E247-I250 PolarHBondContact O-N 2.85Å; Q248-I250 PolarHBondContact O-N 3.34Å; I250-D253 PolarHBondContact O-N 3.15Å; I250-F254 PolarHBondContact O-N 3.26Å |
| 251 | F | 95.8 | Very high | 87.9 | Confident | 92 Ų | 92 | 67.5 Ų | 67.5 | 40% | 0.404 | 35% | 0.347 | S | S | . | . | H | α-helix | trans | -63.6 | -44.2 | 176.3 | 177.4 | -106.8 | 0 | 0 | 0 | 111.8 | Y159 E247 Q248 M249 F254 L255 | Y159-F251 HydrophobicContact CD1-CD1 4.13Å; Y159-F251 AromaticContact CD2-CD1 3.89Å; Y159-F251 HydrophobicContact CD2-CD1 3.89Å; Y159-F251 AromaticContact CD2-CE1 3.85Å; Y159-F251 HydrophobicContact CD2-CE1 3.85Å; Y159-F251 HydrophobicContact CE1-CD1 4.44Å; Y159-F251 HydrophobicContact CE2-CD1 4.23Å; Y159-F251 AromaticContact CE2-CE1 3.83Å; Y159-F251 HydrophobicContact CE2-CE1 3.83Å; Y159-F251 AromaticContact CG-CD1 3.85Å; Y159-F251 HydrophobicContact CG-CD1 3.85Å; Y159-F251 HydrophobicContact CG-CE1 4.27Å; E247-F251 PolarHBondContact O-N 3.08Å; Q248-F251 PolarHBondContact O-N 2.68Å; M249-F251 VanDerWaalsContact C-N 3.31Å; M249-F251 PolarHBondContact O-N 3.13Å; F251-F254 PolarHBondContact O-N 3.5Å; F251-L255 HydrophobicContact CD1-CD1 3.93Å; F251-L255 HydrophobicContact CE1-CD1 3.45Å; F251-L255 VanDerWaalsContact CE1-CD1 3.45Å; F251-L255 HydrophobicContact CE1-CG 4.23Å; F251-L255 HydrophobicContact CZ-CD1 3.8Å; F251-L255 HydrophobicContact CZ-CD2 4.3Å; F251-L255 HydrophobicContact CZ-CG 4.17Å; F251-L255 WeakPolarHBondContact O-CG 3.42Å; F251-L255 PolarHBondContact O-N 3.25Å; F251-L255 VanDerWaalsContact O-N 3.08Å |
| 252 | G | 95.2 | Very high | 90.3 | Very high | 0 Ų | 0 | 62.8 Ų | 62.8 | 0% | 0 | 32% | 0.324 | C | S | . | . | H | α-helix | trans | -59.3 | -47.4 | 174.6 | 0 | 0 | 0 | 0 | 0 | 112.1 | Q248 M249 F254 L255 V256 | Q248-G252 PolarHBondContact O-N 2.89Å; M249-G252 PolarHBondContact O-N 3.44Å; G252-F254 VanDerWaalsContact C-N 3.31Å; G252-F254 PolarHBondContact O-N 2.85Å; G252-L255 WeakPolarHBondContact O-CB 3.45Å; G252-L255 PolarHBondContact O-N 3.37Å; G252-L255 VanDerWaalsContact O-N 3.09Å; G252-V256 WeakPolarHBondContact O-CG2 3.47Å; G252-V256 PolarHBondContact O-N 3.44Å |
| 253 | D | 95.6 | Very high | 92.2 | Very high | 46 Ų | 46 | 61.9 Ų | 61.9 | 25% | 0.246 | 32% | 0.318 | C | S | . | . | H | α-helix | trans | -61.7 | -39.4 | 179.5 | -67.1 | -8.1 | 0 | 0 | 0 | 111.9 | T160 S164 L168 M249 I250 L255 V256 I257 | T160-D253 WeakPolarHBondContact CB-OD1 3.05Å; T160-D253 PolarHBondContact OG1-OD1 3.26Å; S164-D253 PolarHBondContact OG-OD1 2.99Å; L168-D253 HydrophobicContact CD1-CB 3.57Å; M249-D253 WeakPolarHBondContact O-CB 3.43Å; M249-D253 PolarHBondContact O-N 3.14Å; I250-D253 PolarHBondContact O-N 3.15Å; D253-L255 PolarHBondContact O-N 3.41Å; D253-V256 PolarHBondContact O-N 2.77Å; D253-I257 WeakPolarHBondContact O-CG1 3.5Å; D253-I257 PolarHBondContact O-N 2.92Å |
| 254 | F | 97.4 | Very high | 93.7 | Very high | 121 Ų | 121 | 54.3 Ų | 54.3 | 53% | 0.531 | 28% | 0.278 | S | S | . | . | H | α-helix | trans | -62.2 | -41.8 | 173.5 | 180 | -102.3 | 0 | 0 | 0 | 112.5 | I250 F251 G252 V256 I257 I258 | I250-F254 PolarHBondContact O-N 3.26Å; F251-F254 PolarHBondContact O-N 3.5Å; G252-F254 VanDerWaalsContact C-N 3.31Å; G252-F254 PolarHBondContact O-N 2.85Å; F254-V256 VanDerWaalsContact C-N 3.33Å; F254-V256 PolarHBondContact O-N 3.34Å; F254-I257 PolarHBondContact O-N 2.91Å; F254-I258 HydrophobicContact CD1-CD1 3.82Å; F254-I258 HydrophobicContact CE1-CD1 3.19Å; F254-I258 HydrophobicContact CE1-CG1 4.19Å; F254-I258 HydrophobicContact CE2-CD1 4.3Å; F254-I258 HydrophobicContact CZ-CD1 3.48Å; F254-I258 VanDerWaalsContact CZ-CD1 3.48Å; F254-I258 HydrophobicContact CZ-CG1 4.22Å; F254-I258 PolarHBondContact O-N 3.49Å |
| 255 | L | 97.8 | Very high | 94.8 | Very high | 5 Ų | 5 | 54.7 Ų | 54.7 | 3% | 0.026 | 28% | 0.282 | C | S | . | . | H | α-helix | trans | -62.2 | -40.4 | 174.3 | -70.5 | 170.9 | 0 | 0 | 0 | 111.6 | W151 S152 T155 A156 Y159 F251 G252 D253 I257 I258 G259 | W151-L255 HydrophobicContact CH2-CD2 4.04Å; W151-L255 HydrophobicContact CZ3-CD2 3.96Å; S152-L255 WeakPolarHBondContact CB-O 3.43Å; S152-L255 VanDerWaalsContact OG-C 3.3Å; S152-L255 WeakPolarHBondContact OG-CA 3.24Å; S152-L255 PolarHBondContact OG-O 3.03Å; T155-L255 HydrophobicContact CG2-CD1 3.55Å; A156-L255 HydrophobicContact CB-CB 4.1Å; Y159-L255 HydrophobicContact CD2-CD1 4.32Å; F251-L255 HydrophobicContact CD1-CD1 3.93Å; F251-L255 HydrophobicContact CE1-CD1 3.45Å; F251-L255 VanDerWaalsContact CE1-CD1 3.45Å; F251-L255 HydrophobicContact CE1-CG 4.23Å; F251-L255 HydrophobicContact CZ-CD1 3.8Å; F251-L255 HydrophobicContact CZ-CD2 4.3Å; F251-L255 HydrophobicContact CZ-CG 4.17Å; F251-L255 WeakPolarHBondContact O-CG 3.42Å; F251-L255 PolarHBondContact O-N 3.25Å; F251-L255 VanDerWaalsContact O-N 3.08Å; G252-L255 WeakPolarHBondContact O-CB 3.45Å; G252-L255 PolarHBondContact O-N 3.37Å; G252-L255 VanDerWaalsContact O-N 3.09Å; D253-L255 PolarHBondContact O-N 3.41Å; L255-I257 PolarHBondContact O-N 2.87Å; L255-I258 PolarHBondContact O-N 3.37Å; L255-G259 PolarHBondContact O-N 2.94Å |
| 256 | V | 97.4 | Very high | 95.4 | Very high | 0 Ų | 0 | 51.3 Ų | 51.3 | 0% | 0 | 26% | 0.261 | C | S | . | . | H | α-helix | trans | -62.2 | -46.1 | 176.8 | -175.5 | 0 | 0 | 0 | 0 | 110.8 | I153 A156 T160 I165 L168 D169 G252 D253 F254 I258 G259 A260 | I153-V256 HydrophobicContact CD1-CB 4.41Å; I153-V256 HydrophobicContact CD1-CG1 4Å; A156-V256 HydrophobicContact CB-CG2 3.51Å; T160-V256 HydrophobicContact CG2-CG2 4.17Å; I165-V256 HydrophobicContact CB-CG2 4.23Å; I165-V256 HydrophobicContact CG1-CG2 3.75Å; I165-V256 HydrophobicContact CG2-CG1 4.42Å; I165-V256 HydrophobicContact CG2-CG2 4.37Å; L168-V256 HydrophobicContact CB-CB 3.95Å; L168-V256 HydrophobicContact CB-CG1 3.45Å; L168-V256 VanDerWaalsContact CB-CG1 3.45Å; L168-V256 HydrophobicContact CD1-CB 4.14Å; D169-V256 WeakPolarHBondContact OD1-CG1 3.19Å; G252-V256 WeakPolarHBondContact O-CG2 3.47Å; G252-V256 PolarHBondContact O-N 3.44Å; D253-V256 PolarHBondContact O-N 2.77Å; F254-V256 VanDerWaalsContact C-N 3.33Å; F254-V256 PolarHBondContact O-N 3.34Å; V256-I258 VanDerWaalsContact C-N 3.34Å; V256-I258 PolarHBondContact O-N 3.42Å; V256-G259 CarbonylContact O-C 3.49Å; V256-G259 PolarHBondContact O-N 3.06Å; V256-G259 VanDerWaalsContact O-N 3.09Å; V256-A260 WeakPolarHBondContact O-CB 3.48Å; V256-A260 PolarHBondContact O-N 3Å |
| 257 | I | 97.5 | Very high | 95.8 | Very high | 58 Ų | 58 | 48.3 Ų | 48.3 | 30% | 0.297 | 23% | 0.234 | S | C | . | . | H | α-helix | trans | -58.6 | -45.9 | 178.9 | -66.5 | 165.8 | 0 | 0 | 0 | 111.1 | L168 I171 D253 F254 L255 G259 A260 I261 | L168-I257 HydrophobicContact CD1-CG1 4.47Å; L168-I257 HydrophobicContact CD2-CD1 4.41Å; L168-I257 HydrophobicContact CD2-CG1 4.22Å; I171-I257 HydrophobicContact CD1-CG1 3.91Å; D253-I257 WeakPolarHBondContact O-CG1 3.5Å; D253-I257 PolarHBondContact O-N 2.92Å; F254-I257 PolarHBondContact O-N 2.91Å; L255-I257 PolarHBondContact O-N 2.87Å; I257-G259 VanDerWaalsContact C-N 3.33Å; I257-G259 PolarHBondContact O-N 2.98Å; I257-A260 PolarHBondContact O-N 3.39Å; I257-I261 HydrophobicContact CG2-CD1 3.83Å; I257-I261 WeakPolarHBondContact O-CB 3.37Å; I257-I261 VanDerWaalsContact O-CG1 3.28Å; I257-I261 WeakPolarHBondContact O-CG1 3.49Å; I257-I261 PolarHBondContact O-N 3.24Å |
| 258 | I | 97.9 | Very high | 96.2 | Very high | 62 Ų | 62 | 40.8 Ų | 40.8 | 32% | 0.318 | 20% | 0.2 | S | C | . | . | H | α-helix | trans | -60.1 | -45.3 | 175.4 | -73.8 | 179.2 | 0 | 0 | 0 | 110.9 | F254 L255 V256 S262 | F254-I258 HydrophobicContact CD1-CD1 3.82Å; F254-I258 HydrophobicContact CE1-CD1 3.19Å; F254-I258 HydrophobicContact CE1-CG1 4.19Å; F254-I258 HydrophobicContact CE2-CD1 4.3Å; F254-I258 HydrophobicContact CZ-CD1 3.48Å; F254-I258 VanDerWaalsContact CZ-CD1 3.48Å; F254-I258 HydrophobicContact CZ-CG1 4.22Å; F254-I258 PolarHBondContact O-N 3.49Å; L255-I258 PolarHBondContact O-N 3.37Å; V256-I258 VanDerWaalsContact C-N 3.34Å; V256-I258 PolarHBondContact O-N 3.42Å; I258-S262 WeakPolarHBondContact O-CB 3.19Å; I258-S262 PolarHBondContact O-N 3.44Å; I258-S262 PolarHBondContact O-OG 3.42Å |
| 259 | G | 97.9 | Very high | 96.4 | Very high | 0 Ų | 0 | 38 Ų | 38 | 0% | 0 | 19% | 0.187 | C | C | . | . | H | α-helix | trans | -61.5 | -49.9 | 179.5 | 0 | 0 | 0 | 0 | 0 | 112 | L255 V256 I257 I261 S262 Y263 | L255-G259 PolarHBondContact O-N 2.94Å; V256-G259 CarbonylContact O-C 3.49Å; V256-G259 PolarHBondContact O-N 3.06Å; V256-G259 VanDerWaalsContact O-N 3.09Å; I257-G259 VanDerWaalsContact C-N 3.33Å; I257-G259 PolarHBondContact O-N 2.98Å; G259-I261 PolarHBondContact O-N 3.3Å; G259-S262 PolarHBondContact O-N 2.9Å; G259-Y263 WeakPolarHBondContact O-CB 3.28Å; G259-Y263 VanDerWaalsContact O-CD2 3.28Å; G259-Y263 WeakPolarHBondContact O-CD2 3.38Å; G259-Y263 PolarHBondContact O-N 3.48Å |
| 260 | A | 97.5 | Very high | 96.7 | Very high | 1 Ų | 1 | 34.9 Ų | 34.9 | 1% | 0.008 | 17% | 0.172 | C | C | . | . | H | α-helix | trans | -60.7 | -42.8 | -180 | 0 | 0 | 0 | 0 | 0 | 112.4 | I171 S172 V256 I257 G264 | I171-A260 HydrophobicContact CB-CB 4.34Å; S172-A260 WeakPolarHBondContact CA-O 3.39Å; S172-A260 WeakPolarHBondContact CB-O 3.31Å; V256-A260 WeakPolarHBondContact O-CB 3.48Å; V256-A260 PolarHBondContact O-N 3Å; I257-A260 PolarHBondContact O-N 3.39Å; A260-G264 PolarHBondContact O-N 3.16Å |
| 261 | I | 97.7 | Very high | 96.7 | Very high | 74 Ų | 74 | 29.5 Ų | 29.5 | 38% | 0.379 | 14% | 0.144 | S | C | . | . | H | α-helix | trans | -65.3 | -46.4 | 175.1 | -68 | 169.5 | 0 | 0 | 0 | 110.2 | I171 T175 I257 G259 G264 L265 | I171-I261 HydrophobicContact CG2-CG1 4.08Å; T175-I261 HydrophobicContact CG2-CB 4.47Å; T175-I261 HydrophobicContact CG2-CG2 4.13Å; T175-I261 WeakPolarHBondContact CG2-O 3.47Å; I257-I261 HydrophobicContact CG2-CD1 3.83Å; I257-I261 WeakPolarHBondContact O-CB 3.37Å; I257-I261 VanDerWaalsContact O-CG1 3.28Å; I257-I261 WeakPolarHBondContact O-CG1 3.49Å; I257-I261 PolarHBondContact O-N 3.24Å; G259-I261 PolarHBondContact O-N 3.3Å; I261-G264 PolarHBondContact O-N 3.37Å; I261-L265 WeakPolarHBondContact O-CB 3.49Å; I261-L265 PolarHBondContact O-N 3.06Å |
| 262 | S | 97.9 | Very high | 96.5 | Very high | 23 Ų | 23 | 28.6 Ų | 28.6 | 16% | 0.161 | 14% | 0.138 | C | C | . | . | H | α-helix | trans | -66 | -42.6 | -177.1 | -59.9 | 0 | 0 | 0 | 0 | 112 | I145 I258 G259 L265 S266 | I145-S262 WeakPolarHBondContact CG2-O 3.3Å; I258-S262 WeakPolarHBondContact O-CB 3.19Å; I258-S262 PolarHBondContact O-N 3.44Å; I258-S262 PolarHBondContact O-OG 3.42Å; G259-S262 PolarHBondContact O-N 2.9Å; S262-L265 PolarHBondContact O-N 3.5Å; S262-S266 VanDerWaalsContact O-CB 3.26Å; S262-S266 WeakPolarHBondContact O-CB 3.45Å; S262-S266 PolarHBondContact O-N 2.99Å |
| 263 | Y | 96.6 | Very high | 96.4 | Very high | 50 Ų | 50 | 28.8 Ų | 28.8 | 20% | 0.196 | 14% | 0.139 | C | C | . | . | H | α-helix | trans | -64 | -42.8 | 172.8 | -84.3 | -54.5 | 0 | 0 | 0 | 112.4 | A149 N150 I153 G259 L265 S266 N267 | A149-Y263 HydrophobicContact CB-CD1 3.77Å; A149-Y263 HydrophobicContact CB-CD2 3.85Å; A149-Y263 HydrophobicContact CB-CE1 3.82Å; A149-Y263 HydrophobicContact CB-CE2 3.91Å; A149-Y263 HydrophobicContact CB-CG 3.79Å; N150-Y263 VanDerWaalsContact CA-OH 3.3Å; N150-Y263 WeakPolarHBondContact CA-OH 3.36Å; N150-Y263 PolarHBondContact OD1-OH 3.46Å; I153-Y263 HydrophobicContact CB-CE2 4.14Å; I153-Y263 HydrophobicContact CG1-CD2 3.92Å; I153-Y263 HydrophobicContact CG1-CE2 3.48Å; I153-Y263 VanDerWaalsContact CG1-CE2 3.48Å; G259-Y263 WeakPolarHBondContact O-CB 3.28Å; G259-Y263 VanDerWaalsContact O-CD2 3.28Å; G259-Y263 WeakPolarHBondContact O-CD2 3.38Å; G259-Y263 PolarHBondContact O-N 3.48Å; Y263-L265 VanDerWaalsContact C-N 3.29Å; Y263-L265 PolarHBondContact O-N 3.28Å; Y263-S266 PolarHBondContact O-N 2.63Å; Y263-N267 WeakPolarHBondContact O-CB 3.49Å; Y263-N267 VanDerWaalsContact O-CG 3.28Å; Y263-N267 PolarHBondContact O-N 3.09Å |
| 264 | G | 96.6 | Very high | 96.3 | Very high | 0 Ų | 0 | 26.7 Ų | 26.7 | 0% | 0 | 13% | 0.128 | C | C | . | . | H | α-helix | trans | -58.3 | -44.8 | 176.8 | 0 | 0 | 0 | 0 | 0 | 112 | V176 A260 I261 V268 | V176-G264 VanDerWaalsContact CG2-O 3.22Å; V176-G264 WeakPolarHBondContact CG2-O 3.43Å; A260-G264 PolarHBondContact O-N 3.16Å; I261-G264 PolarHBondContact O-N 3.37Å; G264-V268 WeakPolarHBondContact O-CG2 3.4Å; G264-V268 PolarHBondContact O-N 3.4Å |
| 265 | L | 96.7 | Very high | 96 | Very high | 45 Ų | 45 | 25.3 Ų | 25.3 | 24% | 0.236 | 13% | 0.126 | C | C | . | . | H | α-helix | trans | -67.6 | -44.1 | 175.2 | -177.2 | 60.6 | 0 | 0 | 0 | 112.1 | I145 F183 I261 S262 Y263 N267 V268 L269 | I145-L265 HydrophobicContact CD1-CD2 4.03Å; F183-L265 HydrophobicContact CD2-CD1 4.37Å; F183-L265 HydrophobicContact CE2-CD1 3.68Å; F183-L265 HydrophobicContact CZ-CD1 4.33Å; I261-L265 WeakPolarHBondContact O-CB 3.49Å; I261-L265 PolarHBondContact O-N 3.06Å; S262-L265 PolarHBondContact O-N 3.5Å; Y263-L265 VanDerWaalsContact C-N 3.29Å; Y263-L265 PolarHBondContact O-N 3.28Å; L265-N267 VanDerWaalsContact C-N 3.35Å; L265-N267 PolarHBondContact O-N 2.63Å; L265-V268 PolarHBondContact O-N 2.85Å; L265-L269 HydrophobicContact CD1-CD1 4.05Å; L265-L269 HydrophobicContact CD1-CG 4.12Å; L265-L269 HydrophobicContact CG-CD1 3.88Å; L265-L269 HydrophobicContact CG-CG 4.35Å; L265-L269 WeakPolarHBondContact O-CG 3.32Å; L265-L269 PolarHBondContact O-N 3.3Å |
| 266 | S | 96.7 | Very high | 95.6 | Very high | 0 Ų | 0 | 30.2 Ų | 30.2 | 0% | 0 | 15% | 0.147 | C | C | . | . | H | α-helix | trans | -55.9 | -48.1 | 178.4 | -171.7 | 0 | 0 | 0 | 0 | 110.9 | D146 S262 Y263 V268 L269 Q270 | D146-S266 PolarHBondContact OD1-OG 2.99Å; D146-S266 VanDerWaalsContact OD1-OG 3.06Å; S262-S266 VanDerWaalsContact O-CB 3.26Å; S262-S266 WeakPolarHBondContact O-CB 3.45Å; S262-S266 PolarHBondContact O-N 2.99Å; Y263-S266 PolarHBondContact O-N 2.63Å; S266-V268 VanDerWaalsContact C-N 3.34Å; S266-V268 PolarHBondContact O-N 3.43Å; S266-L269 PolarHBondContact O-N 2.97Å; S266-Q270 WeakPolarHBondContact O-CB 3.35Å; S266-Q270 PolarHBondContact O-N 3.1Å |
| 267 | N | 95.9 | Very high | 95.3 | Very high | 10 Ų | 10 | 32.4 Ų | 32.4 | 5% | 0.053 | 16% | 0.155 | C | C | . | . | H | α-helix | trans | -63.5 | -37.6 | -178.4 | -69.1 | -8 | 0 | 0 | 0 | 112.7 | Y263 L265 Q271 A348 N352 | Y263-N267 WeakPolarHBondContact O-CB 3.49Å; Y263-N267 VanDerWaalsContact O-CG 3.28Å; Y263-N267 PolarHBondContact O-N 3.09Å; L265-N267 VanDerWaalsContact C-N 3.35Å; L265-N267 PolarHBondContact O-N 2.63Å; N267-Q271 WeakPolarHBondContact O-CB 3.02Å; N267-Q271 PolarHBondContact O-N 3.46Å; N267-A348 HydrophobicContact CB-CB 4.41Å; N267-N352 PolarHBondContact ND2-ND2 3.26Å; N267-N352 PolarHBondContact ND2-OD1 3.42Å |
| 268 | V | 96.4 | Very high | 95 | Very high | 0 Ų | 0 | 31 Ų | 31 | 0% | 0 | 16% | 0.155 | C | C | . | . | H | α-helix | trans | -69.9 | -45.6 | 176.4 | 174.2 | 0 | 0 | 0 | 0 | 111.4 | V176 S180 F183 L184 G264 L265 S266 Q270 Q271 Y272 A348 | V176-V268 HydrophobicContact CB-CG2 4.33Å; V176-V268 HydrophobicContact CG1-CG2 3.75Å; V176-V268 HydrophobicContact CG2-CG2 4.48Å; S180-V268 WeakPolarHBondContact OG-CG2 3.43Å; F183-V268 HydrophobicContact CB-CG1 3.99Å; F183-V268 HydrophobicContact CD2-CG1 4.34Å; L184-V268 HydrophobicContact CD1-CG1 3.89Å; L184-V268 HydrophobicContact CG-CG1 4.2Å; G264-V268 WeakPolarHBondContact O-CG2 3.4Å; G264-V268 PolarHBondContact O-N 3.4Å; L265-V268 PolarHBondContact O-N 2.85Å; S266-V268 VanDerWaalsContact C-N 3.34Å; S266-V268 PolarHBondContact O-N 3.43Å; V268-Q270 VanDerWaalsContact C-N 3.34Å; V268-Q271 PolarHBondContact O-N 2.91Å; V268-Y272 PolarHBondContact O-N 3.2Å; V268-A348 HydrophobicContact CG2-CB 3.95Å |
| 269 | L | 95.5 | Very high | 94.9 | Very high | 20 Ų | 20 | 29.7 Ų | 29.7 | 11% | 0.105 | 15% | 0.149 | C | C | . | . | H | α-helix | trans | -66.4 | -38.7 | 178.5 | -67.9 | 176.7 | 0 | 0 | 0 | 111.5 | L141 I142 I145 F183 L265 S266 Y272 L273 | L141-L269 HydrophobicContact CD2-CD1 4.03Å; I142-L269 HydrophobicContact CD1-CB 3.51Å; I142-L269 HydrophobicContact CG1-CB 3.79Å; I142-L269 HydrophobicContact CG1-CD1 4.13Å; I145-L269 HydrophobicContact CD1-CD1 4.09Å; F183-L269 HydrophobicContact CD1-CD2 3.98Å; F183-L269 HydrophobicContact CD2-CD2 4.42Å; F183-L269 HydrophobicContact CE1-CD2 4Å; F183-L269 HydrophobicContact CE2-CD2 4.46Å; F183-L269 HydrophobicContact CG-CD2 4.2Å; F183-L269 HydrophobicContact CZ-CD2 4.26Å; L265-L269 HydrophobicContact CD1-CD1 4.05Å; L265-L269 HydrophobicContact CD1-CG 4.12Å; L265-L269 HydrophobicContact CG-CD1 3.88Å; L265-L269 HydrophobicContact CG-CG 4.35Å; L265-L269 WeakPolarHBondContact O-CG 3.32Å; L265-L269 PolarHBondContact O-N 3.3Å; S266-L269 PolarHBondContact O-N 2.97Å; L269-Y272 PolarHBondContact O-N 2.84Å; L269-L273 PolarHBondContact O-N 3.3Å |
| 270 | Q | 96 | Very high | 94.8 | Very high | 8 Ų | 8 | 33 Ų | 33 | 4% | 0.037 | 17% | 0.169 | C | C | . | . | H | α-helix | trans | -58.7 | -49.6 | 171.9 | 172.1 | 170.8 | -0.5 | 0 | 0 | 110.6 | S266 V268 Y272 L273 V274 F282 P340 L343 | S266-Q270 WeakPolarHBondContact O-CB 3.35Å; S266-Q270 PolarHBondContact O-N 3.1Å; V268-Q270 VanDerWaalsContact C-N 3.34Å; Q270-Y272 VanDerWaalsContact C-N 3.29Å; Q270-Y272 PolarHBondContact O-N 2.61Å; Q270-L273 PolarHBondContact O-N 3.5Å; Q270-V274 HydrophobicContact CG-CG2 4.07Å; Q270-V274 VanDerWaalsContact O-CB 3.27Å; Q270-V274 WeakPolarHBondContact O-CB 3.35Å; Q270-V274 WeakPolarHBondContact O-CG2 3.22Å; Q270-V274 PolarHBondContact O-N 3.38Å; Q270-F282 HydrophobicContact CB-CE1 4.48Å; Q270-F282 HydrophobicContact CB-CE2 4.21Å; Q270-F282 HydrophobicContact CB-CZ 3.77Å; Q270-F282 HydrophobicContact CG-CE1 3.64Å; Q270-F282 HydrophobicContact CG-CE2 4.13Å; Q270-F282 HydrophobicContact CG-CZ 3.42Å; Q270-F282 VanDerWaalsContact CG-CZ 3.42Å; Q270-P340 VanDerWaalsContact NE2-CD 3.34Å; Q270-L343 HydrophobicContact CB-CD1 4.24Å; Q270-L343 HydrophobicContact CG-CD1 3.68Å |
| 271 | Q | 94.5 | Very high | 94.6 | Very high | 4 Ų | 4 | 33.9 Ų | 33.9 | 2% | 0.019 | 17% | 0.173 | C | C | . | . | H | α-helix | trans | -56.5 | -45.7 | 176.3 | -170.4 | -179.2 | 9.8 | 0 | 0 | 111.1 | L184 Y186 N267 V268 L275 L343 S346 | L184-Q271 VanDerWaalsContact CD1-OE1 3.3Å; Y186-Q271 PolarHBondContact OH-NE2 2.95Å; N267-Q271 WeakPolarHBondContact O-CB 3.02Å; N267-Q271 PolarHBondContact O-N 3.46Å; V268-Q271 PolarHBondContact O-N 2.91Å; Q271-L275 HydrophobicContact CG-CD1 4.03Å; Q271-L275 WeakPolarHBondContact O-CB 3.49Å; Q271-L275 VanDerWaalsContact O-CG 3.23Å; Q271-L275 WeakPolarHBondContact O-CG 3.13Å; Q271-L275 PolarHBondContact O-N 2.94Å; Q271-L275 VanDerWaalsContact O-N 3.13Å; Q271-L343 HydrophobicContact CB-CB 4.37Å; Q271-L343 HydrophobicContact CB-CD1 4.44Å; Q271-L343 HydrophobicContact CB-CD2 4.39Å; Q271-L343 HydrophobicContact CG-CB 4.29Å; Q271-L343 PolarHBondContact NE2-O 3.42Å; Q271-S346 PolarHBondContact NE2-O 2.84Å; Q271-S346 VanDerWaalsContact NE2-O 3.09Å |
| 272 | Y | 92.4 | Very high | 94.5 | Very high | 73 Ų | 73 | 30.6 Ų | 30.6 | 29% | 0.286 | 16% | 0.156 | S | C | . | . | H | α-helix | trans | -60.5 | -49 | 178.3 | 176 | -100.2 | 0 | 0 | 0 | 112.9 | L184 V268 L269 Q270 K276 | L184-Y272 HydrophobicContact CD2-CD2 4.35Å; V268-Y272 PolarHBondContact O-N 3.2Å; L269-Y272 PolarHBondContact O-N 2.84Å; Q270-Y272 VanDerWaalsContact C-N 3.29Å; Q270-Y272 PolarHBondContact O-N 2.61Å; Y272-K276 HydrophobicContact CE1-CD 4.17Å; Y272-K276 WeakPolarHBondContact O-CB 3.45Å; Y272-K276 PolarHBondContact O-N 3.26Å; Y272-K276 PolarHBondContact OH-NZ 3.25Å |
| 273 | L | 92.6 | Very high | 94.5 | Very high | 4 Ų | 4 | 29.7 Ų | 29.7 | 2% | 0.021 | 15% | 0.149 | C | C | . | . | H | α-helix | trans | -72.8 | -37.6 | -177.2 | -68.7 | -166.6 | 0 | 0 | 0 | 113.1 | F138 Y139 I142 L269 Q270 K276 Y277 F282 | F138-L273 HydrophobicContact CB-CD1 3.9Å; F138-L273 HydrophobicContact CB-CD2 4.16Å; Y139-L273 HydrophobicContact CD1-CD1 3.53Å; Y139-L273 HydrophobicContact CE1-CB 4.2Å; Y139-L273 HydrophobicContact CE1-CD1 3.61Å; Y139-L273 HydrophobicContact CE1-CG 4.49Å; I142-L273 HydrophobicContact CD1-CD1 3.25Å; I142-L273 HydrophobicContact CD1-CG 3.8Å; I142-L273 HydrophobicContact CG1-CD1 4.29Å; L269-L273 PolarHBondContact O-N 3.3Å; Q270-L273 PolarHBondContact O-N 3.5Å; L273-K276 PolarHBondContact O-N 3.37Å; L273-Y277 HydrophobicContact CD2-CD2 4.04Å; L273-Y277 HydrophobicContact CD2-CE2 3.8Å; L273-Y277 PolarHBondContact O-N 3.38Å; L273-F282 HydrophobicContact CB-CD2 4.08Å; L273-F282 HydrophobicContact CB-CE2 4.47Å; L273-F282 HydrophobicContact CD1-CD2 4.5Å |
| 274 | V | 94 | Very high | 94.5 | Very high | 2 Ų | 2 | 27.3 Ų | 27.3 | 1% | 0.012 | 14% | 0.14 | C | C | . | . | H | α-helix | trans | -64.2 | -42.4 | 177.8 | 169.9 | 0 | 0 | 0 | 0 | 110.5 | Q270 K276 G278 I279 F282 P340 M344 | Q270-V274 HydrophobicContact CG-CG2 4.07Å; Q270-V274 VanDerWaalsContact O-CB 3.27Å; Q270-V274 WeakPolarHBondContact O-CB 3.35Å; Q270-V274 WeakPolarHBondContact O-CG2 3.22Å; Q270-V274 PolarHBondContact O-N 3.38Å; V274-K276 VanDerWaalsContact C-N 3.25Å; V274-K276 PolarHBondContact O-N 3.03Å; V274-G278 VanDerWaalsContact O-CA 3.24Å; V274-G278 WeakPolarHBondContact O-CA 3.47Å; V274-G278 PolarHBondContact O-N 3.49Å; V274-I279 HydrophobicContact CG1-CG1 3.61Å; V274-F282 HydrophobicContact CG2-CB 3.91Å; V274-F282 HydrophobicContact CG2-CD1 3.61Å; V274-F282 HydrophobicContact CG2-CD2 4.03Å; V274-F282 HydrophobicContact CG2-CE1 4.16Å; V274-F282 HydrophobicContact CG2-CG 3.55Å; V274-P340 HydrophobicContact CG1-CB 4.09Å; V274-P340 HydrophobicContact CG2-CB 3.97Å; V274-M344 HydrophobicContact CG1-CG 3.55Å; V274-M344 HydrophobicContact CG1-SD 3.74Å |
| 275 | L | 90.1 | Very high | 94.5 | Very high | 92 Ų | 92 | 27.4 Ų | 27.4 | 48% | 0.482 | 14% | 0.14 | S | C | . | . | H | α-helix | trans | -65.1 | -30 | 175.2 | -71.4 | 174.2 | 0 | 0 | 0 | 112.6 | Q271 M344 | Q271-L275 HydrophobicContact CG-CD1 4.03Å; Q271-L275 WeakPolarHBondContact O-CB 3.49Å; Q271-L275 VanDerWaalsContact O-CG 3.23Å; Q271-L275 WeakPolarHBondContact O-CG 3.13Å; Q271-L275 PolarHBondContact O-N 2.94Å; Q271-L275 VanDerWaalsContact O-N 3.13Å; L275-M344 HydrophobicContact CD2-CG 4.27Å |
| 276 | K | 89.9 | Confident | 94.5 | Very high | 108 Ų | 108 | 25.6 Ų | 25.6 | 47% | 0.47 | 13% | 0.131 | S | C | . | . | H | α-helix | trans | -87.2 | -37.6 | -176.3 | -166.9 | 175.8 | -178.4 | -176 | 0 | 114.1 | Y272 L273 V274 | Y272-K276 HydrophobicContact CE1-CD 4.17Å; Y272-K276 WeakPolarHBondContact O-CB 3.45Å; Y272-K276 PolarHBondContact O-N 3.26Å; Y272-K276 PolarHBondContact OH-NZ 3.25Å; L273-K276 PolarHBondContact O-N 3.37Å; V274-K276 VanDerWaalsContact C-N 3.25Å; V274-K276 PolarHBondContact O-N 3.03Å |
| 277 | Y | 90.2 | Very high | 94.6 | Very high | 46 Ų | 46 | 25.6 Ų | 25.6 | 18% | 0.18 | 13% | 0.131 | C | C | . | . | H | α-helix | trans | -124.8 | -10.1 | -170.1 | -56.7 | -53.8 | 0 | 0 | 0 | 114.1 | R135 Y139 L273 | R135-Y277 HydrophobicContact CG-CD1 4.3Å; R135-Y277 HydrophobicContact CG-CD2 4.33Å; R135-Y277 HydrophobicContact CG-CE1 3.89Å; R135-Y277 HydrophobicContact CG-CE2 3.89Å; Y139-Y277 WeakPolarHBondContact OH-CB 3.38Å; Y139-Y277 WeakPolarHBondContact OH-CD2 3.31Å; L273-Y277 HydrophobicContact CD2-CD2 4.04Å; L273-Y277 HydrophobicContact CD2-CE2 3.8Å; L273-Y277 PolarHBondContact O-N 3.38Å |
| 278 | G | 92 | Very high | 94.7 | Very high | 29 Ų | 29 | 26.9 Ų | 26.9 | 30% | 0.299 | 14% | 0.138 | S | C | . | . | trans | 95.7 | 160.7 | 177.3 | 0 | 0 | 0 | 0 | 0 | 114.4 | V274 F282 | V274-G278 VanDerWaalsContact O-CA 3.24Å; V274-G278 WeakPolarHBondContact O-CA 3.47Å; V274-G278 PolarHBondContact O-N 3.49Å; G278-F282 WeakPolarHBondContact O-CB 3.49Å; G278-F282 PolarHBondContact O-N 3.35Å | ||
| 279 | I | 95.5 | Very high | 94.7 | Very high | 34 Ų | 34 | 27.4 Ų | 27.4 | 17% | 0.174 | 14% | 0.14 | C | C | . | . | H | α-helix | trans | -68.1 | -50.2 | -172.6 | -61.4 | 175.2 | 0 | 0 | 0 | 112.2 | V274 F282 L283 P340 L341 M344 | V274-I279 HydrophobicContact CG1-CG1 3.61Å; I279-F282 PolarHBondContact O-N 2.97Å; I279-L283 HydrophobicContact CG2-CD1 3.6Å; I279-L283 HydrophobicContact CG2-CG 4.09Å; I279-L283 WeakPolarHBondContact O-CB 3.04Å; I279-L283 WeakPolarHBondContact O-CG 3.34Å; I279-L283 PolarHBondContact O-N 2.84Å; I279-P340 HydrophobicContact CB-CB 4.42Å; I279-P340 HydrophobicContact CD1-CB 4.41Å; I279-P340 HydrophobicContact CG1-CB 4.01Å; I279-P340 HydrophobicContact CG2-CB 3.83Å; I279-P340 HydrophobicContact CG2-CG 4.21Å; I279-L341 HydrophobicContact CD1-CD2 3.33Å; I279-L341 HydrophobicContact CD1-CG 3.99Å; I279-M344 HydrophobicContact CD1-CG 4.49Å; I279-M344 HydrophobicContact CD1-SD 3.42Å; I279-M344 WeakPolarHBondContact CD1-SD 3.42Å; I279-M344 HydrophobicContact CG1-SD 3.45Å; I279-M344 WeakPolarHBondContact CG1-SD 2.97Å |
| 280 | V | 95.9 | Very high | 94.9 | Very high | 70 Ų | 70 | 26.5 Ų | 26.5 | 42% | 0.424 | 14% | 0.135 | S | C | . | . | H | α-helix | trans | -67.4 | -41.9 | -170.7 | -178.9 | 0 | 0 | 0 | 0 | 111.1 | Y68 G284 | Y68-V280 HydrophobicContact CD2-CG1 4.19Å; Y68-V280 HydrophobicContact CG-CG1 4.5Å; V280-G284 PolarHBondContact O-N 2.85Å |
| 281 | E | 93.8 | Very high | 95 | Very high | 19 Ų | 19 | 26.5 Ų | 26.5 | 9% | 0.089 | 14% | 0.136 | C | C | . | . | H | α-helix | trans | -61 | -45.6 | 173.9 | -179.1 | 167.7 | 146.5 | 0 | 0 | 111 | Y68 R135 Y139 C285 | Y68-E281 HydrophobicContact CD2-CB 4.38Å; Y68-E281 HydrophobicContact CE1-CB 4.47Å; Y68-E281 HydrophobicContact CE1-CG 4.18Å; Y68-E281 HydrophobicContact CE2-CB 3.64Å; Y68-E281 HydrophobicContact CE2-CG 4.06Å; Y68-E281 VanDerWaalsContact OH-CG 3.25Å; Y68-E281 WeakPolarHBondContact OH-CG 3.23Å; Y68-E281 PolarHBondContact OH-OE2 2.8Å; R135-E281 VanDerWaalsContact CD-OE1 3.23Å; R135-E281 WeakPolarHBondContact CD-OE1 3.4Å; R135-E281 IonicContact CZ-OE1 3.85Å; R135-E281 IonicContact NE-OE1 3.99Å; R135-E281 IonicContact NH1-OE1 2.9Å; R135-E281 PolarHBondContact NH1-OE1 3.25Å; R135-E281 IonicContact NH1-OE2 3.52Å; Y139-E281 HydrophobicContact CE2-CG 4.11Å; Y139-E281 PolarHBondContact OH-OE1 3.04Å; E281-C285 WeakPolarHBondContact O-CB 3.27Å; E281-C285 PolarHBondContact O-N 3.02Å; E281-C285 PolarHBondContact O-SG 3.46Å |
| 282 | F | 96.1 | Very high | 95.1 | Very high | 6 Ų | 6 | 30.4 Ų | 30.4 | 3% | 0.026 | 16% | 0.156 | C | C | . | . | H | α-helix | trans | -60.3 | -55.6 | 177.3 | 172.1 | -93.3 | 0 | 0 | 0 | 112 | Y139 I142 Q270 L273 V274 G278 I279 G284 C285 V286 P340 | Y139-F282 AromaticContact CD1-CD2 3.99Å; Y139-F282 HydrophobicContact CD1-CD2 3.99Å; Y139-F282 HydrophobicContact CE1-CB 4.22Å; Y139-F282 AromaticContact CE1-CD2 3.83Å; Y139-F282 HydrophobicContact CE1-CD2 3.83Å; Y139-F282 HydrophobicContact CE1-CG 4.5Å; I142-F282 HydrophobicContact CD1-CE2 4.14Å; I142-F282 HydrophobicContact CG2-CE2 4.33Å; I142-F282 HydrophobicContact CG2-CZ 4.41Å; Q270-F282 HydrophobicContact CB-CE1 4.48Å; Q270-F282 HydrophobicContact CB-CE2 4.21Å; Q270-F282 HydrophobicContact CB-CZ 3.77Å; Q270-F282 HydrophobicContact CG-CE1 3.64Å; Q270-F282 HydrophobicContact CG-CE2 4.13Å; Q270-F282 HydrophobicContact CG-CZ 3.42Å; Q270-F282 VanDerWaalsContact CG-CZ 3.42Å; L273-F282 HydrophobicContact CB-CD2 4.08Å; L273-F282 HydrophobicContact CB-CE2 4.47Å; L273-F282 HydrophobicContact CD1-CD2 4.5Å; V274-F282 HydrophobicContact CG2-CB 3.91Å; V274-F282 HydrophobicContact CG2-CD1 3.61Å; V274-F282 HydrophobicContact CG2-CD2 4.03Å; V274-F282 HydrophobicContact CG2-CE1 4.16Å; V274-F282 HydrophobicContact CG2-CG 3.55Å; G278-F282 WeakPolarHBondContact O-CB 3.49Å; G278-F282 PolarHBondContact O-N 3.35Å; I279-F282 PolarHBondContact O-N 2.97Å; F282-G284 VanDerWaalsContact C-N 3.33Å; F282-G284 PolarHBondContact O-N 2.92Å; F282-C285 PolarHBondContact O-N 3.12Å; F282-V286 HydrophobicContact CD2-CG2 3.97Å; F282-V286 HydrophobicContact CE1-CG2 4.46Å; F282-V286 HydrophobicContact CE2-CG2 3.67Å; F282-V286 HydrophobicContact CG-CG2 4.48Å; F282-V286 HydrophobicContact CZ-CG2 3.92Å; F282-V286 WeakPolarHBondContact O-CB 3.26Å; F282-V286 WeakPolarHBondContact O-CG2 3.39Å; F282-V286 PolarHBondContact O-N 3.36Å; F282-P340 HydrophobicContact CD1-CG 4.36Å; F282-P340 HydrophobicContact CE1-CG 4.44Å |
| 283 | L | 97.6 | Very high | 95.4 | Very high | 4 Ų | 4 | 28.2 Ų | 28.2 | 2% | 0.021 | 15% | 0.15 | C | C | . | . | H | α-helix | trans | -61.8 | -40.9 | -178.1 | -72.9 | 177.7 | 0 | 0 | 0 | 111.9 | L60 Y64 I279 G287 Y336 P340 | L60-L283 HydrophobicContact CD2-CD2 4.17Å; Y64-L283 HydrophobicContact CD1-CB 4.4Å; Y64-L283 HydrophobicContact CD1-CD1 3.91Å; Y64-L283 HydrophobicContact CD2-CB 4.14Å; Y64-L283 HydrophobicContact CD2-CD1 3.98Å; Y64-L283 HydrophobicContact CE1-CD1 3.83Å; Y64-L283 HydrophobicContact CE2-CD1 3.9Å; Y64-L283 HydrophobicContact CG-CB 3.89Å; Y64-L283 HydrophobicContact CG-CD1 3.98Å; I279-L283 HydrophobicContact CG2-CD1 3.6Å; I279-L283 HydrophobicContact CG2-CG 4.09Å; I279-L283 WeakPolarHBondContact O-CB 3.04Å; I279-L283 WeakPolarHBondContact O-CG 3.34Å; I279-L283 PolarHBondContact O-N 2.84Å; L283-G287 WeakPolarHBondContact O-CA 3.48Å; L283-G287 PolarHBondContact O-N 3.05Å; L283-Y336 WeakPolarHBondContact CD2-O 3.47Å; L283-P340 HydrophobicContact CD1-CG 4.23Å; L283-P340 HydrophobicContact CD2-CG 3.74Å; L283-P340 HydrophobicContact CG-CG 4.03Å |
| 284 | G | 96.9 | Very high | 95.6 | Very high | 0 Ų | 0 | 28.1 Ų | 28.1 | 0% | 0 | 15% | 0.149 | C | C | . | . | H | α-helix | trans | -65.7 | -45.2 | 178.7 | 0 | 0 | 0 | 0 | 0 | 113.3 | V280 F282 L288 | V280-G284 PolarHBondContact O-N 2.85Å; F282-G284 VanDerWaalsContact C-N 3.33Å; F282-G284 PolarHBondContact O-N 2.92Å; G284-L288 WeakPolarHBondContact O-CB 3.48Å; G284-L288 PolarHBondContact O-N 3.2Å; G284-L288 VanDerWaalsContact O-N 3.11Å |
| 285 | C | 95.9 | Very high | 95.8 | Very high | 1 Ų | 1 | 31.9 Ų | 31.9 | 1% | 0.007 | 17% | 0.169 | C | C | . | . | H | α-helix | trans | -72 | -47.5 | 179.9 | -65.5 | 0 | 0 | 0 | 0 | 112.3 | Y139 E281 F282 L288 I289 | Y139-C285 HydrophobicContact CD2-CB 3.41Å; Y139-C285 VanDerWaalsContact CD2-CB 3.41Å; Y139-C285 HydrophobicContact CE2-CB 3.99Å; Y139-C285 HydrophobicContact CG-CB 3.73Å; E281-C285 WeakPolarHBondContact O-CB 3.27Å; E281-C285 PolarHBondContact O-N 3.02Å; E281-C285 PolarHBondContact O-SG 3.46Å; F282-C285 PolarHBondContact O-N 3.12Å; C285-L288 PolarHBondContact O-N 2.95Å; C285-I289 WeakPolarHBondContact O-CG1 3.41Å; C285-I289 PolarHBondContact O-N 3.17Å |
| 286 | V | 97.5 | Very high | 96.2 | Very high | 7 Ų | 7 | 32 Ų | 32 | 4% | 0.042 | 17% | 0.169 | C | C | . | . | H | α-helix | trans | -64.6 | -43 | 178.8 | 172.4 | 0 | 0 | 0 | 0 | 110.3 | Y139 A143 F282 L288 I289 A290 | Y139-V286 HydrophobicContact CD1-CG2 4.1Å; Y139-V286 HydrophobicContact CG-CG2 4.48Å; A143-V286 HydrophobicContact CB-CG1 4.11Å; F282-V286 HydrophobicContact CD2-CG2 3.97Å; F282-V286 HydrophobicContact CE1-CG2 4.46Å; F282-V286 HydrophobicContact CE2-CG2 3.67Å; F282-V286 HydrophobicContact CG-CG2 4.48Å; F282-V286 HydrophobicContact CZ-CG2 3.92Å; F282-V286 WeakPolarHBondContact O-CB 3.26Å; F282-V286 WeakPolarHBondContact O-CG2 3.39Å; F282-V286 PolarHBondContact O-N 3.36Å; V286-L288 VanDerWaalsContact C-N 3.34Å; V286-L288 PolarHBondContact O-N 3.06Å; V286-I289 PolarHBondContact O-N 3.4Å; V286-A290 WeakPolarHBondContact O-CB 3.49Å; V286-A290 PolarHBondContact O-N 3.2Å |
| 287 | G | 98 | Very high | 96.5 | Very high | 0 Ų | 0 | 30.2 Ų | 30.2 | 0% | 0 | 16% | 0.16 | C | C | . | . | H | α-helix | trans | -58.4 | -42.9 | 174.6 | 0 | 0 | 0 | 0 | 0 | 112.8 | L283 S291 | L283-G287 WeakPolarHBondContact O-CA 3.48Å; L283-G287 PolarHBondContact O-N 3.05Å; G287-S291 WeakPolarHBondContact O-CB 3.29Å; G287-S291 PolarHBondContact O-N 3.15Å; G287-S291 PolarHBondContact O-OG 3.24Å |
| 288 | L | 97.5 | Very high | 96.8 | Very high | 37 Ų | 37 | 28.8 Ų | 28.8 | 19% | 0.194 | 16% | 0.155 | C | C | . | . | H | α-helix | trans | -61.9 | -50.9 | 176.3 | 179.8 | 148.7 | 0 | 0 | 0 | 111.6 | F61 F69 F136 G284 C285 V286 S291 I292 | F61-L288 HydrophobicContact CD2-CB 3.61Å; F61-L288 HydrophobicContact CD2-CD1 4.01Å; F61-L288 HydrophobicContact CD2-CG 4.18Å; F61-L288 HydrophobicContact CE2-CB 4.07Å; F61-L288 HydrophobicContact CE2-CD1 3.54Å; F61-L288 HydrophobicContact CE2-CG 4.18Å; F61-L288 HydrophobicContact CG-CB 4.19Å; F61-L288 HydrophobicContact CZ-CD1 4.05Å; F69-L288 HydrophobicContact CE2-CD1 3.93Å; F69-L288 HydrophobicContact CZ-CD1 4.41Å; F136-L288 HydrophobicContact CE2-CD2 4.37Å; F136-L288 HydrophobicContact CZ-CD2 4.06Å; G284-L288 WeakPolarHBondContact O-CB 3.48Å; G284-L288 PolarHBondContact O-N 3.2Å; G284-L288 VanDerWaalsContact O-N 3.11Å; C285-L288 PolarHBondContact O-N 2.95Å; V286-L288 VanDerWaalsContact C-N 3.34Å; V286-L288 PolarHBondContact O-N 3.06Å; L288-S291 PolarHBondContact O-OG 3.36Å; L288-I292 HydrophobicContact CD2-CD1 3.78Å; L288-I292 HydrophobicContact CG-CD1 4.27Å; L288-I292 WeakPolarHBondContact O-CG1 3.26Å; L288-I292 PolarHBondContact O-N 3.24Å; L288-I292 VanDerWaalsContact O-N 3.16Å |
| 289 | I | 97.6 | Very high | 97 | Very high | 12 Ų | 12 | 31.5 Ų | 31.5 | 6% | 0.062 | 17% | 0.166 | C | C | . | . | H | α-helix | trans | -69.9 | -45.3 | -174.8 | -60.7 | 166.5 | 0 | 0 | 0 | 110.4 | F136 A143 C285 V286 S291 I292 I293 | F136-I289 HydrophobicContact CD1-CD1 4.11Å; F136-I289 HydrophobicContact CD2-CD1 4.18Å; F136-I289 HydrophobicContact CE1-CD1 3.67Å; F136-I289 HydrophobicContact CE1-CG1 3.97Å; F136-I289 HydrophobicContact CE2-CD1 3.75Å; F136-I289 HydrophobicContact CE2-CG1 3.97Å; F136-I289 HydrophobicContact CG-CD1 4.36Å; F136-I289 HydrophobicContact CZ-CD1 3.48Å; F136-I289 VanDerWaalsContact CZ-CD1 3.48Å; F136-I289 HydrophobicContact CZ-CG1 3.47Å; F136-I289 VanDerWaalsContact CZ-CG1 3.47Å; A143-I289 HydrophobicContact CB-CB 3.88Å; A143-I289 HydrophobicContact CB-CG2 3.78Å; C285-I289 WeakPolarHBondContact O-CG1 3.41Å; C285-I289 PolarHBondContact O-N 3.17Å; V286-I289 PolarHBondContact O-N 3.4Å; I289-S291 VanDerWaalsContact C-N 3.35Å; I289-S291 PolarHBondContact O-N 2.96Å; I289-I292 PolarHBondContact O-N 2.96Å; I289-I293 HydrophobicContact CG2-CD1 3.74Å; I289-I293 HydrophobicContact CG2-CG1 4.35Å; I289-I293 WeakPolarHBondContact O-CG1 3.37Å; I289-I293 PolarHBondContact O-N 2.97Å |
| 290 | A | 98.4 | Very high | 96.9 | Very high | 0 Ų | 0 | 34 Ų | 34 | 0% | 0 | 19% | 0.187 | C | C | . | . | H | α-helix | trans | -63.7 | -38.9 | 178.8 | 0 | 0 | 0 | 0 | 0 | 111.9 | Y57 A143 V147 V286 I292 I293 T294 | Y57-A290 HydrophobicContact CD1-CB 3.35Å; Y57-A290 HydrophobicContact CD2-CB 4.15Å; Y57-A290 HydrophobicContact CE1-CB 3.59Å; Y57-A290 HydrophobicContact CE2-CB 4.34Å; Y57-A290 HydrophobicContact CG-CB 3.64Å; A143-A290 HydrophobicContact CB-CB 4.17Å; V147-A290 HydrophobicContact CG2-CB 3.69Å; V286-A290 WeakPolarHBondContact O-CB 3.49Å; V286-A290 PolarHBondContact O-N 3.2Å; A290-I292 PolarHBondContact O-N 2.97Å; A290-I293 PolarHBondContact O-N 2.68Å; A290-T294 WeakPolarHBondContact O-CB 3.36Å; A290-T294 WeakPolarHBondContact O-CG2 3.45Å; A290-T294 PolarHBondContact O-N 2.99Å; A290-T294 PolarHBondContact O-OG1 3.22Å |
| 291 | S | 98.1 | Very high | 96.9 | Very high | 8 Ų | 8 | 36.4 Ų | 36.4 | 6% | 0.056 | 20% | 0.197 | C | C | . | . | H | α-helix | trans | -64.7 | -38.2 | 175.5 | 61.3 | 0 | 0 | 0 | 0 | 112.5 | G287 L288 I289 T294 L295 | G287-S291 WeakPolarHBondContact O-CB 3.29Å; G287-S291 PolarHBondContact O-N 3.15Å; G287-S291 PolarHBondContact O-OG 3.24Å; L288-S291 PolarHBondContact O-OG 3.36Å; I289-S291 VanDerWaalsContact C-N 3.35Å; I289-S291 PolarHBondContact O-N 2.96Å; S291-T294 WeakPolarHBondContact CA-OG1 3.31Å; S291-T294 PolarHBondContact O-OG1 3.31Å; S291-L295 WeakPolarHBondContact O-CB 3.4Å; S291-L295 PolarHBondContact O-N 3.05Å |
| 292 | I | 98.1 | Very high | 96.9 | Very high | 86 Ų | 86 | 36 Ų | 36 | 44% | 0.441 | 20% | 0.195 | S | C | . | . | H | α-helix | trans | -65.2 | -49.1 | 174.2 | -69.7 | 165.7 | 0 | 0 | 0 | 110.9 | L288 I289 A290 L295 I296 | L288-I292 HydrophobicContact CD2-CD1 3.78Å; L288-I292 HydrophobicContact CG-CD1 4.27Å; L288-I292 WeakPolarHBondContact O-CG1 3.26Å; L288-I292 PolarHBondContact O-N 3.24Å; L288-I292 VanDerWaalsContact O-N 3.16Å; I289-I292 PolarHBondContact O-N 2.96Å; A290-I292 PolarHBondContact O-N 2.97Å; I292-L295 PolarHBondContact O-N 3.49Å; I292-I296 HydrophobicContact CG2-CD1 3.79Å; I292-I296 VanDerWaalsContact O-CG1 3.29Å; I292-I296 WeakPolarHBondContact O-CG1 3.34Å; I292-I296 PolarHBondContact O-N 3.05Å |
| 293 | I | 97.8 | Very high | 96.7 | Very high | 28 Ų | 28 | 42.9 Ų | 42.9 | 14% | 0.144 | 23% | 0.225 | C | C | . | . | H | α-helix | trans | -60.7 | -50.8 | -179.4 | -65.7 | 169.1 | 0 | 0 | 0 | 110.3 | F144 V147 I289 A290 L295 I296 Y297 | F144-I293 HydrophobicContact CB-CD1 4.49Å; V147-I293 HydrophobicContact CG1-CG2 3.99Å; I289-I293 HydrophobicContact CG2-CD1 3.74Å; I289-I293 HydrophobicContact CG2-CG1 4.35Å; I289-I293 WeakPolarHBondContact O-CG1 3.37Å; I289-I293 PolarHBondContact O-N 2.97Å; A290-I293 PolarHBondContact O-N 2.68Å; I293-L295 PolarHBondContact O-N 3.24Å; I293-I296 PolarHBondContact O-N 3.35Å; I293-Y297 HydrophobicContact CG2-CD2 4.05Å; I293-Y297 HydrophobicContact CG2-CE2 3.87Å; I293-Y297 PolarHBondContact O-N 2.85Å |
| 294 | T | 97.7 | Very high | 96.4 | Very high | 1 Ų | 1 | 49.3 Ų | 49.3 | 1% | 0.006 | 25% | 0.254 | C | S | . | . | H | α-helix | trans | -62.9 | -40.9 | -179.9 | 48.8 | 0 | 0 | 0 | 0 | 111.9 | Y57 V147 A290 S291 I296 Y297 T298 | Y57-T294 HydrophobicContact CD2-CG2 3.67Å; Y57-T294 HydrophobicContact CE2-CG2 3.71Å; V147-T294 HydrophobicContact CB-CG2 4.28Å; V147-T294 HydrophobicContact CG1-CG2 3.58Å; V147-T294 HydrophobicContact CG2-CG2 3.69Å; A290-T294 WeakPolarHBondContact O-CB 3.36Å; A290-T294 WeakPolarHBondContact O-CG2 3.45Å; A290-T294 PolarHBondContact O-N 2.99Å; A290-T294 PolarHBondContact O-OG1 3.22Å; S291-T294 WeakPolarHBondContact CA-OG1 3.31Å; S291-T294 PolarHBondContact O-OG1 3.31Å; T294-I296 PolarHBondContact O-N 3.5Å; T294-Y297 PolarHBondContact O-N 3.18Å; T294-T298 WeakPolarHBondContact O-CB 3.49Å; T294-T298 PolarHBondContact O-N 3.03Å; T294-T298 PolarHBondContact O-OG1 2.95Å |
| 295 | L | 97.8 | Very high | 96 | Very high | 82 Ų | 82 | 51.9 Ų | 51.9 | 43% | 0.429 | 27% | 0.272 | S | S | . | . | H | α-helix | trans | -60.1 | -46.9 | 175.7 | -178.2 | 61.9 | 0 | 0 | 0 | 112 | F54 S291 I292 I293 Y297 T298 V299 | F54-L295 HydrophobicContact CD2-CB 4Å; F54-L295 HydrophobicContact CD2-CD1 4.41Å; F54-L295 HydrophobicContact CE2-CB 3.79Å; F54-L295 HydrophobicContact CE2-CD1 3.98Å; F54-L295 HydrophobicContact CE2-CD2 4.46Å; F54-L295 HydrophobicContact CE2-CG 4.3Å; F54-L295 HydrophobicContact CZ-CD1 4.2Å; S291-L295 WeakPolarHBondContact O-CB 3.4Å; S291-L295 PolarHBondContact O-N 3.05Å; I292-L295 PolarHBondContact O-N 3.49Å; I293-L295 PolarHBondContact O-N 3.24Å; L295-Y297 VanDerWaalsContact C-N 3.33Å; L295-Y297 PolarHBondContact O-N 3.08Å; L295-T298 PolarHBondContact O-N 3.09Å; L295-V299 HydrophobicContact CD1-CG2 4.17Å; L295-V299 WeakPolarHBondContact O-CB 3.28Å; L295-V299 VanDerWaalsContact O-CG2 3.3Å; L295-V299 WeakPolarHBondContact O-CG2 3.42Å; L295-V299 PolarHBondContact O-N 3.37Å |
| 296 | I | 97.5 | Very high | 95.7 | Very high | 93 Ų | 93 | 54.8 Ų | 54.8 | 48% | 0.477 | 29% | 0.287 | S | S | . | . | H | α-helix | trans | -59.7 | -46.8 | 178 | -69.3 | 167.5 | 0 | 0 | 0 | 110 | I292 I293 T294 S300 | I292-I296 HydrophobicContact CG2-CD1 3.79Å; I292-I296 VanDerWaalsContact O-CG1 3.29Å; I292-I296 WeakPolarHBondContact O-CG1 3.34Å; I292-I296 PolarHBondContact O-N 3.05Å; I293-I296 PolarHBondContact O-N 3.35Å; T294-I296 PolarHBondContact O-N 3.5Å; I296-S300 VanDerWaalsContact O-CB 3.25Å; I296-S300 WeakPolarHBondContact O-CB 3.32Å; I296-S300 PolarHBondContact O-N 3.2Å; I296-S300 PolarHBondContact O-OG 3.13Å |
| 297 | Y | 96.1 | Very high | 95.2 | Very high | 72 Ų | 72 | 56.8 Ų | 56.8 | 28% | 0.282 | 30% | 0.301 | S | S | . | . | H | α-helix | trans | -67.1 | -43.1 | 179.8 | -73.5 | -7.1 | 0 | 0 | 0 | 112.6 | L50 H148 I293 T294 L295 V299 S300 L301 | L50-Y297 HydrophobicContact CD2-CD2 3.9Å; L50-Y297 HydrophobicContact CD2-CG 4.41Å; H148-Y297 AromaticContact CE1-CE2 3.93Å; H148-Y297 AromaticContact NE2-CE2 3.72Å; H148-Y297 PolarHBondContact NE2-OH 3.37Å; I293-Y297 HydrophobicContact CG2-CD2 4.05Å; I293-Y297 HydrophobicContact CG2-CE2 3.87Å; I293-Y297 PolarHBondContact O-N 2.85Å; T294-Y297 PolarHBondContact O-N 3.18Å; L295-Y297 VanDerWaalsContact C-N 3.33Å; L295-Y297 PolarHBondContact O-N 3.08Å; Y297-V299 PolarHBondContact O-N 3.44Å; Y297-S300 PolarHBondContact O-N 3.23Å; Y297-L301 WeakPolarHBondContact O-CB 3.22Å; Y297-L301 PolarHBondContact O-N 3.33Å |
| 298 | T | 96.7 | Very high | 94.6 | Very high | 15 Ų | 15 | 60.9 Ų | 60.9 | 9% | 0.092 | 32% | 0.321 | C | S | . | . | I | π-helix | trans | -59.3 | -46.4 | 176.2 | -65 | 0 | 0 | 0 | 0 | 111.5 | L50 A51 T294 L295 S300 E302 K303 I306 | L50-T298 VanDerWaalsContact C-OG1 3.22Å; L50-T298 VanDerWaalsContact CB-OG1 3.28Å; L50-T298 WeakPolarHBondContact CB-OG1 3.29Å; L50-T298 PolarHBondContact O-OG1 3.03Å; A51-T298 HydrophobicContact CB-CG2 3.73Å; A51-T298 PolarHBondContact N-OG1 3.08Å; T294-T298 WeakPolarHBondContact O-CB 3.49Å; T294-T298 PolarHBondContact O-N 3.03Å; T294-T298 PolarHBondContact O-OG1 2.95Å; L295-T298 PolarHBondContact O-N 3.09Å; T298-S300 VanDerWaalsContact C-N 3.33Å; T298-S300 PolarHBondContact O-N 3.06Å; T298-E302 PolarHBondContact O-N 2.71Å; T298-K303 PolarHBondContact O-N 3.48Å; T298-I306 HydrophobicContact CG2-CD1 3.83Å |
| 299 | V | 95.8 | Very high | 94 | Very high | 87 Ų | 87 | 60.9 Ų | 60.9 | 53% | 0.527 | 32% | 0.321 | S | S | . | . | I | π-helix | trans | -66.7 | -36.2 | 179.1 | 173.3 | 0 | 0 | 0 | 0 | 111.7 | L295 Y297 K303 | L295-V299 HydrophobicContact CD1-CG2 4.17Å; L295-V299 WeakPolarHBondContact O-CB 3.28Å; L295-V299 VanDerWaalsContact O-CG2 3.3Å; L295-V299 WeakPolarHBondContact O-CG2 3.42Å; L295-V299 PolarHBondContact O-N 3.37Å; Y297-V299 PolarHBondContact O-N 3.44Å; V299-K303 WeakPolarHBondContact O-CB 3.37Å |
| 300 | S | 95 | Very high | 93.3 | Very high | 87 Ų | 87 | 66.9 Ų | 66.9 | 61% | 0.608 | 35% | 0.353 | S | S | * | . | I | π-helix | trans | -81.5 | -39.4 | -175.2 | -55.4 | 0 | 0 | 0 | 0 | 113.3 | I296 Y297 T298 | I296-S300 VanDerWaalsContact O-CB 3.25Å; I296-S300 WeakPolarHBondContact O-CB 3.32Å; I296-S300 PolarHBondContact O-N 3.2Å; I296-S300 PolarHBondContact O-OG 3.13Å; Y297-S300 PolarHBondContact O-N 3.23Å; T298-S300 VanDerWaalsContact C-N 3.33Å; T298-S300 PolarHBondContact O-N 3.06Å |
| 301 | L | 94.5 | Very high | 92.4 | Very high | 119 Ų | 119 | 74 Ų | 74 | 62% | 0.623 | 38% | 0.384 | S | S | * | . | I | π-helix | trans | -107 | -34.3 | -169.1 | -59.6 | 176.4 | 0 | 0 | 0 | 113.3 | L50 Y297 | L50-L301 HydrophobicContact CD1-CB 4.31Å; L50-L301 HydrophobicContact CD1-CD1 4.01Å; Y297-L301 WeakPolarHBondContact O-CB 3.22Å; Y297-L301 PolarHBondContact O-N 3.33Å |
| 302 | E | 95 | Very high | 91.2 | Very high | 12 Ų | 12 | 78.3 Ų | 78.3 | 6% | 0.056 | 41% | 0.406 | C | S | . | . | I | π-helix | trans | -110.1 | -6.6 | -168.3 | -70.7 | -179.8 | -175.2 | 0 | 0 | 114.4 | L48 P49 L50 A51 T298 H304 S305 I306 | L48-E302 HydrophobicContact CD2-CB 4.01Å; L48-E302 HydrophobicContact CD2-CG 4.16Å; P49-E302 WeakPolarHBondContact CD-OE1 3.36Å; P49-E302 VanDerWaalsContact CG-OE1 3.23Å; P49-E302 WeakPolarHBondContact CG-OE1 3.24Å; P49-E302 VanDerWaalsContact N-OE1 3.16Å; L50-E302 WeakPolarHBondContact CB-OE1 3.18Å; L50-E302 HydrophobicContact CD1-CG 4.24Å; L50-E302 WeakPolarHBondContact CD1-OE1 3.37Å; L50-E302 WeakPolarHBondContact CG-OE1 3.29Å; L50-E302 PolarHBondContact N-OE1 3.23Å; L50-E302 PolarHBondContact N-OE2 2.6Å; A51-E302 VanDerWaalsContact CB-OE2 3.28Å; A51-E302 WeakPolarHBondContact CB-OE2 3.12Å; A51-E302 PolarHBondContact N-OE2 3.34Å; T298-E302 PolarHBondContact O-N 2.71Å; E302-H304 PolarHBondContact O-N 3.26Å; E302-H304 VanDerWaalsContact O-N 3.13Å; E302-S305 PolarHBondContact O-N 3.46Å; E302-S305 VanDerWaalsContact O-N 3.09Å; E302-I306 HydrophobicContact CB-CD1 4.25Å; E302-I306 WeakPolarHBondContact O-CG1 3.27Å; E302-I306 PolarHBondContact O-N 3.16Å |
| 303 | K | 92.3 | Very high | 89.6 | Confident | 149 Ų | 149 | 75 Ų | 75 | 65% | 0.648 | 39% | 0.39 | S | S | * | . | H | α-helix | trans | -50.8 | -41.4 | -178.9 | 177.7 | -177.3 | 175.3 | -174.6 | 0 | 113 | T298 V299 S307 | T298-K303 PolarHBondContact O-N 3.48Å; V299-K303 WeakPolarHBondContact O-CB 3.37Å; K303-S307 PolarHBondContact O-N 2.88Å |
| 304 | H | 89.7 | Confident | 87.8 | Confident | 140 Ų | 140 | 80.1 Ų | 80.1 | 65% | 0.648 | 42% | 0.423 | S | S | * | . | H | α-helix | trans | -69.6 | -45.7 | 179.9 | -175.9 | 38.3 | 0 | 0 | 0 | 112.1 | E302 I306 S307 M308 | E302-H304 PolarHBondContact O-N 3.26Å; E302-H304 VanDerWaalsContact O-N 3.13Å; H304-I306 VanDerWaalsContact C-N 3.35Å; H304-I306 PolarHBondContact O-N 3.47Å; H304-S307 WeakPolarHBondContact O-CB 3.5Å; H304-S307 PolarHBondContact O-N 2.77Å; H304-S307 VanDerWaalsContact O-N 3.14Å; H304-M308 WeakPolarHBondContact O-CG 3.45Å; H304-M308 PolarHBondContact O-N 3.19Å |
| 305 | S | 89.3 | Confident | 86 | Confident | 53 Ų | 53 | 85 Ų | 85 | 37% | 0.371 | 46% | 0.457 | S | S | . | . | H | α-helix | trans | -60.7 | -42.3 | 177.7 | -53.6 | 0 | 0 | 0 | 0 | 112 | E302 S307 M308 I309 | E302-S305 PolarHBondContact O-N 3.46Å; E302-S305 VanDerWaalsContact O-N 3.09Å; S305-S307 VanDerWaalsContact C-N 3.32Å; S305-S307 PolarHBondContact O-N 3.35Å; S305-M308 PolarHBondContact O-N 3.11Å; S305-I309 WeakPolarHBondContact O-CD1 3.35Å; S305-I309 WeakPolarHBondContact O-CG1 3.42Å; S305-I309 PolarHBondContact O-N 3.09Å |
| 306 | I | 89.6 | Confident | 84.3 | Confident | 63 Ų | 63 | 85.2 Ų | 85.2 | 32% | 0.323 | 46% | 0.457 | S | S | . | . | H | α-helix | trans | -59.8 | -44.7 | 174.6 | -65.7 | 165.7 | 0 | 0 | 0 | 110.6 | L48 A51 T298 E302 H304 M308 I309 L310 | L48-I306 HydrophobicContact CD1-CG1 3.91Å; L48-I306 HydrophobicContact CD2-CG1 3.89Å; A51-I306 HydrophobicContact CB-CD1 3.95Å; A51-I306 HydrophobicContact CB-CG1 4.48Å; T298-I306 HydrophobicContact CG2-CD1 3.83Å; E302-I306 HydrophobicContact CB-CD1 4.25Å; E302-I306 WeakPolarHBondContact O-CG1 3.27Å; E302-I306 PolarHBondContact O-N 3.16Å; H304-I306 VanDerWaalsContact C-N 3.35Å; H304-I306 PolarHBondContact O-N 3.47Å; I306-M308 PolarHBondContact O-N 3.45Å; I306-I309 PolarHBondContact O-N 2.87Å; I306-L310 WeakPolarHBondContact O-CB 3.34Å; I306-L310 PolarHBondContact O-N 3.19Å |
| 307 | S | 87.7 | Confident | 83.2 | Confident | 48 Ų | 48 | 84.6 Ų | 84.6 | 34% | 0.336 | 45% | 0.454 | S | S | . | . | H | α-helix | trans | -61.4 | -44.4 | 177.8 | -170.1 | 0 | 0 | 0 | 0 | 111.6 | K303 H304 S305 I309 L310 F311 | K303-S307 PolarHBondContact O-N 2.88Å; H304-S307 WeakPolarHBondContact O-CB 3.5Å; H304-S307 PolarHBondContact O-N 2.77Å; H304-S307 VanDerWaalsContact O-N 3.14Å; S305-S307 VanDerWaalsContact C-N 3.32Å; S305-S307 PolarHBondContact O-N 3.35Å; S307-I309 PolarHBondContact O-N 3.35Å; S307-L310 PolarHBondContact O-N 3.42Å; S307-F311 WeakPolarHBondContact O-CD2 3.3Å; S307-F311 PolarHBondContact O-N 3.44Å; S307-F311 VanDerWaalsContact OG-CE2 3.3Å; S307-F311 WeakPolarHBondContact OG-CE2 3.21Å |
| 308 | M | 85.2 | Confident | 82.6 | Confident | 87 Ų | 87 | 85.2 Ų | 85.2 | 43% | 0.429 | 46% | 0.462 | S | S | . | . | H | α-helix | trans | -61.8 | -42.9 | 178.5 | -73.3 | -62.5 | -63.1 | 0 | 0 | 112.1 | H304 S305 I306 F311 N312 | H304-M308 WeakPolarHBondContact O-CG 3.45Å; H304-M308 PolarHBondContact O-N 3.19Å; S305-M308 PolarHBondContact O-N 3.11Å; I306-M308 PolarHBondContact O-N 3.45Å; M308-F311 PolarHBondContact O-N 2.87Å; M308-N312 VanDerWaalsContact O-CB 3.28Å; M308-N312 WeakPolarHBondContact O-CB 3.36Å; M308-N312 VanDerWaalsContact O-CG 3.29Å; M308-N312 PolarHBondContact O-N 3.35Å |
| 309 | I | 83.6 | Confident | 82.2 | Confident | 37 Ų | 37 | 90.4 Ų | 90.4 | 19% | 0.19 | 49% | 0.494 | C | S | . | . | H | α-helix | trans | -64.3 | -47.7 | 176.6 | -68.9 | 160.6 | 0 | 0 | 0 | 109.9 | I46 L48 S305 I306 S307 F311 N312 V313 | I46-I309 HydrophobicContact CD1-CG2 4.48Å; I46-I309 HydrophobicContact CG1-CD1 4.33Å; I46-I309 HydrophobicContact CG2-CD1 3.81Å; L48-I309 HydrophobicContact CD1-CD1 3.53Å; L48-I309 HydrophobicContact CD2-CD1 4.36Å; L48-I309 HydrophobicContact CG-CD1 3.92Å; S305-I309 WeakPolarHBondContact O-CD1 3.35Å; S305-I309 WeakPolarHBondContact O-CG1 3.42Å; S305-I309 PolarHBondContact O-N 3.09Å; I306-I309 PolarHBondContact O-N 2.87Å; S307-I309 PolarHBondContact O-N 3.35Å; I309-F311 PolarHBondContact O-N 2.95Å; I309-N312 PolarHBondContact O-N 2.85Å; I309-V313 HydrophobicContact CB-CG2 4.49Å; I309-V313 HydrophobicContact CG2-CG2 3.49Å; I309-V313 VanDerWaalsContact CG2-CG2 3.49Å; I309-V313 VanDerWaalsContact O-CB 3.23Å; I309-V313 WeakPolarHBondContact O-CB 3.47Å; I309-V313 WeakPolarHBondContact O-CG2 3.47Å; I309-V313 PolarHBondContact O-N 3.16Å |
| 310 | L | 82.9 | Confident | 81.8 | Confident | 137 Ų | 137 | 91.4 Ų | 91.4 | 72% | 0.717 | 49% | 0.492 | S | S | * | . | H | α-helix | trans | -58.9 | -36.1 | -180 | -173.5 | 64 | 0 | 0 | 0 | 112.7 | I306 S307 | I306-L310 WeakPolarHBondContact O-CB 3.34Å; I306-L310 PolarHBondContact O-N 3.19Å; S307-L310 PolarHBondContact O-N 3.42Å |
| 311 | F | 80.9 | Confident | 81.6 | Confident | 149 Ų | 149 | 87.6 Ų | 87.6 | 65% | 0.654 | 47% | 0.465 | S | S | * | . | H | α-helix | trans | -78 | -35.7 | 176.3 | -74.8 | -62.4 | 0 | 0 | 0 | 113.8 | S307 M308 I309 | S307-F311 WeakPolarHBondContact O-CD2 3.3Å; S307-F311 PolarHBondContact O-N 3.44Å; S307-F311 VanDerWaalsContact OG-CE2 3.3Å; S307-F311 WeakPolarHBondContact OG-CE2 3.21Å; M308-F311 PolarHBondContact O-N 2.87Å; I309-F311 PolarHBondContact O-N 2.95Å |
| 312 | N | 73 | Confident | 81.4 | Confident | 99 Ų | 99 | 85.9 Ų | 85.9 | 53% | 0.529 | 46% | 0.455 | S | S | . | . | H | α-helix | trans | -86.7 | -20 | -175.2 | -72.8 | -6.4 | 0 | 0 | 0 | 114.2 | M308 I309 T314 S315 | M308-N312 VanDerWaalsContact O-CB 3.28Å; M308-N312 WeakPolarHBondContact O-CB 3.36Å; M308-N312 VanDerWaalsContact O-CG 3.29Å; M308-N312 PolarHBondContact O-N 3.35Å; I309-N312 PolarHBondContact O-N 2.85Å; N312-T314 PolarHBondContact O-N 3.22Å; N312-T314 VanDerWaalsContact O-N 3.1Å; N312-S315 PolarHBondContact O-OG 3.23Å |
| 313 | V | 64 | Low | 81.4 | Confident | 17 Ų | 17 | 87.1 Ų | 87.1 | 10% | 0.103 | 47% | 0.471 | C | S | . | . | G | 310 helix | trans | -70.7 | -6.7 | -169.8 | 166.8 | 0 | 0 | 0 | 0 | 114 | I309 S315 M316 L318 | I309-V313 HydrophobicContact CB-CG2 4.49Å; I309-V313 HydrophobicContact CG2-CG2 3.49Å; I309-V313 VanDerWaalsContact CG2-CG2 3.49Å; I309-V313 VanDerWaalsContact O-CB 3.23Å; I309-V313 WeakPolarHBondContact O-CB 3.47Å; I309-V313 WeakPolarHBondContact O-CG2 3.47Å; I309-V313 PolarHBondContact O-N 3.16Å; V313-S315 PolarHBondContact O-N 3.35Å; V313-M316 HydrophobicContact CG1-CB 4.35Å; V313-M316 PolarHBondContact O-N 3.16Å; V313-L318 HydrophobicContact CG1-CB 3.85Å; V313-L318 HydrophobicContact CG1-CD1 3.21Å; V313-L318 HydrophobicContact CG1-CG 4.07Å |
| 314 | T | 60.3 | Low | 81.4 | Confident | 136 Ų | 136 | 80.9 Ų | 80.9 | 83% | 0.834 | 45% | 0.446 | S | S | * | . | G | 310 helix | trans | -57.5 | -18.6 | 175.5 | 47.9 | 0 | 0 | 0 | 0 | 114.6 | N312 | N312-T314 PolarHBondContact O-N 3.22Å; N312-T314 VanDerWaalsContact O-N 3.1Å |
| 315 | S | 58.3 | Low | 81.7 | Confident | 103 Ų | 103 | 76.7 Ų | 76.7 | 72% | 0.72 | 43% | 0.426 | S | S | * | . | G | 310 helix | trans | -105 | -13.8 | 176.2 | 58.5 | 0 | 0 | 0 | 0 | 114.9 | N312 V313 | N312-S315 PolarHBondContact O-OG 3.23Å; V313-S315 PolarHBondContact O-N 3.35Å |
| 316 | M | 62.1 | Low | 82 | Confident | 87 Ų | 87 | 79.4 Ų | 79.4 | 43% | 0.429 | 44% | 0.435 | S | S | . | . | S | Bend | trans | -82.2 | 162.1 | -178.1 | -73.3 | -77.3 | 173.3 | 0 | 0 | 110.3 | Y44 V313 L318 | Y44-M316 HydrophobicContact CD1-SD 3.53Å; Y44-M316 VanDerWaalsContact CD1-SD 3.53Å; Y44-M316 HydrophobicContact CE1-SD 3.96Å; V313-M316 HydrophobicContact CG1-CB 4.35Å; V313-M316 PolarHBondContact O-N 3.16Å; M316-L318 PolarHBondContact O-N 3.44Å |
| 317 | D | 75.3 | Confident | 82.3 | Confident | 79 Ų | 79 | 77.5 Ų | 77.5 | 42% | 0.422 | 43% | 0.431 | S | S | . | . | trans | -62.8 | 70.9 | 164 | -71.8 | -44.9 | 0 | 0 | 0 | 110.1 | Y44 T319 K320 V321 | Y44-D317 PolarHBondContact OH-OD2 2.95Å; Y44-D317 VanDerWaalsContact OH-OD2 3.06Å; D317-T319 PolarHBondContact O-N 3.35Å; D317-T319 VanDerWaalsContact O-N 3.08Å; D317-K320 HydrophobicContact CB-CB 3.95Å; D317-K320 HydrophobicContact CB-CD 3.64Å; D317-K320 HydrophobicContact CB-CG 3.84Å; D317-K320 WeakPolarHBondContact O-CA 3.3Å; D317-K320 WeakPolarHBondContact O-CB 3.32Å; D317-K320 PolarHBondContact O-N 2.91Å; D317-K320 WeakPolarHBondContact OD2-CD 3.21Å; D317-K320 WeakPolarHBondContact OD2-CE 3.1Å; D317-K320 IonicContact OD2-NZ 2.71Å; D317-K320 PolarHBondContact OD2-NZ 3.19Å; D317-V321 PolarHBondContact O-N 3.41Å; D317-V321 VanDerWaalsContact O-N 3.14Å | ||
| 318 | L | 83.4 | Confident | 82.8 | Confident | 85 Ų | 85 | 75.4 Ų | 75.4 | 45% | 0.445 | 42% | 0.416 | S | S | . | . | H | α-helix | trans | -50.1 | -39.4 | -176.8 | 171.3 | 67.7 | 0 | 0 | 0 | 111 | V313 M316 K320 V321 I322 | V313-L318 HydrophobicContact CG1-CB 3.85Å; V313-L318 HydrophobicContact CG1-CD1 3.21Å; V313-L318 HydrophobicContact CG1-CG 4.07Å; M316-L318 PolarHBondContact O-N 3.44Å; L318-K320 VanDerWaalsContact C-N 3.34Å; L318-K320 PolarHBondContact O-N 3.04Å; L318-V321 PolarHBondContact O-N 3Å; L318-I322 HydrophobicContact CD1-CD1 3.48Å; L318-I322 VanDerWaalsContact CD1-CD1 3.48Å; L318-I322 HydrophobicContact CD1-CG1 3.81Å; L318-I322 HydrophobicContact CD2-CD1 4.46Å; L318-I322 HydrophobicContact CG-CD1 3.84Å; L318-I322 HydrophobicContact CG-CG1 4.36Å; L318-I322 WeakPolarHBondContact O-CB 3.42Å; L318-I322 WeakPolarHBondContact O-CG1 3.19Å; L318-I322 PolarHBondContact O-N 3.5Å |
| 319 | T | 87.8 | Confident | 83.4 | Confident | 125 Ų | 125 | 71.9 Ų | 71.9 | 77% | 0.767 | 40% | 0.4 | S | S | * | . | H | α-helix | trans | -61.5 | -38.7 | 177.2 | -49.6 | 0 | 0 | 0 | 0 | 112.6 | D317 G323 | D317-T319 PolarHBondContact O-N 3.35Å; D317-T319 VanDerWaalsContact O-N 3.08Å; T319-G323 WeakPolarHBondContact O-CA 3.34Å; T319-G323 PolarHBondContact O-N 3.07Å |
| 320 | K | 88 | Confident | 84.1 | Confident | 108 Ų | 108 | 74.9 Ų | 74.9 | 47% | 0.47 | 42% | 0.416 | S | S | . | . | H | α-helix | trans | -70.9 | -45.1 | 177.2 | -65.9 | 179.7 | -170.3 | 162.5 | 0 | 110.8 | Y44 D317 L318 G323 C324 | Y44-K320 WeakPolarHBondContact OH-CD 3.49Å; D317-K320 HydrophobicContact CB-CB 3.95Å; D317-K320 HydrophobicContact CB-CD 3.64Å; D317-K320 HydrophobicContact CB-CG 3.84Å; D317-K320 WeakPolarHBondContact O-CA 3.3Å; D317-K320 WeakPolarHBondContact O-CB 3.32Å; D317-K320 PolarHBondContact O-N 2.91Å; D317-K320 WeakPolarHBondContact OD2-CD 3.21Å; D317-K320 WeakPolarHBondContact OD2-CE 3.1Å; D317-K320 IonicContact OD2-NZ 2.71Å; D317-K320 PolarHBondContact OD2-NZ 3.19Å; L318-K320 VanDerWaalsContact C-N 3.34Å; L318-K320 PolarHBondContact O-N 3.04Å; K320-G323 PolarHBondContact O-N 2.93Å; K320-C324 WeakPolarHBondContact O-CB 3.14Å; K320-C324 PolarHBondContact O-N 3.41Å; K320-C324 PolarHBondContact O-SG 3.29Å |
| 321 | V | 90 | Very high | 84.8 | Confident | 7 Ų | 7 | 68.7 Ų | 68.7 | 4% | 0.042 | 39% | 0.385 | C | S | . | . | H | α-helix | trans | -61.9 | -54.6 | 178.9 | 177.1 | 0 | 0 | 0 | 0 | 110.6 | Y44 I46 D317 L318 G323 C324 F325 | Y44-V321 HydrophobicContact CD2-CG2 4.32Å; I46-V321 HydrophobicContact CD1-CB 4.43Å; I46-V321 HydrophobicContact CD1-CG1 3.6Å; I46-V321 HydrophobicContact CD1-CG2 3.9Å; D317-V321 PolarHBondContact O-N 3.41Å; D317-V321 VanDerWaalsContact O-N 3.14Å; L318-V321 PolarHBondContact O-N 3Å; V321-G323 VanDerWaalsContact C-N 3.29Å; V321-G323 PolarHBondContact O-N 2.85Å; V321-C324 PolarHBondContact O-N 2.64Å; V321-C324 VanDerWaalsContact O-N 3.15Å; V321-F325 HydrophobicContact CG1-CD2 3.97Å; V321-F325 HydrophobicContact CG1-CE2 3.91Å; V321-F325 WeakPolarHBondContact O-CD2 3.49Å; V321-F325 PolarHBondContact O-N 2.98Å |
| 322 | I | 91.7 | Very high | 85.6 | Confident | 83 Ų | 83 | 61.9 Ų | 61.9 | 43% | 0.426 | 36% | 0.355 | S | S | . | . | H | α-helix | trans | -58.3 | -44.1 | 176.5 | -71 | -178.2 | 0 | 0 | 0 | 110.6 | L318 C324 F325 I326 | L318-I322 HydrophobicContact CD1-CD1 3.48Å; L318-I322 VanDerWaalsContact CD1-CD1 3.48Å; L318-I322 HydrophobicContact CD1-CG1 3.81Å; L318-I322 HydrophobicContact CD2-CD1 4.46Å; L318-I322 HydrophobicContact CG-CD1 3.84Å; L318-I322 HydrophobicContact CG-CG1 4.36Å; L318-I322 WeakPolarHBondContact O-CB 3.42Å; L318-I322 WeakPolarHBondContact O-CG1 3.19Å; L318-I322 PolarHBondContact O-N 3.5Å; I322-C324 VanDerWaalsContact C-N 3.28Å; I322-C324 PolarHBondContact O-N 3.5Å; I322-F325 PolarHBondContact O-N 3.06Å; I322-I326 HydrophobicContact CG2-CD1 3.6Å; I322-I326 HydrophobicContact CG2-CG1 4.21Å; I322-I326 WeakPolarHBondContact O-CG1 3.44Å; I322-I326 PolarHBondContact O-N 3.19Å |
| 323 | G | 93.6 | Very high | 86.9 | Confident | 38 Ų | 38 | 58.6 Ų | 58.6 | 39% | 0.392 | 34% | 0.336 | S | S | . | . | H | α-helix | trans | -56.8 | -41.3 | 177.5 | 0 | 0 | 0 | 0 | 0 | 112.5 | T319 K320 V321 G327 | T319-G323 WeakPolarHBondContact O-CA 3.34Å; T319-G323 PolarHBondContact O-N 3.07Å; K320-G323 PolarHBondContact O-N 2.93Å; V321-G323 VanDerWaalsContact C-N 3.29Å; V321-G323 PolarHBondContact O-N 2.85Å; G323-G327 PolarHBondContact O-N 2.81Å |
| 324 | C | 93.8 | Very high | 88.5 | Confident | 18 Ų | 18 | 61.2 Ų | 61.2 | 12% | 0.122 | 35% | 0.349 | C | S | . | . | H | α-helix | trans | -69.9 | -39.4 | 176.3 | -65.7 | 0 | 0 | 0 | 0 | 112.4 | C37 L41 K320 V321 I322 G327 Y328 | C37-C324 HydrophobicContact CB-CB 4.14Å; L41-C324 HydrophobicContact CD1-CB 3.17Å; K320-C324 WeakPolarHBondContact O-CB 3.14Å; K320-C324 PolarHBondContact O-N 3.41Å; K320-C324 PolarHBondContact O-SG 3.29Å; V321-C324 PolarHBondContact O-N 2.64Å; V321-C324 VanDerWaalsContact O-N 3.15Å; I322-C324 VanDerWaalsContact C-N 3.28Å; I322-C324 PolarHBondContact O-N 3.5Å; C324-G327 PolarHBondContact O-N 3.39Å; C324-Y328 WeakPolarHBondContact O-CB 3.41Å; C324-Y328 PolarHBondContact O-N 3.29Å |
| 325 | F | 95.1 | Very high | 90.3 | Very high | 52 Ų | 52 | 55.2 Ų | 55.2 | 23% | 0.228 | 31% | 0.312 | C | S | . | . | H | α-helix | trans | -61.2 | -45.5 | 173.6 | -89.2 | -85.8 | 0 | 0 | 0 | 112 | L41 I46 L48 I52 V321 I322 A329 | L41-F325 HydrophobicContact CD2-CD2 4.1Å; L41-F325 HydrophobicContact CD2-CE1 4.41Å; L41-F325 HydrophobicContact CD2-CE2 3.5Å; L41-F325 VanDerWaalsContact CD2-CE2 3.5Å; L41-F325 HydrophobicContact CD2-CZ 3.66Å; L41-F325 HydrophobicContact CG-CE2 4.37Å; I46-F325 HydrophobicContact CG2-CE2 4.29Å; I46-F325 HydrophobicContact CG2-CZ 4.26Å; L48-F325 HydrophobicContact CB-CZ 4.4Å; L48-F325 HydrophobicContact CD1-CZ 3.96Å; I52-F325 HydrophobicContact CB-CD1 4.2Å; I52-F325 HydrophobicContact CB-CE1 3.83Å; I52-F325 HydrophobicContact CD1-CD1 4.36Å; I52-F325 HydrophobicContact CD1-CE1 4.33Å; I52-F325 HydrophobicContact CG1-CD1 3.69Å; I52-F325 HydrophobicContact CG1-CE1 3.76Å; V321-F325 HydrophobicContact CG1-CD2 3.97Å; V321-F325 HydrophobicContact CG1-CE2 3.91Å; V321-F325 WeakPolarHBondContact O-CD2 3.49Å; V321-F325 PolarHBondContact O-N 2.98Å; I322-F325 PolarHBondContact O-N 3.06Å; F325-A329 WeakPolarHBondContact O-CB 3.3Å; F325-A329 PolarHBondContact O-N 3.31Å |
| 326 | I | 96.3 | Very high | 92.2 | Very high | 110 Ų | 110 | 51.1 Ų | 51.1 | 56% | 0.564 | 28% | 0.281 | S | S | * | . | H | α-helix | trans | -66.5 | -47.1 | 178 | -65.9 | 172.7 | 0 | 0 | 0 | 110.4 | I322 Y328 A329 L330 | I322-I326 HydrophobicContact CG2-CD1 3.6Å; I322-I326 HydrophobicContact CG2-CG1 4.21Å; I322-I326 WeakPolarHBondContact O-CG1 3.44Å; I322-I326 PolarHBondContact O-N 3.19Å; I326-Y328 VanDerWaalsContact C-N 3.33Å; I326-Y328 PolarHBondContact O-N 2.85Å; I326-A329 PolarHBondContact O-N 3.09Å; I326-L330 WeakPolarHBondContact O-CB 3.44Å; I326-L330 PolarHBondContact O-N 3.35Å |
| 327 | G | 96.3 | Very high | 93.9 | Very high | 23 Ų | 23 | 47.4 Ų | 47.4 | 24% | 0.237 | 26% | 0.263 | C | S | . | . | H | α-helix | trans | -60.3 | -42.5 | 179.1 | 0 | 0 | 0 | 0 | 0 | 112.3 | G323 C324 S331 | G323-G327 PolarHBondContact O-N 2.81Å; C324-G327 PolarHBondContact O-N 3.39Å; G327-S331 VanDerWaalsContact O-CB 3.25Å; G327-S331 WeakPolarHBondContact O-CB 3.34Å; G327-S331 PolarHBondContact O-N 3.04Å; G327-S331 PolarHBondContact O-OG 3Å |
| 328 | Y | 97.6 | Very high | 94.9 | Very high | 3 Ų | 3 | 46 Ų | 46 | 1% | 0.012 | 26% | 0.255 | C | S | . | . | H | α-helix | trans | -62.4 | -52.8 | 174 | -174.9 | -84.2 | 0 | 0 | 0 | 111.5 | T34 C37 N38 I52 N53 V154 C324 I326 L330 S331 M332 | T34-Y328 HydrophobicContact CG2-CD2 4.05Å; T34-Y328 HydrophobicContact CG2-CE2 4.08Å; C37-Y328 HydrophobicContact CB-CD2 4.18Å; N38-Y328 WeakPolarHBondContact ND2-CE2 3.31Å; I52-Y328 HydrophobicContact CB-CD1 4.4Å; I52-Y328 HydrophobicContact CB-CE1 4.39Å; I52-Y328 HydrophobicContact CD1-CD1 3.8Å; I52-Y328 HydrophobicContact CD1-CD2 3.84Å; I52-Y328 HydrophobicContact CD1-CE1 4.24Å; I52-Y328 HydrophobicContact CD1-CE2 4.32Å; I52-Y328 HydrophobicContact CD1-CG 3.56Å; I52-Y328 HydrophobicContact CG1-CD1 3.49Å; I52-Y328 VanDerWaalsContact CG1-CD1 3.49Å; I52-Y328 HydrophobicContact CG1-CD2 4.46Å; I52-Y328 HydrophobicContact CG1-CE1 3.92Å; I52-Y328 HydrophobicContact CG1-CG 3.78Å; I52-Y328 HydrophobicContact CG2-CD1 4.38Å; I52-Y328 HydrophobicContact CG2-CE1 3.91Å; I52-Y328 WeakPolarHBondContact O-CD1 3.42Å; N53-Y328 VanDerWaalsContact OD1-CE1 3.31Å; N53-Y328 WeakPolarHBondContact OD1-CE1 3.38Å; N53-Y328 PolarHBondContact OD1-OH 3.49Å; V154-Y328 WeakPolarHBondContact CG2-OH 3.37Å; C324-Y328 WeakPolarHBondContact O-CB 3.41Å; C324-Y328 PolarHBondContact O-N 3.29Å; I326-Y328 VanDerWaalsContact C-N 3.33Å; I326-Y328 PolarHBondContact O-N 2.85Å; Y328-L330 VanDerWaalsContact C-N 3.33Å; Y328-L330 PolarHBondContact O-N 3.15Å; Y328-S331 PolarHBondContact O-N 3.1Å; Y328-M332 HydrophobicContact CD1-CG 3.9Å; Y328-M332 HydrophobicContact CE1-CB 4.46Å; Y328-M332 HydrophobicContact CE1-CG 3.52Å; Y328-M332 HydrophobicContact CE2-CG 4.28Å; Y328-M332 HydrophobicContact CG-CG 4.46Å; Y328-M332 WeakPolarHBondContact O-CB 3.49Å; Y328-M332 WeakPolarHBondContact O-CG 3.5Å; Y328-M332 PolarHBondContact O-N 3.49Å |
| 329 | A | 98.1 | Very high | 95.6 | Very high | 13 Ų | 13 | 42.2 Ų | 42.2 | 11% | 0.107 | 24% | 0.236 | C | C | . | . | H | α-helix | trans | -59.3 | -42.7 | -178.3 | 0 | 0 | 0 | 0 | 0 | 112.3 | P55 F325 I326 F333 | P55-A329 HydrophobicContact CB-CB 3.91Å; P55-A329 HydrophobicContact CG-CB 4.47Å; F325-A329 WeakPolarHBondContact O-CB 3.3Å; F325-A329 PolarHBondContact O-N 3.31Å; I326-A329 PolarHBondContact O-N 3.09Å; A329-F333 VanDerWaalsContact O-CB 3.26Å; A329-F333 WeakPolarHBondContact O-CB 3.48Å; A329-F333 PolarHBondContact O-N 2.96Å |
| 330 | L | 97.9 | Very high | 96 | Very high | 100 Ų | 100 | 36.3 Ų | 36.3 | 52% | 0.524 | 20% | 0.199 | S | C | . | . | H | α-helix | trans | -66.8 | -45.2 | 177.3 | -176.2 | 65.6 | 0 | 0 | 0 | 111.7 | I326 Y328 F333 L334 | I326-L330 WeakPolarHBondContact O-CB 3.44Å; I326-L330 PolarHBondContact O-N 3.35Å; Y328-L330 VanDerWaalsContact C-N 3.33Å; Y328-L330 PolarHBondContact O-N 3.15Å; L330-F333 PolarHBondContact O-N 2.77Å; L330-L334 HydrophobicContact CG-CD1 4.33Å; L330-L334 WeakPolarHBondContact O-CG 3.48Å; L330-L334 PolarHBondContact O-N 3.15Å |
| 331 | S | 98 | Very high | 96.3 | Very high | 8 Ų | 8 | 34.1 Ų | 34.1 | 6% | 0.056 | 19% | 0.192 | C | C | . | . | H | α-helix | trans | -64 | -44.8 | -179.9 | -57.2 | 0 | 0 | 0 | 0 | 111.3 | G327 Y328 L334 L335 | G327-S331 VanDerWaalsContact O-CB 3.25Å; G327-S331 WeakPolarHBondContact O-CB 3.34Å; G327-S331 PolarHBondContact O-N 3.04Å; G327-S331 PolarHBondContact O-OG 3Å; Y328-S331 PolarHBondContact O-N 3.1Å; S331-L334 PolarHBondContact O-N 3.35Å; S331-L335 VanDerWaalsContact O-CB 3.23Å; S331-L335 WeakPolarHBondContact O-CB 3.49Å; S331-L335 PolarHBondContact O-N 3.23Å |
| 332 | M | 98 | Very high | 96.5 | Very high | 6 Ų | 6 | 34.2 Ų | 34.2 | 3% | 0.03 | 19% | 0.193 | C | C | . | . | H | α-helix | trans | -65.1 | -41.5 | 176 | -75.6 | -66.1 | -81.8 | 0 | 0 | 112.2 | T34 H56 N150 Y328 L334 L335 Y336 | T34-M332 HydrophobicContact CG2-CG 3.67Å; T34-M332 HydrophobicContact CG2-SD 3.8Å; H56-M332 HydrophobicContact CB-CB 3.76Å; N150-M332 WeakPolarHBondContact OD1-CE 3.46Å; Y328-M332 HydrophobicContact CD1-CG 3.9Å; Y328-M332 HydrophobicContact CE1-CB 4.46Å; Y328-M332 HydrophobicContact CE1-CG 3.52Å; Y328-M332 HydrophobicContact CE2-CG 4.28Å; Y328-M332 HydrophobicContact CG-CG 4.46Å; Y328-M332 WeakPolarHBondContact O-CB 3.49Å; Y328-M332 WeakPolarHBondContact O-CG 3.5Å; Y328-M332 PolarHBondContact O-N 3.49Å; M332-L334 PolarHBondContact O-N 2.65Å; M332-L335 PolarHBondContact O-N 3.2Å; M332-Y336 HydrophobicContact CE-CD2 4.11Å; M332-Y336 HydrophobicContact CE-CE2 3.36Å; M332-Y336 WeakPolarHBondContact O-CB 3.3Å; M332-Y336 VanDerWaalsContact O-CD2 3.25Å; M332-Y336 WeakPolarHBondContact O-CD2 3.13Å; M332-Y336 PolarHBondContact O-N 3.4Å; M332-Y336 HydrophobicContact SD-CD2 4.47Å; M332-Y336 HydrophobicContact SD-CE2 4.09Å |
| 333 | F | 98.5 | Very high | 96.5 | Very high | 30 Ų | 30 | 30.3 Ų | 30.3 | 13% | 0.132 | 17% | 0.173 | C | C | . | . | H | α-helix | trans | -60.3 | -46.4 | 175.9 | 172.5 | -107.6 | 0 | 0 | 0 | 111.8 | H56 L59 L60 F63 Y64 A329 L330 S337 | H56-F333 HydrophobicContact CB-CB 4.11Å; L59-F333 HydrophobicContact CB-CD2 3.48Å; L59-F333 VanDerWaalsContact CB-CD2 3.48Å; L59-F333 HydrophobicContact CB-CE2 3.76Å; L59-F333 HydrophobicContact CB-CG 4.18Å; L59-F333 HydrophobicContact CD1-CB 4.3Å; L59-F333 HydrophobicContact CD1-CD2 4.41Å; L59-F333 HydrophobicContact CD1-CG 4.28Å; L60-F333 HydrophobicContact CD2-CD2 4.09Å; L60-F333 HydrophobicContact CD2-CE2 4.11Å; L60-F333 HydrophobicContact CG-CD2 4.34Å; F63-F333 HydrophobicContact CB-CE2 4.39Å; F63-F333 HydrophobicContact CB-CZ 4.23Å; F63-F333 HydrophobicContact CD2-CE2 4.21Å; F63-F333 AromaticContact CD2-CZ 3.95Å; F63-F333 HydrophobicContact CD2-CZ 3.95Å; F63-F333 HydrophobicContact CG-CE2 4.49Å; F63-F333 HydrophobicContact CG-CZ 4.04Å; Y64-F333 HydrophobicContact CE2-CE2 4.47Å; A329-F333 VanDerWaalsContact O-CB 3.26Å; A329-F333 WeakPolarHBondContact O-CB 3.48Å; A329-F333 PolarHBondContact O-N 2.96Å; L330-F333 PolarHBondContact O-N 2.77Å; F333-S337 VanDerWaalsContact O-CB 3.26Å; F333-S337 WeakPolarHBondContact O-CB 3.5Å; F333-S337 PolarHBondContact O-N 3.44Å; F333-S337 PolarHBondContact O-OG 3.48Å |
| 334 | L | 98.3 | Very high | 96.3 | Very high | 71 Ų | 71 | 32.9 Ų | 32.9 | 37% | 0.372 | 18% | 0.176 | S | C | . | . | H | α-helix | trans | -63.7 | -44.2 | 176.1 | -73 | 173.8 | 0 | 0 | 0 | 111.5 | L30 L330 S331 M332 Y336 S337 L338 | L30-L334 HydrophobicContact CD1-CB 3.85Å; L30-L334 HydrophobicContact CD2-CB 3.99Å; L30-L334 HydrophobicContact CD2-CD1 4.07Å; L330-L334 HydrophobicContact CG-CD1 4.33Å; L330-L334 WeakPolarHBondContact O-CG 3.48Å; L330-L334 PolarHBondContact O-N 3.15Å; S331-L334 PolarHBondContact O-N 3.35Å; M332-L334 PolarHBondContact O-N 2.65Å; L334-Y336 PolarHBondContact O-N 2.72Å; L334-S337 PolarHBondContact O-N 3.02Å; L334-L338 VanDerWaalsContact O-CB 3.3Å; L334-L338 WeakPolarHBondContact O-CB 3.47Å; L334-L338 WeakPolarHBondContact O-CG 3.26Å; L334-L338 PolarHBondContact O-N 3.47Å |
| 335 | L | 98 | Very high | 95.9 | Very high | 10 Ų | 10 | 39 Ų | 39 | 5% | 0.052 | 20% | 0.196 | C | C | . | . | H | α-helix | trans | -58.8 | -50.9 | 178.9 | 179.9 | 142.7 | 0 | 0 | 0 | 111 | L27 L30 I31 S331 M332 S337 L338 M339 | L27-L335 HydrophobicContact CD2-CG 4.45Å; L30-L335 HydrophobicContact CB-CB 4.16Å; L30-L335 HydrophobicContact CB-CD1 4.23Å; L30-L335 HydrophobicContact CD1-CB 4.31Å; I31-L335 HydrophobicContact CB-CD1 4.29Å; I31-L335 HydrophobicContact CD1-CD1 3.85Å; I31-L335 HydrophobicContact CG1-CD1 3.08Å; S331-L335 VanDerWaalsContact O-CB 3.23Å; S331-L335 WeakPolarHBondContact O-CB 3.49Å; S331-L335 PolarHBondContact O-N 3.23Å; M332-L335 PolarHBondContact O-N 3.2Å; L335-S337 VanDerWaalsContact C-N 3.32Å; L335-S337 PolarHBondContact O-N 2.95Å; L335-L338 PolarHBondContact O-N 3.02Å; L335-M339 HydrophobicContact CD2-CE 4.13Å; L335-M339 HydrophobicContact CG-CE 4.5Å; L335-M339 WeakPolarHBondContact O-CB 3.41Å; L335-M339 PolarHBondContact O-N 3.38Å |
| 336 | Y | 98 | Very high | 95.7 | Very high | 18 Ų | 18 | 37.2 Ų | 37.2 | 7% | 0.071 | 19% | 0.191 | C | C | . | . | H | α-helix | trans | -67 | -34.2 | -178.8 | -86.5 | -114.5 | 0 | 0 | 0 | 112.3 | Y57 L60 D146 N150 L283 M332 L334 P340 | Y57-Y336 HydrophobicContact CE1-CD1 4.4Å; Y57-Y336 AromaticContact CE1-CE1 3.83Å; Y57-Y336 HydrophobicContact CE1-CE1 3.83Å; L60-Y336 HydrophobicContact CD1-CD1 3.71Å; L60-Y336 HydrophobicContact CD1-CG 4.02Å; D146-Y336 VanDerWaalsContact CG-OH 3.28Å; D146-Y336 PolarHBondContact OD1-OH 3.44Å; D146-Y336 WeakPolarHBondContact OD2-CE1 3.47Å; D146-Y336 PolarHBondContact OD2-OH 2.84Å; N150-Y336 PolarHBondContact ND2-OH 3.04Å; L283-Y336 WeakPolarHBondContact CD2-O 3.47Å; M332-Y336 HydrophobicContact CE-CD2 4.11Å; M332-Y336 HydrophobicContact CE-CE2 3.36Å; M332-Y336 WeakPolarHBondContact O-CB 3.3Å; M332-Y336 VanDerWaalsContact O-CD2 3.25Å; M332-Y336 WeakPolarHBondContact O-CD2 3.13Å; M332-Y336 PolarHBondContact O-N 3.4Å; M332-Y336 HydrophobicContact SD-CD2 4.47Å; M332-Y336 HydrophobicContact SD-CE2 4.09Å; L334-Y336 PolarHBondContact O-N 2.72Å; Y336-P340 WeakPolarHBondContact O-CD 3.39Å |
| 337 | S | 98 | Very high | 95.4 | Very high | 8 Ų | 8 | 32.3 Ų | 32.3 | 6% | 0.056 | 17% | 0.166 | C | C | . | . | H | α-helix | trans | -68.9 | -37.5 | 175.7 | -60.7 | 0 | 0 | 0 | 0 | 112.2 | Y64 F333 L334 L335 | Y64-S337 WeakPolarHBondContact OH-CB 3.26Å; F333-S337 VanDerWaalsContact O-CB 3.26Å; F333-S337 WeakPolarHBondContact O-CB 3.5Å; F333-S337 PolarHBondContact O-N 3.44Å; F333-S337 PolarHBondContact O-OG 3.48Å; L334-S337 PolarHBondContact O-N 3.02Å; L335-S337 VanDerWaalsContact C-N 3.32Å; L335-S337 PolarHBondContact O-N 2.95Å |
| 338 | L | 97.4 | Very high | 95.3 | Very high | 50 Ų | 50 | 31.2 Ų | 31.2 | 26% | 0.262 | 15% | 0.154 | S | C | . | . | H | α-helix | trans | -84.5 | -30 | -178.5 | -67.7 | 173 | 0 | 0 | 0 | 113 | L26 L27 L30 L334 L335 L341 V342 | L26-L338 HydrophobicContact CD2-CD1 3.7Å; L26-L338 HydrophobicContact CG-CD1 4.15Å; L27-L338 HydrophobicContact CD2-CB 3.65Å; L30-L338 HydrophobicContact CD1-CD1 3.94Å; L334-L338 VanDerWaalsContact O-CB 3.3Å; L334-L338 WeakPolarHBondContact O-CB 3.47Å; L334-L338 WeakPolarHBondContact O-CG 3.26Å; L334-L338 PolarHBondContact O-N 3.47Å; L335-L338 PolarHBondContact O-N 3.02Å; L338-L341 HydrophobicContact CD2-CD1 4.16Å; L338-L341 WeakPolarHBondContact O-CA 3.44Å; L338-L341 VanDerWaalsContact O-CB 3.32Å; L338-L341 WeakPolarHBondContact O-CB 3.38Å; L338-L341 PolarHBondContact O-N 3.35Å; L338-V342 WeakPolarHBondContact O-CG2 3.29Å; L338-V342 PolarHBondContact O-N 3.03Å; L338-V342 VanDerWaalsContact O-N 3.07Å |
| 339 | M | 97.2 | Very high | 95.2 | Very high | 6 Ų | 6 | 31.1 Ų | 31.1 | 3% | 0.03 | 15% | 0.154 | C | C | . | . | H | α-helix | trans | -52.8 | -50.8 | -175.7 | -178.5 | 66.6 | 76.2 | 0 | 0 | 113.3 | L27 L335 L341 V342 L343 V351 L355 | L27-M339 HydrophobicContact CD1-CE 4.09Å; L27-M339 HydrophobicContact CD1-SD 3.87Å; L335-M339 HydrophobicContact CD2-CE 4.13Å; L335-M339 HydrophobicContact CG-CE 4.5Å; L335-M339 WeakPolarHBondContact O-CB 3.41Å; L335-M339 PolarHBondContact O-N 3.38Å; M339-L341 VanDerWaalsContact C-N 3.28Å; M339-L341 PolarHBondContact O-N 2.86Å; M339-V342 PolarHBondContact O-N 3.45Å; M339-L343 HydrophobicContact CG-CD1 3.87Å; M339-L343 HydrophobicContact CG-CG 4.39Å; M339-L343 WeakPolarHBondContact O-CB 3.47Å; M339-L343 WeakPolarHBondContact O-CG 3.49Å; M339-L343 PolarHBondContact O-N 2.87Å; M339-L343 HydrophobicContact SD-CD1 4.15Å; M339-L343 HydrophobicContact SD-CG 4.19Å; M339-V351 HydrophobicContact CE-CG1 4.17Å; M339-V351 HydrophobicContact SD-CG1 3.65Å; M339-L355 HydrophobicContact CE-CD1 4.29Å |
| 340 | P | 96.1 | Very high | 95 | Very high | 0 Ų | 0 | 30.8 Ų | 30.8 | 0% | 0 | 15% | 0.151 | C | C | . | . | H | α-helix | trans | -59.1 | -36.5 | 175 | -19.7 | 27.8 | 0 | 0 | 0 | 113.7 | Q270 V274 I279 F282 L283 Y336 V342 L343 M344 | Q270-P340 VanDerWaalsContact NE2-CD 3.34Å; V274-P340 HydrophobicContact CG1-CB 4.09Å; V274-P340 HydrophobicContact CG2-CB 3.97Å; I279-P340 HydrophobicContact CB-CB 4.42Å; I279-P340 HydrophobicContact CD1-CB 4.41Å; I279-P340 HydrophobicContact CG1-CB 4.01Å; I279-P340 HydrophobicContact CG2-CB 3.83Å; I279-P340 HydrophobicContact CG2-CG 4.21Å; F282-P340 HydrophobicContact CD1-CG 4.36Å; F282-P340 HydrophobicContact CE1-CG 4.44Å; L283-P340 HydrophobicContact CD1-CG 4.23Å; L283-P340 HydrophobicContact CD2-CG 3.74Å; L283-P340 HydrophobicContact CG-CG 4.03Å; Y336-P340 WeakPolarHBondContact O-CD 3.39Å; P340-V342 VanDerWaalsContact C-N 3.3Å; P340-V342 PolarHBondContact O-N 3.45Å; P340-L343 PolarHBondContact O-N 2.85Å; P340-M344 WeakPolarHBondContact O-CG 3.33Å; P340-M344 PolarHBondContact O-N 2.83Å |
| 341 | L | 93.5 | Very high | 94.8 | Very high | 62 Ų | 62 | 26 Ų | 26 | 33% | 0.325 | 13% | 0.126 | S | C | . | . | H | α-helix | trans | -67.8 | -33.8 | -178.6 | -67.8 | 166.9 | 0 | 0 | 0 | 111.8 | I279 L338 M339 R345 | I279-L341 HydrophobicContact CD1-CD2 3.33Å; I279-L341 HydrophobicContact CD1-CG 3.99Å; L338-L341 HydrophobicContact CD2-CD1 4.16Å; L338-L341 WeakPolarHBondContact O-CA 3.44Å; L338-L341 VanDerWaalsContact O-CB 3.32Å; L338-L341 WeakPolarHBondContact O-CB 3.38Å; L338-L341 PolarHBondContact O-N 3.35Å; M339-L341 VanDerWaalsContact C-N 3.28Å; M339-L341 PolarHBondContact O-N 2.86Å; L341-R345 PolarHBondContact O-NH1 3.46Å; L341-R345 VanDerWaalsContact O-NH1 3.09Å |
| 342 | V | 94.2 | Very high | 94.7 | Very high | 9 Ų | 9 | 26 Ų | 26 | 6% | 0.055 | 13% | 0.125 | C | C | . | . | H | α-helix | trans | -75.1 | -49.3 | 174.4 | -175.7 | 0 | 0 | 0 | 0 | 109.8 | S23 L27 L338 M339 P340 M344 R345 S346 V351 | S23-V342 WeakPolarHBondContact OG-CG1 3.29Å; L27-V342 HydrophobicContact CD1-CB 3.82Å; L27-V342 HydrophobicContact CD1-CG1 4.06Å; L27-V342 HydrophobicContact CD1-CG2 3.62Å; L27-V342 HydrophobicContact CG-CG2 4.07Å; L338-V342 WeakPolarHBondContact O-CG2 3.29Å; L338-V342 PolarHBondContact O-N 3.03Å; L338-V342 VanDerWaalsContact O-N 3.07Å; M339-V342 PolarHBondContact O-N 3.45Å; P340-V342 VanDerWaalsContact C-N 3.3Å; P340-V342 PolarHBondContact O-N 3.45Å; V342-M344 PolarHBondContact O-N 3.2Å; V342-M344 VanDerWaalsContact O-N 3.14Å; V342-R345 CarbonylContact O-C 3.42Å; V342-R345 WeakPolarHBondContact O-CA 3.24Å; V342-R345 PolarHBondContact O-N 2.95Å; V342-S346 PolarHBondContact O-N 2.88Å; V342-S346 PolarHBondContact O-OG 3.32Å; V342-V351 HydrophobicContact CB-CG2 4.38Å; V342-V351 HydrophobicContact CG1-CG2 3.58Å |
| 343 | L | 92.8 | Very high | 94.6 | Very high | 1 Ų | 1 | 25.8 Ų | 25.8 | 1% | 0.005 | 12% | 0.124 | C | C | . | . | H | α-helix | trans | -59.8 | -25 | 178.4 | -70.9 | 173.7 | 0 | 0 | 0 | 114.4 | Q270 Q271 M339 P340 A348 V351 | Q270-L343 HydrophobicContact CB-CD1 4.24Å; Q270-L343 HydrophobicContact CG-CD1 3.68Å; Q271-L343 HydrophobicContact CB-CB 4.37Å; Q271-L343 HydrophobicContact CB-CD1 4.44Å; Q271-L343 HydrophobicContact CB-CD2 4.39Å; Q271-L343 HydrophobicContact CG-CB 4.29Å; Q271-L343 PolarHBondContact NE2-O 3.42Å; M339-L343 HydrophobicContact CG-CD1 3.87Å; M339-L343 HydrophobicContact CG-CG 4.39Å; M339-L343 WeakPolarHBondContact O-CB 3.47Å; M339-L343 WeakPolarHBondContact O-CG 3.49Å; M339-L343 PolarHBondContact O-N 2.87Å; M339-L343 HydrophobicContact SD-CD1 4.15Å; M339-L343 HydrophobicContact SD-CG 4.19Å; P340-L343 PolarHBondContact O-N 2.85Å; L343-A348 VanDerWaalsContact CD2-CA 3.47Å; L343-A348 HydrophobicContact CD2-CB 3.92Å; L343-V351 HydrophobicContact CD2-CB 4.16Å; L343-V351 HydrophobicContact CD2-CG2 3.77Å; L343-V351 HydrophobicContact CG-CG2 4.4Å |
| 344 | M | 89.1 | Confident | 94.5 | Very high | 93 Ų | 93 | 24.4 Ų | 24.4 | 46% | 0.458 | 12% | 0.118 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -74.4 | -25.7 | 171.8 | -80.6 | -168.8 | 66.4 | 0 | 0 | 113.6 | V274 L275 I279 P340 V342 | V274-M344 HydrophobicContact CG1-CG 3.55Å; V274-M344 HydrophobicContact CG1-SD 3.74Å; L275-M344 HydrophobicContact CD2-CG 4.27Å; I279-M344 HydrophobicContact CD1-CG 4.49Å; I279-M344 HydrophobicContact CD1-SD 3.42Å; I279-M344 WeakPolarHBondContact CD1-SD 3.42Å; I279-M344 HydrophobicContact CG1-SD 3.45Å; I279-M344 WeakPolarHBondContact CG1-SD 2.97Å; P340-M344 WeakPolarHBondContact O-CG 3.33Å; P340-M344 PolarHBondContact O-N 2.83Å; V342-M344 PolarHBondContact O-N 3.2Å; V342-M344 VanDerWaalsContact O-N 3.14Å |
| 345 | R | 86.5 | Confident | 94.3 | Very high | 146 Ų | 146 | 22.1 Ų | 22.1 | 55% | 0.551 | 11% | 0.106 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -99.5 | -19.2 | -178.1 | -67 | -173.6 | 175.7 | 89.9 | -4.7 | 112.9 | L341 V342 | L341-R345 PolarHBondContact O-NH1 3.46Å; L341-R345 VanDerWaalsContact O-NH1 3.09Å; V342-R345 CarbonylContact O-C 3.42Å; V342-R345 WeakPolarHBondContact O-CA 3.24Å; V342-R345 PolarHBondContact O-N 2.95Å |
| 346 | S | 89.5 | Confident | 94.1 | Very high | 15 Ų | 15 | 22.1 Ų | 22.1 | 11% | 0.105 | 11% | 0.106 | C | C | . | . | S | Bend | trans | -131.6 | -169.2 | -179.3 | 66.9 | 0 | 0 | 0 | 0 | 111.8 | Q271 V342 V351 | Q271-S346 PolarHBondContact NE2-O 2.84Å; Q271-S346 VanDerWaalsContact NE2-O 3.09Å; V342-S346 PolarHBondContact O-N 2.88Å; V342-S346 PolarHBondContact O-OG 3.32Å; S346-V351 WeakPolarHBondContact OG-CG2 3.39Å |
| 347 | S | 91 | Very high | 94 | Very high | 6 Ų | 6 | 21.2 Ų | 21.2 | 4% | 0.042 | 10% | 0.103 | C | C | . | . | trans | -99.9 | 156.3 | 170.6 | 59.2 | 0 | 0 | 0 | 0 | 111.9 | V349 L350 V351 | S347-V349 PolarHBondContact O-N 3.46Å; S347-L350 PolarHBondContact O-N 3.32Å; S347-L350 WeakPolarHBondContact OG-CB 3.39Å; S347-L350 PolarHBondContact OG-N 3.38Å; S347-L350 VanDerWaalsContact OG-N 3.08Å; S347-V351 WeakPolarHBondContact O-CG2 3.37Å; S347-V351 PolarHBondContact O-N 3.28Å | ||
| 348 | A | 93.6 | Very high | 93.8 | Very high | 0 Ų | 0 | 21.2 Ų | 21.2 | 0% | 0 | 10% | 0.103 | C | C | . | . | H | α-helix | trans | -56.6 | -35.8 | 169.8 | 0 | 0 | 0 | 0 | 0 | 112.3 | V176 N267 V268 L343 V351 N352 | V176-A348 HydrophobicContact CG1-CB 3.83Å; N267-A348 HydrophobicContact CB-CB 4.41Å; V268-A348 HydrophobicContact CG2-CB 3.95Å; L343-A348 VanDerWaalsContact CD2-CA 3.47Å; L343-A348 HydrophobicContact CD2-CB 3.92Å; A348-V351 PolarHBondContact O-N 3.42Å; A348-N352 PolarHBondContact O-N 3.29Å |
| 349 | V | 94.7 | Very high | 93.6 | Very high | 2 Ų | 2 | 19.8 Ų | 19.8 | 1% | 0.012 | 10% | 0.095 | C | C | . | . | H | α-helix | trans | -63.1 | -50 | 174.9 | -176.1 | 0 | 0 | 0 | 0 | 111 | V176 V177 Y188 I196 S347 V351 N352 L353 F392 | V176-V349 HydrophobicContact CG1-CB 4.3Å; V176-V349 HydrophobicContact CG1-CG2 3.75Å; V177-V349 HydrophobicContact CG2-CG1 4Å; V177-V349 HydrophobicContact CG2-CG2 4.21Å; Y188-V349 HydrophobicContact CE1-CG2 4.13Å; Y188-V349 WeakPolarHBondContact OH-CG2 3.21Å; I196-V349 HydrophobicContact CD1-CG1 4.39Å; S347-V349 PolarHBondContact O-N 3.46Å; V349-V351 VanDerWaalsContact C-N 3.28Å; V349-V351 PolarHBondContact O-N 3.01Å; V349-N352 PolarHBondContact O-N 3.46Å; V349-L353 HydrophobicContact CG1-CD1 4.02Å; V349-L353 HydrophobicContact CG1-CG 4.32Å; V349-L353 VanDerWaalsContact O-CG 3.29Å; V349-L353 WeakPolarHBondContact O-CG 3.41Å; V349-L353 PolarHBondContact O-N 3.44Å; V349-F392 HydrophobicContact CB-CE1 4.41Å; V349-F392 HydrophobicContact CB-CE2 4.23Å; V349-F392 HydrophobicContact CB-CZ 3.7Å; V349-F392 HydrophobicContact CG1-CD2 4.4Å; V349-F392 HydrophobicContact CG1-CE1 4.4Å; V349-F392 HydrophobicContact CG1-CE2 3.47Å; V349-F392 VanDerWaalsContact CG1-CE2 3.47Å; V349-F392 HydrophobicContact CG1-CZ 3.47Å; V349-F392 VanDerWaalsContact CG1-CZ 3.47Å |
| 350 | L | 94 | Very high | 93.3 | Very high | 5 Ų | 5 | 19.5 Ų | 19.5 | 3% | 0.026 | 9% | 0.094 | C | C | . | . | H | α-helix | trans | -61.4 | -40.3 | 179.9 | -177.6 | 68.4 | 0 | 0 | 0 | 111.1 | P20 S347 L353 S354 V389 F392 N393 | P20-L350 HydrophobicContact CB-CD2 3.9Å; S347-L350 PolarHBondContact O-N 3.32Å; S347-L350 WeakPolarHBondContact OG-CB 3.39Å; S347-L350 PolarHBondContact OG-N 3.38Å; S347-L350 VanDerWaalsContact OG-N 3.08Å; L350-L353 PolarHBondContact O-N 2.91Å; L350-S354 WeakPolarHBondContact O-CB 3.37Å; L350-S354 PolarHBondContact O-N 3.37Å; L350-S354 PolarHBondContact O-OG 2.95Å; L350-V389 HydrophobicContact CD1-CG1 3.71Å; L350-F392 HydrophobicContact CB-CD1 3.99Å; L350-F392 HydrophobicContact CB-CE1 3.97Å; L350-F392 HydrophobicContact CD1-CB 4.24Å; L350-F392 HydrophobicContact CD1-CD1 3.71Å; L350-F392 HydrophobicContact CD1-CG 4.3Å; L350-F392 HydrophobicContact CG-CD1 4.4Å; L350-N393 HydrophobicContact CD1-CB 4.03Å; L350-N393 HydrophobicContact CD2-CB 4.07Å; L350-N393 WeakPolarHBondContact CD2-OD1 3.45Å |
| 351 | V | 95.1 | Very high | 93.1 | Very high | 1 Ų | 1 | 21.5 Ų | 21.5 | 1% | 0.006 | 10% | 0.102 | C | C | . | . | H | α-helix | trans | -59.9 | -53.9 | 175.4 | 174.7 | 0 | 0 | 0 | 0 | 110 | L27 M339 V342 L343 S346 S347 A348 V349 L353 S354 L355 | L27-V351 HydrophobicContact CD1-CG1 4.05Å; M339-V351 HydrophobicContact CE-CG1 4.17Å; M339-V351 HydrophobicContact SD-CG1 3.65Å; V342-V351 HydrophobicContact CB-CG2 4.38Å; V342-V351 HydrophobicContact CG1-CG2 3.58Å; L343-V351 HydrophobicContact CD2-CB 4.16Å; L343-V351 HydrophobicContact CD2-CG2 3.77Å; L343-V351 HydrophobicContact CG-CG2 4.4Å; S346-V351 WeakPolarHBondContact OG-CG2 3.39Å; S347-V351 WeakPolarHBondContact O-CG2 3.37Å; S347-V351 PolarHBondContact O-N 3.28Å; A348-V351 PolarHBondContact O-N 3.42Å; V349-V351 VanDerWaalsContact C-N 3.28Å; V349-V351 PolarHBondContact O-N 3.01Å; V351-L353 VanDerWaalsContact C-N 3.3Å; V351-L353 PolarHBondContact O-N 2.95Å; V351-S354 CarbonylContact O-C 3.49Å; V351-S354 WeakPolarHBondContact O-CA 3.25Å; V351-S354 WeakPolarHBondContact O-CB 3.43Å; V351-S354 PolarHBondContact O-N 3.45Å; V351-S354 PolarHBondContact O-OG 3.47Å; V351-L355 HydrophobicContact CG1-CD1 4.25Å; V351-L355 HydrophobicContact CG1-CD2 4.35Å; V351-L355 HydrophobicContact CG1-CG 4.13Å; V351-L355 WeakPolarHBondContact O-CG 3.44Å; V351-L355 PolarHBondContact O-N 2.98Å |
| 352 | N | 95.6 | Very high | 93 | Very high | 8 Ų | 8 | 18.9 Ų | 18.9 | 4% | 0.043 | 9% | 0.089 | C | C | . | . | H | α-helix | trans | -65.1 | -32.2 | -177.3 | -73.2 | 3.9 | 0 | 0 | 0 | 113.7 | V176 N267 A348 V349 S354 L355 L356 | V176-N352 WeakPolarHBondContact CG2-ND2 3.42Å; N267-N352 PolarHBondContact ND2-ND2 3.26Å; N267-N352 PolarHBondContact ND2-OD1 3.42Å; A348-N352 PolarHBondContact O-N 3.29Å; V349-N352 PolarHBondContact O-N 3.46Å; N352-S354 VanDerWaalsContact C-N 3.33Å; N352-L355 PolarHBondContact O-N 3.18Å; N352-L356 PolarHBondContact O-N 3.3Å |
| 353 | L | 95.9 | Very high | 92.8 | Very high | 0 Ų | 0 | 19.3 Ų | 19.3 | 0% | 0 | 9% | 0.092 | C | C | . | . | H | α-helix | trans | -63.8 | -39.4 | 169.1 | -68.2 | 174.1 | 0 | 0 | 0 | 111.8 | I173 I196 C199 V349 L350 V351 L355 L356 V389 F392 | I173-L353 HydrophobicContact CD1-CD2 3.91Å; I173-L353 HydrophobicContact CG1-CD2 4.12Å; I173-L353 HydrophobicContact CG2-CD2 3.95Å; I196-L353 HydrophobicContact CB-CD2 4.49Å; I196-L353 HydrophobicContact CG1-CD1 3.88Å; I196-L353 HydrophobicContact CG1-CD2 4.15Å; C199-L353 HydrophobicContact CB-CD2 3.83Å; V349-L353 HydrophobicContact CG1-CD1 4.02Å; V349-L353 HydrophobicContact CG1-CG 4.32Å; V349-L353 VanDerWaalsContact O-CG 3.29Å; V349-L353 WeakPolarHBondContact O-CG 3.41Å; V349-L353 PolarHBondContact O-N 3.44Å; L350-L353 PolarHBondContact O-N 2.91Å; V351-L353 VanDerWaalsContact C-N 3.3Å; V351-L353 PolarHBondContact O-N 2.95Å; L353-L355 VanDerWaalsContact C-N 3.34Å; L353-L356 WeakPolarHBondContact O-CB 3.25Å; L353-L356 PolarHBondContact O-N 3.13Å; L353-V389 HydrophobicContact CB-CG2 4.14Å; L353-F392 HydrophobicContact CD1-CB 4.19Å; L353-F392 HydrophobicContact CD1-CD2 3.58Å; L353-F392 HydrophobicContact CD1-CE2 4.07Å; L353-F392 HydrophobicContact CD1-CG 3.86Å |
| 354 | S | 95.3 | Very high | 92.5 | Very high | 2 Ų | 2 | 22.1 Ų | 22.1 | 1% | 0.014 | 11% | 0.107 | C | C | . | . | H | α-helix | trans | -69.3 | -32.2 | 174.8 | 73.5 | 0 | 0 | 0 | 0 | 112.6 | G24 S28 L350 V351 N352 L356 T357 | G24-S354 VanDerWaalsContact CA-OG 3.31Å; G24-S354 WeakPolarHBondContact CA-OG 3.37Å; S28-S354 WeakPolarHBondContact CB-O 3.11Å; L350-S354 WeakPolarHBondContact O-CB 3.37Å; L350-S354 PolarHBondContact O-N 3.37Å; L350-S354 PolarHBondContact O-OG 2.95Å; V351-S354 CarbonylContact O-C 3.49Å; V351-S354 WeakPolarHBondContact O-CA 3.25Å; V351-S354 WeakPolarHBondContact O-CB 3.43Å; V351-S354 PolarHBondContact O-N 3.45Å; V351-S354 PolarHBondContact O-OG 3.47Å; N352-S354 VanDerWaalsContact C-N 3.33Å; S354-L356 PolarHBondContact O-N 3.38Å; S354-T357 WeakPolarHBondContact O-CB 3.41Å; S354-T357 PolarHBondContact O-N 2.99Å; S354-T357 VanDerWaalsContact O-N 3.1Å; S354-T357 PolarHBondContact O-OG1 3.45Å |
| 355 | L | 95.6 | Very high | 92.5 | Very high | 22 Ų | 22 | 21 Ų | 21 | 12% | 0.115 | 10% | 0.101 | C | C | . | . | H | α-helix | trans | -64.8 | -22.8 | 177 | -63.3 | -175.6 | 0 | 0 | 0 | 112.6 | L27 I31 M339 V351 N352 L353 T357 S358 | L27-L355 HydrophobicContact CB-CD2 3.82Å; I31-L355 HydrophobicContact CD1-CB 4.07Å; I31-L355 HydrophobicContact CD1-CD1 3.49Å; I31-L355 VanDerWaalsContact CD1-CD1 3.49Å; I31-L355 HydrophobicContact CD1-CD2 3.43Å; I31-L355 VanDerWaalsContact CD1-CD2 3.43Å; I31-L355 HydrophobicContact CD1-CG 3.78Å; I31-L355 HydrophobicContact CG1-CD2 4.28Å; M339-L355 HydrophobicContact CE-CD1 4.29Å; V351-L355 HydrophobicContact CG1-CD1 4.25Å; V351-L355 HydrophobicContact CG1-CD2 4.35Å; V351-L355 HydrophobicContact CG1-CG 4.13Å; V351-L355 WeakPolarHBondContact O-CG 3.44Å; V351-L355 PolarHBondContact O-N 2.98Å; N352-L355 PolarHBondContact O-N 3.18Å; L353-L355 VanDerWaalsContact C-N 3.34Å; L355-T357 PolarHBondContact O-N 3.08Å; L355-S358 WeakPolarHBondContact O-CA 3.27Å; L355-S358 WeakPolarHBondContact O-CB 3.29Å; L355-S358 PolarHBondContact O-N 2.97Å; L355-S358 PolarHBondContact O-OG 3.05Å |
| 356 | L | 94.2 | Very high | 92.4 | Very high | 10 Ų | 10 | 15.9 Ų | 15.9 | 5% | 0.052 | 8% | 0.084 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -60.6 | -26.9 | 173.4 | -179 | 65 | 0 | 0 | 0 | 113 | C199 A203 N352 L353 S354 S358 D359 I385 | C199-L356 HydrophobicContact CB-CD2 4.01Å; C199-L356 WeakPolarHBondContact O-CD2 3.33Å; A203-L356 HydrophobicContact CB-CD1 3.43Å; A203-L356 VanDerWaalsContact CB-CD1 3.43Å; A203-L356 HydrophobicContact CB-CD2 3.58Å; A203-L356 HydrophobicContact CB-CG 4Å; N352-L356 PolarHBondContact O-N 3.3Å; L353-L356 WeakPolarHBondContact O-CB 3.25Å; L353-L356 PolarHBondContact O-N 3.13Å; S354-L356 PolarHBondContact O-N 3.38Å; L356-S358 PolarHBondContact O-N 2.89Å; L356-D359 PolarHBondContact O-N 3.14Å; L356-I385 HydrophobicContact CB-CG2 4.36Å; L356-I385 HydrophobicContact CD2-CD1 3.9Å; L356-I385 HydrophobicContact CD2-CG1 3.87Å; L356-I385 HydrophobicContact CD2-CG2 4.12Å; L356-I385 HydrophobicContact CG-CD1 3.89Å; L356-I385 HydrophobicContact CG-CG1 4.38Å; L356-I385 HydrophobicContact CG-CG2 4.45Å |
| 357 | T | 94.8 | Very high | 92.2 | Very high | 0 Ų | 0 | 16.4 Ų | 16.4 | 0% | 0 | 9% | 0.086 | C | C | . | . | H | α-helix | trans | -66.5 | -14.3 | 172.3 | 61.7 | 0 | 0 | 0 | 0 | 113.1 | Q25 S28 S354 L355 D359 V360 Y361 F382 I385 L386 | Q25-T357 PolarHBondContact NE2-OG1 3.16Å; Q25-T357 PolarHBondContact OE1-OG1 3.28Å; S28-T357 WeakPolarHBondContact CB-OG1 3.43Å; S28-T357 PolarHBondContact OG-OG1 3.49Å; S354-T357 WeakPolarHBondContact O-CB 3.41Å; S354-T357 PolarHBondContact O-N 2.99Å; S354-T357 VanDerWaalsContact O-N 3.1Å; S354-T357 PolarHBondContact O-OG1 3.45Å; L355-T357 PolarHBondContact O-N 3.08Å; T357-D359 PolarHBondContact O-N 3.38Å; T357-V360 WeakPolarHBondContact O-CB 3.05Å; T357-V360 PolarHBondContact O-N 3.28Å; T357-V360 VanDerWaalsContact O-N 3.11Å; T357-Y361 WeakPolarHBondContact O-CD2 3.26Å; T357-Y361 PolarHBondContact O-N 3.25Å; T357-Y361 VanDerWaalsContact O-N 3.13Å; T357-F382 HydrophobicContact CG2-CD2 4.1Å; T357-F382 HydrophobicContact CG2-CE2 3.96Å; T357-I385 HydrophobicContact CG2-CB 4.06Å; T357-I385 HydrophobicContact CG2-CG2 3.44Å; T357-I385 VanDerWaalsContact CG2-CG2 3.44Å; T357-L386 HydrophobicContact CG2-CD2 4.42Å |
| 358 | S | 94.5 | Very high | 91.9 | Very high | 8 Ų | 8 | 23.8 Ų | 23.8 | 6% | 0.056 | 12% | 0.117 | C | C | . | . | H | α-helix | trans | -63.1 | -31.5 | 178.4 | 70.7 | 0 | 0 | 0 | 0 | 112.4 | S28 I31 L355 L356 V360 Y361 A362 | S28-S358 WeakPolarHBondContact O-CA 3.09Å; S28-S358 WeakPolarHBondContact O-CB 3.15Å; I31-S358 WeakPolarHBondContact CG2-OG 3.36Å; L355-S358 WeakPolarHBondContact O-CA 3.27Å; L355-S358 WeakPolarHBondContact O-CB 3.29Å; L355-S358 PolarHBondContact O-N 2.97Å; L355-S358 PolarHBondContact O-OG 3.05Å; L356-S358 PolarHBondContact O-N 2.89Å; S358-V360 VanDerWaalsContact C-N 3.29Å; S358-V360 PolarHBondContact O-N 3.43Å; S358-Y361 CarbonylContact O-C 3.27Å; S358-Y361 PolarHBondContact O-N 3.41Å; S358-A362 WeakPolarHBondContact O-CB 3.45Å; S358-A362 PolarHBondContact O-N 2.93Å |
| 359 | D | 91.5 | Very high | 91.3 | Very high | 19 Ų | 19 | 28 Ų | 28 | 10% | 0.102 | 14% | 0.139 | C | C | . | . | H | α-helix | trans | -63.9 | -38.7 | 175.8 | -61.3 | -23.3 | 0 | 0 | 0 | 110.6 | Q166 M206 L356 T357 A362 V363 | Q166-D359 HydrophobicContact CG-CB 4.25Å; Q166-D359 WeakPolarHBondContact CG-OD1 3.24Å; M206-D359 VanDerWaalsContact CE-C 3.49Å; M206-D359 HydrophobicContact CE-CB 3.44Å; M206-D359 VanDerWaalsContact CE-CB 3.44Å; M206-D359 HydrophobicContact SD-CB 4.38Å; L356-D359 PolarHBondContact O-N 3.14Å; T357-D359 PolarHBondContact O-N 3.38Å; D359-A362 PolarHBondContact O-N 3.16Å; D359-V363 WeakPolarHBondContact O-CG2 3.42Å; D359-V363 PolarHBondContact O-N 2.98Å |
| 360 | V | 91.6 | Very high | 90.6 | Very high | 1 Ų | 1 | 31.7 Ų | 31.7 | 1% | 0.006 | 16% | 0.155 | C | C | . | . | H | α-helix | trans | -67.3 | -44.8 | 177.3 | -179.7 | 0 | 0 | 0 | 0 | 108.7 | M206 T357 S358 A362 V363 L364 F382 | M206-V360 HydrophobicContact CE-CB 4.18Å; M206-V360 HydrophobicContact CE-CG2 3.45Å; M206-V360 VanDerWaalsContact CE-CG2 3.45Å; M206-V360 HydrophobicContact CG-CG2 4.39Å; M206-V360 HydrophobicContact SD-CG2 3.24Å; M206-V360 WeakPolarHBondContact SD-CG2 3.34Å; T357-V360 WeakPolarHBondContact O-CB 3.05Å; T357-V360 PolarHBondContact O-N 3.28Å; T357-V360 VanDerWaalsContact O-N 3.11Å; S358-V360 VanDerWaalsContact C-N 3.29Å; S358-V360 PolarHBondContact O-N 3.43Å; V360-A362 VanDerWaalsContact C-N 3.31Å; V360-A362 PolarHBondContact O-N 3.44Å; V360-V363 PolarHBondContact O-N 2.96Å; V360-L364 HydrophobicContact CG1-CD1 3.83Å; V360-L364 HydrophobicContact CG1-CG 4.1Å; V360-L364 WeakPolarHBondContact O-CB 3.4Å; V360-L364 VanDerWaalsContact O-CG 3.25Å; V360-L364 WeakPolarHBondContact O-CG 3.34Å; V360-L364 PolarHBondContact O-N 2.76Å; V360-F382 HydrophobicContact CB-CB 4.48Å; V360-F382 HydrophobicContact CB-CD2 3.98Å; V360-F382 HydrophobicContact CG1-CB 3.94Å; V360-F382 HydrophobicContact CG1-CD2 3.9Å; V360-F382 HydrophobicContact CG1-CG 4.15Å; V360-F382 HydrophobicContact CG2-CB 4Å; V360-F382 HydrophobicContact CG2-CD2 4.02Å; V360-F382 HydrophobicContact CG2-CG 4.5Å |
| 361 | Y | 92.9 | Very high | 89.9 | Confident | 41 Ų | 41 | 39.6 Ų | 39.6 | 16% | 0.161 | 19% | 0.192 | C | C | . | . | H | α-helix | trans | -62.2 | -39.8 | 177 | -70.2 | -59.1 | 0 | 0 | 0 | 111.8 | Q25 S28 I29 T357 S358 L364 M365 F382 | Q25-Y361 PolarHBondContact OE1-OH 2.71Å; S28-Y361 WeakPolarHBondContact OG-CD2 3.41Å; S28-Y361 WeakPolarHBondContact OG-CE2 3.35Å; I29-Y361 HydrophobicContact CD1-CE1 4.22Å; I29-Y361 HydrophobicContact CG1-CD1 3.86Å; I29-Y361 HydrophobicContact CG1-CD2 3.76Å; I29-Y361 HydrophobicContact CG1-CE1 3.79Å; I29-Y361 HydrophobicContact CG1-CE2 3.69Å; I29-Y361 HydrophobicContact CG1-CG 3.85Å; T357-Y361 WeakPolarHBondContact O-CD2 3.26Å; T357-Y361 PolarHBondContact O-N 3.25Å; T357-Y361 VanDerWaalsContact O-N 3.13Å; S358-Y361 CarbonylContact O-C 3.27Å; S358-Y361 PolarHBondContact O-N 3.41Å; Y361-L364 PolarHBondContact O-N 2.94Å; Y361-M365 VanDerWaalsContact O-CB 3.3Å; Y361-M365 WeakPolarHBondContact O-CB 3.48Å; Y361-M365 WeakPolarHBondContact O-CG 3.44Å; Y361-M365 PolarHBondContact O-N 3.01Å; Y361-F382 HydrophobicContact CE1-CE2 4.48Å; Y361-F382 HydrophobicContact CE2-CE2 4.04Å; Y361-F382 AromaticContact CZ-CE2 3.84Å; Y361-F382 WeakPolarHBondContact OH-CZ 3.49Å |
| 362 | A | 91.2 | Very high | 88.7 | Confident | 8 Ų | 8 | 44.1 Ų | 44.1 | 7% | 0.066 | 21% | 0.213 | C | C | . | . | H | α-helix | trans | -59.9 | -49 | 175.3 | 0 | 0 | 0 | 0 | 0 | 111 | A35 I36 S358 D359 V360 M365 D366 | A35-A362 HydrophobicContact CB-CB 4.14Å; I36-A362 HydrophobicContact CG1-CB 4.28Å; S358-A362 WeakPolarHBondContact O-CB 3.45Å; S358-A362 PolarHBondContact O-N 2.93Å; D359-A362 PolarHBondContact O-N 3.16Å; V360-A362 VanDerWaalsContact C-N 3.31Å; V360-A362 PolarHBondContact O-N 3.44Å; A362-M365 PolarHBondContact O-N 3.01Å; A362-D366 VanDerWaalsContact O-CB 3.29Å; A362-D366 WeakPolarHBondContact O-CB 3.4Å; A362-D366 PolarHBondContact O-N 3.31Å |
| 363 | V | 88.5 | Confident | 87.6 | Confident | 18 Ų | 18 | 47.7 Ų | 47.7 | 11% | 0.109 | 24% | 0.238 | C | C | . | . | H | α-helix | trans | -63.3 | -45.8 | 177.3 | 171.4 | 0 | 0 | 0 | 0 | 111.8 | D359 V360 M365 D366 I367 Y378 | D359-V363 WeakPolarHBondContact O-CG2 3.42Å; D359-V363 PolarHBondContact O-N 2.98Å; V360-V363 PolarHBondContact O-N 2.96Å; V363-M365 VanDerWaalsContact C-N 3.33Å; V363-M365 PolarHBondContact O-N 3.44Å; V363-D366 PolarHBondContact O-N 3.16Å; V363-I367 HydrophobicContact CG1-CD1 3.69Å; V363-I367 HydrophobicContact CG1-CG1 4.42Å; V363-I367 WeakPolarHBondContact O-CB 3.42Å; V363-I367 VanDerWaalsContact O-CG1 3.25Å; V363-I367 WeakPolarHBondContact O-CG1 3.5Å; V363-I367 PolarHBondContact O-N 3.23Å; V363-Y378 HydrophobicContact CG1-CD1 4.12Å; V363-Y378 HydrophobicContact CG1-CD2 4.14Å; V363-Y378 HydrophobicContact CG1-CE1 3.9Å; V363-Y378 HydrophobicContact CG1-CE2 3.92Å; V363-Y378 HydrophobicContact CG1-CG 4.24Å; V363-Y378 HydrophobicContact CG2-CE1 4.4Å |
| 364 | L | 88.2 | Confident | 86.8 | Confident | 60 Ų | 60 | 52.4 Ų | 52.4 | 31% | 0.314 | 26% | 0.259 | S | S | . | . | H | α-helix | trans | -61.7 | -41.6 | 179.7 | -74.9 | 176.5 | 0 | 0 | 0 | 112.2 | V360 Y361 F368 F374 | V360-L364 HydrophobicContact CG1-CD1 3.83Å; V360-L364 HydrophobicContact CG1-CG 4.1Å; V360-L364 WeakPolarHBondContact O-CB 3.4Å; V360-L364 VanDerWaalsContact O-CG 3.25Å; V360-L364 WeakPolarHBondContact O-CG 3.34Å; V360-L364 PolarHBondContact O-N 2.76Å; Y361-L364 PolarHBondContact O-N 2.94Å; L364-F368 WeakPolarHBondContact O-CB 3.46Å; L364-F368 PolarHBondContact O-N 2.89Å; L364-F374 HydrophobicContact CD2-CD2 4.21Å; L364-F374 HydrophobicContact CD2-CE2 3.77Å |
| 365 | M | 87.5 | Confident | 86.2 | Confident | 68 Ų | 68 | 55.2 Ų | 55.2 | 34% | 0.335 | 27% | 0.271 | S | S | . | . | H | α-helix | trans | -74.4 | -36 | 178.3 | -66.1 | -70.2 | 179.3 | 0 | 0 | 111.7 | I36 Y361 A362 V363 I367 F368 I369 | I36-M365 HydrophobicContact CD1-CB 3.2Å; I36-M365 HydrophobicContact CD1-CG 3.95Å; I36-M365 HydrophobicContact CG1-CB 4.39Å; Y361-M365 VanDerWaalsContact O-CB 3.3Å; Y361-M365 WeakPolarHBondContact O-CB 3.48Å; Y361-M365 WeakPolarHBondContact O-CG 3.44Å; Y361-M365 PolarHBondContact O-N 3.01Å; A362-M365 PolarHBondContact O-N 3.01Å; V363-M365 VanDerWaalsContact C-N 3.33Å; V363-M365 PolarHBondContact O-N 3.44Å; M365-I367 VanDerWaalsContact C-N 3.34Å; M365-F368 PolarHBondContact O-N 3.27Å; M365-I369 WeakPolarHBondContact O-CB 3.18Å; M365-I369 WeakPolarHBondContact O-CG1 3.37Å; M365-I369 PolarHBondContact O-N 3.33Å |
| 366 | D | 85.3 | Confident | 85.9 | Confident | 39 Ų | 39 | 61.8 Ų | 61.8 | 21% | 0.209 | 30% | 0.296 | C | S | . | . | H | α-helix | trans | -61.1 | -44.1 | 172 | -171.3 | 69.5 | 0 | 0 | 0 | 110.8 | A362 V363 F368 I369 F370 H372 | A362-D366 VanDerWaalsContact O-CB 3.29Å; A362-D366 WeakPolarHBondContact O-CB 3.4Å; A362-D366 PolarHBondContact O-N 3.31Å; V363-D366 PolarHBondContact O-N 3.16Å; D366-F368 VanDerWaalsContact C-N 3.34Å; D366-F368 PolarHBondContact O-N 3.25Å; D366-I369 PolarHBondContact O-N 3.11Å; D366-F370 WeakPolarHBondContact O-CB 3.35Å; D366-F370 WeakPolarHBondContact O-CD2 3.48Å; D366-F370 PolarHBondContact O-N 3.47Å; D366-F370 WeakPolarHBondContact OD1-CD2 3.23Å; D366-F370 WeakPolarHBondContact OD1-CE2 3.5Å; D366-H372 IonicContact OD2-CD2 3.45Å; D366-H372 PolarHBondContact OD2-CD2 3.3Å |
| 367 | I | 85.4 | Confident | 85.7 | Confident | 27 Ų | 27 | 63.7 Ų | 63.7 | 14% | 0.138 | 31% | 0.306 | C | S | . | . | H | α-helix | trans | -60.4 | -42.9 | 172.3 | -71.9 | 165.8 | 0 | 0 | 0 | 111.3 | V363 M365 H371 H372 F374 | V363-I367 HydrophobicContact CG1-CD1 3.69Å; V363-I367 HydrophobicContact CG1-CG1 4.42Å; V363-I367 WeakPolarHBondContact O-CB 3.42Å; V363-I367 VanDerWaalsContact O-CG1 3.25Å; V363-I367 WeakPolarHBondContact O-CG1 3.5Å; V363-I367 PolarHBondContact O-N 3.23Å; M365-I367 VanDerWaalsContact C-N 3.34Å; I367-H371 WeakPolarHBondContact O-CA 3.37Å; I367-H371 PolarHBondContact O-N 3.17Å; I367-H372 HydrophobicContact CG1-CB 4.09Å; I367-H372 WeakPolarHBondContact CG2-O 3.25Å; I367-F374 HydrophobicContact CD1-CB 4.37Å; I367-F374 HydrophobicContact CD1-CD2 4.03Å; I367-F374 HydrophobicContact CG2-CB 4.23Å |
| 368 | F | 83.6 | Confident | 85.4 | Confident | 160 Ų | 160 | 64.2 Ų | 64.2 | 70% | 0.702 | 31% | 0.308 | S | S | * | . | H | α-helix | trans | -67 | -37.9 | 179.9 | -175.6 | -98.8 | 0 | 0 | 0 | 112.6 | L364 M365 D366 | L364-F368 WeakPolarHBondContact O-CB 3.46Å; L364-F368 PolarHBondContact O-N 2.89Å; M365-F368 PolarHBondContact O-N 3.27Å; D366-F368 VanDerWaalsContact C-N 3.34Å; D366-F368 PolarHBondContact O-N 3.25Å |
| 369 | I | 82.2 | Confident | 85.3 | Confident | 90 Ų | 90 | 67.9 Ų | 67.9 | 46% | 0.462 | 33% | 0.326 | S | S | . | . | H | α-helix | trans | -82.2 | -39.5 | -176.9 | -67 | 166.5 | 0 | 0 | 0 | 111.7 | I36 M365 D366 | I36-I369 HydrophobicContact CG2-CD1 4.25Å; M365-I369 WeakPolarHBondContact O-CB 3.18Å; M365-I369 WeakPolarHBondContact O-CG1 3.37Å; M365-I369 PolarHBondContact O-N 3.33Å; D366-I369 PolarHBondContact O-N 3.11Å |
| 370 | F | 80.6 | Confident | 85.4 | Confident | 78 Ų | 78 | 71.3 Ų | 71.3 | 34% | 0.342 | 34% | 0.344 | S | S | . | . | H | α-helix | trans | -108.9 | 1.8 | -172.9 | -61.7 | -75 | 0 | 0 | 0 | 114.4 | V40 D366 H372 | V40-F370 HydrophobicContact CG2-CE2 3.9Å; V40-F370 HydrophobicContact CG2-CZ 3.6Å; D366-F370 WeakPolarHBondContact O-CB 3.35Å; D366-F370 WeakPolarHBondContact O-CD2 3.48Å; D366-F370 PolarHBondContact O-N 3.47Å; D366-F370 WeakPolarHBondContact OD1-CD2 3.23Å; D366-F370 WeakPolarHBondContact OD1-CE2 3.5Å; F370-H372 VanDerWaalsContact C-N 3.26Å; F370-H372 PolarHBondContact O-N 2.49Å |
| 371 | H | 79 | Confident | 85.5 | Confident | 171 Ų | 171 | 71.6 Ų | 71.6 | 79% | 0.792 | 35% | 0.346 | S | S | * | . | trans | 56.2 | 35.6 | 179.5 | -57.2 | -67.8 | 0 | 0 | 0 | 114 | I367 | I367-H371 WeakPolarHBondContact O-CA 3.37Å; I367-H371 PolarHBondContact O-N 3.17Å | ||
| 372 | H | 69.7 | Low | 85.5 | Confident | 97 Ų | 97 | 71.5 Ų | 71.5 | 45% | 0.449 | 35% | 0.346 | S | S | . | . | trans | -69 | 161.6 | 173.8 | -82 | -57.2 | 0 | 0 | 0 | 112.6 | D366 I367 F370 F374 | D366-H372 IonicContact OD2-CD2 3.45Å; D366-H372 PolarHBondContact OD2-CD2 3.3Å; I367-H372 HydrophobicContact CG1-CB 4.09Å; I367-H372 WeakPolarHBondContact CG2-O 3.25Å; F370-H372 VanDerWaalsContact C-N 3.26Å; F370-H372 PolarHBondContact O-N 2.49Å; H372-F374 PolarHBondContact O-N 3.4Å | ||
| 373 | S | 72 | Confident | 85.7 | Confident | 82 Ų | 82 | 75.4 Ų | 75.4 | 57% | 0.573 | 37% | 0.365 | S | S | * | . | trans | -68.6 | 115.4 | -177.8 | 53.8 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 374 | F | 78.4 | Confident | 86 | Confident | 99 Ų | 99 | 76.8 Ų | 76.8 | 43% | 0.434 | 37% | 0.372 | S | S | . | . | trans | -76.8 | 130.4 | 174.9 | 176.7 | -97.2 | 0 | 0 | 0 | 111.7 | L364 I367 H372 I379 | L364-F374 HydrophobicContact CD2-CD2 4.21Å; L364-F374 HydrophobicContact CD2-CE2 3.77Å; I367-F374 HydrophobicContact CD1-CB 4.37Å; I367-F374 HydrophobicContact CD1-CD2 4.03Å; I367-F374 HydrophobicContact CG2-CB 4.23Å; H372-F374 PolarHBondContact O-N 3.4Å; F374-I379 HydrophobicContact CE1-CD1 4.21Å; F374-I379 HydrophobicContact CE2-CD1 4.3Å; F374-I379 HydrophobicContact CE2-CG1 4.3Å; F374-I379 HydrophobicContact CZ-CD1 3.43Å; F374-I379 VanDerWaalsContact CZ-CD1 3.43Å; F374-I379 HydrophobicContact CZ-CG1 3.74Å | ||
| 375 | H | 84.6 | Confident | 86.3 | Confident | 61 Ų | 61 | 73.9 Ų | 73.9 | 28% | 0.282 | 36% | 0.357 | S | S | . | . | trans | -117.5 | 135.4 | 172.6 | -155.8 | 88.5 | 0 | 0 | 0 | 111.2 | T209 I213 L377 Y378 | T209-H375 HydrophobicContact CG2-CB 4.36Å; I213-H375 HydrophobicContact CD1-CB 3.62Å; I213-H375 HydrophobicContact CG1-CB 4.3Å; H375-L377 WeakPolarHBondContact CD2-CD1 3.24Å; H375-L377 VanDerWaalsContact CD2-CG 3.47Å; H375-L377 WeakPolarHBondContact CD2-CG 3.19Å; H375-L377 VanDerWaalsContact NE2-CD1 3.35Å; H375-L377 WeakPolarHBondContact NE2-CD1 3.5Å; H375-L377 PolarHBondContact O-N 2.93Å; H375-L377 VanDerWaalsContact O-N 3.13Å; H375-Y378 HydrophobicContact CB-CD2 4.32Å; H375-Y378 HydrophobicContact CB-CE2 4.24Å; H375-Y378 VanDerWaalsContact O-CD2 3.23Å; H375-Y378 WeakPolarHBondContact O-CD2 3.42Å; H375-Y378 PolarHBondContact O-N 3.19Å | ||
| 376 | Y | 87.6 | Confident | 86.7 | Confident | 160 Ų | 160 | 73 Ų | 73 | 63% | 0.627 | 35% | 0.353 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -64.6 | -20.4 | -173.5 | 62.8 | -92.7 | 0 | 0 | 0 | 114 | Y378 I379 L380 | Y376-Y378 PolarHBondContact O-N 3.05Å; Y376-I379 PolarHBondContact O-N 2.97Å; Y376-I379 VanDerWaalsContact O-N 3.11Å; Y376-L380 PolarHBondContact O-N 3.35Å |
| 377 | L | 89.8 | Confident | 87.1 | Confident | 50 Ų | 50 | 76.7 Ų | 76.7 | 26% | 0.262 | 37% | 0.372 | S | S | . | . | H | α-helix | trans | -57.7 | -30.2 | 176.7 | -72.7 | 161.7 | 0 | 0 | 0 | 112.5 | T209 H375 I379 L380 C381 | T209-L377 HydrophobicContact CG2-CB 3.76Å; T209-L377 HydrophobicContact CG2-CD1 4.16Å; T209-L377 WeakPolarHBondContact OG1-CB 3.14Å; H375-L377 WeakPolarHBondContact CD2-CD1 3.24Å; H375-L377 VanDerWaalsContact CD2-CG 3.47Å; H375-L377 WeakPolarHBondContact CD2-CG 3.19Å; H375-L377 VanDerWaalsContact NE2-CD1 3.35Å; H375-L377 WeakPolarHBondContact NE2-CD1 3.5Å; H375-L377 PolarHBondContact O-N 2.93Å; H375-L377 VanDerWaalsContact O-N 3.13Å; L377-I379 PolarHBondContact O-N 3.44Å; L377-L380 HydrophobicContact CD2-CD2 4.4Å; L377-L380 WeakPolarHBondContact O-CB 3.32Å; L377-L380 PolarHBondContact O-N 3.36Å; L377-C381 PolarHBondContact O-N 2.8Å; L377-C381 PolarHBondContact O-SG 2.91Å |
| 378 | Y | 89.5 | Confident | 87.6 | Confident | 12 Ų | 12 | 75.4 Ų | 75.4 | 5% | 0.047 | 37% | 0.365 | C | S | . | . | H | α-helix | trans | -62.9 | -41.3 | 175.6 | -66.1 | -64.3 | 0 | 0 | 0 | 112.4 | T209 D210 I213 V363 H375 Y376 L380 C381 F382 | T209-Y378 HydrophobicContact CG2-CD1 4.21Å; T209-Y378 HydrophobicContact CG2-CD2 4.25Å; T209-Y378 HydrophobicContact CG2-CE1 3.83Å; T209-Y378 HydrophobicContact CG2-CE2 3.87Å; T209-Y378 HydrophobicContact CG2-CG 4.41Å; D210-Y378 VanDerWaalsContact OD1-CE1 3.23Å; D210-Y378 WeakPolarHBondContact OD1-CE1 3.3Å; D210-Y378 VanDerWaalsContact OD1-CZ 3.25Å; D210-Y378 PolarHBondContact OD1-OH 3.35Å; I213-Y378 HydrophobicContact CD1-CE2 3.64Å; I213-Y378 WeakPolarHBondContact CD1-OH 3.23Å; V363-Y378 HydrophobicContact CG1-CD1 4.12Å; V363-Y378 HydrophobicContact CG1-CD2 4.14Å; V363-Y378 HydrophobicContact CG1-CE1 3.9Å; V363-Y378 HydrophobicContact CG1-CE2 3.92Å; V363-Y378 HydrophobicContact CG1-CG 4.24Å; V363-Y378 HydrophobicContact CG2-CE1 4.4Å; H375-Y378 HydrophobicContact CB-CD2 4.32Å; H375-Y378 HydrophobicContact CB-CE2 4.24Å; H375-Y378 VanDerWaalsContact O-CD2 3.23Å; H375-Y378 WeakPolarHBondContact O-CD2 3.42Å; H375-Y378 PolarHBondContact O-N 3.19Å; Y376-Y378 PolarHBondContact O-N 3.05Å; Y378-L380 VanDerWaalsContact C-N 3.34Å; Y378-C381 PolarHBondContact O-N 3.4Å; Y378-F382 WeakPolarHBondContact O-CB 3.35Å; Y378-F382 PolarHBondContact O-N 3.45Å |
| 379 | I | 91.7 | Very high | 88.1 | Confident | 85 Ų | 85 | 67.8 Ų | 67.8 | 44% | 0.436 | 33% | 0.332 | S | S | . | . | H | α-helix | trans | -66.3 | -40.1 | 176.1 | -68.3 | 174.9 | 0 | 0 | 0 | 110.3 | F374 Y376 L377 F382 L383 | F374-I379 HydrophobicContact CE1-CD1 4.21Å; F374-I379 HydrophobicContact CE2-CD1 4.3Å; F374-I379 HydrophobicContact CE2-CG1 4.3Å; F374-I379 HydrophobicContact CZ-CD1 3.43Å; F374-I379 VanDerWaalsContact CZ-CD1 3.43Å; F374-I379 HydrophobicContact CZ-CG1 3.74Å; Y376-I379 PolarHBondContact O-N 2.97Å; Y376-I379 VanDerWaalsContact O-N 3.11Å; L377-I379 PolarHBondContact O-N 3.44Å; I379-F382 WeakPolarHBondContact O-CB 3.34Å; I379-F382 PolarHBondContact O-N 3.02Å; I379-L383 HydrophobicContact CG2-CD1 4.26Å; I379-L383 HydrophobicContact CG2-CG 4.49Å; I379-L383 WeakPolarHBondContact O-CG 3.33Å; I379-L383 PolarHBondContact O-N 3.3Å |
| 380 | L | 93.7 | Very high | 88.5 | Confident | 91 Ų | 91 | 64.5 Ų | 64.5 | 48% | 0.476 | 32% | 0.32 | S | S | . | . | H | α-helix | trans | -60.6 | -47 | 176.6 | 179.9 | 62.7 | 0 | 0 | 0 | 111.2 | Y376 L377 Y378 F382 L383 I384 | Y376-L380 PolarHBondContact O-N 3.35Å; L377-L380 HydrophobicContact CD2-CD2 4.4Å; L377-L380 WeakPolarHBondContact O-CB 3.32Å; L377-L380 PolarHBondContact O-N 3.36Å; Y378-L380 VanDerWaalsContact C-N 3.34Å; L380-F382 VanDerWaalsContact C-N 3.34Å; L380-F382 PolarHBondContact O-N 2.75Å; L380-L383 PolarHBondContact O-N 2.99Å; L380-I384 HydrophobicContact CD1-CD1 4.48Å; L380-I384 HydrophobicContact CG-CD1 4.2Å; L380-I384 WeakPolarHBondContact O-CG1 3.01Å; L380-I384 PolarHBondContact O-N 3.26Å; L380-I384 VanDerWaalsContact O-N 3.08Å |
| 381 | C | 93.5 | Very high | 89.1 | Confident | 7 Ų | 7 | 64.5 Ų | 64.5 | 5% | 0.047 | 32% | 0.324 | C | S | . | . | H | α-helix | trans | -62.1 | -41.9 | 177.3 | -63 | 0 | 0 | 0 | 0 | 111.8 | M206 L377 Y378 L383 I384 I385 | M206-C381 HydrophobicContact CG-CB 3.42Å; M206-C381 VanDerWaalsContact CG-CB 3.42Å; M206-C381 HydrophobicContact SD-CB 4.41Å; L377-C381 PolarHBondContact O-N 2.8Å; L377-C381 PolarHBondContact O-SG 2.91Å; Y378-C381 PolarHBondContact O-N 3.4Å; C381-L383 PolarHBondContact O-N 2.55Å; C381-I384 WeakPolarHBondContact O-CB 3.47Å; C381-I384 PolarHBondContact O-N 3.24Å; C381-I385 WeakPolarHBondContact O-CG1 3.45Å; C381-I385 PolarHBondContact O-N 3.25Å |
| 382 | F | 93.4 | Very high | 89.7 | Confident | 38 Ų | 38 | 56.5 Ų | 56.5 | 17% | 0.167 | 29% | 0.287 | C | S | . | . | H | α-helix | trans | -56.7 | -46.2 | 174.7 | -179.7 | -107 | 0 | 0 | 0 | 112.6 | T357 V360 Y361 Y378 I379 L380 I384 I385 L386 | T357-F382 HydrophobicContact CG2-CD2 4.1Å; T357-F382 HydrophobicContact CG2-CE2 3.96Å; V360-F382 HydrophobicContact CB-CB 4.48Å; V360-F382 HydrophobicContact CB-CD2 3.98Å; V360-F382 HydrophobicContact CG1-CB 3.94Å; V360-F382 HydrophobicContact CG1-CD2 3.9Å; V360-F382 HydrophobicContact CG1-CG 4.15Å; V360-F382 HydrophobicContact CG2-CB 4Å; V360-F382 HydrophobicContact CG2-CD2 4.02Å; V360-F382 HydrophobicContact CG2-CG 4.5Å; Y361-F382 HydrophobicContact CE1-CE2 4.48Å; Y361-F382 HydrophobicContact CE2-CE2 4.04Å; Y361-F382 AromaticContact CZ-CE2 3.84Å; Y361-F382 WeakPolarHBondContact OH-CZ 3.49Å; Y378-F382 WeakPolarHBondContact O-CB 3.35Å; Y378-F382 PolarHBondContact O-N 3.45Å; I379-F382 WeakPolarHBondContact O-CB 3.34Å; I379-F382 PolarHBondContact O-N 3.02Å; L380-F382 VanDerWaalsContact C-N 3.34Å; L380-F382 PolarHBondContact O-N 2.75Å; F382-I384 VanDerWaalsContact C-N 3.33Å; F382-I384 PolarHBondContact O-N 3.44Å; F382-I385 PolarHBondContact O-N 2.94Å; F382-L386 HydrophobicContact CD1-CD1 3.89Å; F382-L386 HydrophobicContact CD1-CG 4.47Å; F382-L386 HydrophobicContact CE1-CD1 3.3Å; F382-L386 HydrophobicContact CE1-CG 4.11Å; F382-L386 HydrophobicContact CE2-CD1 4.37Å; F382-L386 HydrophobicContact CE2-CG 4.39Å; F382-L386 HydrophobicContact CZ-CD1 3.58Å; F382-L386 HydrophobicContact CZ-CD2 4.4Å; F382-L386 HydrophobicContact CZ-CG 4.06Å; F382-L386 WeakPolarHBondContact O-CG 2.94Å; F382-L386 PolarHBondContact O-N 3.14Å |
| 383 | L | 95 | Very high | 90.6 | Very high | 90 Ų | 90 | 52.3 Ų | 52.3 | 47% | 0.471 | 27% | 0.268 | S | S | . | . | H | α-helix | trans | -63.5 | -38.9 | 177.2 | -68.7 | 173.6 | 0 | 0 | 0 | 111.9 | I379 L380 C381 L386 L387 | I379-L383 HydrophobicContact CG2-CD1 4.26Å; I379-L383 HydrophobicContact CG2-CG 4.49Å; I379-L383 WeakPolarHBondContact O-CG 3.33Å; I379-L383 PolarHBondContact O-N 3.3Å; L380-L383 PolarHBondContact O-N 2.99Å; C381-L383 PolarHBondContact O-N 2.55Å; L383-L386 PolarHBondContact O-N 2.78Å; L383-L387 WeakPolarHBondContact O-CB 3.18Å; L383-L387 VanDerWaalsContact O-CG 3.27Å; L383-L387 WeakPolarHBondContact O-CG 3.34Å; L383-L387 PolarHBondContact O-N 3.13Å |
| 384 | I | 96 | Very high | 91.3 | Very high | 47 Ų | 47 | 52.5 Ų | 52.5 | 24% | 0.241 | 27% | 0.265 | C | S | . | . | H | α-helix | trans | -62.9 | -42.5 | 175.9 | -68.8 | 167.2 | 0 | 0 | 0 | 111.2 | S198 L380 C381 F382 L387 G388 | S198-I384 VanDerWaalsContact O-CG2 3.26Å; S198-I384 WeakPolarHBondContact O-CG2 3.44Å; S198-I384 PolarHBondContact OG-O 3.15Å; L380-I384 HydrophobicContact CD1-CD1 4.48Å; L380-I384 HydrophobicContact CG-CD1 4.2Å; L380-I384 WeakPolarHBondContact O-CG1 3.01Å; L380-I384 PolarHBondContact O-N 3.26Å; L380-I384 VanDerWaalsContact O-N 3.08Å; C381-I384 WeakPolarHBondContact O-CB 3.47Å; C381-I384 PolarHBondContact O-N 3.24Å; F382-I384 VanDerWaalsContact C-N 3.33Å; F382-I384 PolarHBondContact O-N 3.44Å; I384-L387 PolarHBondContact O-N 3.41Å; I384-G388 PolarHBondContact O-N 3.13Å |
| 385 | I | 95 | Very high | 91.4 | Very high | 0 Ų | 0 | 51.3 Ų | 51.3 | 0% | 0 | 26% | 0.263 | C | S | . | . | H | α-helix | trans | -64.5 | -47.1 | 176.5 | -61.5 | 162.1 | 0 | 0 | 0 | 110 | M206 L356 T357 C381 F382 L387 G388 V389 | M206-I385 HydrophobicContact SD-CD1 3.96Å; L356-I385 HydrophobicContact CB-CG2 4.36Å; L356-I385 HydrophobicContact CD2-CD1 3.9Å; L356-I385 HydrophobicContact CD2-CG1 3.87Å; L356-I385 HydrophobicContact CD2-CG2 4.12Å; L356-I385 HydrophobicContact CG-CD1 3.89Å; L356-I385 HydrophobicContact CG-CG1 4.38Å; L356-I385 HydrophobicContact CG-CG2 4.45Å; T357-I385 HydrophobicContact CG2-CB 4.06Å; T357-I385 HydrophobicContact CG2-CG2 3.44Å; T357-I385 VanDerWaalsContact CG2-CG2 3.44Å; C381-I385 WeakPolarHBondContact O-CG1 3.45Å; C381-I385 PolarHBondContact O-N 3.25Å; F382-I385 PolarHBondContact O-N 2.94Å; I385-L387 VanDerWaalsContact C-N 3.32Å; I385-L387 PolarHBondContact O-N 2.74Å; I385-G388 WeakPolarHBondContact O-CA 3.02Å; I385-G388 PolarHBondContact O-N 2.99Å; I385-G388 VanDerWaalsContact O-N 3.09Å; I385-V389 HydrophobicContact CG2-CG2 4.29Å; I385-V389 WeakPolarHBondContact O-CG2 3.49Å; I385-V389 PolarHBondContact O-N 3.43Å |
| 386 | L | 94.5 | Very high | 91 | Very high | 48 Ų | 48 | 54 Ų | 54 | 25% | 0.251 | 28% | 0.276 | S | S | . | . | H | α-helix | trans | -60 | -40.1 | 177.7 | -76.4 | -177.4 | 0 | 0 | 0 | 112.9 | Q25 T357 F382 L383 V389 G390 | Q25-L386 HydrophobicContact CG-CD2 4.25Å; T357-L386 HydrophobicContact CG2-CD2 4.42Å; F382-L386 HydrophobicContact CD1-CD1 3.89Å; F382-L386 HydrophobicContact CD1-CG 4.47Å; F382-L386 HydrophobicContact CE1-CD1 3.3Å; F382-L386 HydrophobicContact CE1-CG 4.11Å; F382-L386 HydrophobicContact CE2-CD1 4.37Å; F382-L386 HydrophobicContact CE2-CG 4.39Å; F382-L386 HydrophobicContact CZ-CD1 3.58Å; F382-L386 HydrophobicContact CZ-CD2 4.4Å; F382-L386 HydrophobicContact CZ-CG 4.06Å; F382-L386 WeakPolarHBondContact O-CG 2.94Å; F382-L386 PolarHBondContact O-N 3.14Å; L383-L386 PolarHBondContact O-N 2.78Å; L386-V389 PolarHBondContact O-N 3.2Å; L386-G390 PolarHBondContact O-N 2.71Å |
| 387 | L | 93.9 | Very high | 90.6 | Very high | 117 Ų | 117 | 47.2 Ų | 47.2 | 61% | 0.613 | 25% | 0.252 | S | S | * | . | H | α-helix | trans | -63.3 | -43.1 | 173.7 | -73.8 | 172.6 | 0 | 0 | 0 | 111.1 | L383 I384 I385 G390 L391 | L383-L387 WeakPolarHBondContact O-CB 3.18Å; L383-L387 VanDerWaalsContact O-CG 3.27Å; L383-L387 WeakPolarHBondContact O-CG 3.34Å; L383-L387 PolarHBondContact O-N 3.13Å; I384-L387 PolarHBondContact O-N 3.41Å; I385-L387 VanDerWaalsContact C-N 3.32Å; I385-L387 PolarHBondContact O-N 2.74Å; L387-G390 PolarHBondContact O-N 3.33Å; L387-L391 WeakPolarHBondContact O-CB 3.11Å; L387-L391 VanDerWaalsContact O-CG 3.3Å; L387-L391 WeakPolarHBondContact O-CG 3.13Å; L387-L391 PolarHBondContact O-N 3.5Å |
| 388 | G | 95.2 | Very high | 89.9 | Confident | 0 Ų | 0 | 49.6 Ų | 49.6 | 0% | 0 | 27% | 0.268 | C | S | . | . | H | α-helix | trans | -61 | -45.1 | 175.6 | 0 | 0 | 0 | 0 | 0 | 113.2 | G195 I384 I385 G390 L391 F392 | G195-G388 VanDerWaalsContact CA-O 3.31Å; G195-G388 WeakPolarHBondContact CA-O 3.12Å; I384-G388 PolarHBondContact O-N 3.13Å; I385-G388 WeakPolarHBondContact O-CA 3.02Å; I385-G388 PolarHBondContact O-N 2.99Å; I385-G388 VanDerWaalsContact O-N 3.09Å; G388-G390 VanDerWaalsContact C-N 3.34Å; G388-L391 PolarHBondContact O-N 3.42Å; G388-F392 PolarHBondContact O-N 3.1Å |
| 389 | V | 94.5 | Very high | 89.1 | Confident | 0 Ų | 0 | 53.8 Ų | 53.8 | 0% | 0 | 29% | 0.29 | C | S | . | . | H | α-helix | trans | -61.4 | -43.2 | 174.1 | 172.8 | 0 | 0 | 0 | 0 | 110.6 | I21 L350 L353 I385 L386 F392 N393 | I21-V389 HydrophobicContact CG1-CG1 4.19Å; L350-V389 HydrophobicContact CD1-CG1 3.71Å; L353-V389 HydrophobicContact CB-CG2 4.14Å; I385-V389 HydrophobicContact CG2-CG2 4.29Å; I385-V389 WeakPolarHBondContact O-CG2 3.49Å; I385-V389 PolarHBondContact O-N 3.43Å; L386-V389 PolarHBondContact O-N 3.2Å; V389-F392 PolarHBondContact O-N 3.25Å; V389-N393 WeakPolarHBondContact O-CB 3.39Å; V389-N393 PolarHBondContact O-N 3.02Å |
| 390 | G | 92.1 | Very high | 87.9 | Confident | 21 Ų | 21 | 51.3 Ų | 51.3 | 22% | 0.216 | 28% | 0.279 | C | S | . | . | H | α-helix | trans | -60.1 | -48.2 | 175.5 | 0 | 0 | 0 | 0 | 0 | 112.4 | L386 L387 G388 F392 N393 V394 | L386-G390 PolarHBondContact O-N 2.71Å; L387-G390 PolarHBondContact O-N 3.33Å; G388-G390 VanDerWaalsContact C-N 3.34Å; G390-F392 VanDerWaalsContact C-N 3.34Å; G390-F392 PolarHBondContact O-N 3.45Å; G390-N393 PolarHBondContact O-N 2.78Å; G390-N393 VanDerWaalsContact O-N 3.16Å; G390-V394 WeakPolarHBondContact O-CG2 3.27Å; G390-V394 PolarHBondContact O-N 3.34Å |
| 391 | L | 91.7 | Very high | 86.3 | Confident | 79 Ų | 79 | 53.1 Ų | 53.1 | 41% | 0.414 | 29% | 0.289 | S | S | . | . | H | α-helix | trans | -60.9 | -40.7 | 177.1 | -73.6 | 172.9 | 0 | 0 | 0 | 112.3 | I194 L387 G388 N393 V394 | I194-L391 HydrophobicContact CG2-CD1 4.21Å; L387-L391 WeakPolarHBondContact O-CB 3.11Å; L387-L391 VanDerWaalsContact O-CG 3.3Å; L387-L391 WeakPolarHBondContact O-CG 3.13Å; L387-L391 PolarHBondContact O-N 3.5Å; G388-L391 PolarHBondContact O-N 3.42Å; L391-N393 VanDerWaalsContact C-N 3.33Å; L391-V394 PolarHBondContact O-N 2.77Å |
| 392 | F | 91.5 | Very high | 84.2 | Confident | 2 Ų | 2 | 59 Ų | 59 | 1% | 0.009 | 31% | 0.314 | C | S | . | . | H | α-helix | trans | -63.5 | -39.9 | 175.1 | -171.5 | -77.5 | 0 | 0 | 0 | 111.5 | Y188 H192 I196 V349 L350 L353 G388 V389 G390 V394 P397 | Y188-F392 HydrophobicContact CE1-CZ 4.33Å; H192-F392 HydrophobicContact CB-CD2 3.74Å; H192-F392 HydrophobicContact CB-CE2 3.57Å; H192-F392 HydrophobicContact CB-CZ 4.33Å; H192-F392 AromaticContact CD2-CD2 3.92Å; H192-F392 AromaticContact CD2-CE1 3.89Å; H192-F392 AromaticContact CD2-CE2 3.75Å; H192-F392 AromaticContact CD2-CZ 3.74Å; H192-F392 AromaticContact CG-CE2 3.97Å; I196-F392 HydrophobicContact CD1-CD2 4.47Å; I196-F392 HydrophobicContact CD1-CE2 4.1Å; I196-F392 HydrophobicContact CG1-CD2 4.13Å; I196-F392 HydrophobicContact CG1-CE2 4.19Å; V349-F392 HydrophobicContact CB-CE1 4.41Å; V349-F392 HydrophobicContact CB-CE2 4.23Å; V349-F392 HydrophobicContact CB-CZ 3.7Å; V349-F392 HydrophobicContact CG1-CD2 4.4Å; V349-F392 HydrophobicContact CG1-CE1 4.4Å; V349-F392 HydrophobicContact CG1-CE2 3.47Å; V349-F392 VanDerWaalsContact CG1-CE2 3.47Å; V349-F392 HydrophobicContact CG1-CZ 3.47Å; V349-F392 VanDerWaalsContact CG1-CZ 3.47Å; L350-F392 HydrophobicContact CB-CD1 3.99Å; L350-F392 HydrophobicContact CB-CE1 3.97Å; L350-F392 HydrophobicContact CD1-CB 4.24Å; L350-F392 HydrophobicContact CD1-CD1 3.71Å; L350-F392 HydrophobicContact CD1-CG 4.3Å; L350-F392 HydrophobicContact CG-CD1 4.4Å; L353-F392 HydrophobicContact CD1-CB 4.19Å; L353-F392 HydrophobicContact CD1-CD2 3.58Å; L353-F392 HydrophobicContact CD1-CE2 4.07Å; L353-F392 HydrophobicContact CD1-CG 3.86Å; G388-F392 PolarHBondContact O-N 3.1Å; V389-F392 PolarHBondContact O-N 3.25Å; G390-F392 VanDerWaalsContact C-N 3.34Å; G390-F392 PolarHBondContact O-N 3.45Å; F392-V394 VanDerWaalsContact C-N 3.32Å; F392-V394 PolarHBondContact O-N 3.07Å; F392-P397 HydrophobicContact CE1-CG 4Å; F392-P397 HydrophobicContact CZ-CG 3.96Å |
| 393 | N | 89.4 | Confident | 81.8 | Confident | 10 Ų | 10 | 66.4 Ų | 66.4 | 5% | 0.053 | 35% | 0.346 | C | S | . | . | H | α-helix | trans | -81.1 | -4.5 | -175.5 | -160.9 | 36.2 | 0 | 0 | 0 | 114.6 | T17 L350 V389 G390 L391 N395 | T17-N393 WeakPolarHBondContact CA-ND2 3.38Å; T17-N393 PolarHBondContact O-ND2 3Å; L350-N393 HydrophobicContact CD1-CB 4.03Å; L350-N393 HydrophobicContact CD2-CB 4.07Å; L350-N393 WeakPolarHBondContact CD2-OD1 3.45Å; V389-N393 WeakPolarHBondContact O-CB 3.39Å; V389-N393 PolarHBondContact O-N 3.02Å; G390-N393 PolarHBondContact O-N 2.78Å; G390-N393 VanDerWaalsContact O-N 3.16Å; L391-N393 VanDerWaalsContact C-N 3.33Å; N393-N395 VanDerWaalsContact C-N 3.29Å; N393-N395 PolarHBondContact O-N 3.24Å |
| 394 | V | 85.8 | Confident | 79.5 | Confident | 85 Ų | 85 | 69 Ų | 69 | 52% | 0.515 | 36% | 0.36 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -59.1 | -43.8 | 176.5 | 174 | 0 | 0 | 0 | 0 | 110.9 | G390 L391 F392 | G390-V394 WeakPolarHBondContact O-CG2 3.27Å; G390-V394 PolarHBondContact O-N 3.34Å; L391-V394 PolarHBondContact O-N 2.77Å; F392-V394 VanDerWaalsContact C-N 3.32Å; F392-V394 PolarHBondContact O-N 3.07Å |
| 395 | N | 80.5 | Confident | 76.9 | Confident | 75 Ų | 75 | 70.5 Ų | 70.5 | 40% | 0.401 | 37% | 0.374 | S | S | . | . | S | Bend | trans | -119.1 | 133 | 175.7 | -66.8 | -35.1 | 0 | 0 | 0 | 108 | N191 H192 N393 | N191-N395 PolarHBondContact ND2-ND2 2.71Å; H192-N395 PolarHBondContact NE2-O 2.77Å; N393-N395 VanDerWaalsContact C-N 3.29Å; N393-N395 PolarHBondContact O-N 3.24Å |
| 396 | Q | 76.5 | Confident | 74.3 | Confident | 117 Ų | 117 | 83 Ų | 83 | 55% | 0.547 | 42% | 0.421 | S | S | . | . | P | Polyproline II helix | trans | -75.6 | 141.2 | 171 | -67.7 | -176.9 | -18.5 | 0 | 0 | 109.4 | V398 | Q396-V398 PolarHBondContact O-N 3.46Š|
| 397 | P | 78.8 | Confident | 71.7 | Confident | 18 Ų | 18 | 84.5 Ų | 84.5 | 12% | 0.117 | 44% | 0.436 | C | S | . | . | P | Polyproline II helix | trans | -54.7 | 133.2 | 170.8 | -25.1 | 33.4 | 0 | 0 | 0 | 110.8 | Y186 Y188 F392 | Y186-P397 HydrophobicContact CD2-CB 3.88Å; Y186-P397 HydrophobicContact CD2-CG 4.39Å; Y186-P397 HydrophobicContact CE2-CB 4.25Å; Y186-P397 HydrophobicContact CG-CB 4.03Å; Y188-P397 HydrophobicContact CD1-CB 4.39Å; Y188-P397 HydrophobicContact CD1-CG 4.39Å; Y188-P397 HydrophobicContact CE1-CB 4.29Å; Y188-P397 HydrophobicContact CE1-CG 4.22Å; F392-P397 HydrophobicContact CE1-CG 4Å; F392-P397 HydrophobicContact CZ-CG 3.96Å |
| 398 | V | 75.3 | Confident | 68.7 | Low | 100 Ų | 100 | 85.6 Ų | 85.6 | 61% | 0.606 | 44% | 0.443 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -82.6 | 126.9 | -179.5 | -176.8 | 0 | 0 | 0 | 0 | 108.7 | R187 Q396 T400 | R187-V398 PolarHBondContact N-O 3.5Å; R187-V398 PolarHBondContact O-N 3.09Å; Q396-V398 PolarHBondContact O-N 3.46Å; V398-T400 PolarHBondContact O-N 2.78Å |
| 399 | I | 74.1 | Confident | 66.5 | Low | 99 Ų | 99 | 91.2 Ų | 91.2 | 51% | 0.508 | 48% | 0.481 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -75.2 | 120.5 | 170.4 | -51.9 | -173.8 | 0 | 0 | 0 | 107.4 | Y186 D401 | Y186-I399 HydrophobicContact CD1-CG1 4.1Å; Y186-I399 HydrophobicContact CE1-CD1 4.19Å; Y186-I399 HydrophobicContact CE1-CG1 3.72Å; I399-D401 PolarHBondContact O-N 3.31Å |
| 400 | T | 66.5 | Low | 63.8 | Low | 33 Ų | 33 | 97.3 Ų | 97.3 | 20% | 0.202 | 51% | 0.507 | C | S | . | . | P | Polyproline II helix | trans | -69.6 | 120 | 174.1 | -46.5 | 0 | 0 | 0 | 0 | 108.6 | S185 R187 V398 K402 | S185-T400 WeakPolarHBondContact O-CB 3.49Å; S185-T400 PolarHBondContact O-N 3.46Å; S185-T400 VanDerWaalsContact O-N 3.09Å; S185-T400 PolarHBondContact O-OG1 3.46Å; R187-T400 WeakPolarHBondContact CG-OG1 3.08Å; R187-T400 PolarHBondContact NE-OG1 2.76Å; V398-T400 PolarHBondContact O-N 2.78Å; T400-K402 PolarHBondContact O-N 3.49Å; T400-K402 VanDerWaalsContact O-N 3.14Å |
| 401 | D | 59.4 | Low | 60.9 | Low | 130 Ų | 130 | 105.7 Ų | 105.7 | 70% | 0.695 | 53% | 0.532 | S | S | * | . | P | Polyproline II helix | trans | -59.1 | 119.7 | 170.9 | -88.3 | -24 | 0 | 0 | 0 | 109.1 | I399 K403 D404 | I399-D401 PolarHBondContact O-N 3.31Å; D401-K403 PolarHBondContact O-N 3.23Å; D401-D404 PolarHBondContact O-N 2.87Å |
| 402 | K | 48.6 | Very low | 58.1 | Low | 129 Ų | 129 | 109.4 Ų | 109.4 | 56% | 0.561 | 55% | 0.552 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -63.4 | 15.3 | 179.6 | -84.8 | -173.4 | 176.8 | 179.3 | 0 | 114.7 | T400 D404 | T400-K402 PolarHBondContact O-N 3.49Å; T400-K402 VanDerWaalsContact O-N 3.14Å; K402-D404 VanDerWaalsContact C-N 3.25Å |
| 403 | K | 44.4 | Very low | 55.5 | Low | 194 Ų | 194 | 114.8 Ų | 114.8 | 84% | 0.843 | 58% | 0.577 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -68.1 | -26.2 | 167.7 | -76 | -175.5 | 178.4 | 174.8 | 0 | 112.1 | D401 | D401-K403 PolarHBondContact O-N 3.23Š|
| 404 | D | 46 | Very low | 52.8 | Low | 144 Ų | 144 | 119.5 Ų | 119.5 | 77% | 0.77 | 61% | 0.606 | S | S | * | * | S | Bend | trans | -99.3 | 6.1 | -176.7 | -76.1 | -13.5 | 0 | 0 | 0 | 116.1 | D401 K402 | D401-D404 PolarHBondContact O-N 2.87Å; K402-D404 VanDerWaalsContact C-N 3.25Å |
| 405 | C | 40.9 | Very low | 50.2 | Low | 80 Ų | 80 | 124.2 Ų | 124.2 | 54% | 0.541 | 62% | 0.62 | S | S | . | * | trans | -129.8 | 92.3 | 172.7 | -73.3 | 0 | 0 | 0 | 0 | 111.5 | S407 | C405-S407 PolarHBondContact O-N 2.93Š| ||
| 406 | R | 39.9 | Very low | 48.1 | Very low | 262 Ų | 262 | 132.2 Ų | 132.2 | 99% | 0.989 | 66% | 0.661 | S | S | * | * | trans | -70.3 | 5.9 | 167.4 | -101.6 | -176 | -173.8 | 178.2 | 3.2 | 114.3 | ||||
| 407 | S | 41.3 | Very low | 46.6 | Very low | 79 Ų | 79 | 133 Ų | 133 | 55% | 0.552 | 67% | 0.667 | S | S | * | * | trans | -129.8 | 102.5 | 175.5 | 56.7 | 0 | 0 | 0 | 0 | 110.1 | C405 | C405-S407 PolarHBondContact O-N 2.93Š| ||
| 408 | N | 31 | Very low | 44.9 | Very low | 141 Ų | 141 | 139.1 Ų | 139.1 | 75% | 0.754 | 70% | 0.696 | S | S | * | * | trans | 168 | 107.3 | 131.5 | -78.8 | -13.3 | 0 | 0 | 0 | 113.3 | F410 | N408-F410 PolarHBondContact O-N 3.32Š| ||
| 409 | C | 47.8 | Very low | 43.3 | Very low | 118 Ų | 118 | 141.2 Ų | 141.2 | 80% | 0.797 | 70% | 0.701 | S | S | * | * | S | Bend | trans | 50 | -6.7 | 141.4 | -128 | 0 | 0 | 0 | 0 | 125.5 | ||
| 410 | F | 37.6 | Very low | 41.4 | Very low | 128 Ų | 128 | 143.7 Ų | 143.7 | 56% | 0.561 | 71% | 0.712 | S | S | * | * | trans | -120.6 | 49.4 | 174.5 | -83.6 | -77.8 | 0 | 0 | 0 | 113.8 | F138 F183 N408 | F138-F410 AromaticContact CE1-CE1 3.9Å; F138-F410 HydrophobicContact CE1-CE1 3.9Å; F138-F410 HydrophobicContact CZ-CD1 4.47Å; F138-F410 HydrophobicContact CZ-CE1 4.05Å; F183-F410 HydrophobicContact CE1-CE2 4.42Å; N408-F410 PolarHBondContact O-N 3.32Å | ||
| 411 | R | 31.6 | Very low | 39.9 | Very low | 197 Ų | 197 | 150.6 Ų | 150.6 | 74% | 0.743 | 74% | 0.744 | S | S | * | * | trans | -124.5 | 54 | 164.4 | -156.4 | -179.6 | -174.4 | 174 | 2.6 | 111.4 | ||||
| 412 | L | 34.5 | Very low | 38.6 | Very low | 156 Ų | 156 | 152 Ų | 152 | 82% | 0.817 | 75% | 0.748 | S | S | * | * | trans | -101.7 | 115.6 | 143.2 | -76.7 | 131.7 | 0 | 0 | 0 | 103 | ||||
| 413 | E | 35.3 | Very low | 37.9 | Very low | 116 Ų | 116 | 153.6 Ų | 153.6 | 54% | 0.542 | 76% | 0.761 | S | S | . | * | S | Bend | cis | -154.6 | 121.4 | 20.9 | -61.5 | 164.6 | 132.5 | 0 | 0 | 105.9 | I134 | I134-E413 WeakPolarHBondContact CD1-OE2 3.21Š|
| 414 | T | 34.2 | Very low | 37.4 | Very low | 109 Ų | 109 | 150.5 Ų | 150.5 | 67% | 0.669 | 75% | 0.754 | S | S | * | * | trans | -157.1 | 65.7 | 150 | 57.4 | 0 | 0 | 0 | 0 | 106.4 | ||||
| 415 | K | 29.3 | Very low | 36.6 | Very low | 183 Ų | 183 | 151.1 Ų | 151.1 | 80% | 0.796 | 75% | 0.753 | S | S | * | * | trans | -142.2 | 85.5 | 160.1 | -89.3 | -164.8 | 176.3 | -173.4 | 0 | 105.9 | ||||
| 416 | L | 36.3 | Very low | 36.2 | Very low | 244 Ų | 244 | 157.5 Ų | 157.5 | 100% | 1.277 | 77% | 0.773 | S | S | * | * | trans | 169.8 | 0 | 157.5 | -88.4 | 153.2 | 0 | 0 | 0 | 105.2 |
Retrieved 416 of 416 residues in 101 ms
(Link to these results)