| 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 | 58.7 | Low | 78.7 | Confident | 196 Ų | 196 | 80.9 Ų | 80.9 | 97% | 0.966 | 42% | 0.423 | S | S | * | . | 0 | -53.4 | 0 | -75.9 | -179.3 | 156.1 | 0 | 0 | 112.6 | V3 F4 G5 | M1-V3 PolarHBondContact O-N 3.01Å; M1-F4 PolarHBondContact O-N 3.34Å; M1-F4 VanDerWaalsContact O-N 3.08Å; M1-G5 PolarHBondContact O-N 2.98Å | |||
| 2 | M | 69.3 | Low | 79.8 | Confident | 44 Ų | 44 | 78 Ų | 78 | 22% | 0.217 | 41% | 0.407 | C | S | . | . | H | α-helix | trans | -53.9 | -45.4 | -179 | -54.1 | -167.8 | 78.7 | 0 | 0 | 114.3 | F4 G5 K6 L7 T31 L32 L122 | M2-F4 PolarHBondContact O-N 3.16Å; M2-G5 PolarHBondContact O-N 3.22Å; M2-K6 WeakPolarHBondContact O-CA 3.48Å; M2-K6 PolarHBondContact O-N 3.26Å; M2-L7 WeakPolarHBondContact CE-O 3.43Å; M2-L7 PolarHBondContact O-N 3.04Å; M2-L7 VanDerWaalsContact O-N 3.13Å; M2-T31 HydrophobicContact CE-CG2 3.2Å; M2-T31 HydrophobicContact SD-CG2 4.45Å; M2-L32 HydrophobicContact SD-CD2 4.28Å; M2-L122 HydrophobicContact CE-CD1 4.3Å |
| 3 | V | 68.6 | Low | 80.8 | Confident | 95 Ų | 95 | 72 Ų | 72 | 58% | 0.576 | 38% | 0.376 | S | S | * | . | H | α-helix | trans | -61.4 | -44.6 | 176.4 | 178 | 0 | 0 | 0 | 0 | 111.6 | M1 K6 Y28 | M1-V3 PolarHBondContact O-N 3.01Å; V3-K6 PolarHBondContact O-N 2.99Å; V3-Y28 HydrophobicContact CG2-CD1 4.45Å; V3-Y28 HydrophobicContact CG2-CE1 3.97Å |
| 4 | F | 71.5 | Confident | 81.7 | Confident | 190 Ų | 190 | 73.8 Ų | 73.8 | 83% | 0.833 | 38% | 0.376 | S | S | * | . | H | α-helix | trans | -70 | -39.5 | 180 | -72 | -74.9 | 0 | 0 | 0 | 112.7 | M1 M2 K6 | M1-F4 PolarHBondContact O-N 3.34Å; M1-F4 VanDerWaalsContact O-N 3.08Å; M2-F4 PolarHBondContact O-N 3.16Å; F4-K6 VanDerWaalsContact C-N 3.26Å; F4-K6 PolarHBondContact O-N 3.12Å |
| 5 | G | 70.4 | Confident | 82.5 | Confident | 58 Ų | 58 | 70.7 Ų | 70.7 | 60% | 0.598 | 36% | 0.361 | S | S | * | . | H | α-helix | trans | -80.1 | -4.1 | 176.7 | 0 | 0 | 0 | 0 | 0 | 114 | M1 M2 L7 | M1-G5 PolarHBondContact O-N 2.98Å; M2-G5 PolarHBondContact O-N 3.22Å; G5-L7 PolarHBondContact O-N 3.48Å |
| 6 | K | 77.4 | Confident | 83.1 | Confident | 168 Ų | 168 | 74.7 Ų | 74.7 | 73% | 0.73 | 38% | 0.375 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 48.9 | 28.4 | -171.7 | -60.7 | -178.9 | 180 | 177.2 | 0 | 113.3 | M2 V3 F4 Y8 | M2-K6 WeakPolarHBondContact O-CA 3.48Å; M2-K6 PolarHBondContact O-N 3.26Å; V3-K6 PolarHBondContact O-N 2.99Å; F4-K6 VanDerWaalsContact C-N 3.26Å; F4-K6 PolarHBondContact O-N 3.12Å; K6-Y8 PolarHBondContact O-N 3.08Å |
| 7 | L | 83.7 | Confident | 83.5 | Confident | 26 Ų | 26 | 72.2 Ų | 72.2 | 14% | 0.136 | 37% | 0.373 | C | S | . | . | trans | -96.6 | 91.6 | -176.9 | -165.9 | 129.4 | 0 | 0 | 0 | 108.3 | M2 G5 W119 L122 E123 | M2-L7 WeakPolarHBondContact CE-O 3.43Å; M2-L7 PolarHBondContact O-N 3.04Å; M2-L7 VanDerWaalsContact O-N 3.13Å; G5-L7 PolarHBondContact O-N 3.48Å; L7-W119 HydrophobicContact CD1-CH2 4.49Å; L7-W119 HydrophobicContact CD1-CZ2 4.3Å; L7-W119 HydrophobicContact CD2-CE3 4.1Å; L7-W119 HydrophobicContact CD2-CH2 4.07Å; L7-W119 HydrophobicContact CD2-CZ2 4.46Å; L7-W119 HydrophobicContact CD2-CZ3 3.87Å; L7-L122 HydrophobicContact CD2-CB 3.76Å; L7-L122 HydrophobicContact CD2-CD1 4.34Å; L7-L122 HydrophobicContact CG-CB 4.47Å; L7-E123 HydrophobicContact CD1-CB 3.89Å; L7-E123 HydrophobicContact CD1-CG 4.08Å | ||
| 8 | Y | 89.9 | Confident | 83.7 | Confident | 54 Ų | 54 | 73.9 Ų | 73.9 | 21% | 0.212 | 39% | 0.392 | C | S | . | . | S | Bend | trans | -148.6 | 158.4 | 176.6 | 70.9 | -79.9 | 0 | 0 | 0 | 109.3 | K6 S10 Y28 T31 | K6-Y8 PolarHBondContact O-N 3.08Å; Y8-S10 VanDerWaalsContact C-N 3.31Å; Y8-S10 PolarHBondContact O-N 3.21Å; Y8-Y28 AromaticContact CD1-CE1 3.86Å; Y8-Y28 HydrophobicContact CD1-CE1 3.86Å; Y8-Y28 AromaticContact CD1-CZ 3.98Å; Y8-Y28 HydrophobicContact CE1-CE1 4.46Å; Y8-Y28 HydrophobicContact CG-CD1 4.15Å; Y8-Y28 AromaticContact CG-CE1 3.9Å; Y8-Y28 HydrophobicContact CG-CE1 3.9Å; Y8-T31 WeakPolarHBondContact CA-OG1 3.17Å |
| 9 | L | 91.2 | Very high | 84.1 | Confident | 18 Ų | 18 | 80.9 Ų | 80.9 | 9% | 0.094 | 41% | 0.413 | C | S | . | . | trans | -63.2 | 91.3 | 170.9 | -68.4 | 175.5 | 0 | 0 | 0 | 109.2 | L23 G27 L30 T31 A34 L122 Q126 | L9-L23 HydrophobicContact CB-CD1 4.1Å; L9-L23 WeakPolarHBondContact O-CD1 3.33Å; L9-G27 WeakPolarHBondContact O-CA 3.24Å; L9-L30 HydrophobicContact CD1-CD2 4.21Å; L9-L30 HydrophobicContact CD1-CG 4.04Å; L9-T31 WeakPolarHBondContact CB-OG1 3.42Å; L9-T31 HydrophobicContact CG-CG2 4.35Å; L9-T31 PolarHBondContact N-OG1 3.35Å; L9-A34 HydrophobicContact CD1-CB 3.86Å; L9-L122 HydrophobicContact CD1-CD2 4.3Å; L9-L122 HydrophobicContact CD2-CD2 3.46Å; L9-L122 VanDerWaalsContact CD2-CD2 3.46Å; L9-L122 HydrophobicContact CG-CD2 3.56Å; L9-Q126 HydrophobicContact CD2-CG 4.44Å | ||
| 10 | S | 91.3 | Very high | 84.5 | Confident | 37 Ų | 37 | 81.3 Ų | 81.3 | 26% | 0.259 | 41% | 0.413 | S | S | . | . | trans | -81.7 | -29.9 | 175.5 | 65.8 | 0 | 0 | 0 | 0 | 111.5 | Y8 V22 L23 Q126 | Y8-S10 VanDerWaalsContact C-N 3.31Å; Y8-S10 PolarHBondContact O-N 3.21Å; S10-V22 WeakPolarHBondContact O-CA 3.2Å; S10-L23 PolarHBondContact O-N 2.93Å; S10-Q126 PolarHBondContact OG-OE1 3.49Å; S10-Q126 VanDerWaalsContact OG-OE1 3.06Å | ||
| 11 | S | 93.2 | Very high | 84.9 | Confident | 4 Ų | 4 | 80.6 Ų | 80.6 | 3% | 0.028 | 41% | 0.409 | C | S | . | . | B | Isolated β-bridge | trans | -141.8 | 144.5 | -177.9 | -177.3 | 0 | 0 | 0 | 0 | 111 | G13 E20 M21 Q126 | S11-G13 VanDerWaalsContact C-N 3.31Å; S11-G13 PolarHBondContact OG-N 3Å; S11-E20 WeakPolarHBondContact CB-OE1 3.49Å; S11-E20 WeakPolarHBondContact OG-CG 3.45Å; S11-E20 PolarHBondContact OG-OE1 3.39Å; S11-M21 WeakPolarHBondContact CA-O 3.38Å; S11-Q126 PolarHBondContact O-NE2 3.26Å |
| 12 | L | 92.9 | Very high | 86.6 | Confident | 46 Ų | 46 | 76 Ų | 76 | 24% | 0.241 | 39% | 0.392 | C | S | . | . | trans | -92.4 | 5.5 | 167.2 | -63.9 | -178.6 | 0 | 0 | 0 | 112.5 | I15 M21 L23 L30 | L12-I15 HydrophobicContact CB-CD1 3.99Å; L12-I15 HydrophobicContact CB-CG1 4.48Å; L12-I15 HydrophobicContact CD1-CD1 4.14Å; L12-I15 WeakPolarHBondContact O-CG2 3.34Å; L12-M21 HydrophobicContact CB-CB 4.3Å; L12-M21 HydrophobicContact CB-CG 4.42Å; L12-M21 HydrophobicContact CD1-CG 4.45Å; L12-M21 HydrophobicContact CD1-SD 3.96Å; L12-M21 PolarHBondContact N-O 2.94Å; L12-L23 HydrophobicContact CD1-CD1 4.47Å; L12-L23 HydrophobicContact CD1-CD2 4.04Å; L12-L23 HydrophobicContact CD2-CD1 4Å; L12-L23 HydrophobicContact CG-CD1 3.87Å; L12-L23 HydrophobicContact CG-CD2 4.09Å; L12-L23 HydrophobicContact CG-CG 4.18Å; L12-L30 HydrophobicContact CD1-CD2 4.25Å; L12-L30 HydrophobicContact CD2-CD2 3.8Å; L12-L30 HydrophobicContact CG-CD2 4.39Å | ||
| 13 | G | 92.9 | Very high | 87.7 | Confident | 0 Ų | 0 | 75.2 Ų | 75.2 | 0% | 0 | 39% | 0.388 | C | S | . | . | trans | 77.8 | -159.8 | -175.9 | 0 | 0 | 0 | 0 | 0 | 112.7 | S11 I15 M21 E210 | S11-G13 VanDerWaalsContact C-N 3.31Å; S11-G13 PolarHBondContact OG-N 3Å; G13-I15 VanDerWaalsContact C-N 3.28Å; G13-I15 PolarHBondContact O-N 2.97Å; G13-I15 VanDerWaalsContact O-N 3.12Å; G13-M21 PolarHBondContact O-N 3.01Å; G13-E210 VanDerWaalsContact CA-OE2 3.28Å; G13-E210 WeakPolarHBondContact CA-OE2 3.34Å | ||
| 14 | Y | 93.5 | Very high | 88.7 | Confident | 97 Ų | 97 | 72 Ų | 72 | 38% | 0.38 | 37% | 0.374 | S | S | . | . | S | Bend | trans | -91 | 54.8 | -171.8 | -65.3 | -88.8 | 0 | 0 | 0 | 111.9 | F16 S18 E20 E210 W211 | Y14-F16 VanDerWaalsContact C-N 3.31Å; Y14-F16 PolarHBondContact O-N 3.32Å; Y14-S18 WeakPolarHBondContact CD1-O 3.32Å; Y14-S18 WeakPolarHBondContact CE1-O 3.41Å; Y14-E20 HydrophobicContact CD1-CB 4.11Å; Y14-E20 HydrophobicContact CE1-CB 3.72Å; Y14-E210 WeakPolarHBondContact CD2-OE1 3.34Å; Y14-E210 PolarHBondContact N-OE2 3.26Å; Y14-W211 PolarHBondContact O-N 3.15Å |
| 15 | I | 92.7 | Very high | 89.5 | Confident | 27 Ų | 27 | 68.3 Ų | 68.3 | 14% | 0.138 | 37% | 0.369 | C | S | . | . | trans | -77.2 | -14.7 | -175.4 | 60.2 | 167.2 | 0 | 0 | 0 | 114 | L12 G13 M21 V135 W211 L214 | L12-I15 HydrophobicContact CB-CD1 3.99Å; L12-I15 HydrophobicContact CB-CG1 4.48Å; L12-I15 HydrophobicContact CD1-CD1 4.14Å; L12-I15 WeakPolarHBondContact O-CG2 3.34Å; G13-I15 VanDerWaalsContact C-N 3.28Å; G13-I15 PolarHBondContact O-N 2.97Å; G13-I15 VanDerWaalsContact O-N 3.12Å; I15-M21 HydrophobicContact CD1-CB 4.37Å; I15-M21 HydrophobicContact CD1-SD 3.73Å; I15-M21 HydrophobicContact CG1-CB 4.08Å; I15-M21 HydrophobicContact CG1-SD 4.34Å; I15-V135 HydrophobicContact CG2-CG2 3.55Å; I15-W211 VanDerWaalsContact O-CB 3.29Å; I15-W211 WeakPolarHBondContact O-CB 3.26Å; I15-L214 HydrophobicContact CB-CD2 3.72Å; I15-L214 HydrophobicContact CG2-CD2 3.8Å | ||
| 16 | F | 92.3 | Very high | 90.5 | Very high | 135 Ų | 135 | 71.2 Ų | 71.2 | 59% | 0.592 | 37% | 0.365 | S | S | * | . | B | Isolated β-bridge | trans | -118.4 | 64.9 | 176.4 | -68.6 | -73.2 | 0 | 0 | 0 | 111.2 | Y14 S18 W19 M21 | Y14-F16 VanDerWaalsContact C-N 3.31Å; Y14-F16 PolarHBondContact O-N 3.32Å; F16-S18 PolarHBondContact O-N 3.39Å; F16-W19 PolarHBondContact O-N 3.46Å; F16-M21 HydrophobicContact CD2-CE 3.59Å; F16-M21 HydrophobicContact CD2-SD 4.26Å; F16-M21 HydrophobicContact CE2-CE 3.28Å; F16-M21 HydrophobicContact CE2-SD 3.85Å; F16-M21 HydrophobicContact CZ-CE 4.38Å |
| 17 | G | 90.1 | Very high | 91.3 | Very high | 33 Ų | 33 | 63.2 Ų | 63.2 | 34% | 0.34 | 33% | 0.33 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 73 | -125.1 | 179.8 | 0 | 0 | 0 | 0 | 0 | 111.5 | ||
| 18 | S | 87.9 | Confident | 91.7 | Very high | 103 Ų | 103 | 65.8 Ų | 65.8 | 72% | 0.72 | 34% | 0.339 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -89.5 | 0.7 | 178.2 | 54.9 | 0 | 0 | 0 | 0 | 113.9 | Y14 F16 | Y14-S18 WeakPolarHBondContact CD1-O 3.32Å; Y14-S18 WeakPolarHBondContact CE1-O 3.41Å; F16-S18 PolarHBondContact O-N 3.39Å |
| 19 | W | 91.4 | Very high | 91.9 | Very high | 206 Ų | 206 | 69.4 Ų | 69.4 | 78% | 0.78 | 36% | 0.356 | S | S | * | . | B | Isolated β-bridge | trans | -90.3 | 119.6 | -180 | -76.7 | 56.1 | 0 | 0 | 0 | 110.6 | F16 M21 | F16-W19 PolarHBondContact O-N 3.46Å; W19-M21 PolarHBondContact O-N 3.49Å |
| 20 | E | 91.1 | Very high | 92 | Very high | 88 Ų | 88 | 70.4 Ų | 70.4 | 41% | 0.411 | 36% | 0.361 | S | S | . | . | trans | -71.2 | 124.7 | 171.8 | -170.6 | -177.8 | -180 | 0 | 0 | 110 | S11 Y14 V22 | S11-E20 WeakPolarHBondContact CB-OE1 3.49Å; S11-E20 WeakPolarHBondContact OG-CG 3.45Å; S11-E20 PolarHBondContact OG-OE1 3.39Å; Y14-E20 HydrophobicContact CD1-CB 4.11Å; Y14-E20 HydrophobicContact CE1-CB 3.72Å; E20-V22 HydrophobicContact CG-CG2 4.2Å; E20-V22 PolarHBondContact O-N 3.28Å; E20-V22 VanDerWaalsContact O-N 3.17Å | ||
| 21 | M | 93.8 | Very high | 92.2 | Very high | 67 Ų | 67 | 68.6 Ų | 68.6 | 33% | 0.33 | 35% | 0.349 | S | S | . | . | trans | -85.8 | 88.8 | 177.4 | 179.1 | 163.7 | -90.7 | 0 | 0 | 111.1 | S11 L12 G13 I15 F16 W19 L23 | S11-M21 WeakPolarHBondContact CA-O 3.38Å; L12-M21 HydrophobicContact CB-CB 4.3Å; L12-M21 HydrophobicContact CB-CG 4.42Å; L12-M21 HydrophobicContact CD1-CG 4.45Å; L12-M21 HydrophobicContact CD1-SD 3.96Å; L12-M21 PolarHBondContact N-O 2.94Å; G13-M21 PolarHBondContact O-N 3.01Å; I15-M21 HydrophobicContact CD1-CB 4.37Å; I15-M21 HydrophobicContact CD1-SD 3.73Å; I15-M21 HydrophobicContact CG1-CB 4.08Å; I15-M21 HydrophobicContact CG1-SD 4.34Å; F16-M21 HydrophobicContact CD2-CE 3.59Å; F16-M21 HydrophobicContact CD2-SD 4.26Å; F16-M21 HydrophobicContact CE2-CE 3.28Å; F16-M21 HydrophobicContact CE2-SD 3.85Å; F16-M21 HydrophobicContact CZ-CE 4.38Å; W19-M21 PolarHBondContact O-N 3.49Å; M21-L23 HydrophobicContact CG-CD2 4.37Å | ||
| 22 | V | 93.7 | Very high | 92.2 | Very high | 100 Ų | 100 | 73.7 Ų | 73.7 | 61% | 0.606 | 38% | 0.375 | S | S | * | . | B | Isolated β-bridge | trans | -80.4 | 127.7 | 174.2 | -176.6 | 0 | 0 | 0 | 0 | 110.6 | S10 E20 | S10-V22 WeakPolarHBondContact O-CA 3.2Å; E20-V22 HydrophobicContact CG-CG2 4.2Å; E20-V22 PolarHBondContact O-N 3.28Å; E20-V22 VanDerWaalsContact O-N 3.17Å |
| 23 | L | 92.1 | Very high | 92.3 | Very high | 28 Ų | 28 | 76.6 Ų | 76.6 | 15% | 0.147 | 39% | 0.386 | C | S | . | . | trans | -92 | -20.8 | -173.6 | -63.2 | 174.6 | 0 | 0 | 0 | 114.1 | L9 S10 L12 M21 F26 L30 | L9-L23 HydrophobicContact CB-CD1 4.1Å; L9-L23 WeakPolarHBondContact O-CD1 3.33Å; S10-L23 PolarHBondContact O-N 2.93Å; L12-L23 HydrophobicContact CD1-CD1 4.47Å; L12-L23 HydrophobicContact CD1-CD2 4.04Å; L12-L23 HydrophobicContact CD2-CD1 4Å; L12-L23 HydrophobicContact CG-CD1 3.87Å; L12-L23 HydrophobicContact CG-CD2 4.09Å; L12-L23 HydrophobicContact CG-CG 4.18Å; M21-L23 HydrophobicContact CG-CD2 4.37Å; L23-F26 WeakPolarHBondContact O-CB 3.33Å; L23-F26 PolarHBondContact O-N 2.86Å; L23-L30 HydrophobicContact CD1-CB 4.48Å; L23-L30 HydrophobicContact CD1-CD2 3.44Å; L23-L30 VanDerWaalsContact CD1-CD2 3.44Å; L23-L30 HydrophobicContact CD2-CD2 4.43Å | ||
| 24 | G | 89.8 | Confident | 92.5 | Very high | 26 Ų | 26 | 77.7 Ų | 77.7 | 27% | 0.268 | 40% | 0.395 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 55.6 | -141.5 | -174.7 | 0 | 0 | 0 | 0 | 0 | 112.4 | F26 G27 | G24-F26 PolarHBondContact O-N 3.41Å; G24-G27 PolarHBondContact O-N 3.49Å |
| 25 | P | 88.5 | Confident | 92.6 | Very high | 113 Ų | 113 | 74.3 Ų | 74.3 | 73% | 0.734 | 38% | 0.384 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -61.1 | -25.3 | -178.9 | -23.9 | 34.3 | 0 | 0 | 0 | 114.7 | G27 Y28 | P25-G27 PolarHBondContact O-N 3.16Å; P25-Y28 WeakPolarHBondContact O-CD2 3.5Å; P25-Y28 PolarHBondContact O-N 3.16Å |
| 26 | F | 91.9 | Very high | 92.7 | Very high | 119 Ų | 119 | 77.3 Ų | 77.3 | 52% | 0.522 | 39% | 0.394 | S | S | . | . | H | α-helix | trans | -63.8 | -22.1 | 175.2 | -174.1 | -107.3 | 0 | 0 | 0 | 112.1 | L23 G24 Y28 F29 L30 | L23-F26 WeakPolarHBondContact O-CB 3.33Å; L23-F26 PolarHBondContact O-N 2.86Å; G24-F26 PolarHBondContact O-N 3.41Å; F26-Y28 PolarHBondContact O-N 2.69Å; F26-F29 HydrophobicContact CD2-CB 4.39Å; F26-F29 HydrophobicContact CD2-CD1 4.47Å; F26-F29 HydrophobicContact CE2-CB 4.35Å; F26-F29 AromaticContact CE2-CD1 3.64Å; F26-F29 HydrophobicContact CE2-CD1 3.64Å; F26-F29 HydrophobicContact CE2-CE1 4.34Å; F26-F29 HydrophobicContact CE2-CG 4.24Å; F26-F29 AromaticContact CZ-CD1 3.73Å; F26-F29 HydrophobicContact CZ-CD1 3.73Å; F26-F29 HydrophobicContact CZ-CE1 4.26Å; F26-F29 PolarHBondContact O-N 3.49Å; F26-F29 VanDerWaalsContact O-N 3.09Å; F26-L30 HydrophobicContact CE1-CB 4.47Å; F26-L30 PolarHBondContact O-N 3.1Å; F26-L30 VanDerWaalsContact O-N 3.12Å |
| 27 | G | 92.9 | Very high | 92.9 | Very high | 0 Ų | 0 | 71.2 Ų | 71.2 | 0% | 0 | 37% | 0.369 | C | S | . | . | H | α-helix | trans | -52 | -36.1 | 173.8 | 0 | 0 | 0 | 0 | 0 | 114 | L9 G24 P25 F29 L30 T31 | L9-G27 WeakPolarHBondContact O-CA 3.24Å; G24-G27 PolarHBondContact O-N 3.49Å; P25-G27 PolarHBondContact O-N 3.16Å; G27-F29 PolarHBondContact O-N 2.69Å; G27-L30 PolarHBondContact O-N 3.34Å; G27-T31 WeakPolarHBondContact O-CB 3.22Å; G27-T31 PolarHBondContact O-N 2.7Å; G27-T31 PolarHBondContact O-OG1 3.38Å |
| 28 | Y | 92.2 | Very high | 93.2 | Very high | 81 Ų | 81 | 69.8 Ų | 69.8 | 32% | 0.318 | 35% | 0.353 | S | S | . | . | H | α-helix | trans | -62.2 | -46.1 | 176.8 | -69.1 | -71.9 | 0 | 0 | 0 | 112.4 | V3 Y8 P25 F26 T31 L32 | V3-Y28 HydrophobicContact CG2-CD1 4.45Å; V3-Y28 HydrophobicContact CG2-CE1 3.97Å; Y8-Y28 AromaticContact CD1-CE1 3.86Å; Y8-Y28 HydrophobicContact CD1-CE1 3.86Å; Y8-Y28 AromaticContact CD1-CZ 3.98Å; Y8-Y28 HydrophobicContact CE1-CE1 4.46Å; Y8-Y28 HydrophobicContact CG-CD1 4.15Å; Y8-Y28 AromaticContact CG-CE1 3.9Å; Y8-Y28 HydrophobicContact CG-CE1 3.9Å; P25-Y28 WeakPolarHBondContact O-CD2 3.5Å; P25-Y28 PolarHBondContact O-N 3.16Å; F26-Y28 PolarHBondContact O-N 2.69Å; Y28-T31 PolarHBondContact O-N 2.92Å; Y28-L32 WeakPolarHBondContact O-CG 3.45Å; Y28-L32 PolarHBondContact O-N 2.93Å |
| 29 | F | 93.5 | Very high | 93.6 | Very high | 129 Ų | 129 | 66.4 Ų | 66.4 | 57% | 0.566 | 33% | 0.327 | S | S | * | . | H | α-helix | trans | -62.8 | -47.8 | 178.4 | 175.7 | -95.4 | 0 | 0 | 0 | 110.7 | F26 G27 T31 L32 F33 | F26-F29 HydrophobicContact CD2-CB 4.39Å; F26-F29 HydrophobicContact CD2-CD1 4.47Å; F26-F29 HydrophobicContact CE2-CB 4.35Å; F26-F29 AromaticContact CE2-CD1 3.64Å; F26-F29 HydrophobicContact CE2-CD1 3.64Å; F26-F29 HydrophobicContact CE2-CE1 4.34Å; F26-F29 HydrophobicContact CE2-CG 4.24Å; F26-F29 AromaticContact CZ-CD1 3.73Å; F26-F29 HydrophobicContact CZ-CD1 3.73Å; F26-F29 HydrophobicContact CZ-CE1 4.26Å; F26-F29 PolarHBondContact O-N 3.49Å; F26-F29 VanDerWaalsContact O-N 3.09Å; G27-F29 PolarHBondContact O-N 2.69Å; F29-T31 PolarHBondContact O-N 3.38Å; F29-L32 PolarHBondContact O-N 3.21Å; F29-F33 PolarHBondContact O-N 3.21Å |
| 30 | L | 94.3 | Very high | 93.8 | Very high | 39 Ų | 39 | 58.3 Ų | 58.3 | 20% | 0.204 | 30% | 0.299 | C | S | . | . | H | α-helix | trans | -63.6 | -34.2 | 179.3 | -169 | 65.3 | 0 | 0 | 0 | 111.9 | L9 L12 L23 F26 G27 F33 A34 | L9-L30 HydrophobicContact CD1-CD2 4.21Å; L9-L30 HydrophobicContact CD1-CG 4.04Å; L12-L30 HydrophobicContact CD1-CD2 4.25Å; L12-L30 HydrophobicContact CD2-CD2 3.8Å; L12-L30 HydrophobicContact CG-CD2 4.39Å; L23-L30 HydrophobicContact CD1-CB 4.48Å; L23-L30 HydrophobicContact CD1-CD2 3.44Å; L23-L30 VanDerWaalsContact CD1-CD2 3.44Å; L23-L30 HydrophobicContact CD2-CD2 4.43Å; F26-L30 HydrophobicContact CE1-CB 4.47Å; F26-L30 PolarHBondContact O-N 3.1Å; F26-L30 VanDerWaalsContact O-N 3.12Å; G27-L30 PolarHBondContact O-N 3.34Å; L30-F33 HydrophobicContact CD1-CD1 4.46Å; L30-F33 WeakPolarHBondContact O-CB 3.45Å; L30-F33 PolarHBondContact O-N 3.13Å; L30-A34 WeakPolarHBondContact O-CB 3.36Å; L30-A34 PolarHBondContact O-N 3.35Å |
| 31 | T | 95 | Very high | 94 | Very high | 0 Ų | 0 | 54.1 Ų | 54.1 | 0% | 0 | 28% | 0.279 | C | S | . | . | H | α-helix | trans | -66.2 | -45.1 | 176.7 | -48.3 | 0 | 0 | 0 | 0 | 111.8 | M2 Y8 L9 G27 Y28 F29 F33 A34 V35 L122 | M2-T31 HydrophobicContact CE-CG2 3.2Å; M2-T31 HydrophobicContact SD-CG2 4.45Å; Y8-T31 WeakPolarHBondContact CA-OG1 3.17Å; L9-T31 WeakPolarHBondContact CB-OG1 3.42Å; L9-T31 HydrophobicContact CG-CG2 4.35Å; L9-T31 PolarHBondContact N-OG1 3.35Å; G27-T31 WeakPolarHBondContact O-CB 3.22Å; G27-T31 PolarHBondContact O-N 2.7Å; G27-T31 PolarHBondContact O-OG1 3.38Å; Y28-T31 PolarHBondContact O-N 2.92Å; F29-T31 PolarHBondContact O-N 3.38Å; T31-F33 PolarHBondContact O-N 3.4Å; T31-A34 PolarHBondContact O-N 3.21Å; T31-A34 VanDerWaalsContact O-N 3.15Å; T31-V35 HydrophobicContact CG2-CG2 4.37Å; T31-V35 WeakPolarHBondContact O-CG2 3.41Å; T31-V35 PolarHBondContact O-N 3.26Å; T31-L122 HydrophobicContact CG2-CD1 3.55Å; T31-L122 HydrophobicContact CG2-CD2 3.74Å; T31-L122 HydrophobicContact CG2-CG 4.31Å |
| 32 | L | 94.3 | Very high | 94.2 | Very high | 111 Ų | 111 | 51 Ų | 51 | 58% | 0.581 | 26% | 0.264 | S | S | * | . | H | α-helix | trans | -58.7 | -41.9 | 174.9 | -68.8 | 175.8 | 0 | 0 | 0 | 111.1 | M2 Y28 F29 W36 | M2-L32 HydrophobicContact SD-CD2 4.28Å; Y28-L32 WeakPolarHBondContact O-CG 3.45Å; Y28-L32 PolarHBondContact O-N 2.93Å; F29-L32 PolarHBondContact O-N 3.21Å; L32-W36 VanDerWaalsContact O-CB 3.27Å; L32-W36 WeakPolarHBondContact O-CB 3.44Å; L32-W36 PolarHBondContact O-N 3.42Å |
| 33 | F | 94.7 | Very high | 94.2 | Very high | 107 Ų | 107 | 48.3 Ų | 48.3 | 47% | 0.469 | 25% | 0.246 | S | C | . | . | H | α-helix | trans | -62.4 | -44.7 | 174.7 | -177.9 | -96.7 | 0 | 0 | 0 | 112 | F29 L30 T31 W36 A37 | F29-F33 PolarHBondContact O-N 3.21Å; L30-F33 HydrophobicContact CD1-CD1 4.46Å; L30-F33 WeakPolarHBondContact O-CB 3.45Å; L30-F33 PolarHBondContact O-N 3.13Å; T31-F33 PolarHBondContact O-N 3.4Å; F33-W36 AromaticContact CD2-CE3 3.97Å; F33-W36 HydrophobicContact CD2-CE3 3.97Å; F33-W36 HydrophobicContact CD2-CZ3 4.06Å; F33-W36 AromaticContact CE2-CE3 3.93Å; F33-W36 HydrophobicContact CE2-CE3 3.93Å; F33-W36 AromaticContact CE2-CZ3 3.54Å; F33-W36 HydrophobicContact CE2-CZ3 3.54Å; F33-W36 HydrophobicContact CZ-CZ3 4.11Å; F33-W36 PolarHBondContact O-N 3.06Å; F33-A37 WeakPolarHBondContact O-CB 3.44Å; F33-A37 PolarHBondContact O-N 3.41Å |
| 34 | A | 96.2 | Very high | 94.1 | Very high | 23 Ų | 23 | 48.4 Ų | 48.4 | 19% | 0.19 | 25% | 0.246 | C | C | . | . | H | α-helix | trans | -64.5 | -43.6 | 179.1 | 0 | 0 | 0 | 0 | 0 | 112.4 | L9 L30 T31 A37 A38 | L9-A34 HydrophobicContact CD1-CB 3.86Å; L30-A34 WeakPolarHBondContact O-CB 3.36Å; L30-A34 PolarHBondContact O-N 3.35Å; T31-A34 PolarHBondContact O-N 3.21Å; T31-A34 VanDerWaalsContact O-N 3.15Å; A34-A37 PolarHBondContact O-N 2.94Å; A34-A38 WeakPolarHBondContact O-CB 3.44Å; A34-A38 PolarHBondContact O-N 3.42Å |
| 35 | V | 96.1 | Very high | 94.2 | Very high | 25 Ų | 25 | 47.2 Ų | 47.2 | 15% | 0.152 | 23% | 0.234 | C | C | . | . | H | α-helix | trans | -60.8 | -50.4 | 175.1 | 172.3 | 0 | 0 | 0 | 0 | 110.4 | T31 A37 A38 I39 F115 I118 L122 | T31-V35 HydrophobicContact CG2-CG2 4.37Å; T31-V35 WeakPolarHBondContact O-CG2 3.41Å; T31-V35 PolarHBondContact O-N 3.26Å; V35-A37 VanDerWaalsContact C-N 3.34Å; V35-A37 PolarHBondContact O-N 3.09Å; V35-A38 PolarHBondContact O-N 3.39Å; V35-I39 HydrophobicContact CG1-CD1 3.75Å; V35-I39 WeakPolarHBondContact O-CB 3.2Å; V35-I39 VanDerWaalsContact O-CG1 3.29Å; V35-I39 WeakPolarHBondContact O-CG1 3.34Å; V35-I39 PolarHBondContact O-N 3.28Å; V35-F115 HydrophobicContact CG1-CD2 4.4Å; V35-I118 HydrophobicContact CB-CG2 4.44Å; V35-I118 HydrophobicContact CG1-CG2 4.28Å; V35-I118 HydrophobicContact CG2-CG1 4.24Å; V35-I118 HydrophobicContact CG2-CG2 4.25Å; V35-L122 HydrophobicContact CG2-CD1 3.61Å |
| 36 | W | 94.8 | Very high | 94.2 | Very high | 91 Ų | 91 | 44 Ų | 44 | 35% | 0.345 | 21% | 0.211 | S | C | . | . | H | α-helix | trans | -58.6 | -46.6 | 177 | 168.3 | 82.6 | 0 | 0 | 0 | 111.7 | L32 F33 N40 M152 F163 | L32-W36 VanDerWaalsContact O-CB 3.27Å; L32-W36 WeakPolarHBondContact O-CB 3.44Å; L32-W36 PolarHBondContact O-N 3.42Å; F33-W36 AromaticContact CD2-CE3 3.97Å; F33-W36 HydrophobicContact CD2-CE3 3.97Å; F33-W36 HydrophobicContact CD2-CZ3 4.06Å; F33-W36 AromaticContact CE2-CE3 3.93Å; F33-W36 HydrophobicContact CE2-CE3 3.93Å; F33-W36 AromaticContact CE2-CZ3 3.54Å; F33-W36 HydrophobicContact CE2-CZ3 3.54Å; F33-W36 HydrophobicContact CZ-CZ3 4.11Å; F33-W36 PolarHBondContact O-N 3.06Å; W36-N40 VanDerWaalsContact CD1-ND2 3.3Å; W36-N40 PolarHBondContact NE1-ND2 3.48Å; W36-N40 VanDerWaalsContact NE1-ND2 3.19Å; W36-N40 WeakPolarHBondContact O-CB 3.4Å; W36-N40 PolarHBondContact O-N 3.02Å; W36-N40 PolarHBondContact O-ND2 3.08Å; W36-M152 HydrophobicContact CH2-CE 3.62Å; W36-M152 HydrophobicContact CZ2-CE 4.3Å; W36-F163 AromaticContact CZ2-CE1 3.82Å; W36-F163 HydrophobicContact CZ2-CE1 3.82Å; W36-F163 AromaticContact CZ2-CZ 3.82Å; W36-F163 HydrophobicContact CZ2-CZ 3.82Å |
| 37 | A | 95.8 | Very high | 94.1 | Very high | 7 Ų | 7 | 40.3 Ų | 40.3 | 6% | 0.058 | 21% | 0.206 | C | C | . | . | H | α-helix | trans | -62.5 | -46.1 | -179.8 | 0 | 0 | 0 | 0 | 0 | 111.6 | F33 A34 V35 N40 A41 M148 | F33-A37 WeakPolarHBondContact O-CB 3.44Å; F33-A37 PolarHBondContact O-N 3.41Å; A34-A37 PolarHBondContact O-N 2.94Å; V35-A37 VanDerWaalsContact C-N 3.34Å; V35-A37 PolarHBondContact O-N 3.09Å; A37-N40 PolarHBondContact O-N 3.44Å; A37-A41 VanDerWaalsContact O-CB 3.24Å; A37-A41 WeakPolarHBondContact O-CB 3.48Å; A37-A41 PolarHBondContact O-N 3.1Å; A37-M148 HydrophobicContact CB-CE 3.91Å |
| 38 | A | 96.9 | Very high | 94.1 | Very high | 2 Ų | 2 | 41 Ų | 41 | 2% | 0.017 | 21% | 0.21 | C | C | . | . | H | α-helix | trans | -65 | -45.5 | 179.8 | 0 | 0 | 0 | 0 | 0 | 112 | A34 V35 N40 A41 F42 I118 | A34-A38 WeakPolarHBondContact O-CB 3.44Å; A34-A38 PolarHBondContact O-N 3.42Å; V35-A38 PolarHBondContact O-N 3.39Å; A38-N40 VanDerWaalsContact C-N 3.33Å; A38-N40 PolarHBondContact O-N 3.35Å; A38-A41 WeakPolarHBondContact O-CB 3.38Å; A38-A41 PolarHBondContact O-N 3.29Å; A38-F42 WeakPolarHBondContact O-CD2 3.43Å; A38-F42 PolarHBondContact O-N 2.93Å; A38-I118 HydrophobicContact CB-CB 3.55Å; A38-I118 HydrophobicContact CB-CD1 4.01Å; A38-I118 HydrophobicContact CB-CG1 3.73Å; A38-I118 HydrophobicContact CB-CG2 4.1Å |
| 39 | I | 96.7 | Very high | 94.2 | Very high | 33 Ų | 33 | 39.5 Ų | 39.5 | 17% | 0.169 | 21% | 0.207 | C | C | . | . | H | α-helix | trans | -56.5 | -49.7 | 176 | -71.5 | 168.5 | 0 | 0 | 0 | 110.7 | V35 A41 F42 N43 T111 F115 | V35-I39 HydrophobicContact CG1-CD1 3.75Å; V35-I39 WeakPolarHBondContact O-CB 3.2Å; V35-I39 VanDerWaalsContact O-CG1 3.29Å; V35-I39 WeakPolarHBondContact O-CG1 3.34Å; V35-I39 PolarHBondContact O-N 3.28Å; I39-A41 VanDerWaalsContact C-N 3.31Å; I39-A41 PolarHBondContact O-N 3.4Å; I39-F42 PolarHBondContact O-N 3.06Å; I39-N43 WeakPolarHBondContact O-CB 3.34Å; I39-N43 PolarHBondContact O-N 3.02Å; I39-T111 HydrophobicContact CG2-CG2 3.77Å; I39-F115 HydrophobicContact CD1-CB 4.16Å; I39-F115 HydrophobicContact CD1-CD2 4.22Å; I39-F115 HydrophobicContact CG1-CB 4.13Å |
| 40 | N | 94.5 | Very high | 94.3 | Very high | 36 Ų | 36 | 33.3 Ų | 33.3 | 19% | 0.193 | 18% | 0.18 | C | C | . | . | H | α-helix | trans | -66.5 | -34.5 | 179.8 | -79.3 | -87.1 | 0 | 0 | 0 | 112 | W36 A37 A38 N43 M44 M148 | W36-N40 VanDerWaalsContact CD1-ND2 3.3Å; W36-N40 PolarHBondContact NE1-ND2 3.48Å; W36-N40 VanDerWaalsContact NE1-ND2 3.19Å; W36-N40 WeakPolarHBondContact O-CB 3.4Å; W36-N40 PolarHBondContact O-N 3.02Å; W36-N40 PolarHBondContact O-ND2 3.08Å; A37-N40 PolarHBondContact O-N 3.44Å; A38-N40 VanDerWaalsContact C-N 3.33Å; A38-N40 PolarHBondContact O-N 3.35Å; N40-N43 PolarHBondContact O-N 3.43Å; N40-M44 WeakPolarHBondContact O-CB 3.44Å; N40-M44 VanDerWaalsContact O-CG 3.26Å; N40-M44 WeakPolarHBondContact O-CG 3.34Å; N40-M44 PolarHBondContact O-N 3Å; N40-M148 HydrophobicContact CB-SD 3.88Å |
| 41 | A | 96.2 | Very high | 94.4 | Very high | 0 Ų | 0 | 31.5 Ų | 31.5 | 0% | 0 | 17% | 0.17 | C | C | . | . | H | α-helix | trans | -62 | -46.6 | 177.2 | 0 | 0 | 0 | 0 | 0 | 111.8 | A37 A38 I39 M44 V45 P144 M148 | A37-A41 VanDerWaalsContact O-CB 3.24Å; A37-A41 WeakPolarHBondContact O-CB 3.48Å; A37-A41 PolarHBondContact O-N 3.1Å; A38-A41 WeakPolarHBondContact O-CB 3.38Å; A38-A41 PolarHBondContact O-N 3.29Å; I39-A41 VanDerWaalsContact C-N 3.31Å; I39-A41 PolarHBondContact O-N 3.4Å; A41-M44 PolarHBondContact O-N 3.03Å; A41-V45 PolarHBondContact O-N 3.14Å; A41-P144 HydrophobicContact CB-CB 3.91Å; A41-M148 HydrophobicContact CB-CB 4.04Å; A41-M148 HydrophobicContact CB-CE 4.37Å; A41-M148 HydrophobicContact CB-CG 4.48Å; A41-M148 HydrophobicContact CB-SD 3.79Å; A41-M148 PolarHBondContact N-SD 3.48Å; A41-M148 VanDerWaalsContact N-SD 3.42Å |
| 42 | F | 97.1 | Very high | 94.5 | Very high | 0 Ų | 0 | 31.5 Ų | 31.5 | 0% | 0 | 17% | 0.17 | C | C | . | . | H | α-helix | trans | -67.6 | -41.5 | 176.1 | -82.8 | -89.7 | 0 | 0 | 0 | 112 | A38 I39 M44 V45 L52 I113 V117 I141 P144 | A38-F42 WeakPolarHBondContact O-CD2 3.43Å; A38-F42 PolarHBondContact O-N 2.93Å; I39-F42 PolarHBondContact O-N 3.06Å; F42-M44 PolarHBondContact O-N 3.49Å; F42-V45 WeakPolarHBondContact O-CG2 3.17Å; F42-V45 PolarHBondContact O-N 3.09Å; F42-L52 HydrophobicContact CB-CD1 4.13Å; F42-L52 HydrophobicContact CD1-CD1 3.79Å; F42-L52 HydrophobicContact CG-CD1 4.47Å; F42-L52 VanDerWaalsContact O-CD1 3.3Å; F42-L52 WeakPolarHBondContact O-CD1 3.48Å; F42-I113 HydrophobicContact CD1-CG2 3.84Å; F42-I113 HydrophobicContact CE1-CG2 4.14Å; F42-I113 HydrophobicContact CG-CG2 4.48Å; F42-V117 HydrophobicContact CE1-CG2 4.44Å; F42-V117 HydrophobicContact CE2-CB 4.13Å; F42-V117 HydrophobicContact CE2-CG1 3.93Å; F42-V117 HydrophobicContact CE2-CG2 4.39Å; F42-V117 HydrophobicContact CZ-CB 4.19Å; F42-V117 HydrophobicContact CZ-CG1 3.96Å; F42-V117 HydrophobicContact CZ-CG2 3.98Å; F42-I141 HydrophobicContact CE2-CB 4.35Å; F42-I141 HydrophobicContact CE2-CG2 3.87Å; F42-I141 HydrophobicContact CZ-CG2 3.98Å; F42-P144 HydrophobicContact CE1-CG 4.33Å; F42-P144 HydrophobicContact CE2-CG 4.5Å; F42-P144 HydrophobicContact CZ-CG 4.25Å |
| 43 | N | 94.1 | Very high | 94.7 | Very high | 44 Ų | 44 | 26.2 Ų | 26.2 | 24% | 0.235 | 14% | 0.143 | C | C | . | . | H | α-helix | trans | -61.7 | -42.4 | 175.2 | -178.9 | -101.5 | 0 | 0 | 0 | 112.2 | I39 N40 V45 D46 D107 S110 | I39-N43 WeakPolarHBondContact O-CB 3.34Å; I39-N43 PolarHBondContact O-N 3.02Å; N40-N43 PolarHBondContact O-N 3.43Å; N43-V45 PolarHBondContact O-N 3.21Å; N43-D46 WeakPolarHBondContact O-CB 3.37Å; N43-D46 PolarHBondContact O-N 3.4Å; N43-D107 PolarHBondContact ND2-OD1 3.44Å; N43-S110 PolarHBondContact ND2-OG 2.9Å |
| 44 | M | 91.1 | Very high | 94.9 | Very high | 30 Ų | 30 | 21.4 Ų | 21.4 | 15% | 0.148 | 12% | 0.123 | C | C | . | . | H | α-helix | trans | -68.2 | -28.4 | -177.6 | -83.1 | -174.1 | 65.8 | 0 | 0 | 114.5 | N40 A41 F42 D46 M148 I151 H169 | N40-M44 WeakPolarHBondContact O-CB 3.44Å; N40-M44 VanDerWaalsContact O-CG 3.26Å; N40-M44 WeakPolarHBondContact O-CG 3.34Å; N40-M44 PolarHBondContact O-N 3Å; A41-M44 PolarHBondContact O-N 3.03Å; F42-M44 PolarHBondContact O-N 3.49Å; M44-D46 VanDerWaalsContact C-N 3.33Å; M44-M148 HydrophobicContact CE-CG 4.47Å; M44-M148 HydrophobicContact SD-CB 4.36Å; M44-M148 HydrophobicContact SD-CG 3.7Å; M44-I151 HydrophobicContact CE-CB 4Å; M44-I151 HydrophobicContact CE-CD1 4.19Å; M44-I151 HydrophobicContact CE-CG2 3.7Å; M44-H169 PolarHBondContact O-CE1 3.38Å; M44-H169 PolarHBondContact O-ND1 3.5Å |
| 45 | V | 91.5 | Very high | 95 | Very high | 1 Ų | 1 | 20.4 Ų | 20.4 | 1% | 0.006 | 11% | 0.114 | C | C | . | . | H | α-helix | trans | -81 | -12.8 | 177.5 | -66 | 0 | 0 | 0 | 0 | 113.5 | A41 F42 N43 G47 L51 L52 L55 P144 D147 | A41-V45 PolarHBondContact O-N 3.14Å; F42-V45 WeakPolarHBondContact O-CG2 3.17Å; F42-V45 PolarHBondContact O-N 3.09Å; N43-V45 PolarHBondContact O-N 3.21Å; V45-G47 PolarHBondContact O-N 3.38Å; V45-L51 WeakPolarHBondContact O-CD2 3.43Å; V45-L52 HydrophobicContact CG2-CD1 4.14Å; V45-L55 HydrophobicContact CB-CD1 4.06Å; V45-L55 HydrophobicContact CG1-CD1 4.35Å; V45-L55 HydrophobicContact CG2-CD1 3.85Å; V45-P144 HydrophobicContact CG1-CB 4.32Å; V45-D147 HydrophobicContact CG1-CB 4.33Å |
| 46 | D | 89.4 | Confident | 95.1 | Very high | 47 Ų | 47 | 19.2 Ų | 19.2 | 25% | 0.251 | 11% | 0.107 | S | C | . | . | trans | -73.8 | 66.6 | 178.5 | -165.6 | 22.9 | 0 | 0 | 0 | 112.5 | N43 M44 L52 | N43-D46 WeakPolarHBondContact O-CB 3.37Å; N43-D46 PolarHBondContact O-N 3.4Å; M44-D46 VanDerWaalsContact C-N 3.33Å; D46-L52 HydrophobicContact CB-CB 4.07Å; D46-L52 HydrophobicContact CB-CD2 3.91Å; D46-L52 HydrophobicContact CB-CG 4.44Å | ||
| 47 | G | 88.8 | Confident | 95.2 | Very high | 41 Ų | 41 | 15.9 Ų | 15.9 | 42% | 0.423 | 10% | 0.097 | S | C | . | . | trans | -119.5 | -10.5 | -176.9 | 0 | 0 | 0 | 0 | 0 | 115.3 | V45 | V45-G47 PolarHBondContact O-N 3.38Š| ||
| 48 | I | 93.7 | Very high | 95.4 | Very high | 15 Ų | 15 | 16.5 Ų | 16.5 | 8% | 0.077 | 10% | 0.101 | C | C | . | . | S | Bend | trans | -142.8 | 155 | 178.1 | 59 | 160.5 | 0 | 0 | 0 | 111.7 | G50 L51 H171 M175 S181 A184 F185 | I48-G50 PolarHBondContact O-N 3.03Å; I48-L51 HydrophobicContact CD1-CB 4.03Å; I48-L51 HydrophobicContact CD1-CD2 4.01Å; I48-L51 HydrophobicContact CG1-CB 3.53Å; I48-L51 HydrophobicContact CG1-CD2 3.65Å; I48-L51 HydrophobicContact CG1-CG 4.21Å; I48-L51 PolarHBondContact O-N 2.83Å; I48-H171 HydrophobicContact CD1-CB 3.8Å; I48-H171 HydrophobicContact CG1-CB 3.99Å; I48-H171 HydrophobicContact CG2-CB 4.22Å; I48-M175 HydrophobicContact CG2-CE 3.52Å; I48-M175 HydrophobicContact CG2-SD 4.04Å; I48-S181 WeakPolarHBondContact CB-OG 3.3Å; I48-A184 HydrophobicContact CD1-CB 3.95Å; I48-F185 HydrophobicContact CD1-CB 4.05Å |
| 49 | D | 94.3 | Very high | 95.5 | Very high | 48 Ų | 48 | 16.5 Ų | 16.5 | 26% | 0.257 | 10% | 0.1 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -55.9 | 128.2 | 179.8 | -57 | -27.2 | 0 | 0 | 0 | 112.3 | L51 N93 L94 K102 | D49-L51 VanDerWaalsContact C-N 3.27Å; D49-L51 PolarHBondContact O-N 3.09Å; D49-N93 WeakPolarHBondContact CA-OD1 3.48Å; D49-L94 HydrophobicContact CB-CD2 4.32Å; D49-K102 VanDerWaalsContact OD1-CE 3.24Å; D49-K102 WeakPolarHBondContact OD1-CE 3.22Å; D49-K102 IonicContact OD1-NZ 3.53Å; D49-K102 PolarHBondContact OD1-NZ 3.27Å; D49-K102 IonicContact OD2-NZ 2.7Å; D49-K102 PolarHBondContact OD2-NZ 3.05Å |
| 50 | G | 95.5 | Very high | 95.6 | Very high | 0 Ų | 0 | 15 Ų | 15 | 0% | 0 | 9% | 0.092 | C | C | . | . | T | Hydrogen-bonded Turn | trans | 85.5 | -19.8 | 175.3 | 0 | 0 | 0 | 0 | 0 | 114.4 | I48 G53 G54 N93 F185 | I48-G50 PolarHBondContact O-N 3.03Å; G50-G53 PolarHBondContact O-N 2.94Å; G50-G54 PolarHBondContact O-N 2.79Å; G50-N93 PolarHBondContact N-OD1 3.45Å; G50-F185 WeakPolarHBondContact O-CE2 3.43Å |
| 51 | L | 96.7 | Very high | 95.8 | Very high | 1 Ų | 1 | 14.6 Ų | 14.6 | 1% | 0.005 | 9% | 0.094 | C | C | . | . | H | α-helix | trans | -66.1 | -51.5 | -166.5 | 178.3 | 62.9 | 0 | 0 | 0 | 113.8 | V45 I48 D49 G53 G54 L55 H171 F185 I188 | V45-L51 WeakPolarHBondContact O-CD2 3.43Å; I48-L51 HydrophobicContact CD1-CB 4.03Å; I48-L51 HydrophobicContact CD1-CD2 4.01Å; I48-L51 HydrophobicContact CG1-CB 3.53Å; I48-L51 HydrophobicContact CG1-CD2 3.65Å; I48-L51 HydrophobicContact CG1-CG 4.21Å; I48-L51 PolarHBondContact O-N 2.83Å; D49-L51 VanDerWaalsContact C-N 3.27Å; D49-L51 PolarHBondContact O-N 3.09Å; L51-G53 VanDerWaalsContact C-N 3.32Å; L51-G53 PolarHBondContact O-N 3.24Å; L51-G54 PolarHBondContact O-N 3.38Å; L51-L55 HydrophobicContact CD1-CD1 3.82Å; L51-L55 HydrophobicContact CD1-CG 3.91Å; L51-L55 HydrophobicContact CG-CD1 3.98Å; L51-L55 HydrophobicContact CG-CG 4.42Å; L51-L55 WeakPolarHBondContact O-CB 3.5Å; L51-L55 WeakPolarHBondContact O-CG 3.41Å; L51-L55 PolarHBondContact O-N 3Å; L51-H171 HydrophobicContact CD2-CB 4Å; L51-F185 HydrophobicContact CB-CD2 4.35Å; L51-F185 HydrophobicContact CD1-CD2 4.46Å; L51-I188 HydrophobicContact CD1-CB 3.78Å; L51-I188 HydrophobicContact CD1-CD1 4.19Å; L51-I188 HydrophobicContact CD1-CG2 3.65Å; L51-I188 HydrophobicContact CD2-CD1 4.04Å |
| 52 | L | 96.7 | Very high | 95.9 | Very high | 0 Ų | 0 | 14.7 Ų | 14.7 | 0% | 0 | 10% | 0.095 | C | C | . | . | H | α-helix | trans | -58.5 | -48.3 | 178.1 | 176.5 | 67.2 | 0 | 0 | 0 | 110.9 | F42 V45 D46 G54 L55 S56 M105 S110 | F42-L52 HydrophobicContact CB-CD1 4.13Å; F42-L52 HydrophobicContact CD1-CD1 3.79Å; F42-L52 HydrophobicContact CG-CD1 4.47Å; F42-L52 VanDerWaalsContact O-CD1 3.3Å; F42-L52 WeakPolarHBondContact O-CD1 3.48Å; V45-L52 HydrophobicContact CG2-CD1 4.14Å; D46-L52 HydrophobicContact CB-CB 4.07Å; D46-L52 HydrophobicContact CB-CD2 3.91Å; D46-L52 HydrophobicContact CB-CG 4.44Å; L52-G54 PolarHBondContact O-N 3.49Å; L52-L55 PolarHBondContact O-N 2.85Å; L52-S56 WeakPolarHBondContact O-CB 3.39Å; L52-S56 PolarHBondContact O-N 2.71Å; L52-S56 PolarHBondContact O-OG 3.38Å; L52-M105 HydrophobicContact CD2-CB 3.95Å; L52-M105 HydrophobicContact CD2-CE 3.58Å; L52-M105 HydrophobicContact CD2-CG 3.52Å; L52-M105 HydrophobicContact CD2-SD 4.33Å; L52-M105 HydrophobicContact CG-CE 4.19Å; L52-S110 VanDerWaalsContact CD2-CB 3.4Å |
| 53 | G | 97.7 | Very high | 95.9 | Very high | 0 Ų | 0 | 14.7 Ų | 14.7 | 0% | 0 | 10% | 0.095 | C | C | . | . | H | α-helix | trans | -58.7 | -46.1 | 178.8 | 0 | 0 | 0 | 0 | 0 | 112 | G50 L51 S56 C57 I90 | G50-G53 PolarHBondContact O-N 2.94Å; L51-G53 VanDerWaalsContact C-N 3.32Å; L51-G53 PolarHBondContact O-N 3.24Å; G53-S56 WeakPolarHBondContact O-CB 3.34Å; G53-S56 PolarHBondContact O-N 2.92Å; G53-C57 PolarHBondContact O-N 3.14Å; G53-C57 PolarHBondContact O-SG 3.08Å; G53-C57 VanDerWaalsContact O-SG 3.36Å; G53-I90 VanDerWaalsContact C-CD1 3.47Å |
| 54 | G | 98.2 | Very high | 96.1 | Very high | 5 Ų | 5 | 12.6 Ų | 12.6 | 5% | 0.052 | 8% | 0.084 | C | C | . | . | H | α-helix | trans | -63.8 | -43.1 | 177.7 | 0 | 0 | 0 | 0 | 0 | 113.5 | G50 L51 L52 S56 C57 V58 | G50-G54 PolarHBondContact O-N 2.79Å; L51-G54 PolarHBondContact O-N 3.38Å; L52-G54 PolarHBondContact O-N 3.49Å; G54-S56 VanDerWaalsContact C-N 3.3Å; G54-S56 PolarHBondContact O-N 2.88Å; G54-C57 PolarHBondContact O-N 3.15Å; G54-V58 WeakPolarHBondContact O-CG2 3.37Å; G54-V58 PolarHBondContact O-N 3.08Å |
| 55 | L | 98.3 | Very high | 96.5 | Very high | 2 Ų | 2 | 14.6 Ų | 14.6 | 1% | 0.01 | 9% | 0.094 | C | C | . | . | H | α-helix | trans | -63.6 | -38.1 | 175.1 | -69.2 | 178.4 | 0 | 0 | 0 | 111.7 | V45 L51 L52 V58 S59 I143 P144 I188 A192 | V45-L55 HydrophobicContact CB-CD1 4.06Å; V45-L55 HydrophobicContact CG1-CD1 4.35Å; V45-L55 HydrophobicContact CG2-CD1 3.85Å; L51-L55 HydrophobicContact CD1-CD1 3.82Å; L51-L55 HydrophobicContact CD1-CG 3.91Å; L51-L55 HydrophobicContact CG-CD1 3.98Å; L51-L55 HydrophobicContact CG-CG 4.42Å; L51-L55 WeakPolarHBondContact O-CB 3.5Å; L51-L55 WeakPolarHBondContact O-CG 3.41Å; L51-L55 PolarHBondContact O-N 3Å; L52-L55 PolarHBondContact O-N 2.85Å; L55-V58 PolarHBondContact O-N 3.32Å; L55-S59 PolarHBondContact O-N 3.32Å; L55-S59 PolarHBondContact O-OG 2.99Å; L55-I143 HydrophobicContact CD1-CG2 4.32Å; L55-I143 HydrophobicContact CD2-CB 4.4Å; L55-I143 HydrophobicContact CD2-CG2 4.23Å; L55-P144 HydrophobicContact CD1-CG 4.22Å; L55-I188 HydrophobicContact CD2-CG2 4.3Å; L55-A192 HydrophobicContact CD2-CB 3.31Å |
| 56 | S | 98.3 | Very high | 96.8 | Very high | 0 Ų | 0 | 15.2 Ų | 15.2 | 0% | 0 | 10% | 0.097 | C | C | . | . | H | α-helix | trans | -63.4 | -45.7 | 175.2 | -49.9 | 0 | 0 | 0 | 0 | 111.2 | L52 G53 G54 V58 S59 F60 I113 | L52-S56 WeakPolarHBondContact O-CB 3.39Å; L52-S56 PolarHBondContact O-N 2.71Å; L52-S56 PolarHBondContact O-OG 3.38Å; G53-S56 WeakPolarHBondContact O-CB 3.34Å; G53-S56 PolarHBondContact O-N 2.92Å; G54-S56 VanDerWaalsContact C-N 3.3Å; G54-S56 PolarHBondContact O-N 2.88Å; S56-V58 VanDerWaalsContact C-N 3.29Å; S56-V58 PolarHBondContact O-N 3.5Å; S56-S59 PolarHBondContact O-N 3.19Å; S56-F60 WeakPolarHBondContact O-CD2 3.1Å; S56-F60 PolarHBondContact O-N 3.12Å; S56-I113 WeakPolarHBondContact OG-CG2 3.48Å |
| 57 | C | 98.7 | Very high | 97.2 | Very high | 21 Ų | 21 | 13 Ų | 13 | 14% | 0.142 | 9% | 0.085 | C | C | . | . | H | α-helix | trans | -59.6 | -40.3 | 175.2 | -72.5 | 0 | 0 | 0 | 0 | 112 | G53 G54 A61 | G53-C57 PolarHBondContact O-N 3.14Å; G53-C57 PolarHBondContact O-SG 3.08Å; G53-C57 VanDerWaalsContact O-SG 3.36Å; G54-C57 PolarHBondContact O-N 3.15Å; C57-A61 WeakPolarHBondContact O-CB 3.26Å; C57-A61 PolarHBondContact O-N 3.06Å |
| 58 | V | 98.7 | Very high | 97.6 | Very high | 21 Ų | 21 | 17.4 Ų | 17.4 | 13% | 0.127 | 9% | 0.089 | C | C | . | . | H | α-helix | trans | -61.3 | -49.3 | 174.6 | 168.7 | 0 | 0 | 0 | 0 | 111 | G54 L55 S56 A61 A62 T189 A192 A193 A196 | G54-V58 WeakPolarHBondContact O-CG2 3.37Å; G54-V58 PolarHBondContact O-N 3.08Å; L55-V58 PolarHBondContact O-N 3.32Å; S56-V58 VanDerWaalsContact C-N 3.29Å; S56-V58 PolarHBondContact O-N 3.5Å; V58-A61 PolarHBondContact O-N 3.41Å; V58-A62 WeakPolarHBondContact O-CB 3.32Å; V58-A62 PolarHBondContact O-N 2.94Å; V58-T189 HydrophobicContact CG2-CG2 3.87Å; V58-A192 HydrophobicContact CG1-CB 4.18Å; V58-A193 HydrophobicContact CG1-CB 4.45Å; V58-A193 HydrophobicContact CG2-CB 4.04Å; V58-A196 HydrophobicContact CG1-CB 3.74Å |
| 59 | S | 98.7 | Very high | 97.6 | Very high | 2 Ų | 2 | 22.9 Ų | 22.9 | 1% | 0.014 | 11% | 0.113 | C | C | . | . | H | α-helix | trans | -63.5 | -47.8 | -179.4 | -61.6 | 0 | 0 | 0 | 0 | 111.9 | L55 S56 A61 A62 I63 I140 | L55-S59 PolarHBondContact O-N 3.32Å; L55-S59 PolarHBondContact O-OG 2.99Å; S56-S59 PolarHBondContact O-N 3.19Å; S59-A61 VanDerWaalsContact C-N 3.34Å; S59-A61 PolarHBondContact O-N 3.02Å; S59-A62 PolarHBondContact O-N 3.39Å; S59-I63 WeakPolarHBondContact O-CD1 2.96Å; S59-I63 VanDerWaalsContact O-CG1 3.24Å; S59-I63 WeakPolarHBondContact O-CG1 3.2Å; S59-I63 PolarHBondContact O-N 2.92Å; S59-I140 PolarHBondContact OG-O 2.87Å |
| 60 | F | 98.7 | Very high | 97.6 | Very high | 0 Ų | 0 | 24.5 Ų | 24.5 | 0% | 0 | 12% | 0.121 | C | C | . | . | H | α-helix | trans | -64.7 | -36.3 | 176.5 | -72.1 | -57.7 | 0 | 0 | 0 | 112.7 | S56 G64 C79 M82 I83 I86 I113 T116 V117 I120 | S56-F60 WeakPolarHBondContact O-CD2 3.1Å; S56-F60 PolarHBondContact O-N 3.12Å; F60-G64 WeakPolarHBondContact O-CA 3.45Å; F60-G64 PolarHBondContact O-N 3.5Å; F60-C79 HydrophobicContact CB-CB 4.29Å; F60-C79 HydrophobicContact CD1-CB 4.34Å; F60-C79 WeakPolarHBondContact O-CB 3.36Å; F60-M82 HydrophobicContact CD1-CB 4.15Å; F60-M82 HydrophobicContact CD1-CG 4.46Å; F60-M82 HydrophobicContact CD2-CB 3.87Å; F60-M82 HydrophobicContact CE1-CB 4.13Å; F60-M82 HydrophobicContact CE1-CG 4.08Å; F60-M82 HydrophobicContact CE2-CB 3.86Å; F60-M82 HydrophobicContact CE2-CE 4.18Å; F60-M82 HydrophobicContact CE2-CG 4.41Å; F60-M82 HydrophobicContact CG-CB 4.04Å; F60-M82 HydrophobicContact CZ-CB 3.99Å; F60-M82 HydrophobicContact CZ-CE 3.9Å; F60-M82 HydrophobicContact CZ-CG 4.06Å; F60-I83 HydrophobicContact CB-CD1 4.02Å; F60-I83 HydrophobicContact CB-CG1 3.69Å; F60-I86 HydrophobicContact CD2-CD1 3.88Å; F60-I86 HydrophobicContact CE2-CD1 3.74Å; F60-I113 HydrophobicContact CE2-CD1 4.12Å; F60-T116 HydrophobicContact CE1-CG2 3.97Å; F60-T116 HydrophobicContact CZ-CG2 3.98Å; F60-V117 HydrophobicContact CD1-CG2 4.45Å; F60-V117 HydrophobicContact CE1-CG2 3.83Å; F60-V117 HydrophobicContact CE2-CG2 4.04Å; F60-V117 HydrophobicContact CZ-CG2 3.59Å; F60-I120 HydrophobicContact CE1-CD1 4.07Å |
| 61 | A | 98.7 | Very high | 97.5 | Very high | 28 Ų | 28 | 26.9 Ų | 26.9 | 23% | 0.231 | 15% | 0.146 | C | C | . | . | H | α-helix | trans | -66 | -44 | 177.2 | 0 | 0 | 0 | 0 | 0 | 110.9 | C57 V58 S59 G64 M65 I83 | C57-A61 WeakPolarHBondContact O-CB 3.26Å; C57-A61 PolarHBondContact O-N 3.06Å; V58-A61 PolarHBondContact O-N 3.41Å; S59-A61 VanDerWaalsContact C-N 3.34Å; S59-A61 PolarHBondContact O-N 3.02Å; A61-G64 PolarHBondContact O-N 3.43Å; A61-M65 WeakPolarHBondContact O-CB 3.49Å; A61-M65 WeakPolarHBondContact O-CE 3.2Å; A61-M65 VanDerWaalsContact O-CG 3.23Å; A61-M65 WeakPolarHBondContact O-CG 3.47Å; A61-M65 PolarHBondContact O-N 2.78Å; A61-I83 HydrophobicContact CB-CD1 3.85Å |
| 62 | A | 98.7 | Very high | 97.4 | Very high | 3 Ų | 3 | 29.9 Ų | 29.9 | 3% | 0.025 | 16% | 0.16 | C | C | . | . | H | α-helix | trans | -62.9 | -48.8 | 178.4 | 0 | 0 | 0 | 0 | 0 | 111.9 | V58 S59 M65 I66 I140 A196 V200 | V58-A62 WeakPolarHBondContact O-CB 3.32Å; V58-A62 PolarHBondContact O-N 2.94Å; S59-A62 PolarHBondContact O-N 3.39Å; A62-M65 PolarHBondContact O-N 3.44Å; A62-I66 WeakPolarHBondContact O-CG1 3.36Å; A62-I66 PolarHBondContact O-N 2.9Å; A62-I66 VanDerWaalsContact O-N 3.16Å; A62-I140 HydrophobicContact CB-CG1 4.02Å; A62-I140 HydrophobicContact CB-CG2 4.29Å; A62-A196 HydrophobicContact CB-CB 3.99Å; A62-V200 HydrophobicContact CB-CG2 3.7Å |
| 63 | I | 98.5 | Very high | 97.3 | Very high | 0 Ų | 0 | 32.8 Ų | 32.8 | 0% | 0 | 18% | 0.178 | C | C | . | . | H | α-helix | trans | -60.6 | -50.5 | 176 | -63.7 | 165.8 | 0 | 0 | 0 | 110 | S59 M65 I66 L67 V117 I120 L121 I132 I140 | S59-I63 WeakPolarHBondContact O-CD1 2.96Å; S59-I63 VanDerWaalsContact O-CG1 3.24Å; S59-I63 WeakPolarHBondContact O-CG1 3.2Å; S59-I63 PolarHBondContact O-N 2.92Å; I63-M65 VanDerWaalsContact C-N 3.33Å; I63-M65 PolarHBondContact O-N 3.34Å; I63-I66 PolarHBondContact O-N 3.24Å; I63-L67 HydrophobicContact CG2-CD1 3.55Å; I63-L67 HydrophobicContact CG2-CG 4.19Å; I63-L67 WeakPolarHBondContact O-CB 3.26Å; I63-L67 VanDerWaalsContact O-CG 3.25Å; I63-L67 WeakPolarHBondContact O-CG 3.27Å; I63-L67 PolarHBondContact O-N 3.02Å; I63-V117 HydrophobicContact CD1-CG1 4.27Å; I63-I120 HydrophobicContact CG2-CG2 3.64Å; I63-L121 HydrophobicContact CD1-CD1 4.5Å; I63-L121 HydrophobicContact CD1-CD2 3.74Å; I63-L121 HydrophobicContact CD1-CG 3.88Å; I63-L121 HydrophobicContact CG1-CD2 3.82Å; I63-I132 HydrophobicContact CG1-CD1 4.47Å; I63-I132 HydrophobicContact CG2-CD1 4.1Å; I63-I140 HydrophobicContact CD1-CG2 4.03Å; I63-I140 HydrophobicContact CG1-CD1 3.9Å; I63-I140 HydrophobicContact CG1-CG2 3.77Å |
| 64 | G | 98.3 | Very high | 97.2 | Very high | 0 Ų | 0 | 37 Ų | 37 | 0% | 0 | 21% | 0.207 | C | C | . | . | H | α-helix | trans | -59.9 | -39.3 | -178.7 | 0 | 0 | 0 | 0 | 0 | 113.2 | F60 A61 W68 A76 | F60-G64 WeakPolarHBondContact O-CA 3.45Å; F60-G64 PolarHBondContact O-N 3.5Å; A61-G64 PolarHBondContact O-N 3.43Å; G64-W68 VanDerWaalsContact O-CB 3.22Å; G64-W68 WeakPolarHBondContact O-CB 3.19Å; G64-W68 PolarHBondContact O-N 3.14Å; G64-A76 WeakPolarHBondContact O-CB 3.39Å |
| 65 | M | 98.1 | Very high | 97.1 | Very high | 72 Ų | 72 | 38.2 Ų | 38.2 | 36% | 0.355 | 21% | 0.212 | S | C | . | . | H | α-helix | trans | -64.3 | -48.6 | 175.2 | -77.2 | -175.4 | -63.4 | 0 | 0 | 112 | A61 A62 I63 L67 W68 F69 V200 | A61-M65 WeakPolarHBondContact O-CB 3.49Å; A61-M65 WeakPolarHBondContact O-CE 3.2Å; A61-M65 VanDerWaalsContact O-CG 3.23Å; A61-M65 WeakPolarHBondContact O-CG 3.47Å; A61-M65 PolarHBondContact O-N 2.78Å; A62-M65 PolarHBondContact O-N 3.44Å; I63-M65 VanDerWaalsContact C-N 3.33Å; I63-M65 PolarHBondContact O-N 3.34Å; M65-L67 VanDerWaalsContact C-N 3.34Å; M65-L67 PolarHBondContact O-N 3.45Å; M65-W68 PolarHBondContact O-N 3.28Å; M65-F69 HydrophobicContact CB-CE2 4.43Å; M65-F69 WeakPolarHBondContact O-CD2 3.47Å; M65-F69 PolarHBondContact O-N 2.89Å; M65-V200 HydrophobicContact CE-CG2 4.46Å |
| 66 | I | 97.7 | Very high | 97 | Very high | 13 Ų | 13 | 38.1 Ų | 38.1 | 7% | 0.067 | 21% | 0.212 | C | C | . | . | H | α-helix | trans | -60.6 | -47.5 | 179.6 | -62.4 | 164.8 | 0 | 0 | 0 | 110 | A62 I63 W68 F69 D70 P131 I132 T136 I140 V200 E203 | A62-I66 WeakPolarHBondContact O-CG1 3.36Å; A62-I66 PolarHBondContact O-N 2.9Å; A62-I66 VanDerWaalsContact O-N 3.16Å; I63-I66 PolarHBondContact O-N 3.24Å; I66-W68 VanDerWaalsContact C-N 3.3Å; I66-W68 PolarHBondContact O-N 2.9Å; I66-F69 PolarHBondContact O-N 3.18Å; I66-D70 WeakPolarHBondContact O-CB 3.46Å; I66-D70 PolarHBondContact O-N 2.98Å; I66-P131 VanDerWaalsContact CG2-O 3.31Å; I66-P131 WeakPolarHBondContact CG2-O 3.39Å; I66-I132 HydrophobicContact CB-CD1 4.41Å; I66-I132 HydrophobicContact CB-CG1 4.22Å; I66-I132 HydrophobicContact CD1-CD1 4.25Å; I66-I132 HydrophobicContact CD1-CG1 4.16Å; I66-I132 HydrophobicContact CG2-CD1 4.45Å; I66-I132 HydrophobicContact CG2-CG1 3.74Å; I66-T136 HydrophobicContact CD1-CG2 3.93Å; I66-I140 HydrophobicContact CD1-CD1 4.04Å; I66-V200 HydrophobicContact CD1-CB 4.47Å; I66-V200 HydrophobicContact CD1-CG2 3.92Å; I66-V200 HydrophobicContact CG1-CB 4.31Å; I66-V200 HydrophobicContact CG1-CG1 4.05Å; I66-V200 HydrophobicContact CG1-CG2 3.99Å; I66-E203 HydrophobicContact CD1-CB 4.49Å; I66-E203 HydrophobicContact CG2-CG 4.16Å |
| 67 | L | 97.3 | Very high | 97 | Very high | 0 Ų | 0 | 42.9 Ų | 42.9 | 0% | 0 | 24% | 0.236 | C | C | . | . | H | α-helix | trans | -64.1 | -34.4 | 179.3 | -65.3 | 174.2 | 0 | 0 | 0 | 113.2 | I63 M65 G71 Q72 L75 A76 I120 T124 P131 | I63-L67 HydrophobicContact CG2-CD1 3.55Å; I63-L67 HydrophobicContact CG2-CG 4.19Å; I63-L67 WeakPolarHBondContact O-CB 3.26Å; I63-L67 VanDerWaalsContact O-CG 3.25Å; I63-L67 WeakPolarHBondContact O-CG 3.27Å; I63-L67 PolarHBondContact O-N 3.02Å; M65-L67 VanDerWaalsContact C-N 3.34Å; M65-L67 PolarHBondContact O-N 3.45Å; L67-G71 PolarHBondContact O-N 3.37Å; L67-G71 VanDerWaalsContact O-N 3.17Å; L67-Q72 HydrophobicContact CB-CB 4.26Å; L67-Q72 HydrophobicContact CD2-CB 4.12Å; L67-Q72 CarbonylContact O-C 3.54Å; L67-Q72 WeakPolarHBondContact O-CA 3.46Å; L67-Q72 PolarHBondContact O-N 3.14Å; L67-L75 HydrophobicContact CD1-CB 3.69Å; L67-A76 HydrophobicContact CB-CB 3.9Å; L67-I120 HydrophobicContact CD1-CG2 4.42Å; L67-T124 HydrophobicContact CD1-CG2 4.07Å; L67-T124 HydrophobicContact CD2-CG2 3.55Å; L67-T124 HydrophobicContact CG-CG2 4.37Å; L67-P131 HydrophobicContact CD2-CB 4.02Å; L67-P131 HydrophobicContact CD2-CG 3.48Å; L67-P131 VanDerWaalsContact CD2-CG 3.48Å |
| 68 | W | 97.2 | Very high | 96.9 | Very high | 134 Ų | 134 | 50.2 Ų | 50.2 | 51% | 0.508 | 26% | 0.261 | S | S | . | . | H | α-helix | trans | -64.6 | -44.3 | 175.1 | -173.9 | -88.4 | 0 | 0 | 0 | 111.3 | G64 M65 I66 G71 T73 A76 I77 F80 | G64-W68 VanDerWaalsContact O-CB 3.22Å; G64-W68 WeakPolarHBondContact O-CB 3.19Å; G64-W68 PolarHBondContact O-N 3.14Å; M65-W68 PolarHBondContact O-N 3.28Å; I66-W68 VanDerWaalsContact C-N 3.3Å; I66-W68 PolarHBondContact O-N 2.9Å; W68-G71 PolarHBondContact O-N 2.93Å; W68-T73 HydrophobicContact CE3-CG2 4.34Å; W68-T73 HydrophobicContact CZ3-CG2 4.33Å; W68-A76 HydrophobicContact CB-CB 4.08Å; W68-A76 HydrophobicContact CE3-CB 4.05Å; W68-I77 HydrophobicContact CZ3-CG1 4.43Å; W68-F80 HydrophobicContact CE3-CE2 4.22Å |
| 69 | F | 94.8 | Very high | 96.9 | Very high | 131 Ų | 131 | 49.2 Ų | 49.2 | 58% | 0.575 | 26% | 0.255 | S | S | * | . | H | α-helix | trans | -71.3 | -31.5 | 178.4 | -69.1 | -56.1 | 0 | 0 | 0 | 113.4 | M65 I66 G71 Y204 | M65-F69 HydrophobicContact CB-CE2 4.43Å; M65-F69 WeakPolarHBondContact O-CD2 3.47Å; M65-F69 PolarHBondContact O-N 2.89Å; I66-F69 PolarHBondContact O-N 3.18Å; F69-G71 PolarHBondContact O-N 3.4Å; F69-Y204 HydrophobicContact CB-CD2 4.42Å; F69-Y204 HydrophobicContact CD1-CE2 4.43Å; F69-Y204 HydrophobicContact CD2-CD2 4.42Å; F69-Y204 HydrophobicContact CG-CD2 4.35Å; F69-Y204 HydrophobicContact CG-CE2 4.33Å |
| 70 | D | 94 | Very high | 96.9 | Very high | 81 Ų | 81 | 52.8 Ų | 52.8 | 43% | 0.433 | 27% | 0.27 | S | S | . | . | H | α-helix | trans | -71.6 | -16.3 | 172.7 | -172.2 | 72.3 | 0 | 0 | 0 | 113 | I66 Q72 P131 | I66-D70 WeakPolarHBondContact O-CB 3.46Å; I66-D70 PolarHBondContact O-N 2.98Å; D70-Q72 WeakPolarHBondContact OD2-CG 3.3Å; D70-Q72 PolarHBondContact OD2-NE2 3.3Å; D70-P131 HydrophobicContact CB-CB 3.82Å; D70-P131 WeakPolarHBondContact OD2-CB 3.42Å |
| 71 | G | 94.6 | Very high | 96.9 | Very high | 50 Ų | 50 | 55.1 Ų | 55.1 | 52% | 0.515 | 29% | 0.29 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 91.8 | 2.6 | -178.4 | 0 | 0 | 0 | 0 | 0 | 114.4 | L67 W68 F69 T73 | L67-G71 PolarHBondContact O-N 3.37Å; L67-G71 VanDerWaalsContact O-N 3.17Å; W68-G71 PolarHBondContact O-N 2.93Å; F69-G71 PolarHBondContact O-N 3.4Å; G71-T73 PolarHBondContact O-N 3.39Å |
| 72 | Q | 94 | Very high | 96.8 | Very high | 64 Ų | 64 | 55.8 Ų | 55.8 | 30% | 0.299 | 29% | 0.288 | S | S | . | . | trans | -77.4 | 59 | 172.1 | -67.4 | -174.3 | 44.4 | 0 | 0 | 111.9 | L67 D70 S74 L75 A76 P131 | L67-Q72 HydrophobicContact CB-CB 4.26Å; L67-Q72 HydrophobicContact CD2-CB 4.12Å; L67-Q72 CarbonylContact O-C 3.54Å; L67-Q72 WeakPolarHBondContact O-CA 3.46Å; L67-Q72 PolarHBondContact O-N 3.14Å; D70-Q72 WeakPolarHBondContact OD2-CG 3.3Å; D70-Q72 PolarHBondContact OD2-NE2 3.3Å; Q72-S74 VanDerWaalsContact C-N 3.26Å; Q72-S74 PolarHBondContact O-N 3.24Å; Q72-L75 PolarHBondContact O-N 3.42Å; Q72-A76 PolarHBondContact O-N 2.82Å; Q72-P131 VanDerWaalsContact NE2-CD 3.33Å; Q72-P131 VanDerWaalsContact NE2-CG 3.28Å | ||
| 73 | T | 95.1 | Very high | 96.8 | Very high | 62 Ų | 62 | 57 Ų | 57 | 38% | 0.38 | 29% | 0.294 | S | S | . | . | H | α-helix | trans | -59.1 | -33.9 | -172.7 | 54.9 | 0 | 0 | 0 | 0 | 113.2 | W68 G71 A76 I77 | W68-T73 HydrophobicContact CE3-CG2 4.34Å; W68-T73 HydrophobicContact CZ3-CG2 4.33Å; G71-T73 PolarHBondContact O-N 3.39Å; T73-A76 PolarHBondContact O-N 3.26Å; T73-I77 WeakPolarHBondContact O-CB 3.48Å; T73-I77 WeakPolarHBondContact O-CD1 3.39Å; T73-I77 WeakPolarHBondContact O-CG1 3.16Å; T73-I77 PolarHBondContact O-N 3.34Å |
| 74 | S | 95.4 | Very high | 96.8 | Very high | 87 Ų | 87 | 60 Ų | 60 | 61% | 0.608 | 32% | 0.318 | S | S | * | . | H | α-helix | trans | -61 | -51.1 | 178.2 | -54.7 | 0 | 0 | 0 | 0 | 112.3 | Q72 I77 W78 | Q72-S74 VanDerWaalsContact C-N 3.26Å; Q72-S74 PolarHBondContact O-N 3.24Å; S74-I77 PolarHBondContact O-N 2.7Å; S74-W78 PolarHBondContact O-N 3.36Å |
| 75 | L | 94.7 | Very high | 96.8 | Very high | 32 Ų | 32 | 63.3 Ų | 63.3 | 17% | 0.168 | 35% | 0.346 | C | S | . | . | H | α-helix | trans | -70.9 | -32.6 | 178 | -71.4 | 177.1 | 0 | 0 | 0 | 112.1 | L67 Q72 W78 C79 T124 | L67-L75 HydrophobicContact CD1-CB 3.69Å; Q72-L75 PolarHBondContact O-N 3.42Å; L75-W78 WeakPolarHBondContact O-CB 3.39Å; L75-W78 PolarHBondContact O-N 3.49Å; L75-C79 PolarHBondContact O-N 3.19Å; L75-C79 VanDerWaalsContact O-N 3.08Å; L75-C79 PolarHBondContact O-SG 3.05Å; L75-C79 VanDerWaalsContact O-SG 3.33Å; L75-T124 HydrophobicContact CD1-CG2 3.93Å |
| 76 | A | 97.7 | Very high | 96.8 | Very high | 0 Ų | 0 | 60.4 Ų | 60.4 | 0% | 0 | 33% | 0.332 | C | S | . | . | H | α-helix | trans | -60.5 | -45.4 | 172.7 | 0 | 0 | 0 | 0 | 0 | 111.7 | G64 L67 W68 Q72 T73 W78 C79 F80 | G64-A76 WeakPolarHBondContact O-CB 3.39Å; L67-A76 HydrophobicContact CB-CB 3.9Å; W68-A76 HydrophobicContact CB-CB 4.08Å; W68-A76 HydrophobicContact CE3-CB 4.05Å; Q72-A76 PolarHBondContact O-N 2.82Å; T73-A76 PolarHBondContact O-N 3.26Å; A76-W78 VanDerWaalsContact C-N 3.3Å; A76-W78 PolarHBondContact O-N 3.29Å; A76-C79 WeakPolarHBondContact O-CB 3.36Å; A76-C79 PolarHBondContact O-N 3.18Å; A76-C79 VanDerWaalsContact O-N 3.11Å; A76-F80 HydrophobicContact CB-CE2 4.19Å; A76-F80 WeakPolarHBondContact O-CD2 3.3Å; A76-F80 PolarHBondContact O-N 3.41Å |
| 77 | I | 97.9 | Very high | 96.7 | Very high | 99 Ų | 99 | 64 Ų | 64 | 51% | 0.508 | 35% | 0.351 | S | S | . | . | H | α-helix | trans | -61 | -39.9 | 176.2 | -70.8 | 164 | 0 | 0 | 0 | 110.8 | W68 T73 S74 C79 F80 A81 | W68-I77 HydrophobicContact CZ3-CG1 4.43Å; T73-I77 WeakPolarHBondContact O-CB 3.48Å; T73-I77 WeakPolarHBondContact O-CD1 3.39Å; T73-I77 WeakPolarHBondContact O-CG1 3.16Å; T73-I77 PolarHBondContact O-N 3.34Å; S74-I77 PolarHBondContact O-N 2.7Å; I77-C79 VanDerWaalsContact C-N 3.33Å; I77-C79 PolarHBondContact O-N 2.84Å; I77-F80 PolarHBondContact O-N 3.42Å; I77-A81 VanDerWaalsContact O-CB 3.28Å; I77-A81 WeakPolarHBondContact O-CB 3.3Å; I77-A81 PolarHBondContact O-N 3.46Å |
| 78 | W | 96.7 | Very high | 96.7 | Very high | 176 Ų | 176 | 67.4 Ų | 67.4 | 67% | 0.667 | 37% | 0.373 | S | S | * | . | H | α-helix | trans | -58.6 | -43.8 | 173.4 | -81.8 | 108.1 | 0 | 0 | 0 | 112.3 | S74 L75 A76 A81 M82 | S74-W78 PolarHBondContact O-N 3.36Å; L75-W78 WeakPolarHBondContact O-CB 3.39Å; L75-W78 PolarHBondContact O-N 3.49Å; A76-W78 VanDerWaalsContact C-N 3.3Å; A76-W78 PolarHBondContact O-N 3.29Å; W78-A81 PolarHBondContact O-N 2.9Å; W78-M82 WeakPolarHBondContact O-CG 3.18Å; W78-M82 PolarHBondContact O-N 2.98Å |
| 79 | C | 98.3 | Very high | 96.7 | Very high | 0 Ų | 0 | 62.3 Ų | 62.3 | 0% | 0 | 35% | 0.354 | C | S | . | . | H | α-helix | trans | -61.5 | -45.8 | 176.2 | -64.6 | 0 | 0 | 0 | 0 | 111.7 | F60 L75 A76 I77 A81 M82 I83 | F60-C79 HydrophobicContact CB-CB 4.29Å; F60-C79 HydrophobicContact CD1-CB 4.34Å; F60-C79 WeakPolarHBondContact O-CB 3.36Å; L75-C79 PolarHBondContact O-N 3.19Å; L75-C79 VanDerWaalsContact O-N 3.08Å; L75-C79 PolarHBondContact O-SG 3.05Å; L75-C79 VanDerWaalsContact O-SG 3.33Å; A76-C79 WeakPolarHBondContact O-CB 3.36Å; A76-C79 PolarHBondContact O-N 3.18Å; A76-C79 VanDerWaalsContact O-N 3.11Å; I77-C79 VanDerWaalsContact C-N 3.33Å; I77-C79 PolarHBondContact O-N 2.84Å; C79-A81 PolarHBondContact O-N 3.43Å; C79-M82 WeakPolarHBondContact O-CB 3.32Å; C79-M82 PolarHBondContact O-N 3.4Å; C79-I83 WeakPolarHBondContact O-CG1 3.37Å; C79-I83 PolarHBondContact O-N 2.8Å; C79-I83 VanDerWaalsContact O-N 3.1Å |
| 80 | F | 98.4 | Very high | 96.8 | Very high | 77 Ų | 77 | 57 Ų | 57 | 34% | 0.338 | 33% | 0.331 | S | S | . | . | H | α-helix | trans | -68.3 | -33.3 | 178.1 | -61.6 | -51.4 | 0 | 0 | 0 | 112.9 | W68 A76 I77 I83 A84 | W68-F80 HydrophobicContact CE3-CE2 4.22Å; A76-F80 HydrophobicContact CB-CE2 4.19Å; A76-F80 WeakPolarHBondContact O-CD2 3.3Å; A76-F80 PolarHBondContact O-N 3.41Å; I77-F80 PolarHBondContact O-N 3.42Å; F80-I83 HydrophobicContact CD1-CD1 4.1Å; F80-I83 WeakPolarHBondContact O-CB 3.25Å; F80-I83 PolarHBondContact O-N 2.9Å; F80-A84 PolarHBondContact O-N 3.49Å |
| 81 | A | 98.2 | Very high | 96.9 | Very high | 49 Ų | 49 | 57.4 Ų | 57.4 | 41% | 0.405 | 33% | 0.332 | S | S | . | . | H | α-helix | trans | -64.9 | -40.3 | 172.6 | 0 | 0 | 0 | 0 | 0 | 111.5 | I77 W78 C79 I83 A84 A85 | I77-A81 VanDerWaalsContact O-CB 3.28Å; I77-A81 WeakPolarHBondContact O-CB 3.3Å; I77-A81 PolarHBondContact O-N 3.46Å; W78-A81 PolarHBondContact O-N 2.9Å; C79-A81 PolarHBondContact O-N 3.43Å; A81-I83 VanDerWaalsContact C-N 3.33Å; A81-I83 PolarHBondContact O-N 2.83Å; A81-A84 PolarHBondContact O-N 3.41Å; A81-A85 WeakPolarHBondContact O-CB 3.4Å; A81-A85 PolarHBondContact O-N 2.68Å |
| 82 | M | 98.1 | Very high | 97 | Very high | 42 Ų | 42 | 57.3 Ų | 57.3 | 21% | 0.207 | 32% | 0.319 | C | S | . | . | H | α-helix | trans | -61.1 | -42 | 172.8 | -69.5 | -62.2 | -69.1 | 0 | 0 | 111.3 | F60 W78 C79 A85 I86 I113 T116 | F60-M82 HydrophobicContact CD1-CB 4.15Å; F60-M82 HydrophobicContact CD1-CG 4.46Å; F60-M82 HydrophobicContact CD2-CB 3.87Å; F60-M82 HydrophobicContact CE1-CB 4.13Å; F60-M82 HydrophobicContact CE1-CG 4.08Å; F60-M82 HydrophobicContact CE2-CB 3.86Å; F60-M82 HydrophobicContact CE2-CE 4.18Å; F60-M82 HydrophobicContact CE2-CG 4.41Å; F60-M82 HydrophobicContact CG-CB 4.04Å; F60-M82 HydrophobicContact CZ-CB 3.99Å; F60-M82 HydrophobicContact CZ-CE 3.9Å; F60-M82 HydrophobicContact CZ-CG 4.06Å; W78-M82 WeakPolarHBondContact O-CG 3.18Å; W78-M82 PolarHBondContact O-N 2.98Å; C79-M82 WeakPolarHBondContact O-CB 3.32Å; C79-M82 PolarHBondContact O-N 3.4Å; M82-A85 PolarHBondContact O-N 2.74Å; M82-I86 WeakPolarHBondContact O-CB 3.47Å; M82-I86 VanDerWaalsContact O-CD1 3.3Å; M82-I86 WeakPolarHBondContact O-CD1 3.43Å; M82-I86 WeakPolarHBondContact O-CG1 3.45Å; M82-I86 PolarHBondContact O-N 3.03Å; M82-I113 HydrophobicContact CE-CD1 3.75Å; M82-T116 HydrophobicContact CE-CG2 4.16Å |
| 83 | I | 98.6 | Very high | 97.1 | Very high | 29 Ų | 29 | 54.4 Ų | 54.4 | 15% | 0.149 | 31% | 0.306 | C | S | . | . | H | α-helix | trans | -60.1 | -48.5 | 173.8 | -63.6 | 172.3 | 0 | 0 | 0 | 110.6 | F60 A61 C79 F80 A81 A85 I86 L87 | F60-I83 HydrophobicContact CB-CD1 4.02Å; F60-I83 HydrophobicContact CB-CG1 3.69Å; A61-I83 HydrophobicContact CB-CD1 3.85Å; C79-I83 WeakPolarHBondContact O-CG1 3.37Å; C79-I83 PolarHBondContact O-N 2.8Å; C79-I83 VanDerWaalsContact O-N 3.1Å; F80-I83 HydrophobicContact CD1-CD1 4.1Å; F80-I83 WeakPolarHBondContact O-CB 3.25Å; F80-I83 PolarHBondContact O-N 2.9Å; A81-I83 VanDerWaalsContact C-N 3.33Å; A81-I83 PolarHBondContact O-N 2.83Å; I83-A85 PolarHBondContact O-N 3.26Å; I83-I86 PolarHBondContact O-N 3.35Å; I83-I86 VanDerWaalsContact O-N 3.08Å; I83-L87 HydrophobicContact CG2-CD1 4.2Å; I83-L87 HydrophobicContact CG2-CG 4.23Å; I83-L87 WeakPolarHBondContact O-CG 3.43Å; I83-L87 PolarHBondContact O-N 3.06Å |
| 84 | A | 98.5 | Very high | 97.1 | Very high | 61 Ų | 61 | 52.8 Ų | 52.8 | 50% | 0.504 | 29% | 0.294 | S | S | . | . | H | α-helix | trans | -58.3 | -37.1 | 178.7 | 0 | 0 | 0 | 0 | 0 | 112.3 | F80 A81 P88 | F80-A84 PolarHBondContact O-N 3.49Å; A81-A84 PolarHBondContact O-N 3.41Å; A84-P88 WeakPolarHBondContact O-CD 3.44Å |
| 85 | A | 97.2 | Very high | 97 | Very high | 71 Ų | 71 | 49.4 Ų | 49.4 | 59% | 0.587 | 27% | 0.273 | S | S | * | . | H | α-helix | trans | -72.4 | -32.8 | 175.5 | 0 | 0 | 0 | 0 | 0 | 113.4 | A81 M82 I83 | A81-A85 WeakPolarHBondContact O-CB 3.4Å; A81-A85 PolarHBondContact O-N 2.68Å; M82-A85 PolarHBondContact O-N 2.74Å; I83-A85 PolarHBondContact O-N 3.26Å |
| 86 | I | 97.7 | Very high | 96.9 | Very high | 10 Ų | 10 | 52.5 Ų | 52.5 | 5% | 0.051 | 29% | 0.289 | C | S | . | . | H | α-helix | trans | -79.7 | -29.9 | -178.6 | -68.6 | 163.1 | 0 | 0 | 0 | 112.1 | F60 M82 I83 Y89 I90 I113 | F60-I86 HydrophobicContact CD2-CD1 3.88Å; F60-I86 HydrophobicContact CE2-CD1 3.74Å; M82-I86 WeakPolarHBondContact O-CB 3.47Å; M82-I86 VanDerWaalsContact O-CD1 3.3Å; M82-I86 WeakPolarHBondContact O-CD1 3.43Å; M82-I86 WeakPolarHBondContact O-CG1 3.45Å; M82-I86 PolarHBondContact O-N 3.03Å; I83-I86 PolarHBondContact O-N 3.35Å; I83-I86 VanDerWaalsContact O-N 3.08Å; I86-Y89 HydrophobicContact CG2-CD1 4.37Å; I86-Y89 WeakPolarHBondContact O-CA 3.33Å; I86-Y89 VanDerWaalsContact O-CB 3.31Å; I86-Y89 WeakPolarHBondContact O-CB 3.29Å; I86-Y89 PolarHBondContact O-N 2.97Å; I86-Y89 VanDerWaalsContact O-N 3.07Å; I86-I90 HydrophobicContact CG2-CD1 3.77Å; I86-I90 HydrophobicContact CG2-CG1 3.91Å; I86-I90 PolarHBondContact O-N 2.88Å; I86-I113 HydrophobicContact CD1-CD1 3.75Å; I86-I113 HydrophobicContact CG1-CD1 4.26Å |
| 87 | L | 97.2 | Very high | 96.6 | Very high | 89 Ų | 89 | 57.8 Ų | 57.8 | 47% | 0.466 | 32% | 0.316 | S | S | . | . | H | α-helix | trans | -56.9 | -48.8 | -177.2 | -78.1 | 173.6 | 0 | 0 | 0 | 113.6 | I83 Y89 I90 M91 | I83-L87 HydrophobicContact CG2-CD1 4.2Å; I83-L87 HydrophobicContact CG2-CG 4.23Å; I83-L87 WeakPolarHBondContact O-CG 3.43Å; I83-L87 PolarHBondContact O-N 3.06Å; L87-Y89 VanDerWaalsContact C-N 3.28Å; L87-Y89 PolarHBondContact O-N 3.49Å; L87-I90 PolarHBondContact O-N 2.91Å; L87-M91 WeakPolarHBondContact O-CG 3.36Å; L87-M91 PolarHBondContact O-N 3.01Å; L87-M91 VanDerWaalsContact O-N 3.09Å |
| 88 | P | 96.8 | Very high | 96.2 | Very high | 71 Ų | 71 | 54.6 Ų | 54.6 | 46% | 0.461 | 31% | 0.308 | S | S | . | . | H | α-helix | trans | -57.2 | -40.6 | 173.3 | -25.7 | 34.1 | 0 | 0 | 0 | 112.8 | A84 M91 L92 | A84-P88 WeakPolarHBondContact O-CD 3.44Å; P88-M91 PolarHBondContact O-N 3.36Å; P88-L92 VanDerWaalsContact O-CG 3.32Å; P88-L92 WeakPolarHBondContact O-CG 3.15Å; P88-L92 PolarHBondContact O-N 2.72Å |
| 89 | Y | 96.1 | Very high | 95.8 | Very high | 28 Ų | 28 | 57.2 Ų | 57.2 | 11% | 0.11 | 32% | 0.318 | C | S | . | . | H | α-helix | trans | -59.4 | -48.1 | 175.3 | 160.3 | -100.7 | 0 | 0 | 0 | 111.5 | I86 L87 M91 L92 N93 V103 M105 | I86-Y89 HydrophobicContact CG2-CD1 4.37Å; I86-Y89 WeakPolarHBondContact O-CA 3.33Å; I86-Y89 VanDerWaalsContact O-CB 3.31Å; I86-Y89 WeakPolarHBondContact O-CB 3.29Å; I86-Y89 PolarHBondContact O-N 2.97Å; I86-Y89 VanDerWaalsContact O-N 3.07Å; L87-Y89 VanDerWaalsContact C-N 3.28Å; L87-Y89 PolarHBondContact O-N 3.49Å; Y89-M91 VanDerWaalsContact C-N 3.3Å; Y89-M91 PolarHBondContact O-N 3.33Å; Y89-L92 PolarHBondContact O-N 3.37Å; Y89-N93 HydrophobicContact CD2-CB 4.35Å; Y89-N93 HydrophobicContact CE1-CB 4.43Å; Y89-N93 HydrophobicContact CE2-CB 3.8Å; Y89-N93 WeakPolarHBondContact O-CB 3.41Å; Y89-N93 PolarHBondContact O-N 2.81Å; Y89-V103 HydrophobicContact CD2-CG1 4.27Å; Y89-M105 HydrophobicContact CD1-SD 4.37Å; Y89-M105 HydrophobicContact CE1-SD 4.06Å; Y89-M105 HydrophobicContact CE2-CB 4.1Å; Y89-M105 HydrophobicContact CE2-SD 4.25Å; Y89-M105 WeakPolarHBondContact OH-CB 3.48Å; Y89-M105 PolarHBondContact OH-N 2.76Å |
| 90 | I | 96.6 | Very high | 95.5 | Very high | 18 Ų | 18 | 67.6 Ų | 67.6 | 9% | 0.092 | 36% | 0.357 | C | S | . | . | H | α-helix | trans | -57.8 | -44.5 | 178.4 | -66.8 | 170.6 | 0 | 0 | 0 | 110.6 | G53 I86 L87 L92 N93 L94 | G53-I90 VanDerWaalsContact C-CD1 3.47Å; I86-I90 HydrophobicContact CG2-CD1 3.77Å; I86-I90 HydrophobicContact CG2-CG1 3.91Å; I86-I90 PolarHBondContact O-N 2.88Å; L87-I90 PolarHBondContact O-N 2.91Å; I90-L92 PolarHBondContact O-N 2.96Å; I90-N93 PolarHBondContact O-N 3.1Å; I90-L94 HydrophobicContact CG2-CD1 3.73Å; I90-L94 HydrophobicContact CG2-CG 4.25Å; I90-L94 WeakPolarHBondContact O-CB 3.18Å; I90-L94 VanDerWaalsContact O-CG 3.28Å; I90-L94 WeakPolarHBondContact O-CG 3.34Å; I90-L94 PolarHBondContact O-N 2.96Å |
| 91 | M | 96.6 | Very high | 95.2 | Very high | 91 Ų | 91 | 70 Ų | 70 | 45% | 0.448 | 37% | 0.365 | S | S | . | . | H | α-helix | trans | -62.3 | -44.9 | -179.7 | -66.1 | -178.6 | 72.5 | 0 | 0 | 112.3 | L87 P88 Y89 G95 I96 | L87-M91 WeakPolarHBondContact O-CG 3.36Å; L87-M91 PolarHBondContact O-N 3.01Å; L87-M91 VanDerWaalsContact O-N 3.09Å; P88-M91 PolarHBondContact O-N 3.36Å; Y89-M91 VanDerWaalsContact C-N 3.3Å; Y89-M91 PolarHBondContact O-N 3.33Å; M91-G95 PolarHBondContact O-N 3.27Å; M91-I96 HydrophobicContact CB-CD1 4.13Å; M91-I96 HydrophobicContact CE-CG2 4.46Å; M91-I96 HydrophobicContact CG-CD1 4.14Å; M91-I96 WeakPolarHBondContact O-CB 3.4Å; M91-I96 WeakPolarHBondContact O-CG1 3.4Å; M91-I96 PolarHBondContact O-N 3.49Å |
| 92 | L | 96.6 | Very high | 95 | Very high | 47 Ų | 47 | 70.6 Ų | 70.6 | 25% | 0.246 | 36% | 0.358 | C | S | . | . | H | α-helix | trans | -67.4 | -42.5 | 177.2 | -66.6 | 175.3 | 0 | 0 | 0 | 111.4 | P88 Y89 I90 L94 G95 L97 K102 V103 | P88-L92 VanDerWaalsContact O-CG 3.32Å; P88-L92 WeakPolarHBondContact O-CG 3.15Å; P88-L92 PolarHBondContact O-N 2.72Å; Y89-L92 PolarHBondContact O-N 3.37Å; I90-L92 PolarHBondContact O-N 2.96Å; L92-L94 PolarHBondContact O-N 3.33Å; L92-G95 WeakPolarHBondContact O-CA 3.16Å; L92-G95 PolarHBondContact O-N 3.26Å; L92-L97 HydrophobicContact CD2-CB 4.4Å; L92-L97 HydrophobicContact CD2-CD1 3.76Å; L92-L97 HydrophobicContact CD2-CG 4.36Å; L92-K102 WeakPolarHBondContact O-CA 3.47Å; L92-V103 HydrophobicContact CB-CB 4.23Å; L92-V103 HydrophobicContact CB-CG2 4.13Å; L92-V103 HydrophobicContact CD1-CG2 3.95Å |
| 93 | N | 95.8 | Very high | 94.8 | Very high | 4 Ų | 4 | 71.7 Ų | 71.7 | 2% | 0.021 | 37% | 0.367 | C | S | . | . | H | α-helix | trans | -67.5 | -35.8 | -179.5 | -175.5 | -110 | 0 | 0 | 0 | 112.5 | D49 G50 Y89 I90 G95 K102 V103 | D49-N93 WeakPolarHBondContact CA-OD1 3.48Å; G50-N93 PolarHBondContact N-OD1 3.45Å; Y89-N93 HydrophobicContact CD2-CB 4.35Å; Y89-N93 HydrophobicContact CE1-CB 4.43Å; Y89-N93 HydrophobicContact CE2-CB 3.8Å; Y89-N93 WeakPolarHBondContact O-CB 3.41Å; Y89-N93 PolarHBondContact O-N 2.81Å; I90-N93 PolarHBondContact O-N 3.1Å; N93-G95 PolarHBondContact O-N 3.29Å; N93-K102 VanDerWaalsContact O-CE 3.22Å; N93-K102 WeakPolarHBondContact O-CE 3.24Å; N93-V103 WeakPolarHBondContact CA-O 3.13Å; N93-V103 VanDerWaalsContact CB-O 3.3Å; N93-V103 WeakPolarHBondContact CB-O 3.32Å; N93-V103 PolarHBondContact ND2-O 3Å |
| 94 | L | 95.5 | Very high | 94.5 | Very high | 27 Ų | 27 | 76.8 Ų | 76.8 | 14% | 0.141 | 39% | 0.389 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -70.8 | -9.4 | 170.6 | -71.3 | 174.7 | 0 | 0 | 0 | 113.5 | D49 I90 L92 I96 R182 F185 | D49-L94 HydrophobicContact CB-CD2 4.32Å; I90-L94 HydrophobicContact CG2-CD1 3.73Å; I90-L94 HydrophobicContact CG2-CG 4.25Å; I90-L94 WeakPolarHBondContact O-CB 3.18Å; I90-L94 VanDerWaalsContact O-CG 3.28Å; I90-L94 WeakPolarHBondContact O-CG 3.34Å; I90-L94 PolarHBondContact O-N 2.96Å; L92-L94 PolarHBondContact O-N 3.33Å; L94-I96 HydrophobicContact CB-CD1 4.4Å; L94-I96 HydrophobicContact CB-CG1 4.02Å; L94-I96 HydrophobicContact CD1-CD1 4.43Å; L94-R182 PolarHBondContact O-NH2 2.99Å; L94-F185 HydrophobicContact CD1-CE1 4.01Å; L94-F185 HydrophobicContact CD2-CD1 4.11Å; L94-F185 HydrophobicContact CD2-CE1 4.26Å |
| 95 | G | 93.6 | Very high | 94.2 | Very high | 16 Ų | 16 | 75.6 Ų | 75.6 | 17% | 0.165 | 37% | 0.373 | C | S | . | . | T | Hydrogen-bonded Turn | trans | 71 | 30.8 | -179.5 | 0 | 0 | 0 | 0 | 0 | 113.3 | M91 L92 N93 L97 G98 | M91-G95 PolarHBondContact O-N 3.27Å; L92-G95 WeakPolarHBondContact O-CA 3.16Å; L92-G95 PolarHBondContact O-N 3.26Å; N93-G95 PolarHBondContact O-N 3.29Å; G95-L97 VanDerWaalsContact C-N 3.33Å; G95-L97 PolarHBondContact O-N 3Å; G95-G98 PolarHBondContact O-N 3.47Å |
| 96 | I | 92.5 | Very high | 93.9 | Very high | 97 Ų | 97 | 74 Ų | 74 | 50% | 0.497 | 36% | 0.363 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -62.9 | -40.8 | -177.9 | -63.2 | -179.6 | 0 | 0 | 0 | 110.9 | M91 L94 G98 | M91-I96 HydrophobicContact CB-CD1 4.13Å; M91-I96 HydrophobicContact CE-CG2 4.46Å; M91-I96 HydrophobicContact CG-CD1 4.14Å; M91-I96 WeakPolarHBondContact O-CB 3.4Å; M91-I96 WeakPolarHBondContact O-CG1 3.4Å; M91-I96 PolarHBondContact O-N 3.49Å; L94-I96 HydrophobicContact CB-CD1 4.4Å; L94-I96 HydrophobicContact CB-CG1 4.02Å; L94-I96 HydrophobicContact CD1-CD1 4.43Å; I96-G98 PolarHBondContact O-N 3.46Å |
| 97 | L | 92.2 | Very high | 93.6 | Very high | 111 Ų | 111 | 79 Ų | 79 | 58% | 0.581 | 39% | 0.39 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -81.8 | 10.3 | 175.5 | -60.6 | -177.4 | 0 | 0 | 0 | 113.3 | L92 G95 Y101 | L92-L97 HydrophobicContact CD2-CB 4.4Å; L92-L97 HydrophobicContact CD2-CD1 3.76Å; L92-L97 HydrophobicContact CD2-CG 4.36Å; G95-L97 VanDerWaalsContact C-N 3.33Å; G95-L97 PolarHBondContact O-N 3Å; L97-Y101 HydrophobicContact CB-CD2 4.41Å; L97-Y101 VanDerWaalsContact O-CD2 3.25Å; L97-Y101 WeakPolarHBondContact O-CD2 3.47Å |
| 98 | G | 89.5 | Confident | 93.4 | Very high | 32 Ų | 32 | 78.8 Ų | 78.8 | 33% | 0.33 | 40% | 0.401 | S | S | . | . | trans | 99.5 | 154.2 | -177.4 | 0 | 0 | 0 | 0 | 0 | 113.4 | G95 I96 R100 Y101 | G95-G98 PolarHBondContact O-N 3.47Å; I96-G98 PolarHBondContact O-N 3.46Å; G98-R100 PolarHBondContact O-N 2.91Å; G98-R100 VanDerWaalsContact O-N 3.13Å; G98-Y101 PolarHBondContact O-N 3.21Å | ||
| 99 | R | 88.6 | Confident | 93.3 | Very high | 232 Ų | 232 | 76.3 Ų | 76.3 | 88% | 0.875 | 39% | 0.388 | S | S | * | . | G | 310 helix | trans | -62.2 | -23.5 | -173.7 | -69.1 | -175.8 | 179 | 175.1 | 1.1 | 114.1 | Y101 K102 | R99-Y101 VanDerWaalsContact C-N 3.28Å; R99-Y101 PolarHBondContact O-N 2.85Å; R99-K102 WeakPolarHBondContact O-CB 3.24Å; R99-K102 PolarHBondContact O-N 3.38Å |
| 100 | R | 92 | Very high | 93.3 | Very high | 217 Ų | 217 | 75 Ų | 75 | 82% | 0.819 | 38% | 0.383 | S | S | * | . | G | 310 helix | trans | -63.4 | -32.5 | 178.8 | -176.8 | -179.3 | 179.9 | -173.6 | 1.6 | 112.8 | G98 | G98-R100 PolarHBondContact O-N 2.91Å; G98-R100 VanDerWaalsContact O-N 3.13Å |
| 101 | Y | 92.1 | Very high | 93.3 | Very high | 128 Ų | 128 | 76.8 Ų | 76.8 | 50% | 0.502 | 40% | 0.395 | S | S | . | . | G | 310 helix | trans | -101.5 | 15.4 | -176.9 | -52.3 | -78.1 | 0 | 0 | 0 | 112.2 | L97 G98 R99 V103 | L97-Y101 HydrophobicContact CB-CD2 4.41Å; L97-Y101 VanDerWaalsContact O-CD2 3.25Å; L97-Y101 WeakPolarHBondContact O-CD2 3.47Å; G98-Y101 PolarHBondContact O-N 3.21Å; R99-Y101 VanDerWaalsContact C-N 3.28Å; R99-Y101 PolarHBondContact O-N 2.85Å; Y101-V103 PolarHBondContact O-N 2.84Å |
| 102 | K | 93.5 | Very high | 93.3 | Very high | 61 Ų | 61 | 77.3 Ų | 77.3 | 27% | 0.265 | 40% | 0.399 | S | S | . | . | trans | -67.8 | 121.8 | -177.2 | -173.9 | 174.9 | 176.1 | -179.4 | 0 | 110 | D49 L92 N93 R99 F104 | D49-K102 VanDerWaalsContact OD1-CE 3.24Å; D49-K102 WeakPolarHBondContact OD1-CE 3.22Å; D49-K102 IonicContact OD1-NZ 3.53Å; D49-K102 PolarHBondContact OD1-NZ 3.27Å; D49-K102 IonicContact OD2-NZ 2.7Å; D49-K102 PolarHBondContact OD2-NZ 3.05Å; L92-K102 WeakPolarHBondContact O-CA 3.47Å; N93-K102 VanDerWaalsContact O-CE 3.22Å; N93-K102 WeakPolarHBondContact O-CE 3.24Å; R99-K102 WeakPolarHBondContact O-CB 3.24Å; R99-K102 PolarHBondContact O-N 3.38Å; K102-F104 HydrophobicContact CD-CE1 4.28Å; K102-F104 HydrophobicContact CD-CE2 4.34Å; K102-F104 HydrophobicContact CD-CZ 3.82Å; K102-F104 VanDerWaalsContact CE-CE1 3.42Å; K102-F104 VanDerWaalsContact CE-CZ 3.46Å; K102-F104 HydrophobicContact CG-CE2 4.29Å; K102-F104 HydrophobicContact CG-CZ 4.21Å | ||
| 103 | V | 94.1 | Very high | 93.3 | Very high | 66 Ų | 66 | 75.5 Ų | 75.5 | 40% | 0.4 | 39% | 0.39 | S | S | . | . | trans | -105.9 | 143 | 176.3 | 179.5 | 0 | 0 | 0 | 0 | 109 | Y89 L92 N93 Y101 | Y89-V103 HydrophobicContact CD2-CG1 4.27Å; L92-V103 HydrophobicContact CB-CB 4.23Å; L92-V103 HydrophobicContact CB-CG2 4.13Å; L92-V103 HydrophobicContact CD1-CG2 3.95Å; N93-V103 WeakPolarHBondContact CA-O 3.13Å; N93-V103 VanDerWaalsContact CB-O 3.3Å; N93-V103 WeakPolarHBondContact CB-O 3.32Å; N93-V103 PolarHBondContact ND2-O 3Å; Y101-V103 PolarHBondContact O-N 2.84Å | ||
| 104 | F | 92.5 | Very high | 93.4 | Very high | 136 Ų | 136 | 75.3 Ų | 75.3 | 60% | 0.596 | 39% | 0.388 | S | S | * | . | trans | -112.3 | 145.7 | 174.2 | -62.4 | -87.5 | 0 | 0 | 0 | 109.3 | K102 | K102-F104 HydrophobicContact CD-CE1 4.28Å; K102-F104 HydrophobicContact CD-CE2 4.34Å; K102-F104 HydrophobicContact CD-CZ 3.82Å; K102-F104 VanDerWaalsContact CE-CE1 3.42Å; K102-F104 VanDerWaalsContact CE-CZ 3.46Å; K102-F104 HydrophobicContact CG-CE2 4.29Å; K102-F104 HydrophobicContact CG-CZ 4.21Å | ||
| 105 | M | 91 | Very high | 93.5 | Very high | 36 Ų | 36 | 78.2 Ų | 78.2 | 18% | 0.177 | 40% | 0.4 | C | S | . | . | trans | -63.8 | -45.7 | -179.1 | -168.2 | 74.4 | 128.2 | 0 | 0 | 111.9 | L52 Y89 I113 | L52-M105 HydrophobicContact CD2-CB 3.95Å; L52-M105 HydrophobicContact CD2-CE 3.58Å; L52-M105 HydrophobicContact CD2-CG 3.52Å; L52-M105 HydrophobicContact CD2-SD 4.33Å; L52-M105 HydrophobicContact CG-CE 4.19Å; Y89-M105 HydrophobicContact CD1-SD 4.37Å; Y89-M105 HydrophobicContact CE1-SD 4.06Å; Y89-M105 HydrophobicContact CE2-CB 4.1Å; Y89-M105 HydrophobicContact CE2-SD 4.25Å; Y89-M105 WeakPolarHBondContact OH-CB 3.48Å; Y89-M105 PolarHBondContact OH-N 2.76Å; M105-I113 HydrophobicContact CE-CB 4.35Å; M105-I113 HydrophobicContact CE-CD1 4.27Å; M105-I113 HydrophobicContact CE-CG1 3.32Å | ||
| 106 | G | 91 | Very high | 93.6 | Very high | 37 Ų | 37 | 78.9 Ų | 78.9 | 38% | 0.381 | 40% | 0.401 | S | S | . | . | H | α-helix | trans | 67.9 | 171.2 | -169.7 | 0 | 0 | 0 | 0 | 0 | 113.2 | A108 G109 S110 | G106-A108 VanDerWaalsContact C-N 3.31Å; G106-A108 PolarHBondContact O-N 3.48Å; G106-G109 PolarHBondContact O-N 2.93Å; G106-S110 PolarHBondContact O-N 2.93Å; G106-S110 VanDerWaalsContact O-N 3.1Å; G106-S110 PolarHBondContact O-OG 3.01Å |
| 107 | D | 91.5 | Very high | 93.9 | Very high | 115 Ų | 115 | 74.3 Ų | 74.3 | 62% | 0.615 | 38% | 0.378 | S | S | * | . | H | α-helix | trans | -63.8 | -36.3 | -177.2 | -67.3 | -34.6 | 0 | 0 | 0 | 112.7 | N43 S110 T111 | N43-D107 PolarHBondContact ND2-OD1 3.44Å; D107-S110 WeakPolarHBondContact CA-OG 3.12Å; D107-S110 PolarHBondContact O-OG 2.83Å; D107-S110 VanDerWaalsContact O-OG 3.1Å; D107-T111 WeakPolarHBondContact O-CB 3.37Å; D107-T111 PolarHBondContact O-N 2.94Å; D107-T111 PolarHBondContact O-OG1 3.47Å |
| 108 | A | 93.6 | Very high | 94.1 | Very high | 85 Ų | 85 | 69.7 Ų | 69.7 | 70% | 0.702 | 35% | 0.353 | S | S | * | . | H | α-helix | trans | -62.5 | -45.9 | 178.4 | 0 | 0 | 0 | 0 | 0 | 111.7 | G106 L112 | G106-A108 VanDerWaalsContact C-N 3.31Å; G106-A108 PolarHBondContact O-N 3.48Å; A108-L112 WeakPolarHBondContact O-CB 3.37Å; A108-L112 PolarHBondContact O-N 3.07Å |
| 109 | G | 94.2 | Very high | 94.4 | Very high | 18 Ų | 18 | 72.5 Ų | 72.5 | 19% | 0.186 | 35% | 0.354 | C | S | . | . | H | α-helix | trans | -69.1 | -42.4 | 179.5 | 0 | 0 | 0 | 0 | 0 | 112.3 | G106 L112 I113 | G106-G109 PolarHBondContact O-N 2.93Å; G109-L112 PolarHBondContact O-N 3.05Å; G109-I113 WeakPolarHBondContact O-CG1 3.33Å; G109-I113 PolarHBondContact O-N 2.97Å |
| 110 | S | 95.9 | Very high | 94.7 | Very high | 0 Ų | 0 | 62 Ų | 62 | 0% | 0 | 32% | 0.315 | C | S | . | . | H | α-helix | trans | -66.3 | -38.5 | 178.2 | 60.6 | 0 | 0 | 0 | 0 | 112.9 | N43 L52 G106 D107 G114 | N43-S110 PolarHBondContact ND2-OG 2.9Å; L52-S110 VanDerWaalsContact CD2-CB 3.4Å; G106-S110 PolarHBondContact O-N 2.93Å; G106-S110 VanDerWaalsContact O-N 3.1Å; G106-S110 PolarHBondContact O-OG 3.01Å; D107-S110 WeakPolarHBondContact CA-OG 3.12Å; D107-S110 PolarHBondContact O-OG 2.83Å; D107-S110 VanDerWaalsContact O-OG 3.1Å; S110-G114 PolarHBondContact O-N 3.39Å |
| 111 | T | 96.3 | Very high | 94.9 | Very high | 56 Ų | 56 | 51.8 Ų | 51.8 | 34% | 0.344 | 28% | 0.277 | S | S | . | . | H | α-helix | trans | -63.9 | -45.1 | 173.8 | -61 | 0 | 0 | 0 | 0 | 111.4 | I39 D107 G114 F115 | I39-T111 HydrophobicContact CG2-CG2 3.77Å; D107-T111 WeakPolarHBondContact O-CB 3.37Å; D107-T111 PolarHBondContact O-N 2.94Å; D107-T111 PolarHBondContact O-OG1 3.47Å; T111-G114 PolarHBondContact O-N 3.38Å; T111-F115 VanDerWaalsContact O-CB 3.3Å; T111-F115 WeakPolarHBondContact O-CB 3.19Å; T111-F115 PolarHBondContact O-N 3.48Å |
| 112 | L | 96.7 | Very high | 95 | Very high | 102 Ų | 102 | 45.8 Ų | 45.8 | 53% | 0.534 | 25% | 0.254 | S | S | . | . | H | α-helix | trans | -59.7 | -49.1 | 177.3 | 177.8 | 63.4 | 0 | 0 | 0 | 111.3 | A108 G109 G114 F115 T116 | A108-L112 WeakPolarHBondContact O-CB 3.37Å; A108-L112 PolarHBondContact O-N 3.07Å; G109-L112 PolarHBondContact O-N 3.05Å; L112-G114 PolarHBondContact O-N 2.99Å; L112-F115 PolarHBondContact O-N 3.12Å; L112-T116 WeakPolarHBondContact O-CB 3.28Å; L112-T116 PolarHBondContact O-N 3.03Å; L112-T116 PolarHBondContact O-OG1 3.33Å |
| 113 | I | 97.7 | Very high | 95 | Very high | 9 Ų | 9 | 46.7 Ų | 46.7 | 5% | 0.046 | 26% | 0.259 | C | S | . | . | H | α-helix | trans | -58.6 | -50.2 | 176.6 | -71.3 | -54.9 | 0 | 0 | 0 | 111.5 | F42 S56 F60 M82 I86 M105 G109 F115 T116 V117 | F42-I113 HydrophobicContact CD1-CG2 3.84Å; F42-I113 HydrophobicContact CE1-CG2 4.14Å; F42-I113 HydrophobicContact CG-CG2 4.48Å; S56-I113 WeakPolarHBondContact OG-CG2 3.48Å; F60-I113 HydrophobicContact CE2-CD1 4.12Å; M82-I113 HydrophobicContact CE-CD1 3.75Å; I86-I113 HydrophobicContact CD1-CD1 3.75Å; I86-I113 HydrophobicContact CG1-CD1 4.26Å; M105-I113 HydrophobicContact CE-CB 4.35Å; M105-I113 HydrophobicContact CE-CD1 4.27Å; M105-I113 HydrophobicContact CE-CG1 3.32Å; G109-I113 WeakPolarHBondContact O-CG1 3.33Å; G109-I113 PolarHBondContact O-N 2.97Å; I113-F115 VanDerWaalsContact C-N 3.27Å; I113-F115 PolarHBondContact O-N 3.42Å; I113-T116 PolarHBondContact O-N 3.47Å; I113-V117 HydrophobicContact CG2-CG2 4.4Å; I113-V117 WeakPolarHBondContact O-CG2 3.35Å; I113-V117 PolarHBondContact O-N 2.99Å |
| 114 | G | 97.6 | Very high | 95 | Very high | 0 Ų | 0 | 43.5 Ų | 43.5 | 0% | 0 | 24% | 0.239 | C | C | . | . | H | α-helix | trans | -59.2 | -41.6 | -179.7 | 0 | 0 | 0 | 0 | 0 | 111.8 | S110 T111 L112 I118 | S110-G114 PolarHBondContact O-N 3.39Å; T111-G114 PolarHBondContact O-N 3.38Å; L112-G114 PolarHBondContact O-N 2.99Å; G114-I118 VanDerWaalsContact O-CG2 3.32Å; G114-I118 WeakPolarHBondContact O-CG2 3.29Å; G114-I118 PolarHBondContact O-N 3.49Å; G114-I118 VanDerWaalsContact O-N 3.08Å |
| 115 | F | 96.8 | Very high | 95.1 | Very high | 89 Ų | 89 | 37.3 Ų | 37.3 | 39% | 0.39 | 21% | 0.213 | S | C | . | . | H | α-helix | trans | -63.7 | -46.7 | 174.6 | 177.2 | -100.3 | 0 | 0 | 0 | 112.3 | V35 I39 T111 L112 I113 V117 I118 W119 | V35-F115 HydrophobicContact CG1-CD2 4.4Å; I39-F115 HydrophobicContact CD1-CB 4.16Å; I39-F115 HydrophobicContact CD1-CD2 4.22Å; I39-F115 HydrophobicContact CG1-CB 4.13Å; T111-F115 VanDerWaalsContact O-CB 3.3Å; T111-F115 WeakPolarHBondContact O-CB 3.19Å; T111-F115 PolarHBondContact O-N 3.48Å; L112-F115 PolarHBondContact O-N 3.12Å; I113-F115 VanDerWaalsContact C-N 3.27Å; I113-F115 PolarHBondContact O-N 3.42Å; F115-V117 PolarHBondContact O-N 3.37Å; F115-I118 WeakPolarHBondContact O-CG2 3.32Å; F115-I118 PolarHBondContact O-N 3.38Å; F115-W119 HydrophobicContact CZ-CE3 4.05Å; F115-W119 WeakPolarHBondContact O-CB 3.32Å; F115-W119 PolarHBondContact O-N 2.86Å |
| 116 | T | 97 | Very high | 95.1 | Very high | 29 Ų | 29 | 36.8 Ų | 36.8 | 18% | 0.178 | 21% | 0.21 | C | C | . | . | H | α-helix | trans | -63.2 | -42.9 | 179.2 | -57.1 | 0 | 0 | 0 | 0 | 111.5 | F60 M82 L112 I113 W119 I120 | F60-T116 HydrophobicContact CE1-CG2 3.97Å; F60-T116 HydrophobicContact CZ-CG2 3.98Å; M82-T116 HydrophobicContact CE-CG2 4.16Å; L112-T116 WeakPolarHBondContact O-CB 3.28Å; L112-T116 PolarHBondContact O-N 3.03Å; L112-T116 PolarHBondContact O-OG1 3.33Å; I113-T116 PolarHBondContact O-N 3.47Å; T116-W119 PolarHBondContact O-N 2.81Å; T116-I120 HydrophobicContact CG2-CD1 4Å; T116-I120 WeakPolarHBondContact O-CG1 3.47Å; T116-I120 PolarHBondContact O-N 3.03Å |
| 117 | V | 98.2 | Very high | 94.7 | Very high | 1 Ų | 1 | 37.3 Ų | 37.3 | 1% | 0.006 | 22% | 0.215 | C | C | . | . | H | α-helix | trans | -62 | -50.7 | 177.7 | 171.5 | 0 | 0 | 0 | 0 | 110.7 | F42 F60 I63 I113 F115 W119 I120 L121 I141 | F42-V117 HydrophobicContact CE1-CG2 4.44Å; F42-V117 HydrophobicContact CE2-CB 4.13Å; F42-V117 HydrophobicContact CE2-CG1 3.93Å; F42-V117 HydrophobicContact CE2-CG2 4.39Å; F42-V117 HydrophobicContact CZ-CB 4.19Å; F42-V117 HydrophobicContact CZ-CG1 3.96Å; F42-V117 HydrophobicContact CZ-CG2 3.98Å; F60-V117 HydrophobicContact CD1-CG2 4.45Å; F60-V117 HydrophobicContact CE1-CG2 3.83Å; F60-V117 HydrophobicContact CE2-CG2 4.04Å; F60-V117 HydrophobicContact CZ-CG2 3.59Å; I63-V117 HydrophobicContact CD1-CG1 4.27Å; I113-V117 HydrophobicContact CG2-CG2 4.4Å; I113-V117 WeakPolarHBondContact O-CG2 3.35Å; I113-V117 PolarHBondContact O-N 2.99Å; F115-V117 PolarHBondContact O-N 3.37Å; V117-W119 VanDerWaalsContact C-N 3.33Å; V117-W119 PolarHBondContact O-N 3.15Å; V117-I120 PolarHBondContact O-N 3.33Å; V117-L121 HydrophobicContact CG1-CD1 3.9Å; V117-L121 HydrophobicContact CG1-CG 4.48Å; V117-L121 WeakPolarHBondContact O-CB 3.42Å; V117-L121 VanDerWaalsContact O-CG 3.3Å; V117-L121 WeakPolarHBondContact O-CG 3.46Å; V117-L121 PolarHBondContact O-N 3.26Å; V117-I141 HydrophobicContact CG1-CG2 3.6Å |
| 118 | I | 96.8 | Very high | 93.9 | Very high | 14 Ų | 14 | 42.2 Ų | 42.2 | 7% | 0.072 | 23% | 0.231 | C | C | . | . | H | α-helix | trans | -68.7 | -33 | -179.2 | -166.6 | 55.2 | 0 | 0 | 0 | 112.4 | V35 A38 G114 F115 L121 L122 | V35-I118 HydrophobicContact CB-CG2 4.44Å; V35-I118 HydrophobicContact CG1-CG2 4.28Å; V35-I118 HydrophobicContact CG2-CG1 4.24Å; V35-I118 HydrophobicContact CG2-CG2 4.25Å; A38-I118 HydrophobicContact CB-CB 3.55Å; A38-I118 HydrophobicContact CB-CD1 4.01Å; A38-I118 HydrophobicContact CB-CG1 3.73Å; A38-I118 HydrophobicContact CB-CG2 4.1Å; G114-I118 VanDerWaalsContact O-CG2 3.32Å; G114-I118 WeakPolarHBondContact O-CG2 3.29Å; G114-I118 PolarHBondContact O-N 3.49Å; G114-I118 VanDerWaalsContact O-N 3.08Å; F115-I118 WeakPolarHBondContact O-CG2 3.32Å; F115-I118 PolarHBondContact O-N 3.38Å; I118-L121 HydrophobicContact CD1-CB 4.45Å; I118-L121 PolarHBondContact O-N 2.81Å; I118-L122 HydrophobicContact CD1-CG 4.37Å; I118-L122 HydrophobicContact CG1-CD1 4.23Å; I118-L122 HydrophobicContact CG1-CG 4.29Å; I118-L122 WeakPolarHBondContact O-CB 3.36Å; I118-L122 VanDerWaalsContact O-CG 3.23Å; I118-L122 WeakPolarHBondContact O-CG 3.5Å; I118-L122 PolarHBondContact O-N 3.44Å |
| 119 | W | 94.8 | Very high | 93.2 | Very high | 92 Ų | 92 | 43.9 Ų | 43.9 | 35% | 0.348 | 23% | 0.232 | S | C | . | . | H | α-helix | trans | -59.3 | -52.7 | 174.4 | 176.2 | -87 | 0 | 0 | 0 | 111.2 | L7 F115 T116 V117 L121 L122 E123 | L7-W119 HydrophobicContact CD1-CH2 4.49Å; L7-W119 HydrophobicContact CD1-CZ2 4.3Å; L7-W119 HydrophobicContact CD2-CE3 4.1Å; L7-W119 HydrophobicContact CD2-CH2 4.07Å; L7-W119 HydrophobicContact CD2-CZ2 4.46Å; L7-W119 HydrophobicContact CD2-CZ3 3.87Å; F115-W119 HydrophobicContact CZ-CE3 4.05Å; F115-W119 WeakPolarHBondContact O-CB 3.32Å; F115-W119 PolarHBondContact O-N 2.86Å; T116-W119 PolarHBondContact O-N 2.81Å; V117-W119 VanDerWaalsContact C-N 3.33Å; V117-W119 PolarHBondContact O-N 3.15Å; W119-L121 VanDerWaalsContact C-N 3.32Å; W119-L121 PolarHBondContact O-N 2.86Å; W119-L122 PolarHBondContact O-N 3.41Å; W119-E123 PolarHBondContact NE1-OE2 3.43Å; W119-E123 PolarHBondContact O-N 3.3Å |
| 120 | I | 95.5 | Very high | 92.9 | Very high | 10 Ų | 10 | 45 Ų | 45 | 5% | 0.051 | 23% | 0.232 | C | C | . | . | H | α-helix | trans | -63.4 | -41.2 | 179.5 | -62.2 | 170.2 | 0 | 0 | 0 | 110.1 | F60 I63 L67 T116 V117 L122 E123 T124 | F60-I120 HydrophobicContact CE1-CD1 4.07Å; I63-I120 HydrophobicContact CG2-CG2 3.64Å; L67-I120 HydrophobicContact CD1-CG2 4.42Å; T116-I120 HydrophobicContact CG2-CD1 4Å; T116-I120 WeakPolarHBondContact O-CG1 3.47Å; T116-I120 PolarHBondContact O-N 3.03Å; V117-I120 PolarHBondContact O-N 3.33Å; I120-L122 PolarHBondContact O-N 2.92Å; I120-E123 PolarHBondContact O-N 3.06Å; I120-T124 HydrophobicContact CG2-CG2 4.03Å; I120-T124 WeakPolarHBondContact O-CB 3.36Å; I120-T124 VanDerWaalsContact O-CG2 3.24Å; I120-T124 WeakPolarHBondContact O-CG2 3.31Å; I120-T124 PolarHBondContact O-N 3.41Å; I120-T124 PolarHBondContact O-OG1 2.6Å |
| 121 | L | 96.6 | Very high | 92.6 | Very high | 3 Ų | 3 | 45.5 Ų | 45.5 | 2% | 0.016 | 24% | 0.236 | C | C | . | . | H | α-helix | trans | -61.8 | -40.9 | 175.6 | -71.8 | 173.8 | 0 | 0 | 0 | 112.2 | I63 V117 I118 W119 E123 T124 T125 I132 A137 I140 I141 | I63-L121 HydrophobicContact CD1-CD1 4.5Å; I63-L121 HydrophobicContact CD1-CD2 3.74Å; I63-L121 HydrophobicContact CD1-CG 3.88Å; I63-L121 HydrophobicContact CG1-CD2 3.82Å; V117-L121 HydrophobicContact CG1-CD1 3.9Å; V117-L121 HydrophobicContact CG1-CG 4.48Å; V117-L121 WeakPolarHBondContact O-CB 3.42Å; V117-L121 VanDerWaalsContact O-CG 3.3Å; V117-L121 WeakPolarHBondContact O-CG 3.46Å; V117-L121 PolarHBondContact O-N 3.26Å; I118-L121 HydrophobicContact CD1-CB 4.45Å; I118-L121 PolarHBondContact O-N 2.81Å; W119-L121 VanDerWaalsContact C-N 3.32Å; W119-L121 PolarHBondContact O-N 2.86Å; L121-E123 VanDerWaalsContact C-N 3.32Å; L121-E123 PolarHBondContact O-N 3.33Å; L121-T124 WeakPolarHBondContact CA-OG1 3.45Å; L121-T124 PolarHBondContact O-N 3.43Å; L121-T125 VanDerWaalsContact O-CB 3.22Å; L121-T125 WeakPolarHBondContact O-CB 3.32Å; L121-T125 WeakPolarHBondContact O-CG2 3.48Å; L121-T125 PolarHBondContact O-N 3.43Å; L121-T125 PolarHBondContact O-OG1 3.5Å; L121-I132 HydrophobicContact CD2-CD1 4.44Å; L121-A137 HydrophobicContact CD1-CB 4.25Å; L121-A137 HydrophobicContact CD2-CB 3.91Å; L121-A137 HydrophobicContact CG-CB 4.47Å; L121-I140 HydrophobicContact CD2-CD1 4.02Å; L121-I140 HydrophobicContact CD2-CG2 4.49Å; L121-I141 HydrophobicContact CD1-CG2 3.96Å |
| 122 | L | 94.4 | Very high | 92.6 | Very high | 3 Ų | 3 | 42.8 Ų | 42.8 | 2% | 0.016 | 22% | 0.219 | C | C | . | . | H | α-helix | trans | -65.6 | -36.8 | 176.2 | -73.6 | 172.5 | 0 | 0 | 0 | 112.3 | M2 L7 L9 T31 V35 I118 W119 I120 Q126 | M2-L122 HydrophobicContact CE-CD1 4.3Å; L7-L122 HydrophobicContact CD2-CB 3.76Å; L7-L122 HydrophobicContact CD2-CD1 4.34Å; L7-L122 HydrophobicContact CG-CB 4.47Å; L9-L122 HydrophobicContact CD1-CD2 4.3Å; L9-L122 HydrophobicContact CD2-CD2 3.46Å; L9-L122 VanDerWaalsContact CD2-CD2 3.46Å; L9-L122 HydrophobicContact CG-CD2 3.56Å; T31-L122 HydrophobicContact CG2-CD1 3.55Å; T31-L122 HydrophobicContact CG2-CD2 3.74Å; T31-L122 HydrophobicContact CG2-CG 4.31Å; V35-L122 HydrophobicContact CG2-CD1 3.61Å; I118-L122 HydrophobicContact CD1-CG 4.37Å; I118-L122 HydrophobicContact CG1-CD1 4.23Å; I118-L122 HydrophobicContact CG1-CG 4.29Å; I118-L122 WeakPolarHBondContact O-CB 3.36Å; I118-L122 VanDerWaalsContact O-CG 3.23Å; I118-L122 WeakPolarHBondContact O-CG 3.5Å; I118-L122 PolarHBondContact O-N 3.44Å; W119-L122 PolarHBondContact O-N 3.41Å; I120-L122 PolarHBondContact O-N 2.92Å; L122-Q126 WeakPolarHBondContact O-CB 3.44Å; L122-Q126 WeakPolarHBondContact O-CG 3.4Å |
| 123 | E | 92.2 | Very high | 92.5 | Very high | 79 Ų | 79 | 38.1 Ų | 38.1 | 37% | 0.369 | 20% | 0.195 | S | C | . | . | H | α-helix | trans | -68.2 | -37.4 | 176.1 | -167.9 | 173.1 | 164.7 | 0 | 0 | 112.2 | L7 W119 I120 L121 | L7-E123 HydrophobicContact CD1-CB 3.89Å; L7-E123 HydrophobicContact CD1-CG 4.08Å; W119-E123 PolarHBondContact NE1-OE2 3.43Å; W119-E123 PolarHBondContact O-N 3.3Å; I120-E123 PolarHBondContact O-N 3.06Å; L121-E123 VanDerWaalsContact C-N 3.32Å; L121-E123 PolarHBondContact O-N 3.33Å |
| 124 | T | 94.1 | Very high | 92.4 | Very high | 0 Ų | 0 | 38.4 Ų | 38.4 | 0% | 0 | 20% | 0.198 | C | C | . | . | H | α-helix | trans | -98.5 | -6.4 | -170.3 | 56.7 | 0 | 0 | 0 | 0 | 114.2 | L67 L75 I120 L121 P131 I132 | L67-T124 HydrophobicContact CD1-CG2 4.07Å; L67-T124 HydrophobicContact CD2-CG2 3.55Å; L67-T124 HydrophobicContact CG-CG2 4.37Å; L75-T124 HydrophobicContact CD1-CG2 3.93Å; I120-T124 HydrophobicContact CG2-CG2 4.03Å; I120-T124 WeakPolarHBondContact O-CB 3.36Å; I120-T124 VanDerWaalsContact O-CG2 3.24Å; I120-T124 WeakPolarHBondContact O-CG2 3.31Å; I120-T124 PolarHBondContact O-N 3.41Å; I120-T124 PolarHBondContact O-OG1 2.6Å; L121-T124 WeakPolarHBondContact CA-OG1 3.45Å; L121-T124 PolarHBondContact O-N 3.43Å; T124-P131 HydrophobicContact CG2-CG 4.37Å; T124-P131 WeakPolarHBondContact O-CD 3.35Å; T124-P131 WeakPolarHBondContact O-CG 3Å; T124-I132 PolarHBondContact O-N 2.87Å; T124-I132 VanDerWaalsContact O-N 3.13Å |
| 125 | T | 94.5 | Very high | 92.3 | Very high | 5 Ų | 5 | 38.5 Ų | 38.5 | 3% | 0.031 | 20% | 0.198 | C | C | . | . | S | Bend | trans | -105 | -4.3 | 175.8 | 61.5 | 0 | 0 | 0 | 0 | 114.2 | L121 H130 I132 A137 | L121-T125 VanDerWaalsContact O-CB 3.22Å; L121-T125 WeakPolarHBondContact O-CB 3.32Å; L121-T125 WeakPolarHBondContact O-CG2 3.48Å; L121-T125 PolarHBondContact O-N 3.43Å; L121-T125 PolarHBondContact O-OG1 3.5Å; T125-H130 VanDerWaalsContact C-CB 3.49Å; T125-H130 PolarHBondContact O-CD2 3.38Å; T125-H130 VanDerWaalsContact O-CD2 3.28Å; T125-I132 WeakPolarHBondContact CA-O 3.37Å; T125-I132 WeakPolarHBondContact CB-O 3.24Å; T125-I132 HydrophobicContact CG2-CB 3.98Å; T125-I132 HydrophobicContact CG2-CG2 3.9Å; T125-I132 WeakPolarHBondContact CG2-O 3.39Å; T125-A137 HydrophobicContact CG2-CB 3.88Å |
| 126 | Q | 91.4 | Very high | 92.3 | Very high | 26 Ų | 26 | 34.4 Ų | 34.4 | 12% | 0.121 | 18% | 0.18 | C | C | . | . | S | Bend | trans | -120.7 | 151.1 | -173.9 | -55.7 | -59.4 | -56.3 | 0 | 0 | 110.4 | L9 S10 S11 L122 | L9-Q126 HydrophobicContact CD2-CG 4.44Å; S10-Q126 PolarHBondContact OG-OE1 3.49Å; S10-Q126 VanDerWaalsContact OG-OE1 3.06Å; S11-Q126 PolarHBondContact O-NE2 3.26Å; L122-Q126 WeakPolarHBondContact O-CB 3.44Å; L122-Q126 WeakPolarHBondContact O-CG 3.4Å |
| 127 | G | 83.2 | Confident | 92.4 | Very high | 47 Ų | 47 | 33.6 Ų | 33.6 | 49% | 0.485 | 18% | 0.177 | S | C | . | . | S | Bend | trans | 100.6 | 169.3 | -173.8 | 0 | 0 | 0 | 0 | 0 | 112.9 | T129 H130 | G127-T129 PolarHBondContact O-N 3.31Å; G127-H130 PolarHBondContact O-CD2 2.97Å |
| 128 | K | 73.7 | Confident | 92.4 | Very high | 218 Ų | 218 | 36 Ų | 36 | 95% | 0.948 | 19% | 0.19 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -70.4 | -28.4 | -167.5 | -70.3 | -176.5 | 176.6 | -178.9 | 0 | 115 | ||
| 129 | T | 79.1 | Confident | 92.5 | Very high | 120 Ų | 120 | 35.8 Ų | 35.8 | 74% | 0.736 | 19% | 0.188 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -118.2 | 27.1 | -175.7 | 58.3 | 0 | 0 | 0 | 0 | 110.7 | G127 | G127-T129 PolarHBondContact O-N 3.31Š|
| 130 | H | 88.2 | Confident | 92.6 | Very high | 41 Ų | 41 | 31.6 Ų | 31.6 | 19% | 0.19 | 17% | 0.172 | C | C | . | . | trans | -53.3 | 129.5 | -170.2 | 59.9 | 58.3 | 0 | 0 | 0 | 111 | T125 G127 I132 | T125-H130 VanDerWaalsContact C-CB 3.49Å; T125-H130 PolarHBondContact O-CD2 3.38Å; T125-H130 VanDerWaalsContact O-CD2 3.28Å; G127-H130 PolarHBondContact O-CD2 2.97Å; H130-I132 VanDerWaalsContact C-N 3.27Å; H130-I132 PolarHBondContact ND1-O 2.86Å; H130-I132 PolarHBondContact O-N 3.07Å | ||
| 131 | P | 90.5 | Very high | 92.8 | Very high | 11 Ų | 11 | 31.7 Ų | 31.7 | 7% | 0.071 | 17% | 0.173 | C | C | . | . | S | Bend | trans | -71.3 | -20.8 | -175.1 | 26.4 | -38 | 0 | 0 | 0 | 114 | I66 L67 D70 Q72 T124 | I66-P131 VanDerWaalsContact CG2-O 3.31Å; I66-P131 WeakPolarHBondContact CG2-O 3.39Å; L67-P131 HydrophobicContact CD2-CB 4.02Å; L67-P131 HydrophobicContact CD2-CG 3.48Å; L67-P131 VanDerWaalsContact CD2-CG 3.48Å; D70-P131 HydrophobicContact CB-CB 3.82Å; D70-P131 WeakPolarHBondContact OD2-CB 3.42Å; Q72-P131 VanDerWaalsContact NE2-CD 3.33Å; Q72-P131 VanDerWaalsContact NE2-CG 3.28Å; T124-P131 HydrophobicContact CG2-CG 4.37Å; T124-P131 WeakPolarHBondContact O-CD 3.35Å; T124-P131 WeakPolarHBondContact O-CG 3Å |
| 132 | I | 95.3 | Very high | 92.8 | Very high | 0 Ų | 0 | 31.6 Ų | 31.6 | 0% | 0 | 17% | 0.172 | C | C | . | . | S | Bend | trans | -123.5 | 123.2 | -175.9 | -56.5 | -177 | 0 | 0 | 0 | 107.5 | I63 I66 L121 T124 T125 H130 T136 I140 | I63-I132 HydrophobicContact CG1-CD1 4.47Å; I63-I132 HydrophobicContact CG2-CD1 4.1Å; I66-I132 HydrophobicContact CB-CD1 4.41Å; I66-I132 HydrophobicContact CB-CG1 4.22Å; I66-I132 HydrophobicContact CD1-CD1 4.25Å; I66-I132 HydrophobicContact CD1-CG1 4.16Å; I66-I132 HydrophobicContact CG2-CD1 4.45Å; I66-I132 HydrophobicContact CG2-CG1 3.74Å; L121-I132 HydrophobicContact CD2-CD1 4.44Å; T124-I132 PolarHBondContact O-N 2.87Å; T124-I132 VanDerWaalsContact O-N 3.13Å; T125-I132 WeakPolarHBondContact CA-O 3.37Å; T125-I132 WeakPolarHBondContact CB-O 3.24Å; T125-I132 HydrophobicContact CG2-CB 3.98Å; T125-I132 HydrophobicContact CG2-CG2 3.9Å; T125-I132 WeakPolarHBondContact CG2-O 3.39Å; H130-I132 VanDerWaalsContact C-N 3.27Å; H130-I132 PolarHBondContact ND1-O 2.86Å; H130-I132 PolarHBondContact O-N 3.07Å; I132-T136 HydrophobicContact CG2-CG2 3.86Å; I132-I140 HydrophobicContact CD1-CD1 4.3Å; I132-I140 HydrophobicContact CG2-CD1 4.16Å |
| 133 | S | 94.7 | Very high | 93 | Very high | 4 Ų | 4 | 31.7 Ų | 31.7 | 3% | 0.028 | 17% | 0.173 | C | C | . | . | trans | -65.1 | 147.3 | 171.2 | 63.6 | 0 | 0 | 0 | 0 | 111.4 | V135 T136 A137 E203 | S133-V135 PolarHBondContact O-N 3.21Å; S133-V135 VanDerWaalsContact O-N 3.09Å; S133-T136 PolarHBondContact O-N 3.31Å; S133-T136 WeakPolarHBondContact OG-CB 3.16Å; S133-T136 PolarHBondContact OG-N 3.08Å; S133-T136 PolarHBondContact OG-OG1 3.5Å; S133-A137 PolarHBondContact O-N 2.93Å; S133-A137 VanDerWaalsContact O-N 3.16Å; S133-E203 WeakPolarHBondContact CB-OE2 3.23Å; S133-E203 PolarHBondContact N-OE1 3.31Å; S133-E203 PolarHBondContact N-OE2 3.36Å; S133-E203 PolarHBondContact OG-OE2 2.9Å | ||
| 134 | P | 95.2 | Very high | 93.2 | Very high | 15 Ų | 15 | 28 Ų | 28 | 10% | 0.097 | 16% | 0.156 | C | C | . | . | H | α-helix | trans | -55.2 | -29 | 175.3 | -27.7 | 35.9 | 0 | 0 | 0 | 113.6 | A137 | P134-A137 WeakPolarHBondContact O-CB 3.45Å |
| 135 | V | 96.4 | Very high | 93.4 | Very high | 2 Ų | 2 | 29.4 Ų | 29.4 | 1% | 0.012 | 16% | 0.163 | C | C | . | . | H | α-helix | trans | -71.7 | -43.1 | 175 | -177.1 | 0 | 0 | 0 | 0 | 111.6 | I15 S133 A137 L138 E210 M213 L214 | I15-V135 HydrophobicContact CG2-CG2 3.55Å; S133-V135 PolarHBondContact O-N 3.21Å; S133-V135 VanDerWaalsContact O-N 3.09Å; V135-A137 PolarHBondContact O-N 3.35Å; V135-L138 VanDerWaalsContact O-CB 3.26Å; V135-L138 WeakPolarHBondContact O-CB 3.47Å; V135-L138 PolarHBondContact O-N 3.18Å; V135-E210 HydrophobicContact CG2-CB 4.1Å; V135-M213 HydrophobicContact CG1-CB 3.69Å; V135-L214 HydrophobicContact CG1-CB 3.98Å; V135-L214 HydrophobicContact CG2-CB 4.31Å |
| 136 | T | 97.3 | Very high | 93.5 | Very high | 2 Ų | 2 | 29.3 Ų | 29.3 | 1% | 0.012 | 16% | 0.162 | C | C | . | . | H | α-helix | trans | -59.1 | -34.3 | 175.2 | -68.4 | 0 | 0 | 0 | 0 | 111.7 | I66 I132 S133 L138 W139 I140 E203 | I66-T136 HydrophobicContact CD1-CG2 3.93Å; I132-T136 HydrophobicContact CG2-CG2 3.86Å; S133-T136 PolarHBondContact O-N 3.31Å; S133-T136 WeakPolarHBondContact OG-CB 3.16Å; S133-T136 PolarHBondContact OG-N 3.08Å; S133-T136 PolarHBondContact OG-OG1 3.5Å; T136-L138 PolarHBondContact O-N 3.28Å; T136-W139 WeakPolarHBondContact O-CA 3.38Å; T136-W139 WeakPolarHBondContact O-CB 3.27Å; T136-W139 PolarHBondContact O-N 3.04Å; T136-I140 HydrophobicContact CG2-CD1 4.11Å; T136-I140 HydrophobicContact CG2-CG1 4.38Å; T136-I140 WeakPolarHBondContact O-CG1 3.4Å; T136-I140 PolarHBondContact O-N 2.97Å; T136-I140 VanDerWaalsContact O-N 3.07Å; T136-E203 WeakPolarHBondContact CB-OE2 3.16Å; T136-E203 HydrophobicContact CG2-CB 4.33Å; T136-E203 PolarHBondContact OG1-OE2 3.09Å |
| 137 | A | 97.9 | Very high | 93.7 | Very high | 13 Ų | 13 | 28 Ų | 28 | 11% | 0.107 | 16% | 0.156 | C | C | . | . | H | α-helix | trans | -56.2 | -36.8 | 173 | 0 | 0 | 0 | 0 | 0 | 112.8 | L121 T125 S133 P134 V135 W139 I140 I141 | L121-A137 HydrophobicContact CD1-CB 4.25Å; L121-A137 HydrophobicContact CD2-CB 3.91Å; L121-A137 HydrophobicContact CG-CB 4.47Å; T125-A137 HydrophobicContact CG2-CB 3.88Å; S133-A137 PolarHBondContact O-N 2.93Å; S133-A137 VanDerWaalsContact O-N 3.16Å; P134-A137 WeakPolarHBondContact O-CB 3.45Å; V135-A137 PolarHBondContact O-N 3.35Å; A137-W139 VanDerWaalsContact C-N 3.32Å; A137-W139 PolarHBondContact O-N 3.07Å; A137-I140 PolarHBondContact O-N 2.84Å; A137-I141 WeakPolarHBondContact O-CG1 3.26Å; A137-I141 PolarHBondContact O-N 3.36Å |
| 138 | L | 98 | Very high | 94.2 | Very high | 52 Ų | 52 | 26 Ų | 26 | 27% | 0.272 | 13% | 0.134 | S | C | . | . | H | α-helix | trans | -63 | -38.3 | 175.2 | -54.6 | 178.5 | 0 | 0 | 0 | 111.9 | V135 T136 I141 A142 L145 L214 F217 | V135-L138 VanDerWaalsContact O-CB 3.26Å; V135-L138 WeakPolarHBondContact O-CB 3.47Å; V135-L138 PolarHBondContact O-N 3.18Å; T136-L138 PolarHBondContact O-N 3.28Å; L138-I141 CarbonylContact O-C 3.59Å; L138-A142 WeakPolarHBondContact O-CA 3.3Å; L138-A142 WeakPolarHBondContact O-CB 3.09Å; L138-A142 PolarHBondContact O-N 2.81Å; L138-L145 HydrophobicContact CD2-CD2 3.81Å; L138-L214 HydrophobicContact CD1-CD1 3.99Å; L138-F217 HydrophobicContact CB-CD1 4.33Å; L138-F217 HydrophobicContact CB-CD2 3.96Å; L138-F217 HydrophobicContact CB-CE1 4.14Å; L138-F217 HydrophobicContact CB-CE2 3.76Å; L138-F217 HydrophobicContact CB-CG 4.25Å; L138-F217 HydrophobicContact CB-CZ 3.86Å; L138-F217 HydrophobicContact CD1-CD1 4.11Å; L138-F217 HydrophobicContact CD1-CE1 4.22Å; L138-F217 VanDerWaalsContact O-CE2 3.27Å; L138-F217 WeakPolarHBondContact O-CE2 3.37Å |
| 139 | W | 98.4 | Very high | 95.2 | Very high | 9 Ų | 9 | 18.3 Ų | 18.3 | 3% | 0.034 | 11% | 0.105 | C | C | . | . | H | α-helix | trans | -68.7 | -36 | 177.5 | -71.6 | 90.8 | 0 | 0 | 0 | 112.7 | T136 A137 I141 A142 L195 I198 M213 L216 F217 | T136-W139 WeakPolarHBondContact O-CA 3.38Å; T136-W139 WeakPolarHBondContact O-CB 3.27Å; T136-W139 PolarHBondContact O-N 3.04Å; A137-W139 VanDerWaalsContact C-N 3.32Å; A137-W139 PolarHBondContact O-N 3.07Å; W139-I141 PolarHBondContact O-N 3.35Å; W139-A142 WeakPolarHBondContact O-CB 3.34Å; W139-A142 PolarHBondContact O-N 3.36Å; W139-L195 HydrophobicContact CE3-CB 4.27Å; W139-L195 HydrophobicContact CE3-CD2 4.08Å; W139-L195 HydrophobicContact CZ3-CD2 3.67Å; W139-I198 HydrophobicContact CD2-CG2 4.4Å; W139-I198 HydrophobicContact CE3-CB 4.03Å; W139-I198 HydrophobicContact CE3-CG2 3.99Å; W139-I198 HydrophobicContact CH2-CG2 3.91Å; W139-I198 HydrophobicContact CZ2-CG2 4.32Å; W139-I198 HydrophobicContact CZ3-CB 3.98Å; W139-I198 HydrophobicContact CZ3-CD1 3.88Å; W139-I198 HydrophobicContact CZ3-CG2 3.73Å; W139-M213 HydrophobicContact CD2-CE 4.34Å; W139-M213 HydrophobicContact CG-CE 4.25Å; W139-M213 HydrophobicContact CZ2-CE 4.44Å; W139-M213 WeakPolarHBondContact CZ2-O 3.33Å; W139-M213 PolarHBondContact NE1-O 3.39Å; W139-L216 HydrophobicContact CH2-CB 4.09Å; W139-L216 HydrophobicContact CZ2-CB 3.71Å; W139-F217 HydrophobicContact CD2-CD2 4.13Å; W139-F217 HydrophobicContact CG-CD2 4.28Å; W139-F217 HydrophobicContact CZ2-CB 3.86Å; W139-F217 VanDerWaalsContact CZ2-N 3.3Å |
| 140 | I | 98.6 | Very high | 95.8 | Very high | 4 Ų | 4 | 13.3 Ų | 13.3 | 2% | 0.021 | 8% | 0.076 | C | C | . | . | H | α-helix | trans | -65.1 | -38.8 | 179.4 | -69.3 | 172.7 | 0 | 0 | 0 | 112.1 | S59 A62 I63 I66 L121 I132 T136 A137 | S59-I140 PolarHBondContact OG-O 2.87Å; A62-I140 HydrophobicContact CB-CG1 4.02Å; A62-I140 HydrophobicContact CB-CG2 4.29Å; I63-I140 HydrophobicContact CD1-CG2 4.03Å; I63-I140 HydrophobicContact CG1-CD1 3.9Å; I63-I140 HydrophobicContact CG1-CG2 3.77Å; I66-I140 HydrophobicContact CD1-CD1 4.04Å; L121-I140 HydrophobicContact CD2-CD1 4.02Å; L121-I140 HydrophobicContact CD2-CG2 4.49Å; I132-I140 HydrophobicContact CD1-CD1 4.3Å; I132-I140 HydrophobicContact CG2-CD1 4.16Å; T136-I140 HydrophobicContact CG2-CD1 4.11Å; T136-I140 HydrophobicContact CG2-CG1 4.38Å; T136-I140 WeakPolarHBondContact O-CG1 3.4Å; T136-I140 PolarHBondContact O-N 2.97Å; T136-I140 VanDerWaalsContact O-N 3.07Å; A137-I140 PolarHBondContact O-N 2.84Å |
| 141 | I | 98.2 | Very high | 95.9 | Very high | 11 Ų | 11 | 11.4 Ų | 11.4 | 6% | 0.056 | 7% | 0.067 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -108.7 | 23.6 | 178.7 | 65.1 | 166.9 | 0 | 0 | 0 | 112.6 | F42 V117 L121 A137 L138 W139 I143 P144 L145 | F42-I141 HydrophobicContact CE2-CB 4.35Å; F42-I141 HydrophobicContact CE2-CG2 3.87Å; F42-I141 HydrophobicContact CZ-CG2 3.98Å; V117-I141 HydrophobicContact CG1-CG2 3.6Å; L121-I141 HydrophobicContact CD1-CG2 3.96Å; A137-I141 WeakPolarHBondContact O-CG1 3.26Å; A137-I141 PolarHBondContact O-N 3.36Å; L138-I141 CarbonylContact O-C 3.59Å; W139-I141 PolarHBondContact O-N 3.35Å; I141-I143 PolarHBondContact O-N 2.89Å; I141-P144 VanDerWaalsContact O-CD 3.3Å; I141-P144 WeakPolarHBondContact O-CD 3.48Å; I141-L145 HydrophobicContact CG1-CB 4.41Å; I141-L145 VanDerWaalsContact O-CB 3.26Å; I141-L145 WeakPolarHBondContact O-CB 3.33Å; I141-L145 PolarHBondContact O-N 2.79Å |
| 142 | A | 98.3 | Very high | 95.9 | Very high | 1 Ų | 1 | 12.3 Ų | 12.3 | 1% | 0.008 | 7% | 0.071 | C | C | . | . | H | α-helix | trans | -54.7 | -49.9 | -168.2 | 0 | 0 | 0 | 0 | 0 | 113.3 | L138 W139 L145 M146 L195 F217 | L138-A142 WeakPolarHBondContact O-CA 3.3Å; L138-A142 WeakPolarHBondContact O-CB 3.09Å; L138-A142 PolarHBondContact O-N 2.81Å; W139-A142 WeakPolarHBondContact O-CB 3.34Å; W139-A142 PolarHBondContact O-N 3.36Å; A142-L145 PolarHBondContact O-N 3.29Å; A142-M146 HydrophobicContact CB-CE 3.44Å; A142-M146 VanDerWaalsContact CB-CE 3.44Å; A142-M146 WeakPolarHBondContact O-CB 3.49Å; A142-M146 WeakPolarHBondContact O-CE 3.43Å; A142-M146 WeakPolarHBondContact O-CG 3.38Å; A142-M146 PolarHBondContact O-N 2.89Å; A142-L195 HydrophobicContact CB-CB 4.06Å; A142-L195 HydrophobicContact CB-CD1 3.97Å; A142-F217 HydrophobicContact CB-CE2 3.97Å |
| 143 | I | 97.6 | Very high | 95.7 | Very high | 5 Ų | 5 | 18.3 Ų | 18.3 | 3% | 0.026 | 10% | 0.095 | C | C | . | . | H | α-helix | trans | -66.7 | -52.5 | -177.5 | -67.6 | -62.1 | 0 | 0 | 0 | 112.4 | L55 I141 L145 M146 D147 I188 A192 L195 Y224 | L55-I143 HydrophobicContact CD1-CG2 4.32Å; L55-I143 HydrophobicContact CD2-CB 4.4Å; L55-I143 HydrophobicContact CD2-CG2 4.23Å; I141-I143 PolarHBondContact O-N 2.89Å; I143-L145 VanDerWaalsContact C-N 3.31Å; I143-L145 PolarHBondContact O-N 3.27Å; I143-M146 PolarHBondContact O-N 3.36Å; I143-D147 WeakPolarHBondContact O-CB 3.41Å; I143-D147 PolarHBondContact O-N 2.95Å; I143-I188 HydrophobicContact CG2-CG2 3.68Å; I143-A192 HydrophobicContact CB-CB 4.13Å; I143-A192 HydrophobicContact CG1-CB 3.71Å; I143-L195 HydrophobicContact CD1-CD1 3.57Å; I143-L195 HydrophobicContact CG1-CD1 3.88Å; I143-Y224 HydrophobicContact CD1-CD2 4.41Å; I143-Y224 HydrophobicContact CD1-CE2 4.15Å |
| 144 | P | 97.5 | Very high | 95.3 | Very high | 2 Ų | 2 | 20 Ų | 20 | 1% | 0.013 | 10% | 0.1 | C | C | . | . | H | α-helix | trans | -52 | -48.4 | 172.8 | -27 | 31.8 | 0 | 0 | 0 | 113 | A41 F42 V45 L55 I141 M148 | A41-P144 HydrophobicContact CB-CB 3.91Å; F42-P144 HydrophobicContact CE1-CG 4.33Å; F42-P144 HydrophobicContact CE2-CG 4.5Å; F42-P144 HydrophobicContact CZ-CG 4.25Å; V45-P144 HydrophobicContact CG1-CB 4.32Å; L55-P144 HydrophobicContact CD1-CG 4.22Å; I141-P144 VanDerWaalsContact O-CD 3.3Å; I141-P144 WeakPolarHBondContact O-CD 3.48Å; P144-M148 WeakPolarHBondContact O-CB 3.36Å; P144-M148 PolarHBondContact O-N 3.43Å |
| 145 | L | 97.4 | Very high | 94.9 | Very high | 30 Ų | 30 | 19.7 Ų | 19.7 | 16% | 0.157 | 10% | 0.097 | C | C | . | . | H | α-helix | trans | -64.6 | -48.5 | -177.3 | -177.3 | 62.2 | 0 | 0 | 0 | 111.7 | L138 I141 A142 I143 M148 V149 F217 | L138-L145 HydrophobicContact CD2-CD2 3.81Å; I141-L145 HydrophobicContact CG1-CB 4.41Å; I141-L145 VanDerWaalsContact O-CB 3.26Å; I141-L145 WeakPolarHBondContact O-CB 3.33Å; I141-L145 PolarHBondContact O-N 2.79Å; A142-L145 PolarHBondContact O-N 3.29Å; I143-L145 VanDerWaalsContact C-N 3.31Å; I143-L145 PolarHBondContact O-N 3.27Å; L145-M148 HydrophobicContact CD1-CE 4.13Å; L145-M148 PolarHBondContact O-N 3.5Å; L145-V149 HydrophobicContact CD1-CG2 4.21Å; L145-V149 VanDerWaalsContact O-CG2 3.29Å; L145-V149 WeakPolarHBondContact O-CG2 3.38Å; L145-V149 PolarHBondContact O-N 3.31Å; L145-F217 HydrophobicContact CD2-CZ 4.11Å |
| 146 | M | 97 | Very high | 94.6 | Very high | 2 Ų | 2 | 24.6 Ų | 24.6 | 1% | 0.01 | 12% | 0.123 | C | C | . | . | H | α-helix | trans | -60.7 | -46.8 | 178.3 | -78.9 | -172.3 | -113.1 | 0 | 0 | 112.5 | A142 I143 A150 L195 F217 F221 Y224 | A142-M146 HydrophobicContact CB-CE 3.44Å; A142-M146 VanDerWaalsContact CB-CE 3.44Å; A142-M146 WeakPolarHBondContact O-CB 3.49Å; A142-M146 WeakPolarHBondContact O-CE 3.43Å; A142-M146 WeakPolarHBondContact O-CG 3.38Å; A142-M146 PolarHBondContact O-N 2.89Å; I143-M146 PolarHBondContact O-N 3.36Å; M146-A150 WeakPolarHBondContact O-CB 3.02Å; M146-A150 PolarHBondContact O-N 3.41Å; M146-L195 HydrophobicContact CE-CD1 3.72Å; M146-F217 HydrophobicContact CE-CE2 4.09Å; M146-F217 HydrophobicContact CG-CZ 4.49Å; M146-F221 HydrophobicContact CB-CD2 4.32Å; M146-F221 HydrophobicContact CG-CB 4.41Å; M146-F221 HydrophobicContact CG-CD2 3.62Å; M146-F221 HydrophobicContact CG-CE2 4.28Å; M146-F221 HydrophobicContact CG-CG 4.42Å; M146-F221 HydrophobicContact SD-CB 4.36Å; M146-Y224 HydrophobicContact CB-CD1 3.87Å; M146-Y224 HydrophobicContact CB-CD2 4.49Å; M146-Y224 HydrophobicContact CB-CE1 3.92Å; M146-Y224 HydrophobicContact CB-CG 4.18Å; M146-Y224 HydrophobicContact SD-CD1 4.43Å; M146-Y224 HydrophobicContact SD-CD2 4.21Å; M146-Y224 HydrophobicContact SD-CG 3.9Å |
| 147 | D | 95 | Very high | 94.1 | Very high | 0 Ų | 0 | 33.3 Ų | 33.3 | 0% | 0 | 16% | 0.156 | C | C | . | . | H | α-helix | trans | -62.5 | -48 | -179.6 | -166.6 | 60.6 | 0 | 0 | 0 | 110.1 | V45 I143 A150 I151 H169 I170 Y224 | V45-D147 HydrophobicContact CG1-CB 4.33Å; I143-D147 WeakPolarHBondContact O-CB 3.41Å; I143-D147 PolarHBondContact O-N 2.95Å; D147-A150 PolarHBondContact O-N 3.33Å; D147-I151 WeakPolarHBondContact O-CB 3.47Å; D147-I151 WeakPolarHBondContact O-CD1 3.41Å; D147-I151 WeakPolarHBondContact O-CG1 3.23Å; D147-I151 PolarHBondContact O-N 3.01Å; D147-I151 WeakPolarHBondContact OD2-CD1 3.3Å; D147-H169 IonicContact OD2-CE1 2.69Å; D147-H169 IonicContact OD2-CG 3.57Å; D147-H169 IonicContact OD2-ND1 3.54Å; D147-H169 PolarHBondContact OD2-ND1 3.08Å; D147-I170 PolarHBondContact OD1-N 2.89Å; D147-Y224 WeakPolarHBondContact CA-OH 3.46Å; D147-Y224 WeakPolarHBondContact CB-OH 3.34Å; D147-Y224 PolarHBondContact OD1-OH 3.45Å |
| 148 | M | 94.6 | Very high | 93.6 | Very high | 5 Ų | 5 | 38.1 Ų | 38.1 | 3% | 0.025 | 17% | 0.174 | C | C | . | . | H | α-helix | trans | -56.8 | -55.4 | 177.5 | -178.6 | -168.6 | 73 | 0 | 0 | 111.7 | A37 N40 A41 M44 P144 L145 A150 I151 M152 | A37-M148 HydrophobicContact CB-CE 3.91Å; N40-M148 HydrophobicContact CB-SD 3.88Å; A41-M148 HydrophobicContact CB-CB 4.04Å; A41-M148 HydrophobicContact CB-CE 4.37Å; A41-M148 HydrophobicContact CB-CG 4.48Å; A41-M148 HydrophobicContact CB-SD 3.79Å; A41-M148 PolarHBondContact N-SD 3.48Å; A41-M148 VanDerWaalsContact N-SD 3.42Å; M44-M148 HydrophobicContact CE-CG 4.47Å; M44-M148 HydrophobicContact SD-CB 4.36Å; M44-M148 HydrophobicContact SD-CG 3.7Å; P144-M148 WeakPolarHBondContact O-CB 3.36Å; P144-M148 PolarHBondContact O-N 3.43Å; L145-M148 HydrophobicContact CD1-CE 4.13Å; L145-M148 PolarHBondContact O-N 3.5Å; M148-A150 PolarHBondContact O-N 2.99Å; M148-I151 PolarHBondContact O-N 2.74Å; M148-M152 HydrophobicContact CE-SD 4.45Å; M148-M152 HydrophobicContact CG-CG 4.33Å; M148-M152 HydrophobicContact CG-SD 3.72Å; M148-M152 WeakPolarHBondContact O-CB 3.49Å; M148-M152 VanDerWaalsContact O-CG 3.32Å; M148-M152 WeakPolarHBondContact O-CG 3.14Å; M148-M152 PolarHBondContact O-N 3.31Å; M148-M152 HydrophobicContact SD-SD 4.18Å |
| 149 | V | 93.9 | Very high | 93.1 | Very high | 55 Ų | 55 | 39.2 Ų | 39.2 | 33% | 0.333 | 20% | 0.198 | S | C | . | . | H | α-helix | trans | -62.9 | -43.6 | -176.8 | 176.6 | 0 | 0 | 0 | 0 | 110.9 | L145 I151 M152 Y153 F221 | L145-V149 HydrophobicContact CD1-CG2 4.21Å; L145-V149 VanDerWaalsContact O-CG2 3.29Å; L145-V149 WeakPolarHBondContact O-CG2 3.38Å; L145-V149 PolarHBondContact O-N 3.31Å; V149-I151 VanDerWaalsContact C-N 3.28Å; V149-I151 PolarHBondContact O-N 3.19Å; V149-M152 PolarHBondContact O-N 2.89Å; V149-Y153 WeakPolarHBondContact O-CB 3.13Å; V149-Y153 PolarHBondContact O-N 3.46Å; V149-F221 HydrophobicContact CB-CE2 3.88Å; V149-F221 HydrophobicContact CB-CZ 4.1Å; V149-F221 HydrophobicContact CG1-CE2 3.83Å; V149-F221 HydrophobicContact CG1-CZ 3.6Å |
| 150 | A | 92.2 | Very high | 92.5 | Very high | 16 Ų | 16 | 42.2 Ų | 42.2 | 13% | 0.132 | 21% | 0.213 | C | C | . | . | H | α-helix | trans | -61.3 | -37.4 | 179.2 | 0 | 0 | 0 | 0 | 0 | 112.4 | M146 D147 M148 R154 Y224 I228 | M146-A150 WeakPolarHBondContact O-CB 3.02Å; M146-A150 PolarHBondContact O-N 3.41Å; D147-A150 PolarHBondContact O-N 3.33Å; M148-A150 PolarHBondContact O-N 2.99Å; A150-R154 VanDerWaalsContact O-CB 3.3Å; A150-R154 WeakPolarHBondContact O-CB 3.42Å; A150-R154 PolarHBondContact O-N 3.27Å; A150-R154 VanDerWaalsContact O-N 3.12Å; A150-Y224 HydrophobicContact CB-CE1 4.21Å; A150-I228 HydrophobicContact CB-CD1 4.46Å |
| 151 | I | 90 | Very high | 91.7 | Very high | 0 Ų | 0 | 45.1 Ų | 45.1 | 0% | 0 | 23% | 0.234 | C | C | . | . | H | α-helix | trans | -74.4 | -48.8 | 179.1 | -67.2 | 171.7 | 0 | 0 | 0 | 111.1 | M44 D147 M148 V149 Y153 R154 R155 H169 | M44-I151 HydrophobicContact CE-CB 4Å; M44-I151 HydrophobicContact CE-CD1 4.19Å; M44-I151 HydrophobicContact CE-CG2 3.7Å; D147-I151 WeakPolarHBondContact O-CB 3.47Å; D147-I151 WeakPolarHBondContact O-CD1 3.41Å; D147-I151 WeakPolarHBondContact O-CG1 3.23Å; D147-I151 PolarHBondContact O-N 3.01Å; D147-I151 WeakPolarHBondContact OD2-CD1 3.3Å; M148-I151 PolarHBondContact O-N 2.74Å; V149-I151 VanDerWaalsContact C-N 3.28Å; V149-I151 PolarHBondContact O-N 3.19Å; I151-Y153 VanDerWaalsContact C-N 3.31Å; I151-Y153 PolarHBondContact O-N 3.09Å; I151-R154 PolarHBondContact O-N 3.3Å; I151-R154 VanDerWaalsContact O-N 3.16Å; I151-R155 HydrophobicContact CG2-CG 4.34Å; I151-R155 VanDerWaalsContact CG2-CZ 3.43Å; I151-R155 VanDerWaalsContact O-CG 3.32Å; I151-R155 WeakPolarHBondContact O-CG 3.46Å; I151-R155 PolarHBondContact O-N 3Å; I151-H169 HydrophobicContact CD1-CB 4.06Å; I151-H169 WeakPolarHBondContact CD1-CE1 3.11Å; I151-H169 VanDerWaalsContact CD1-CG 3.41Å; I151-H169 WeakPolarHBondContact CD1-ND1 3.5Å |
| 152 | M | 90.8 | Very high | 90.6 | Very high | 30 Ų | 30 | 46 Ų | 46 | 15% | 0.148 | 24% | 0.24 | C | C | . | . | H | α-helix | trans | -57.9 | -46 | 177.2 | -70 | 179.5 | 76.9 | 0 | 0 | 110.8 | W36 M148 V149 R154 R155 L156 P162 | W36-M152 HydrophobicContact CH2-CE 3.62Å; W36-M152 HydrophobicContact CZ2-CE 4.3Å; M148-M152 HydrophobicContact CE-SD 4.45Å; M148-M152 HydrophobicContact CG-CG 4.33Å; M148-M152 HydrophobicContact CG-SD 3.72Å; M148-M152 WeakPolarHBondContact O-CB 3.49Å; M148-M152 VanDerWaalsContact O-CG 3.32Å; M148-M152 WeakPolarHBondContact O-CG 3.14Å; M148-M152 PolarHBondContact O-N 3.31Å; M148-M152 HydrophobicContact SD-SD 4.18Å; V149-M152 PolarHBondContact O-N 2.89Å; M152-R154 VanDerWaalsContact C-N 3.34Å; M152-R154 PolarHBondContact O-N 2.99Å; M152-R155 WeakPolarHBondContact O-CB 3.3Å; M152-R155 PolarHBondContact O-N 3.36Å; M152-R155 VanDerWaalsContact O-N 3.16Å; M152-L156 WeakPolarHBondContact O-CG 3.37Å; M152-L156 PolarHBondContact O-N 3.19Å; M152-P162 HydrophobicContact CE-CB 3.84Å; M152-P162 HydrophobicContact CG-CB 4.43Å |
| 153 | Y | 90.4 | Very high | 89.4 | Confident | 127 Ų | 127 | 52.2 Ų | 52.2 | 50% | 0.498 | 27% | 0.267 | S | S | . | . | H | α-helix | trans | -57.9 | -44.8 | 175.7 | -177.1 | -108.9 | 0 | 0 | 0 | 112.7 | V149 I151 L156 R157 | V149-Y153 WeakPolarHBondContact O-CB 3.13Å; V149-Y153 PolarHBondContact O-N 3.46Å; I151-Y153 VanDerWaalsContact C-N 3.31Å; I151-Y153 PolarHBondContact O-N 3.09Å; Y153-L156 PolarHBondContact O-N 3.28Å; Y153-R157 HydrophobicContact CE1-CG 4.3Å; Y153-R157 PolarHBondContact O-N 3.21Å; Y153-R157 PolarHBondContact OH-NE 2.85Å; Y153-R157 PolarHBondContact OH-NH2 2.98Å |
| 154 | R | 87 | Confident | 88.1 | Confident | 38 Ų | 38 | 53.5 Ų | 53.5 | 14% | 0.143 | 28% | 0.277 | C | S | . | . | H | α-helix | trans | -65.4 | -37.7 | 177.1 | -177.6 | -175.9 | 65.3 | -133.4 | -4.4 | 112.2 | A150 I151 M152 K158 D166 Q168 | A150-R154 VanDerWaalsContact O-CB 3.3Å; A150-R154 WeakPolarHBondContact O-CB 3.42Å; A150-R154 PolarHBondContact O-N 3.27Å; A150-R154 VanDerWaalsContact O-N 3.12Å; I151-R154 PolarHBondContact O-N 3.3Å; I151-R154 VanDerWaalsContact O-N 3.16Å; M152-R154 VanDerWaalsContact C-N 3.34Å; M152-R154 PolarHBondContact O-N 2.99Å; R154-K158 WeakPolarHBondContact O-CG 3.17Å; R154-K158 PolarHBondContact O-N 2.79Å; R154-D166 IonicContact CZ-OD2 3.98Å; R154-D166 IonicContact NE-OD2 3.85Å; R154-D166 IonicContact NH2-OD2 2.69Å; R154-D166 PolarHBondContact NH2-OD2 3.29Å; R154-Q168 VanDerWaalsContact CD-OE1 3.26Å; R154-Q168 VanDerWaalsContact CZ-OE1 3.23Å; R154-Q168 PolarHBondContact NH1-O 3.28Å; R154-Q168 VanDerWaalsContact NH1-O 3.14Å; R154-Q168 PolarHBondContact NH2-O 3.29Å |
| 155 | R | 87 | Confident | 86.6 | Confident | 10 Ų | 10 | 59.8 Ų | 59.8 | 4% | 0.038 | 32% | 0.317 | C | S | . | . | H | α-helix | trans | -64.2 | -49.1 | 176.7 | -72.3 | 174.4 | -178.7 | 167.4 | 0.6 | 110.4 | I151 M152 R157 K158 G159 M160 P162 S164 D166 | I151-R155 HydrophobicContact CG2-CG 4.34Å; I151-R155 VanDerWaalsContact CG2-CZ 3.43Å; I151-R155 VanDerWaalsContact O-CG 3.32Å; I151-R155 WeakPolarHBondContact O-CG 3.46Å; I151-R155 PolarHBondContact O-N 3Å; M152-R155 WeakPolarHBondContact O-CB 3.3Å; M152-R155 PolarHBondContact O-N 3.36Å; M152-R155 VanDerWaalsContact O-N 3.16Å; R155-R157 VanDerWaalsContact C-N 3.35Å; R155-R157 PolarHBondContact O-N 2.59Å; R155-K158 CarbonylContact O-C 3.56Å; R155-K158 WeakPolarHBondContact O-CA 3.08Å; R155-K158 PolarHBondContact O-N 3.45Å; R155-G159 PolarHBondContact O-N 3.44Å; R155-M160 CarbonylContact C-O 3.51Å; R155-M160 HydrophobicContact CB-CB 4.42Å; R155-M160 HydrophobicContact CB-CE 4.32Å; R155-M160 HydrophobicContact CG-CE 4.02Å; R155-M160 PolarHBondContact O-N 2.85Å; R155-P162 WeakPolarHBondContact CD-O 3.33Å; R155-P162 PolarHBondContact NH1-O 2.88Å; R155-S164 PolarHBondContact NE-O 3.35Å; R155-S164 VanDerWaalsContact NE-O 3.12Å; R155-S164 PolarHBondContact NH1-O 2.97Å; R155-S164 PolarHBondContact NH2-O 3.06Å; R155-D166 IonicContact NE-OD2 2.78Å |
| 156 | L | 88.9 | Confident | 85.3 | Confident | 105 Ų | 105 | 59.8 Ų | 59.8 | 55% | 0.55 | 32% | 0.318 | S | S | . | . | H | α-helix | trans | -58.6 | -44 | 176.8 | -68.7 | 172.2 | 0 | 0 | 0 | 112 | M152 Y153 K158 G159 P162 | M152-L156 WeakPolarHBondContact O-CG 3.37Å; M152-L156 PolarHBondContact O-N 3.19Å; Y153-L156 PolarHBondContact O-N 3.28Å; L156-K158 PolarHBondContact O-N 2.85Å; L156-K158 VanDerWaalsContact O-N 3.15Å; L156-G159 PolarHBondContact O-N 3.41Å; L156-P162 HydrophobicContact CD2-CB 4.46Å; L156-P162 HydrophobicContact CD2-CG 4.3Å |
| 157 | R | 88.4 | Confident | 84 | Confident | 185 Ų | 185 | 68.3 Ų | 68.3 | 70% | 0.698 | 35% | 0.35 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -62.9 | -18.5 | 174.9 | -81.4 | -169.7 | 168.1 | -137.6 | 4 | 114.8 | Y153 R155 | Y153-R157 HydrophobicContact CE1-CG 4.3Å; Y153-R157 PolarHBondContact O-N 3.21Å; Y153-R157 PolarHBondContact OH-NE 2.85Å; Y153-R157 PolarHBondContact OH-NH2 2.98Å; R155-R157 VanDerWaalsContact C-N 3.35Å; R155-R157 PolarHBondContact O-N 2.59Å |
| 158 | K | 87.3 | Confident | 83.2 | Confident | 114 Ų | 114 | 71 Ų | 71 | 50% | 0.496 | 36% | 0.362 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -98.3 | 6.5 | 175.5 | -69.9 | 178.3 | 179.6 | 179.7 | 0 | 112.6 | R154 R155 L156 M160 | R154-K158 WeakPolarHBondContact O-CG 3.17Å; R154-K158 PolarHBondContact O-N 2.79Å; R155-K158 CarbonylContact O-C 3.56Å; R155-K158 WeakPolarHBondContact O-CA 3.08Å; R155-K158 PolarHBondContact O-N 3.45Å; L156-K158 PolarHBondContact O-N 2.85Å; L156-K158 VanDerWaalsContact O-N 3.15Å; K158-M160 HydrophobicContact CB-CE 4.12Å; K158-M160 HydrophobicContact CB-CG 4.03Å; K158-M160 HydrophobicContact CB-SD 4.39Å; K158-M160 HydrophobicContact CD-CE 3.83Å; K158-M160 PolarHBondContact O-N 3.44Å |
| 159 | G | 87.4 | Confident | 82.7 | Confident | 75 Ų | 75 | 71.4 Ų | 71.4 | 77% | 0.773 | 36% | 0.364 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 66 | 17.3 | -174.5 | 0 | 0 | 0 | 0 | 0 | 113.5 | R155 L156 | R155-G159 PolarHBondContact O-N 3.44Å; L156-G159 PolarHBondContact O-N 3.41Å |
| 160 | M | 84.2 | Confident | 82.4 | Confident | 72 Ų | 72 | 70.1 Ų | 70.1 | 36% | 0.355 | 36% | 0.355 | S | S | . | . | trans | -92.4 | 151.1 | 177.4 | -58.2 | -174.6 | -47.7 | 0 | 0 | 109.9 | R155 K158 | R155-M160 CarbonylContact C-O 3.51Å; R155-M160 HydrophobicContact CB-CB 4.42Å; R155-M160 HydrophobicContact CB-CE 4.32Å; R155-M160 HydrophobicContact CG-CE 4.02Å; R155-M160 PolarHBondContact O-N 2.85Å; K158-M160 HydrophobicContact CB-CE 4.12Å; K158-M160 HydrophobicContact CB-CG 4.03Å; K158-M160 HydrophobicContact CB-SD 4.39Å; K158-M160 HydrophobicContact CD-CE 3.83Å; K158-M160 PolarHBondContact O-N 3.44Å | ||
| 161 | S | 82.7 | Confident | 82.1 | Confident | 65 Ų | 65 | 69.4 Ų | 69.4 | 46% | 0.455 | 35% | 0.349 | S | S | . | . | trans | -56 | 136.6 | 171.9 | 172.5 | 0 | 0 | 0 | 0 | 110.5 | F163 S164 | S161-F163 PolarHBondContact O-N 2.99Å; S161-F163 VanDerWaalsContact O-N 3.08Å; S161-F163 PolarHBondContact OG-N 3.48Å; S161-S164 PolarHBondContact O-N 3.42Å; S161-S164 PolarHBondContact O-OG 3.08Å | ||
| 162 | P | 74.8 | Confident | 81.9 | Confident | 29 Ų | 29 | 71.8 Ų | 71.8 | 19% | 0.188 | 36% | 0.36 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -59.6 | -19.5 | 175.1 | 21.6 | -30.2 | 0 | 0 | 0 | 113.1 | M152 R155 L156 | M152-P162 HydrophobicContact CE-CB 3.84Å; M152-P162 HydrophobicContact CG-CB 4.43Å; R155-P162 WeakPolarHBondContact CD-O 3.33Å; R155-P162 PolarHBondContact NH1-O 2.88Å; L156-P162 HydrophobicContact CD2-CB 4.46Å; L156-P162 HydrophobicContact CD2-CG 4.3Å |
| 163 | F | 73.1 | Confident | 81.8 | Confident | 131 Ų | 131 | 71.4 Ų | 71.4 | 58% | 0.575 | 36% | 0.358 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -98.8 | -1.2 | -177.9 | -53.8 | -73.4 | 0 | 0 | 0 | 114.4 | W36 S161 | W36-F163 AromaticContact CZ2-CE1 3.82Å; W36-F163 HydrophobicContact CZ2-CE1 3.82Å; W36-F163 AromaticContact CZ2-CZ 3.82Å; W36-F163 HydrophobicContact CZ2-CZ 3.82Å; S161-F163 PolarHBondContact O-N 2.99Å; S161-F163 VanDerWaalsContact O-N 3.08Å; S161-F163 PolarHBondContact OG-N 3.48Å |
| 164 | S | 69.5 | Low | 81.6 | Confident | 33 Ų | 33 | 67 Ų | 67 | 23% | 0.231 | 34% | 0.343 | C | S | . | . | S | Bend | trans | -67.8 | 140.7 | 178.3 | 62.8 | 0 | 0 | 0 | 0 | 111.3 | R155 S161 D166 | R155-S164 PolarHBondContact NE-O 3.35Å; R155-S164 VanDerWaalsContact NE-O 3.12Å; R155-S164 PolarHBondContact NH1-O 2.97Å; R155-S164 PolarHBondContact NH2-O 3.06Å; S161-S164 PolarHBondContact O-N 3.42Å; S161-S164 PolarHBondContact O-OG 3.08Å; S164-D166 PolarHBondContact O-N 3.21Å |
| 165 | P | 67.1 | Low | 81.7 | Confident | 133 Ų | 133 | 67.8 Ų | 67.8 | 86% | 0.864 | 35% | 0.349 | S | S | * | . | trans | -55.6 | 138.5 | 176.5 | -22.2 | 31.2 | 0 | 0 | 0 | 112.1 | ||||
| 166 | D | 69 | Low | 81.7 | Confident | 31 Ų | 31 | 72.2 Ų | 72.2 | 17% | 0.166 | 37% | 0.366 | C | S | . | . | trans | -137.5 | 147.5 | 177 | -162 | -9.3 | 0 | 0 | 0 | 110.9 | R154 R155 S164 Q168 H169 | R154-D166 IonicContact CZ-OD2 3.98Å; R154-D166 IonicContact NE-OD2 3.85Å; R154-D166 IonicContact NH2-OD2 2.69Å; R154-D166 PolarHBondContact NH2-OD2 3.29Å; R155-D166 IonicContact NE-OD2 2.78Å; S164-D166 PolarHBondContact O-N 3.21Å; D166-Q168 WeakPolarHBondContact OD1-CB 3.32Å; D166-Q168 WeakPolarHBondContact OD1-CG 3.48Å; D166-Q168 PolarHBondContact OD1-N 2.95Å; D166-H169 PolarHBondContact O-CD2 3.47Å | ||
| 167 | R | 70.1 | Confident | 81.5 | Confident | 181 Ų | 181 | 67.8 Ų | 67.8 | 68% | 0.683 | 34% | 0.344 | S | S | * | . | S | Bend | trans | -106.9 | 35 | -180 | -63.5 | -172 | -179.8 | -173 | 0.4 | 111.9 | H172 R176 | R167-H172 WeakPolarHBondContact O-CB 3.45Å; R167-R176 VanDerWaalsContact O-CZ 3.28Å; R167-R176 PolarHBondContact O-NH1 2.88Å; R167-R176 PolarHBondContact O-NH2 2.9Å; R167-R176 VanDerWaalsContact O-NH2 3.16Å |
| 168 | Q | 77.9 | Confident | 81.4 | Confident | 55 Ų | 55 | 60.9 Ų | 60.9 | 26% | 0.257 | 33% | 0.331 | S | S | . | . | trans | -129.8 | 22.9 | -172 | -68.8 | -169.2 | 4.5 | 0 | 0 | 112.4 | R154 D166 | R154-Q168 VanDerWaalsContact CD-OE1 3.26Å; R154-Q168 VanDerWaalsContact CZ-OE1 3.23Å; R154-Q168 PolarHBondContact NH1-O 3.28Å; R154-Q168 VanDerWaalsContact NH1-O 3.14Å; R154-Q168 PolarHBondContact NH2-O 3.29Å; D166-Q168 WeakPolarHBondContact OD1-CB 3.32Å; D166-Q168 WeakPolarHBondContact OD1-CG 3.48Å; D166-Q168 PolarHBondContact OD1-N 2.95Å | ||
| 169 | H | 85.4 | Confident | 81.5 | Confident | 15 Ų | 15 | 59.6 Ų | 59.6 | 7% | 0.069 | 33% | 0.325 | C | S | . | . | S | Bend | trans | -62.5 | 155.1 | 161.1 | -66.5 | -92.3 | 0 | 0 | 0 | 111.1 | M44 D147 I151 D166 H171 H172 L173 | M44-H169 PolarHBondContact O-CE1 3.38Å; M44-H169 PolarHBondContact O-ND1 3.5Å; D147-H169 IonicContact OD2-CE1 2.69Å; D147-H169 IonicContact OD2-CG 3.57Å; D147-H169 IonicContact OD2-ND1 3.54Å; D147-H169 PolarHBondContact OD2-ND1 3.08Å; I151-H169 HydrophobicContact CD1-CB 4.06Å; I151-H169 WeakPolarHBondContact CD1-CE1 3.11Å; I151-H169 VanDerWaalsContact CD1-CG 3.41Å; I151-H169 WeakPolarHBondContact CD1-ND1 3.5Å; D166-H169 PolarHBondContact O-CD2 3.47Å; H169-H171 WeakPolarHBondContact CB-CE1 3.48Å; H169-H171 AromaticContact CG-CE1 3.69Å; H169-H171 PolarHBondContact O-N 2.92Å; H169-H172 PolarHBondContact O-N 3.23Å; H169-L173 WeakPolarHBondContact O-CG 3.45Å; H169-L173 PolarHBondContact O-N 3.3Å |
| 170 | I | 86.7 | Confident | 81.8 | Confident | 27 Ų | 27 | 59.6 Ų | 59.6 | 14% | 0.138 | 31% | 0.311 | C | S | . | . | H | α-helix | trans | -51.1 | -42 | 179.4 | -175.9 | 165.3 | 0 | 0 | 0 | 113 | D147 H172 L173 I174 I188 Y224 | D147-I170 PolarHBondContact OD1-N 2.89Å; I170-H172 PolarHBondContact O-N 3.46Å; I170-L173 PolarHBondContact O-N 2.94Å; I170-L173 VanDerWaalsContact O-N 3.15Å; I170-I174 HydrophobicContact CD1-CD1 4.37Å; I170-I174 HydrophobicContact CG1-CD1 3.81Å; I170-I174 HydrophobicContact CG1-CG1 4.31Å; I170-I174 WeakPolarHBondContact O-CG1 3.33Å; I170-I174 PolarHBondContact O-N 2.81Å; I170-I188 HydrophobicContact CD1-CG1 4.38Å; I170-I188 HydrophobicContact CG1-CD1 4.43Å; I170-I188 HydrophobicContact CG1-CG1 4.3Å; I170-I188 HydrophobicContact CG2-CD1 3.95Å; I170-I188 HydrophobicContact CG2-CG1 4.33Å; I170-Y224 WeakPolarHBondContact CB-OH 3.43Å; I170-Y224 HydrophobicContact CD1-CD2 4.47Å; I170-Y224 HydrophobicContact CD1-CE2 3.54Å |
| 171 | H | 85.9 | Confident | 82.3 | Confident | 2 Ų | 2 | 57.8 Ų | 57.8 | 1% | 0.009 | 31% | 0.305 | C | S | . | . | H | α-helix | trans | -63.1 | -40 | 179 | 59.7 | -102.4 | 0 | 0 | 0 | 112.4 | I48 L51 H169 L173 I174 M175 I188 | I48-H171 HydrophobicContact CD1-CB 3.8Å; I48-H171 HydrophobicContact CG1-CB 3.99Å; I48-H171 HydrophobicContact CG2-CB 4.22Å; L51-H171 HydrophobicContact CD2-CB 4Å; H169-H171 WeakPolarHBondContact CB-CE1 3.48Å; H169-H171 AromaticContact CG-CE1 3.69Å; H169-H171 PolarHBondContact O-N 2.92Å; H171-L173 VanDerWaalsContact C-N 3.35Å; H171-L173 PolarHBondContact O-N 3.35Å; H171-I174 PolarHBondContact O-N 3.23Å; H171-M175 WeakPolarHBondContact O-CB 3.3Å; H171-M175 WeakPolarHBondContact O-CG 3.31Å; H171-M175 PolarHBondContact O-N 2.89Å; H171-I188 HydrophobicContact CB-CD1 3.64Å |
| 172 | H | 87.3 | Confident | 82.8 | Confident | 50 Ų | 50 | 61.8 Ų | 61.8 | 23% | 0.231 | 31% | 0.31 | C | S | . | . | H | α-helix | trans | -67.6 | -35.9 | 175 | -72.5 | -45.4 | 0 | 0 | 0 | 112.3 | R167 H169 I170 R176 | R167-H172 WeakPolarHBondContact O-CB 3.45Å; H169-H172 PolarHBondContact O-N 3.23Å; I170-H172 PolarHBondContact O-N 3.46Å; H172-R176 WeakPolarHBondContact O-CB 3.27Å; H172-R176 WeakPolarHBondContact O-CG 3.35Å; H172-R176 PolarHBondContact O-N 3.47Å |
| 173 | L | 87.2 | Confident | 83.8 | Confident | 21 Ų | 21 | 64.7 Ų | 64.7 | 11% | 0.11 | 32% | 0.321 | C | S | . | . | H | α-helix | trans | -67.1 | -43.9 | 177.6 | -65 | 172.1 | 0 | 0 | 0 | 111.5 | H169 I170 H171 R176 A177 I228 A231 | H169-L173 WeakPolarHBondContact O-CG 3.45Å; H169-L173 PolarHBondContact O-N 3.3Å; I170-L173 PolarHBondContact O-N 2.94Å; I170-L173 VanDerWaalsContact O-N 3.15Å; H171-L173 VanDerWaalsContact C-N 3.35Å; H171-L173 PolarHBondContact O-N 3.35Å; L173-R176 PolarHBondContact O-N 3.48Å; L173-A177 PolarHBondContact O-N 3.45Å; L173-A177 VanDerWaalsContact O-N 3.08Å; L173-I228 HydrophobicContact CD1-CB 4.15Å; L173-I228 HydrophobicContact CD1-CD1 4.43Å; L173-I228 HydrophobicContact CD1-CG1 3.95Å; L173-I228 HydrophobicContact CD1-CG2 3.76Å; L173-A231 HydrophobicContact CB-CB 4.19Å; L173-A231 HydrophobicContact CD1-CB 4.32Å |
| 174 | I | 86.6 | Confident | 84.9 | Confident | 34 Ų | 34 | 58.5 Ų | 58.5 | 17% | 0.174 | 29% | 0.294 | C | S | . | . | H | α-helix | trans | -62.5 | -46.4 | 175.7 | -67.4 | 171.5 | 0 | 0 | 0 | 110.3 | I170 H171 R176 A177 F179 A184 L187 I188 | I170-I174 HydrophobicContact CD1-CD1 4.37Å; I170-I174 HydrophobicContact CG1-CD1 3.81Å; I170-I174 HydrophobicContact CG1-CG1 4.31Å; I170-I174 WeakPolarHBondContact O-CG1 3.33Å; I170-I174 PolarHBondContact O-N 2.81Å; H171-I174 PolarHBondContact O-N 3.23Å; I174-R176 VanDerWaalsContact C-N 3.34Å; I174-R176 PolarHBondContact O-N 3.34Å; I174-A177 WeakPolarHBondContact O-CB 3.35Å; I174-A177 PolarHBondContact O-N 3.2Å; I174-A177 VanDerWaalsContact O-N 3.08Å; I174-F179 HydrophobicContact CG2-CB 3.69Å; I174-F179 HydrophobicContact CG2-CD2 3.81Å; I174-F179 HydrophobicContact CG2-CG 3.84Å; I174-F179 WeakPolarHBondContact O-CD2 3.32Å; I174-A184 HydrophobicContact CB-CB 4.1Å; I174-A184 HydrophobicContact CG2-CB 3.69Å; I174-L187 HydrophobicContact CG2-CD1 4.3Å; I174-I188 HydrophobicContact CD1-CD1 4Å; I174-I188 HydrophobicContact CD1-CG1 3.65Å |
| 175 | M | 89.3 | Confident | 86.2 | Confident | 55 Ų | 55 | 58.3 Ų | 58.3 | 27% | 0.271 | 29% | 0.289 | S | S | . | . | H | α-helix | trans | -63.6 | -37.5 | 177 | -70.8 | -170.6 | -64.2 | 0 | 0 | 112.8 | I48 H171 A177 G178 F179 A184 | I48-M175 HydrophobicContact CG2-CE 3.52Å; I48-M175 HydrophobicContact CG2-SD 4.04Å; H171-M175 WeakPolarHBondContact O-CB 3.3Å; H171-M175 WeakPolarHBondContact O-CG 3.31Å; H171-M175 PolarHBondContact O-N 2.89Å; M175-A177 PolarHBondContact O-N 3.07Å; M175-G178 WeakPolarHBondContact O-CA 3.19Å; M175-G178 PolarHBondContact O-N 3.48Å; M175-F179 WeakPolarHBondContact CA-O 3.37Å; M175-A184 HydrophobicContact CG-CB 4.15Å |
| 176 | R | 86.6 | Confident | 87.6 | Confident | 104 Ų | 104 | 55.3 Ų | 55.3 | 39% | 0.392 | 27% | 0.268 | S | S | . | . | H | α-helix | trans | -65.5 | -25.9 | 174.5 | -76.5 | 172.7 | -178.4 | -175.4 | 2.5 | 113.2 | R167 H172 L173 I174 G178 K239 | R167-R176 VanDerWaalsContact O-CZ 3.28Å; R167-R176 PolarHBondContact O-NH1 2.88Å; R167-R176 PolarHBondContact O-NH2 2.9Å; R167-R176 VanDerWaalsContact O-NH2 3.16Å; H172-R176 WeakPolarHBondContact O-CB 3.27Å; H172-R176 WeakPolarHBondContact O-CG 3.35Å; H172-R176 PolarHBondContact O-N 3.47Å; L173-R176 PolarHBondContact O-N 3.48Å; I174-R176 VanDerWaalsContact C-N 3.34Å; I174-R176 PolarHBondContact O-N 3.34Å; R176-G178 PolarHBondContact O-N 2.89Å; R176-K239 VanDerWaalsContact O-CE 3.26Å; R176-K239 WeakPolarHBondContact O-CE 3.04Å; R176-K239 PolarHBondContact O-NZ 3.25Å |
| 177 | A | 84.1 | Confident | 88.9 | Confident | 11 Ų | 11 | 57.7 Ų | 57.7 | 9% | 0.091 | 28% | 0.281 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -72 | -8.3 | 170.3 | 0 | 0 | 0 | 0 | 0 | 113.3 | L173 I174 M175 F179 A235 | L173-A177 PolarHBondContact O-N 3.45Å; L173-A177 VanDerWaalsContact O-N 3.08Å; I174-A177 WeakPolarHBondContact O-CB 3.35Å; I174-A177 PolarHBondContact O-N 3.2Å; I174-A177 VanDerWaalsContact O-N 3.08Å; M175-A177 PolarHBondContact O-N 3.07Å; A177-F179 HydrophobicContact CB-CD2 4.14Å; A177-F179 HydrophobicContact CB-CE2 4.31Å; A177-A235 HydrophobicContact CB-CB 3.79Å |
| 178 | G | 87.3 | Confident | 90.2 | Very high | 41 Ų | 41 | 49.2 Ų | 49.2 | 42% | 0.423 | 25% | 0.249 | S | C | . | . | T | Hydrogen-bonded Turn | trans | 101.2 | 16.9 | 173.3 | 0 | 0 | 0 | 0 | 0 | 114.4 | M175 R176 | M175-G178 WeakPolarHBondContact O-CA 3.19Å; M175-G178 PolarHBondContact O-N 3.48Å; R176-G178 PolarHBondContact O-N 2.89Å |
| 179 | F | 89.1 | Confident | 91.2 | Very high | 86 Ų | 86 | 47.6 Ų | 47.6 | 38% | 0.377 | 24% | 0.243 | S | C | . | . | trans | -82.8 | 154.2 | 167.5 | -67.3 | -91.9 | 0 | 0 | 0 | 110.3 | I174 M175 A177 Q183 L187 | I174-F179 HydrophobicContact CG2-CB 3.69Å; I174-F179 HydrophobicContact CG2-CD2 3.81Å; I174-F179 HydrophobicContact CG2-CG 3.84Å; I174-F179 WeakPolarHBondContact O-CD2 3.32Å; M175-F179 WeakPolarHBondContact CA-O 3.37Å; A177-F179 HydrophobicContact CB-CD2 4.14Å; A177-F179 HydrophobicContact CB-CE2 4.31Å; F179-Q183 VanDerWaalsContact CA-OE1 3.32Å; F179-Q183 HydrophobicContact CB-CB 4.08Å; F179-Q183 HydrophobicContact CD1-CB 4.09Å; F179-L187 HydrophobicContact CD1-CD1 4.03Å; F179-L187 HydrophobicContact CE1-CD1 4.01Å | ||
| 180 | T | 94.2 | Very high | 91.8 | Very high | 76 Ų | 76 | 51.8 Ų | 51.8 | 47% | 0.466 | 27% | 0.265 | S | S | . | . | trans | -77.2 | 163.4 | 172.5 | 69.2 | 0 | 0 | 0 | 0 | 111.1 | R182 Q183 A184 | T180-R182 VanDerWaalsContact C-N 3.3Å; T180-R182 PolarHBondContact O-N 3.29Å; T180-Q183 PolarHBondContact O-N 3.29Å; T180-Q183 VanDerWaalsContact O-N 3.14Å; T180-Q183 WeakPolarHBondContact OG1-CG 3.5Å; T180-Q183 PolarHBondContact OG1-N 3.47Å; T180-A184 PolarHBondContact O-N 3.45Å | ||
| 181 | S | 93.7 | Very high | 92.4 | Very high | 34 Ų | 34 | 52.4 Ų | 52.4 | 24% | 0.238 | 27% | 0.274 | C | S | . | . | H | α-helix | trans | -53.8 | -46.3 | 174.4 | -179.5 | 0 | 0 | 0 | 0 | 111.9 | I48 Q183 A184 F185 | I48-S181 WeakPolarHBondContact CB-OG 3.3Å; S181-Q183 PolarHBondContact O-N 2.91Å; S181-A184 WeakPolarHBondContact O-CB 3.42Å; S181-A184 PolarHBondContact O-N 3.31Å; S181-F185 PolarHBondContact O-N 3.49Å |
| 182 | R | 94.7 | Very high | 93 | Very high | 149 Ų | 149 | 52.7 Ų | 52.7 | 56% | 0.562 | 28% | 0.277 | S | S | * | . | H | α-helix | trans | -62.1 | -39.3 | 176.8 | -67.4 | -176.6 | 177.5 | 179.4 | -4.2 | 112.9 | L94 T180 F185 V186 | L94-R182 PolarHBondContact O-NH2 2.99Å; T180-R182 VanDerWaalsContact C-N 3.3Å; T180-R182 PolarHBondContact O-N 3.29Å; R182-F185 WeakPolarHBondContact O-CB 3.26Å; R182-F185 PolarHBondContact O-N 3.5Å; R182-V186 WeakPolarHBondContact O-CG2 3.41Å; R182-V186 PolarHBondContact O-N 3.32Å |
| 183 | Q | 95.6 | Very high | 93.5 | Very high | 90 Ų | 90 | 51.8 Ų | 51.8 | 42% | 0.421 | 28% | 0.278 | S | S | . | . | H | α-helix | trans | -66.3 | -41.1 | 175.4 | -73.7 | 169.9 | -21.5 | 0 | 0 | 111.6 | F179 T180 S181 V186 L187 | F179-Q183 VanDerWaalsContact CA-OE1 3.32Å; F179-Q183 HydrophobicContact CB-CB 4.08Å; F179-Q183 HydrophobicContact CD1-CB 4.09Å; T180-Q183 PolarHBondContact O-N 3.29Å; T180-Q183 VanDerWaalsContact O-N 3.14Å; T180-Q183 WeakPolarHBondContact OG1-CG 3.5Å; T180-Q183 PolarHBondContact OG1-N 3.47Å; S181-Q183 PolarHBondContact O-N 2.91Å; Q183-V186 PolarHBondContact O-N 3.04Å; Q183-L187 WeakPolarHBondContact O-CB 3.24Å; Q183-L187 VanDerWaalsContact O-CG 3.23Å; Q183-L187 WeakPolarHBondContact O-CG 3.1Å; Q183-L187 PolarHBondContact O-N 3.43Å |
| 184 | A | 95.4 | Very high | 94 | Very high | 0 Ų | 0 | 56.6 Ų | 56.6 | 0% | 0 | 30% | 0.303 | C | S | . | . | H | α-helix | trans | -62.4 | -45.8 | 175.1 | 0 | 0 | 0 | 0 | 0 | 111.4 | I48 I174 M175 T180 S181 V186 L187 I188 | I48-A184 HydrophobicContact CD1-CB 3.95Å; I174-A184 HydrophobicContact CB-CB 4.1Å; I174-A184 HydrophobicContact CG2-CB 3.69Å; M175-A184 HydrophobicContact CG-CB 4.15Å; T180-A184 PolarHBondContact O-N 3.45Å; S181-A184 WeakPolarHBondContact O-CB 3.42Å; S181-A184 PolarHBondContact O-N 3.31Å; A184-V186 PolarHBondContact O-N 2.99Å; A184-L187 PolarHBondContact O-N 3.24Å; A184-I188 HydrophobicContact CB-CD1 4.44Å; A184-I188 WeakPolarHBondContact O-CB 3.4Å; A184-I188 WeakPolarHBondContact O-CD1 3.22Å; A184-I188 WeakPolarHBondContact O-CG1 3.44Å; A184-I188 PolarHBondContact O-N 3.29Å |
| 185 | F | 96.6 | Very high | 94.6 | Very high | 29 Ų | 29 | 56.4 Ų | 56.4 | 13% | 0.127 | 30% | 0.302 | C | S | . | . | H | α-helix | trans | -51.1 | -56.3 | 173.6 | 158.1 | -123.3 | 0 | 0 | 0 | 111.9 | I48 G50 L51 L94 S181 R182 L187 I188 T189 | I48-F185 HydrophobicContact CD1-CB 4.05Å; G50-F185 WeakPolarHBondContact O-CE2 3.43Å; L51-F185 HydrophobicContact CB-CD2 4.35Å; L51-F185 HydrophobicContact CD1-CD2 4.46Å; L94-F185 HydrophobicContact CD1-CE1 4.01Å; L94-F185 HydrophobicContact CD2-CD1 4.11Å; L94-F185 HydrophobicContact CD2-CE1 4.26Å; S181-F185 PolarHBondContact O-N 3.49Å; R182-F185 WeakPolarHBondContact O-CB 3.26Å; R182-F185 PolarHBondContact O-N 3.5Å; F185-L187 PolarHBondContact O-N 3.07Å; F185-I188 PolarHBondContact O-N 2.85Å; F185-T189 WeakPolarHBondContact CD2-OG1 3.34Å; F185-T189 VanDerWaalsContact CE2-OG1 3.24Å; F185-T189 WeakPolarHBondContact CE2-OG1 3.43Å; F185-T189 WeakPolarHBondContact O-CB 3.5Å; F185-T189 PolarHBondContact O-N 2.83Å; F185-T189 PolarHBondContact O-OG1 3.21Å |
| 186 | V | 97.8 | Very high | 95 | Very high | 71 Ų | 71 | 53.9 Ų | 53.9 | 43% | 0.43 | 29% | 0.291 | S | S | . | . | H | α-helix | trans | -61.1 | -47.3 | -178.6 | 172.6 | 0 | 0 | 0 | 0 | 111.3 | R182 Q183 A184 I188 T189 L190 | R182-V186 WeakPolarHBondContact O-CG2 3.41Å; R182-V186 PolarHBondContact O-N 3.32Å; Q183-V186 PolarHBondContact O-N 3.04Å; A184-V186 PolarHBondContact O-N 2.99Å; V186-I188 PolarHBondContact O-N 3.37Å; V186-T189 PolarHBondContact O-N 2.95Å; V186-L190 HydrophobicContact CG1-CD1 3.76Å; V186-L190 HydrophobicContact CG1-CG 4.24Å; V186-L190 WeakPolarHBondContact O-CB 3.39Å; V186-L190 VanDerWaalsContact O-CG 3.27Å; V186-L190 WeakPolarHBondContact O-CG 3.5Å; V186-L190 PolarHBondContact O-N 3.16Å |
| 187 | L | 96.4 | Very high | 95.6 | Very high | 81 Ų | 81 | 51.5 Ų | 51.5 | 42% | 0.424 | 29% | 0.29 | S | S | . | . | H | α-helix | trans | -61.3 | -44.6 | -179.2 | -73 | 171.4 | 0 | 0 | 0 | 112.5 | I174 F179 Q183 A184 F185 A191 | I174-L187 HydrophobicContact CG2-CD1 4.3Å; F179-L187 HydrophobicContact CD1-CD1 4.03Å; F179-L187 HydrophobicContact CE1-CD1 4.01Å; Q183-L187 WeakPolarHBondContact O-CB 3.24Å; Q183-L187 VanDerWaalsContact O-CG 3.23Å; Q183-L187 WeakPolarHBondContact O-CG 3.1Å; Q183-L187 PolarHBondContact O-N 3.43Å; A184-L187 PolarHBondContact O-N 3.24Å; F185-L187 PolarHBondContact O-N 3.07Å; L187-A191 WeakPolarHBondContact O-CB 3.24Å; L187-A191 PolarHBondContact O-N 3.31Å |
| 188 | I | 97.2 | Very high | 96.3 | Very high | 2 Ų | 2 | 54.6 Ų | 54.6 | 1% | 0.01 | 30% | 0.304 | C | S | . | . | H | α-helix | trans | -69.3 | -40.6 | -179.2 | -63.2 | 162.3 | 0 | 0 | 0 | 110.3 | L51 L55 I143 I170 H171 I174 A184 F185 V186 A191 A192 | L51-I188 HydrophobicContact CD1-CB 3.78Å; L51-I188 HydrophobicContact CD1-CD1 4.19Å; L51-I188 HydrophobicContact CD1-CG2 3.65Å; L51-I188 HydrophobicContact CD2-CD1 4.04Å; L55-I188 HydrophobicContact CD2-CG2 4.3Å; I143-I188 HydrophobicContact CG2-CG2 3.68Å; I170-I188 HydrophobicContact CD1-CG1 4.38Å; I170-I188 HydrophobicContact CG1-CD1 4.43Å; I170-I188 HydrophobicContact CG1-CG1 4.3Å; I170-I188 HydrophobicContact CG2-CD1 3.95Å; I170-I188 HydrophobicContact CG2-CG1 4.33Å; H171-I188 HydrophobicContact CB-CD1 3.64Å; I174-I188 HydrophobicContact CD1-CD1 4Å; I174-I188 HydrophobicContact CD1-CG1 3.65Å; A184-I188 HydrophobicContact CB-CD1 4.44Å; A184-I188 WeakPolarHBondContact O-CB 3.4Å; A184-I188 WeakPolarHBondContact O-CD1 3.22Å; A184-I188 WeakPolarHBondContact O-CG1 3.44Å; A184-I188 PolarHBondContact O-N 3.29Å; F185-I188 PolarHBondContact O-N 2.85Å; V186-I188 PolarHBondContact O-N 3.37Å; I188-A191 PolarHBondContact O-N 2.85Å; I188-A192 WeakPolarHBondContact O-CB 3.18Å; I188-A192 PolarHBondContact O-N 3.35Å |
| 189 | T | 98.3 | Very high | 96.7 | Very high | 22 Ų | 22 | 52.6 Ų | 52.6 | 14% | 0.135 | 28% | 0.284 | C | S | . | . | H | α-helix | trans | -67.5 | -40.5 | 179.6 | -52.4 | 0 | 0 | 0 | 0 | 111.2 | V58 F185 V186 A192 A193 | V58-T189 HydrophobicContact CG2-CG2 3.87Å; F185-T189 WeakPolarHBondContact CD2-OG1 3.34Å; F185-T189 VanDerWaalsContact CE2-OG1 3.24Å; F185-T189 WeakPolarHBondContact CE2-OG1 3.43Å; F185-T189 WeakPolarHBondContact O-CB 3.5Å; F185-T189 PolarHBondContact O-N 2.83Å; F185-T189 PolarHBondContact O-OG1 3.21Å; V186-T189 PolarHBondContact O-N 2.95Å; T189-A192 PolarHBondContact O-N 3.35Å; T189-A193 WeakPolarHBondContact O-CB 3.46Å; T189-A193 PolarHBondContact O-N 3.23Å |
| 190 | L | 98.3 | Very high | 97.1 | Very high | 103 Ų | 103 | 49.2 Ų | 49.2 | 54% | 0.539 | 27% | 0.27 | S | S | . | . | H | α-helix | trans | -64.3 | -41.3 | 173.3 | -72.6 | 175.5 | 0 | 0 | 0 | 112 | V186 A192 A193 L194 | V186-L190 HydrophobicContact CG1-CD1 3.76Å; V186-L190 HydrophobicContact CG1-CG 4.24Å; V186-L190 WeakPolarHBondContact O-CB 3.39Å; V186-L190 VanDerWaalsContact O-CG 3.27Å; V186-L190 WeakPolarHBondContact O-CG 3.5Å; V186-L190 PolarHBondContact O-N 3.16Å; L190-A192 VanDerWaalsContact C-N 3.33Å; L190-A192 PolarHBondContact O-N 3.45Å; L190-A193 PolarHBondContact O-N 3Å; L190-L194 WeakPolarHBondContact O-CG 3.33Å; L190-L194 PolarHBondContact O-N 2.95Å |
| 191 | A | 97.9 | Very high | 97.3 | Very high | 39 Ų | 39 | 51 Ų | 51 | 32% | 0.322 | 28% | 0.276 | S | S | . | . | H | α-helix | trans | -62.8 | -40.8 | 174.7 | 0 | 0 | 0 | 0 | 0 | 111.8 | L187 I188 L194 L195 | L187-A191 WeakPolarHBondContact O-CB 3.24Å; L187-A191 PolarHBondContact O-N 3.31Å; I188-A191 PolarHBondContact O-N 2.85Å; A191-L194 PolarHBondContact O-N 3.36Å; A191-L195 WeakPolarHBondContact O-CG 3.38Å; A191-L195 PolarHBondContact O-N 3.06Å; A191-L195 VanDerWaalsContact O-N 3.07Å |
| 192 | A | 98.6 | Very high | 97.3 | Very high | 8 Ų | 8 | 50 Ų | 50 | 7% | 0.066 | 27% | 0.27 | C | S | . | . | H | α-helix | trans | -62.9 | -44.8 | 173.8 | 0 | 0 | 0 | 0 | 0 | 111.6 | L55 V58 I143 I188 T189 L190 L194 L195 A196 | L55-A192 HydrophobicContact CD2-CB 3.31Å; V58-A192 HydrophobicContact CG1-CB 4.18Å; I143-A192 HydrophobicContact CB-CB 4.13Å; I143-A192 HydrophobicContact CG1-CB 3.71Å; I188-A192 WeakPolarHBondContact O-CB 3.18Å; I188-A192 PolarHBondContact O-N 3.35Å; T189-A192 PolarHBondContact O-N 3.35Å; L190-A192 VanDerWaalsContact C-N 3.33Å; L190-A192 PolarHBondContact O-N 3.45Å; A192-L194 PolarHBondContact O-N 3.4Å; A192-L195 PolarHBondContact O-N 2.87Å; A192-A196 WeakPolarHBondContact O-CB 3.45Å; A192-A196 PolarHBondContact O-N 2.92Å |
| 193 | A | 98.7 | Very high | 97.3 | Very high | 32 Ų | 32 | 44.3 Ų | 44.3 | 26% | 0.264 | 25% | 0.249 | S | C | . | . | H | α-helix | trans | -59.9 | -44.9 | 177.3 | 0 | 0 | 0 | 0 | 0 | 111.4 | V58 T189 L190 L195 A196 S197 | V58-A193 HydrophobicContact CG1-CB 4.45Å; V58-A193 HydrophobicContact CG2-CB 4.04Å; T189-A193 WeakPolarHBondContact O-CB 3.46Å; T189-A193 PolarHBondContact O-N 3.23Å; L190-A193 PolarHBondContact O-N 3Å; A193-L195 PolarHBondContact O-N 2.64Å; A193-A196 PolarHBondContact O-N 3.36Å; A193-S197 WeakPolarHBondContact O-CB 3.38Å; A193-S197 PolarHBondContact O-N 3.48Å; A193-S197 PolarHBondContact O-OG 3.43Å |
| 194 | L | 98.6 | Very high | 97.2 | Very high | 122 Ų | 122 | 47.2 Ų | 47.2 | 64% | 0.639 | 26% | 0.258 | S | S | * | . | H | α-helix | trans | -59.7 | -46.2 | 176.1 | -72 | 171.2 | 0 | 0 | 0 | 112.2 | L190 A191 A192 S197 I198 | L190-L194 WeakPolarHBondContact O-CG 3.33Å; L190-L194 PolarHBondContact O-N 2.95Å; A191-L194 PolarHBondContact O-N 3.36Å; A192-L194 PolarHBondContact O-N 3.4Å; L194-S197 PolarHBondContact O-N 2.85Å; L194-I198 WeakPolarHBondContact O-CG1 3.36Å; L194-I198 PolarHBondContact O-N 2.64Å; L194-I198 VanDerWaalsContact O-N 3.09Å |
| 195 | L | 98.6 | Very high | 97 | Very high | 29 Ų | 29 | 50.2 Ų | 50.2 | 15% | 0.152 | 28% | 0.279 | C | S | . | . | H | α-helix | trans | -65 | -44.5 | 177.8 | -69.2 | 168.3 | 0 | 0 | 0 | 111.7 | W139 A142 I143 M146 A191 A192 A193 S197 I198 G199 A220 | W139-L195 HydrophobicContact CE3-CB 4.27Å; W139-L195 HydrophobicContact CE3-CD2 4.08Å; W139-L195 HydrophobicContact CZ3-CD2 3.67Å; A142-L195 HydrophobicContact CB-CB 4.06Å; A142-L195 HydrophobicContact CB-CD1 3.97Å; I143-L195 HydrophobicContact CD1-CD1 3.57Å; I143-L195 HydrophobicContact CG1-CD1 3.88Å; M146-L195 HydrophobicContact CE-CD1 3.72Å; A191-L195 WeakPolarHBondContact O-CG 3.38Å; A191-L195 PolarHBondContact O-N 3.06Å; A191-L195 VanDerWaalsContact O-N 3.07Å; A192-L195 PolarHBondContact O-N 2.87Å; A193-L195 PolarHBondContact O-N 2.64Å; L195-S197 VanDerWaalsContact C-N 3.33Å; L195-S197 PolarHBondContact O-N 3.19Å; L195-I198 WeakPolarHBondContact O-CB 3.28Å; L195-I198 PolarHBondContact O-N 2.92Å; L195-G199 PolarHBondContact O-N 3.46Å; L195-A220 HydrophobicContact CD2-CB 4.48Å |
| 196 | A | 98.6 | Very high | 96.6 | Very high | 3 Ų | 3 | 56.1 Ų | 56.1 | 3% | 0.025 | 31% | 0.306 | C | S | . | . | H | α-helix | trans | -63.4 | -40.2 | 177.1 | 0 | 0 | 0 | 0 | 0 | 111.4 | V58 A62 A192 A193 I198 G199 V200 | V58-A196 HydrophobicContact CG1-CB 3.74Å; A62-A196 HydrophobicContact CB-CB 3.99Å; A192-A196 WeakPolarHBondContact O-CB 3.45Å; A192-A196 PolarHBondContact O-N 2.92Å; A193-A196 PolarHBondContact O-N 3.36Å; A196-I198 VanDerWaalsContact C-N 3.32Å; A196-I198 PolarHBondContact O-N 3.26Å; A196-G199 WeakPolarHBondContact O-CA 3.33Å; A196-G199 PolarHBondContact O-N 2.81Å; A196-G199 VanDerWaalsContact O-N 3.12Å; A196-V200 WeakPolarHBondContact O-CG2 3.47Å; A196-V200 PolarHBondContact O-N 3.4Å |
| 197 | S | 98.3 | Very high | 96.3 | Very high | 54 Ų | 54 | 61.1 Ų | 61.1 | 38% | 0.378 | 32% | 0.323 | S | S | . | . | H | α-helix | trans | -61.7 | -35.9 | 174.6 | -66.7 | 0 | 0 | 0 | 0 | 112.7 | A193 L194 L195 G199 V200 L201 | A193-S197 WeakPolarHBondContact O-CB 3.38Å; A193-S197 PolarHBondContact O-N 3.48Å; A193-S197 PolarHBondContact O-OG 3.43Å; L194-S197 PolarHBondContact O-N 2.85Å; L195-S197 VanDerWaalsContact C-N 3.33Å; L195-S197 PolarHBondContact O-N 3.19Å; S197-G199 VanDerWaalsContact C-N 3.33Å; S197-V200 PolarHBondContact O-N 3.03Å; S197-L201 VanDerWaalsContact O-CB 3.28Å; S197-L201 WeakPolarHBondContact O-CB 3.39Å; S197-L201 WeakPolarHBondContact O-CG 3.5Å; S197-L201 PolarHBondContact O-N 2.99Å |
| 198 | I | 97.8 | Very high | 96.2 | Very high | 75 Ų | 75 | 59.6 Ų | 59.6 | 39% | 0.385 | 32% | 0.317 | S | S | . | . | H | α-helix | trans | -60.1 | -46.2 | 172.6 | -67.4 | 164.1 | 0 | 0 | 0 | 110.1 | W139 L194 L195 A196 A202 M213 | W139-I198 HydrophobicContact CD2-CG2 4.4Å; W139-I198 HydrophobicContact CE3-CB 4.03Å; W139-I198 HydrophobicContact CE3-CG2 3.99Å; W139-I198 HydrophobicContact CH2-CG2 3.91Å; W139-I198 HydrophobicContact CZ2-CG2 4.32Å; W139-I198 HydrophobicContact CZ3-CB 3.98Å; W139-I198 HydrophobicContact CZ3-CD1 3.88Å; W139-I198 HydrophobicContact CZ3-CG2 3.73Å; L194-I198 WeakPolarHBondContact O-CG1 3.36Å; L194-I198 PolarHBondContact O-N 2.64Å; L194-I198 VanDerWaalsContact O-N 3.09Å; L195-I198 WeakPolarHBondContact O-CB 3.28Å; L195-I198 PolarHBondContact O-N 2.92Å; A196-I198 VanDerWaalsContact C-N 3.32Å; A196-I198 PolarHBondContact O-N 3.26Å; I198-A202 VanDerWaalsContact O-CB 3.26Å; I198-A202 WeakPolarHBondContact O-CB 3.38Å; I198-A202 PolarHBondContact O-N 3.28Å; I198-M213 HydrophobicContact CG2-CE 4.33Å |
| 199 | G | 97.3 | Very high | 96 | Very high | 0 Ų | 0 | 62.5 Ų | 62.5 | 0% | 0 | 34% | 0.336 | C | S | . | . | H | α-helix | trans | -58.9 | -51.8 | 174.7 | 0 | 0 | 0 | 0 | 0 | 112.9 | L195 A196 S197 L201 A202 E203 | L195-G199 PolarHBondContact O-N 3.46Å; A196-G199 WeakPolarHBondContact O-CA 3.33Å; A196-G199 PolarHBondContact O-N 2.81Å; A196-G199 VanDerWaalsContact O-N 3.12Å; S197-G199 VanDerWaalsContact C-N 3.33Å; G199-L201 PolarHBondContact O-N 3.33Å; G199-A202 PolarHBondContact O-N 2.95Å; G199-E203 WeakPolarHBondContact O-CB 3.48Å; G199-E203 PolarHBondContact O-N 3.1Å |
| 200 | V | 97.6 | Very high | 95.9 | Very high | 15 Ų | 15 | 63 Ų | 63 | 9% | 0.091 | 34% | 0.337 | C | S | . | . | H | α-helix | trans | -60.6 | -44.5 | -179.4 | 174.8 | 0 | 0 | 0 | 0 | 111.8 | A62 M65 I66 A196 S197 E203 Y204 | A62-V200 HydrophobicContact CB-CG2 3.7Å; M65-V200 HydrophobicContact CE-CG2 4.46Å; I66-V200 HydrophobicContact CD1-CB 4.47Å; I66-V200 HydrophobicContact CD1-CG2 3.92Å; I66-V200 HydrophobicContact CG1-CB 4.31Å; I66-V200 HydrophobicContact CG1-CG1 4.05Å; I66-V200 HydrophobicContact CG1-CG2 3.99Å; A196-V200 WeakPolarHBondContact O-CG2 3.47Å; A196-V200 PolarHBondContact O-N 3.4Å; S197-V200 PolarHBondContact O-N 3.03Å; V200-E203 PolarHBondContact O-N 3.49Å; V200-Y204 WeakPolarHBondContact O-CB 3.29Å; V200-Y204 PolarHBondContact O-N 3.13Å |
| 201 | L | 97 | Very high | 95.8 | Very high | 113 Ų | 113 | 63.6 Ų | 63.6 | 59% | 0.592 | 33% | 0.331 | S | S | * | . | H | α-helix | trans | -68.6 | -37.7 | 179.7 | -70.9 | 170.9 | 0 | 0 | 0 | 112.1 | S197 G199 S205 | S197-L201 VanDerWaalsContact O-CB 3.28Å; S197-L201 WeakPolarHBondContact O-CB 3.39Å; S197-L201 WeakPolarHBondContact O-CG 3.5Å; S197-L201 PolarHBondContact O-N 2.99Å; G199-L201 PolarHBondContact O-N 3.33Å; L201-S205 VanDerWaalsContact O-CB 3.26Å; L201-S205 WeakPolarHBondContact O-CB 3.46Å; L201-S205 PolarHBondContact O-N 3.11Å; L201-S205 PolarHBondContact O-OG 3.44Å |
| 202 | A | 94.9 | Very high | 95.7 | Very high | 12 Ų | 12 | 63.6 Ų | 63.6 | 10% | 0.099 | 33% | 0.327 | C | S | . | . | H | α-helix | trans | -64.4 | -43.9 | 175.2 | 0 | 0 | 0 | 0 | 0 | 111.4 | I198 G199 S205 H206 M213 | I198-A202 VanDerWaalsContact O-CB 3.26Å; I198-A202 WeakPolarHBondContact O-CB 3.38Å; I198-A202 PolarHBondContact O-N 3.28Å; G199-A202 PolarHBondContact O-N 2.95Å; A202-S205 PolarHBondContact O-OG 3.01Å; A202-H206 PolarHBondContact O-N 3.27Å; A202-M213 HydrophobicContact CB-CE 3.25Å; A202-M213 HydrophobicContact CB-CG 4.17Å; A202-M213 HydrophobicContact CB-SD 3.4Å; A202-M213 WeakPolarHBondContact CB-SD 3.33Å |
| 203 | E | 94 | Very high | 95.6 | Very high | 30 Ų | 30 | 63.5 Ų | 63.5 | 14% | 0.14 | 33% | 0.326 | C | S | . | . | H | α-helix | trans | -62.9 | -46.7 | 176.5 | -159.2 | 69.4 | -133.5 | 0 | 0 | 111.1 | I66 S133 T136 G199 V200 H206 | I66-E203 HydrophobicContact CD1-CB 4.49Å; I66-E203 HydrophobicContact CG2-CG 4.16Å; S133-E203 WeakPolarHBondContact CB-OE2 3.23Å; S133-E203 PolarHBondContact N-OE1 3.31Å; S133-E203 PolarHBondContact N-OE2 3.36Å; S133-E203 PolarHBondContact OG-OE2 2.9Å; T136-E203 WeakPolarHBondContact CB-OE2 3.16Å; T136-E203 HydrophobicContact CG2-CB 4.33Å; T136-E203 PolarHBondContact OG1-OE2 3.09Å; G199-E203 WeakPolarHBondContact O-CB 3.48Å; G199-E203 PolarHBondContact O-N 3.1Å; V200-E203 PolarHBondContact O-N 3.49Å; E203-H206 PolarHBondContact O-CE1 3.28Å; E203-H206 PolarHBondContact O-N 3.08Å; E203-H206 PolarHBondContact O-ND1 2.92Å; E203-H206 PolarHBondContact O-NE2 2.79Å |
| 204 | Y | 93.3 | Very high | 95.6 | Very high | 152 Ų | 152 | 63.8 Ų | 63.8 | 60% | 0.596 | 32% | 0.323 | S | S | * | . | H | α-helix | trans | -67.1 | -38.1 | -179.8 | -179.3 | -101.1 | 0 | 0 | 0 | 113.8 | F69 V200 H206 | F69-Y204 HydrophobicContact CB-CD2 4.42Å; F69-Y204 HydrophobicContact CD1-CE2 4.43Å; F69-Y204 HydrophobicContact CD2-CD2 4.42Å; F69-Y204 HydrophobicContact CG-CD2 4.35Å; F69-Y204 HydrophobicContact CG-CE2 4.33Å; V200-Y204 WeakPolarHBondContact O-CB 3.29Å; V200-Y204 PolarHBondContact O-N 3.13Å; Y204-H206 PolarHBondContact O-CD2 3.34Å |
| 205 | S | 92.1 | Very high | 95.5 | Very high | 63 Ų | 63 | 61.4 Ų | 61.4 | 44% | 0.441 | 31% | 0.313 | S | S | . | . | H | α-helix | trans | -78.4 | -20.6 | -177.7 | 60.6 | 0 | 0 | 0 | 0 | 113.4 | L201 A202 F207 | L201-S205 VanDerWaalsContact O-CB 3.26Å; L201-S205 WeakPolarHBondContact O-CB 3.46Å; L201-S205 PolarHBondContact O-N 3.11Å; L201-S205 PolarHBondContact O-OG 3.44Å; A202-S205 PolarHBondContact O-OG 3.01Å; S205-F207 PolarHBondContact O-N 3.46Å |
| 206 | H | 87.7 | Confident | 95.5 | Very high | 153 Ų | 153 | 63.6 Ų | 63.6 | 71% | 0.708 | 32% | 0.324 | S | S | * | . | trans | 51.7 | 11.5 | -173.7 | -57.4 | -74.4 | 0 | 0 | 0 | 115 | A202 E203 Y204 | A202-H206 PolarHBondContact O-N 3.27Å; E203-H206 PolarHBondContact O-CE1 3.28Å; E203-H206 PolarHBondContact O-N 3.08Å; E203-H206 PolarHBondContact O-ND1 2.92Å; E203-H206 PolarHBondContact O-NE2 2.79Å; Y204-H206 PolarHBondContact O-CD2 3.34Å | ||
| 207 | F | 91 | Very high | 95.5 | Very high | 176 Ų | 176 | 64 Ų | 64 | 77% | 0.772 | 33% | 0.325 | S | S | * | . | trans | -85.1 | -30.1 | -172.8 | -177.5 | -101.6 | 0 | 0 | 0 | 112.4 | S205 P209 | S205-F207 PolarHBondContact O-N 3.46Å; F207-P209 WeakPolarHBondContact O-CD 3.32Å | ||
| 208 | V | 93.7 | Very high | 95.4 | Very high | 49 Ų | 49 | 65.1 Ų | 65.1 | 30% | 0.297 | 33% | 0.327 | S | S | . | . | S | Bend | trans | -98.4 | 117.9 | -175 | -171.5 | 0 | 0 | 0 | 0 | 109.4 | V212 M213 | V208-V212 HydrophobicContact CG1-CB 3.88Å; V208-V212 HydrophobicContact CG1-CG1 3.82Å; V208-M213 HydrophobicContact CB-CG 4.26Å; V208-M213 HydrophobicContact CB-SD 4.33Å; V208-M213 HydrophobicContact CG1-CG 3.74Å; V208-M213 HydrophobicContact CG1-SD 3.89Å |
| 209 | P | 94.8 | Very high | 95.4 | Very high | 63 Ų | 63 | 66.5 Ų | 66.5 | 41% | 0.409 | 34% | 0.335 | S | S | . | . | trans | -62.6 | 150.2 | 176.5 | -22.4 | 33.1 | 0 | 0 | 0 | 112.8 | F207 W211 V212 M213 | F207-P209 WeakPolarHBondContact O-CD 3.32Å; P209-W211 VanDerWaalsContact C-N 3.35Å; P209-W211 HydrophobicContact CB-CG 4.5Å; P209-W211 PolarHBondContact O-N 2.99Å; P209-V212 HydrophobicContact CB-CG2 4.25Å; P209-V212 HydrophobicContact CG-CG2 4.26Å; P209-V212 WeakPolarHBondContact O-CB 3.43Å; P209-V212 PolarHBondContact O-N 3.33Å; P209-M213 PolarHBondContact O-N 3.44Å; P209-M213 VanDerWaalsContact O-N 3.08Å | ||
| 210 | E | 94.9 | Very high | 95.5 | Very high | 33 Ų | 33 | 67.6 Ų | 67.6 | 15% | 0.154 | 34% | 0.344 | C | S | . | . | H | α-helix | trans | -57.6 | -41.4 | -178 | -69.9 | -177.1 | -139.4 | 0 | 0 | 113.7 | G13 Y14 V135 V212 M213 L214 | G13-E210 VanDerWaalsContact CA-OE2 3.28Å; G13-E210 WeakPolarHBondContact CA-OE2 3.34Å; Y14-E210 WeakPolarHBondContact CD2-OE1 3.34Å; Y14-E210 PolarHBondContact N-OE2 3.26Å; V135-E210 HydrophobicContact CG2-CB 4.1Å; E210-V212 VanDerWaalsContact C-N 3.27Å; E210-V212 PolarHBondContact O-N 3.2Å; E210-M213 CarbonylContact O-C 3.58Å; E210-M213 WeakPolarHBondContact O-CB 3.28Å; E210-M213 PolarHBondContact O-N 3.19Å; E210-M213 VanDerWaalsContact O-N 3.15Å; E210-L214 PolarHBondContact O-N 2.83Å |
| 211 | W | 96.1 | Very high | 95.4 | Very high | 114 Ų | 114 | 69 Ų | 69 | 43% | 0.432 | 35% | 0.349 | S | S | . | . | H | α-helix | trans | -62.2 | -34.1 | 177.1 | 69.1 | -93.5 | 0 | 0 | 0 | 112.5 | Y14 I15 P209 L214 V215 | Y14-W211 PolarHBondContact O-N 3.15Å; I15-W211 VanDerWaalsContact O-CB 3.29Å; I15-W211 WeakPolarHBondContact O-CB 3.26Å; P209-W211 VanDerWaalsContact C-N 3.35Å; P209-W211 HydrophobicContact CB-CG 4.5Å; P209-W211 PolarHBondContact O-N 2.99Å; W211-L214 PolarHBondContact O-N 3.15Å; W211-V215 WeakPolarHBondContact O-CG2 3.33Å; W211-V215 PolarHBondContact O-N 3.34Å |
| 212 | V | 96.6 | Very high | 95.3 | Very high | 39 Ų | 39 | 70.2 Ų | 70.2 | 24% | 0.236 | 35% | 0.35 | C | S | . | . | H | α-helix | trans | -68.2 | -44.8 | 174.4 | -179.5 | 0 | 0 | 0 | 0 | 109.5 | V208 P209 E210 L214 V215 L216 | V208-V212 HydrophobicContact CG1-CB 3.88Å; V208-V212 HydrophobicContact CG1-CG1 3.82Å; P209-V212 HydrophobicContact CB-CG2 4.25Å; P209-V212 HydrophobicContact CG-CG2 4.26Å; P209-V212 WeakPolarHBondContact O-CB 3.43Å; P209-V212 PolarHBondContact O-N 3.33Å; E210-V212 VanDerWaalsContact C-N 3.27Å; E210-V212 PolarHBondContact O-N 3.2Å; V212-L214 PolarHBondContact O-N 2.87Å; V212-V215 PolarHBondContact O-N 3.19Å; V212-L216 HydrophobicContact CG1-CD1 4.14Å; V212-L216 HydrophobicContact CG1-CG 4.35Å; V212-L216 WeakPolarHBondContact O-CB 3.19Å; V212-L216 WeakPolarHBondContact O-CG 3.49Å; V212-L216 PolarHBondContact O-N 3.45Å |
| 213 | M | 96.9 | Very high | 95.3 | Very high | 7 Ų | 7 | 74.8 Ų | 74.8 | 3% | 0.034 | 37% | 0.372 | C | S | . | . | H | α-helix | trans | -58.6 | -37 | 174.9 | -73.4 | -65.3 | -73.8 | 0 | 0 | 112.1 | V135 W139 I198 A202 V208 P209 E210 F217 | V135-M213 HydrophobicContact CG1-CB 3.69Å; W139-M213 HydrophobicContact CD2-CE 4.34Å; W139-M213 HydrophobicContact CG-CE 4.25Å; W139-M213 HydrophobicContact CZ2-CE 4.44Å; W139-M213 WeakPolarHBondContact CZ2-O 3.33Å; W139-M213 PolarHBondContact NE1-O 3.39Å; I198-M213 HydrophobicContact CG2-CE 4.33Å; A202-M213 HydrophobicContact CB-CE 3.25Å; A202-M213 HydrophobicContact CB-CG 4.17Å; A202-M213 HydrophobicContact CB-SD 3.4Å; A202-M213 WeakPolarHBondContact CB-SD 3.33Å; V208-M213 HydrophobicContact CB-CG 4.26Å; V208-M213 HydrophobicContact CB-SD 4.33Å; V208-M213 HydrophobicContact CG1-CG 3.74Å; V208-M213 HydrophobicContact CG1-SD 3.89Å; P209-M213 PolarHBondContact O-N 3.44Å; P209-M213 VanDerWaalsContact O-N 3.08Å; E210-M213 CarbonylContact O-C 3.58Å; E210-M213 WeakPolarHBondContact O-CB 3.28Å; E210-M213 PolarHBondContact O-N 3.19Å; E210-M213 VanDerWaalsContact O-N 3.15Å; M213-F217 WeakPolarHBondContact O-CB 3.18Å; M213-F217 PolarHBondContact O-N 3.41Å |
| 214 | L | 97.5 | Very high | 95.3 | Very high | 37 Ų | 37 | 74.5 Ų | 74.5 | 19% | 0.194 | 37% | 0.369 | C | S | . | . | H | α-helix | trans | -68.5 | -45.5 | 176.1 | -179.5 | 62.6 | 0 | 0 | 0 | 111.1 | I15 V135 L138 E210 W211 V212 L216 F217 L218 | I15-L214 HydrophobicContact CB-CD2 3.72Å; I15-L214 HydrophobicContact CG2-CD2 3.8Å; V135-L214 HydrophobicContact CG1-CB 3.98Å; V135-L214 HydrophobicContact CG2-CB 4.31Å; L138-L214 HydrophobicContact CD1-CD1 3.99Å; E210-L214 PolarHBondContact O-N 2.83Å; W211-L214 PolarHBondContact O-N 3.15Å; V212-L214 PolarHBondContact O-N 2.87Å; L214-L216 VanDerWaalsContact C-N 3.33Å; L214-L216 PolarHBondContact O-N 3.21Å; L214-F217 WeakPolarHBondContact O-CB 3.48Å; L214-F217 PolarHBondContact O-N 3.09Å; L214-L218 HydrophobicContact CD1-CG 4.46Å; L214-L218 HydrophobicContact CG-CD1 4.35Å; L214-L218 VanDerWaalsContact O-CG 3.31Å; L214-L218 WeakPolarHBondContact O-CG 3.48Å; L214-L218 PolarHBondContact O-N 3.46Å |
| 215 | V | 97.4 | Very high | 95.2 | Very high | 72 Ų | 72 | 68.4 Ų | 68.4 | 44% | 0.436 | 35% | 0.353 | S | S | . | . | H | α-helix | trans | -59.6 | -45.3 | 175.7 | 170.3 | 0 | 0 | 0 | 0 | 110.7 | W211 V212 F217 L218 L219 | W211-V215 WeakPolarHBondContact O-CG2 3.33Å; W211-V215 PolarHBondContact O-N 3.34Å; V212-V215 PolarHBondContact O-N 3.19Å; V215-F217 VanDerWaalsContact C-N 3.33Å; V215-F217 PolarHBondContact O-N 3.26Å; V215-L218 PolarHBondContact O-N 3.42Å; V215-L219 HydrophobicContact CG1-CD1 4.21Å; V215-L219 HydrophobicContact CG1-CG 4.5Å; V215-L219 WeakPolarHBondContact O-CG 3.08Å; V215-L219 PolarHBondContact O-N 3.49Å |
| 216 | L | 97.7 | Very high | 95 | Very high | 75 Ų | 75 | 71.5 Ų | 71.5 | 39% | 0.393 | 36% | 0.356 | S | S | . | . | H | α-helix | trans | -61.8 | -40.2 | 176.2 | -70.8 | 176.5 | 0 | 0 | 0 | 111.9 | W139 V212 L214 L219 A220 | W139-L216 HydrophobicContact CH2-CB 4.09Å; W139-L216 HydrophobicContact CZ2-CB 3.71Å; V212-L216 HydrophobicContact CG1-CD1 4.14Å; V212-L216 HydrophobicContact CG1-CG 4.35Å; V212-L216 WeakPolarHBondContact O-CB 3.19Å; V212-L216 WeakPolarHBondContact O-CG 3.49Å; V212-L216 PolarHBondContact O-N 3.45Å; L214-L216 VanDerWaalsContact C-N 3.33Å; L214-L216 PolarHBondContact O-N 3.21Å; L216-L219 HydrophobicContact CD2-CD1 4.49Å; L216-L219 PolarHBondContact O-N 2.97Å; L216-A220 WeakPolarHBondContact O-CB 3.19Å; L216-A220 PolarHBondContact O-N 3.09Å |
| 217 | F | 98.2 | Very high | 95 | Very high | 11 Ų | 11 | 67.5 Ų | 67.5 | 5% | 0.048 | 35% | 0.345 | C | S | . | . | H | α-helix | trans | -62.6 | -45 | 175.2 | -179.8 | -95.2 | 0 | 0 | 0 | 111.2 | L138 W139 A142 L145 M146 M213 L214 V215 L219 A220 F221 | L138-F217 HydrophobicContact CB-CD1 4.33Å; L138-F217 HydrophobicContact CB-CD2 3.96Å; L138-F217 HydrophobicContact CB-CE1 4.14Å; L138-F217 HydrophobicContact CB-CE2 3.76Å; L138-F217 HydrophobicContact CB-CG 4.25Å; L138-F217 HydrophobicContact CB-CZ 3.86Å; L138-F217 HydrophobicContact CD1-CD1 4.11Å; L138-F217 HydrophobicContact CD1-CE1 4.22Å; L138-F217 VanDerWaalsContact O-CE2 3.27Å; L138-F217 WeakPolarHBondContact O-CE2 3.37Å; W139-F217 HydrophobicContact CD2-CD2 4.13Å; W139-F217 HydrophobicContact CG-CD2 4.28Å; W139-F217 HydrophobicContact CZ2-CB 3.86Å; W139-F217 VanDerWaalsContact CZ2-N 3.3Å; A142-F217 HydrophobicContact CB-CE2 3.97Å; L145-F217 HydrophobicContact CD2-CZ 4.11Å; M146-F217 HydrophobicContact CE-CE2 4.09Å; M146-F217 HydrophobicContact CG-CZ 4.49Å; M213-F217 WeakPolarHBondContact O-CB 3.18Å; M213-F217 PolarHBondContact O-N 3.41Å; L214-F217 WeakPolarHBondContact O-CB 3.48Å; L214-F217 PolarHBondContact O-N 3.09Å; V215-F217 VanDerWaalsContact C-N 3.33Å; V215-F217 PolarHBondContact O-N 3.26Å; F217-L219 VanDerWaalsContact C-N 3.34Å; F217-L219 PolarHBondContact O-N 3.17Å; F217-A220 WeakPolarHBondContact O-CB 3.47Å; F217-A220 PolarHBondContact O-N 2.82Å; F217-F221 WeakPolarHBondContact O-CB 3.4Å; F217-F221 PolarHBondContact O-N 2.91Å |
| 218 | L | 97.9 | Very high | 94.7 | Very high | 78 Ų | 78 | 60.3 Ų | 60.3 | 41% | 0.408 | 31% | 0.314 | S | S | . | . | H | α-helix | trans | -63.1 | -40.5 | 176.8 | -68.3 | 174.5 | 0 | 0 | 0 | 111.5 | L214 V215 F221 F222 | L214-L218 HydrophobicContact CD1-CG 4.46Å; L214-L218 HydrophobicContact CG-CD1 4.35Å; L214-L218 VanDerWaalsContact O-CG 3.31Å; L214-L218 WeakPolarHBondContact O-CG 3.48Å; L214-L218 PolarHBondContact O-N 3.46Å; V215-L218 PolarHBondContact O-N 3.42Å; L218-F221 WeakPolarHBondContact O-CB 3.42Å; L218-F221 PolarHBondContact O-N 3.19Å; L218-F222 HydrophobicContact CB-CE2 4.42Å; L218-F222 WeakPolarHBondContact O-CD2 3.25Å; L218-F222 PolarHBondContact O-N 2.62Å |
| 219 | L | 97.9 | Very high | 94.2 | Very high | 104 Ų | 104 | 66.3 Ų | 66.3 | 55% | 0.545 | 34% | 0.336 | S | S | . | . | H | α-helix | trans | -62.1 | -44.5 | 173.6 | -70.9 | 173.8 | 0 | 0 | 0 | 111.5 | V215 L216 F217 F221 F222 L223 | V215-L219 HydrophobicContact CG1-CD1 4.21Å; V215-L219 HydrophobicContact CG1-CG 4.5Å; V215-L219 WeakPolarHBondContact O-CG 3.08Å; V215-L219 PolarHBondContact O-N 3.49Å; L216-L219 HydrophobicContact CD2-CD1 4.49Å; L216-L219 PolarHBondContact O-N 2.97Å; F217-L219 VanDerWaalsContact C-N 3.34Å; F217-L219 PolarHBondContact O-N 3.17Å; L219-F221 VanDerWaalsContact C-N 3.33Å; L219-F221 PolarHBondContact O-N 3.12Å; L219-F222 PolarHBondContact O-N 2.92Å; L219-L223 VanDerWaalsContact O-CB 3.3Å; L219-L223 WeakPolarHBondContact O-CB 3.18Å; L219-L223 PolarHBondContact O-N 2.89Å |
| 220 | A | 97.7 | Very high | 93.7 | Very high | 23 Ų | 23 | 68.1 Ų | 68.1 | 19% | 0.19 | 33% | 0.334 | C | S | . | . | H | α-helix | trans | -61.4 | -41.5 | 174.4 | 0 | 0 | 0 | 0 | 0 | 111.6 | L195 L216 F217 L223 Y224 | L195-A220 HydrophobicContact CD2-CB 4.48Å; L216-A220 WeakPolarHBondContact O-CB 3.19Å; L216-A220 PolarHBondContact O-N 3.09Å; F217-A220 WeakPolarHBondContact O-CB 3.47Å; F217-A220 PolarHBondContact O-N 2.82Å; A220-L223 PolarHBondContact O-N 3.42Å; A220-Y224 VanDerWaalsContact O-CB 3.24Å; A220-Y224 WeakPolarHBondContact O-CB 3.23Å; A220-Y224 PolarHBondContact O-N 2.97Å |
| 221 | F | 96.8 | Very high | 92.9 | Very high | 45 Ų | 45 | 67.6 Ų | 67.6 | 20% | 0.197 | 34% | 0.336 | C | S | . | . | H | α-helix | trans | -59.2 | -48.3 | 174.9 | 179.1 | -83.1 | 0 | 0 | 0 | 111.9 | M146 V149 F217 L218 L219 Y224 G225 | M146-F221 HydrophobicContact CB-CD2 4.32Å; M146-F221 HydrophobicContact CG-CB 4.41Å; M146-F221 HydrophobicContact CG-CD2 3.62Å; M146-F221 HydrophobicContact CG-CE2 4.28Å; M146-F221 HydrophobicContact CG-CG 4.42Å; M146-F221 HydrophobicContact SD-CB 4.36Å; V149-F221 HydrophobicContact CB-CE2 3.88Å; V149-F221 HydrophobicContact CB-CZ 4.1Å; V149-F221 HydrophobicContact CG1-CE2 3.83Å; V149-F221 HydrophobicContact CG1-CZ 3.6Å; F217-F221 WeakPolarHBondContact O-CB 3.4Å; F217-F221 PolarHBondContact O-N 2.91Å; L218-F221 WeakPolarHBondContact O-CB 3.42Å; L218-F221 PolarHBondContact O-N 3.19Å; L219-F221 VanDerWaalsContact C-N 3.33Å; L219-F221 PolarHBondContact O-N 3.12Å; F221-Y224 WeakPolarHBondContact O-CB 3.11Å; F221-Y224 PolarHBondContact O-N 2.82Å; F221-G225 PolarHBondContact O-N 2.68Å |
| 222 | F | 95.4 | Very high | 91.7 | Very high | 139 Ų | 139 | 69.3 Ų | 69.3 | 61% | 0.61 | 34% | 0.342 | S | S | * | . | H | α-helix | trans | -68.6 | -38.1 | 178.2 | -72.6 | -60.4 | 0 | 0 | 0 | 112.3 | L218 L219 Y224 G225 Y226 | L218-F222 HydrophobicContact CB-CE2 4.42Å; L218-F222 WeakPolarHBondContact O-CD2 3.25Å; L218-F222 PolarHBondContact O-N 2.62Å; L219-F222 PolarHBondContact O-N 2.92Å; F222-Y224 VanDerWaalsContact C-N 3.34Å; F222-G225 PolarHBondContact O-N 3Å; F222-Y226 WeakPolarHBondContact O-CB 3.39Å; F222-Y226 PolarHBondContact O-N 3.03Å |
| 223 | L | 93.9 | Very high | 90.6 | Very high | 108 Ų | 108 | 72.9 Ų | 72.9 | 57% | 0.565 | 36% | 0.355 | S | S | * | . | H | α-helix | trans | -61.3 | -44.5 | 173.3 | 178.9 | 61.7 | 0 | 0 | 0 | 110.9 | L219 A220 Y226 C227 | L219-L223 VanDerWaalsContact O-CB 3.3Å; L219-L223 WeakPolarHBondContact O-CB 3.18Å; L219-L223 PolarHBondContact O-N 2.89Å; A220-L223 PolarHBondContact O-N 3.42Å; L223-Y226 WeakPolarHBondContact O-CB 3.45Å; L223-Y226 PolarHBondContact O-N 3.05Å; L223-C227 WeakPolarHBondContact O-CB 3.48Å; L223-C227 PolarHBondContact O-N 3.32Å; L223-C227 PolarHBondContact O-SG 3.12Å |
| 224 | Y | 93.3 | Very high | 89.5 | Confident | 23 Ų | 23 | 76.1 Ų | 76.1 | 9% | 0.09 | 38% | 0.375 | C | S | . | . | H | α-helix | trans | -58.3 | -50 | 174.5 | 177.5 | -87.9 | 0 | 0 | 0 | 111.4 | I143 M146 D147 A150 I170 A220 F221 F222 Y226 C227 I228 | I143-Y224 HydrophobicContact CD1-CD2 4.41Å; I143-Y224 HydrophobicContact CD1-CE2 4.15Å; M146-Y224 HydrophobicContact CB-CD1 3.87Å; M146-Y224 HydrophobicContact CB-CD2 4.49Å; M146-Y224 HydrophobicContact CB-CE1 3.92Å; M146-Y224 HydrophobicContact CB-CG 4.18Å; M146-Y224 HydrophobicContact SD-CD1 4.43Å; M146-Y224 HydrophobicContact SD-CD2 4.21Å; M146-Y224 HydrophobicContact SD-CG 3.9Å; D147-Y224 WeakPolarHBondContact CA-OH 3.46Å; D147-Y224 WeakPolarHBondContact CB-OH 3.34Å; D147-Y224 PolarHBondContact OD1-OH 3.45Å; A150-Y224 HydrophobicContact CB-CE1 4.21Å; I170-Y224 WeakPolarHBondContact CB-OH 3.43Å; I170-Y224 HydrophobicContact CD1-CD2 4.47Å; I170-Y224 HydrophobicContact CD1-CE2 3.54Å; A220-Y224 VanDerWaalsContact O-CB 3.24Å; A220-Y224 WeakPolarHBondContact O-CB 3.23Å; A220-Y224 PolarHBondContact O-N 2.97Å; F221-Y224 WeakPolarHBondContact O-CB 3.11Å; F221-Y224 PolarHBondContact O-N 2.82Å; F222-Y224 VanDerWaalsContact C-N 3.34Å; Y224-Y226 VanDerWaalsContact C-N 3.32Å; Y224-Y226 PolarHBondContact O-N 3.41Å; Y224-C227 WeakPolarHBondContact O-CB 3.22Å; Y224-C227 PolarHBondContact O-N 3.16Å; Y224-I228 HydrophobicContact CD1-CD1 3.94Å; Y224-I228 HydrophobicContact CD1-CG1 4.43Å; Y224-I228 HydrophobicContact CE1-CD1 3.19Å; Y224-I228 HydrophobicContact CE1-CG1 4.05Å; Y224-I228 PolarHBondContact O-N 3.46Å |
| 225 | G | 91.1 | Very high | 88.3 | Confident | 25 Ų | 25 | 74.7 Ų | 74.7 | 26% | 0.258 | 37% | 0.368 | S | S | . | . | H | α-helix | trans | -60.2 | -39.4 | 176.3 | 0 | 0 | 0 | 0 | 0 | 113 | F221 F222 I228 K229 | F221-G225 PolarHBondContact O-N 2.68Å; F222-G225 PolarHBondContact O-N 3Å; G225-I228 PolarHBondContact O-N 3.28Å; G225-K229 WeakPolarHBondContact O-CB 3.45Å; G225-K229 PolarHBondContact O-N 3.24Å |
| 226 | Y | 88.3 | Confident | 87.2 | Confident | 128 Ų | 128 | 76.2 Ų | 76.2 | 50% | 0.502 | 37% | 0.366 | S | S | . | . | H | α-helix | trans | -63.5 | -46.5 | 174.4 | 179.9 | -100 | 0 | 0 | 0 | 111.8 | F222 L223 Y224 I228 K229 R230 | F222-Y226 WeakPolarHBondContact O-CB 3.39Å; F222-Y226 PolarHBondContact O-N 3.03Å; L223-Y226 WeakPolarHBondContact O-CB 3.45Å; L223-Y226 PolarHBondContact O-N 3.05Å; Y224-Y226 VanDerWaalsContact C-N 3.32Å; Y224-Y226 PolarHBondContact O-N 3.41Å; Y226-I228 PolarHBondContact O-N 3.13Å; Y226-K229 PolarHBondContact O-N 3.35Å; Y226-R230 HydrophobicContact CD1-CG 4.42Å; Y226-R230 HydrophobicContact CD2-CG 4.42Å; Y226-R230 HydrophobicContact CE1-CG 4Å; Y226-R230 HydrophobicContact CE2-CG 3.98Å; Y226-R230 WeakPolarHBondContact O-CB 3.2Å; Y226-R230 WeakPolarHBondContact O-CG 3.44Å; Y226-R230 PolarHBondContact O-N 2.9Å; Y226-R230 PolarHBondContact OH-NE 3.38Å |
| 227 | C | 87.5 | Confident | 86.3 | Confident | 69 Ų | 69 | 79.1 Ų | 79.1 | 47% | 0.466 | 38% | 0.376 | S | S | . | . | H | α-helix | trans | -58.1 | -46.4 | 175.3 | -75.6 | 0 | 0 | 0 | 0 | 111.4 | L223 Y224 K229 R230 A231 | L223-C227 WeakPolarHBondContact O-CB 3.48Å; L223-C227 PolarHBondContact O-N 3.32Å; L223-C227 PolarHBondContact O-SG 3.12Å; Y224-C227 WeakPolarHBondContact O-CB 3.22Å; Y224-C227 PolarHBondContact O-N 3.16Å; C227-K229 PolarHBondContact O-N 2.87Å; C227-R230 CarbonylContact O-C 3.52Å; C227-R230 PolarHBondContact O-N 3.47Å; C227-A231 WeakPolarHBondContact O-CA 3.39Å; C227-A231 WeakPolarHBondContact O-CB 3.4Å; C227-A231 PolarHBondContact O-N 3.27Å |
| 228 | I | 86 | Confident | 85.2 | Confident | 24 Ų | 24 | 81 Ų | 81 | 12% | 0.123 | 39% | 0.386 | C | S | . | . | H | α-helix | trans | -58.3 | -48.5 | 175 | -77.9 | -170.6 | 0 | 0 | 0 | 111.6 | A150 L173 Y224 G225 Y226 R230 A231 | A150-I228 HydrophobicContact CB-CD1 4.46Å; L173-I228 HydrophobicContact CD1-CB 4.15Å; L173-I228 HydrophobicContact CD1-CD1 4.43Å; L173-I228 HydrophobicContact CD1-CG1 3.95Å; L173-I228 HydrophobicContact CD1-CG2 3.76Å; Y224-I228 HydrophobicContact CD1-CD1 3.94Å; Y224-I228 HydrophobicContact CD1-CG1 4.43Å; Y224-I228 HydrophobicContact CE1-CD1 3.19Å; Y224-I228 HydrophobicContact CE1-CG1 4.05Å; Y224-I228 PolarHBondContact O-N 3.46Å; G225-I228 PolarHBondContact O-N 3.28Å; Y226-I228 PolarHBondContact O-N 3.13Å; I228-R230 VanDerWaalsContact C-N 3.27Å; I228-R230 PolarHBondContact O-N 3.06Å; I228-A231 WeakPolarHBondContact O-CB 3.08Å; I228-A231 PolarHBondContact O-N 2.97Å |
| 229 | K | 83.3 | Confident | 84.2 | Confident | 175 Ų | 175 | 83.1 Ų | 83.1 | 76% | 0.761 | 39% | 0.392 | S | S | * | . | H | α-helix | trans | -63.1 | -34.5 | -179.1 | -171.5 | 177.6 | -179 | 179.4 | 0 | 112 | G225 Y226 C227 | G225-K229 WeakPolarHBondContact O-CB 3.45Å; G225-K229 PolarHBondContact O-N 3.24Å; Y226-K229 PolarHBondContact O-N 3.35Å; C227-K229 PolarHBondContact O-N 2.87Å |
| 230 | R | 82.9 | Confident | 83.4 | Confident | 101 Ų | 101 | 86 Ų | 86 | 38% | 0.381 | 40% | 0.395 | S | S | . | . | H | α-helix | trans | -89.5 | -13.4 | 179.1 | -68.7 | -73.1 | -174.3 | 160.6 | -2.5 | 113.6 | Y226 C227 I228 W232 K233 V234 | Y226-R230 HydrophobicContact CD1-CG 4.42Å; Y226-R230 HydrophobicContact CD2-CG 4.42Å; Y226-R230 HydrophobicContact CE1-CG 4Å; Y226-R230 HydrophobicContact CE2-CG 3.98Å; Y226-R230 WeakPolarHBondContact O-CB 3.2Å; Y226-R230 WeakPolarHBondContact O-CG 3.44Å; Y226-R230 PolarHBondContact O-N 2.9Å; Y226-R230 PolarHBondContact OH-NE 3.38Å; C227-R230 CarbonylContact O-C 3.52Å; C227-R230 PolarHBondContact O-N 3.47Å; I228-R230 VanDerWaalsContact C-N 3.27Å; I228-R230 PolarHBondContact O-N 3.06Å; R230-W232 PolarHBondContact O-N 3.4Å; R230-K233 VanDerWaalsContact NH1-NZ 3.11Å; R230-K233 WeakPolarHBondContact O-CA 3.39Å; R230-K233 WeakPolarHBondContact O-CB 3.48Å; R230-K233 PolarHBondContact O-N 3.45Å; R230-V234 PolarHBondContact O-N 3.3Å |
| 231 | A | 78.2 | Confident | 82.6 | Confident | 22 Ų | 22 | 87.7 Ų | 87.7 | 18% | 0.182 | 40% | 0.403 | C | S | . | . | H | α-helix | trans | -52.8 | -35.8 | -176.8 | 0 | 0 | 0 | 0 | 0 | 112.1 | L173 C227 I228 V234 A235 | L173-A231 HydrophobicContact CB-CB 4.19Å; L173-A231 HydrophobicContact CD1-CB 4.32Å; C227-A231 WeakPolarHBondContact O-CA 3.39Å; C227-A231 WeakPolarHBondContact O-CB 3.4Å; C227-A231 PolarHBondContact O-N 3.27Å; I228-A231 WeakPolarHBondContact O-CB 3.08Å; I228-A231 PolarHBondContact O-N 2.97Å; A231-V234 PolarHBondContact O-N 3.08Å; A231-A235 WeakPolarHBondContact O-CB 3.48Å; A231-A235 PolarHBondContact O-N 2.88Å |
| 232 | W | 71.5 | Confident | 81.7 | Confident | 151 Ų | 151 | 91.4 Ų | 91.4 | 57% | 0.572 | 42% | 0.419 | S | S | * | . | H | α-helix | trans | -69.5 | -34.4 | 176.9 | -157.7 | 73.5 | 0 | 0 | 0 | 113.7 | R230 R236 | R230-W232 PolarHBondContact O-N 3.4Å; W232-R236 HydrophobicContact CD2-CG 4.45Å; W232-R236 VanDerWaalsContact CE3-CZ 3.42Å; W232-R236 HydrophobicContact CZ2-CG 4.49Å; W232-R236 VanDerWaalsContact CZ3-NH2 3.32Å; W232-R236 WeakPolarHBondContact O-CB 3.19Å; W232-R236 WeakPolarHBondContact O-CG 3.31Å; W232-R236 PolarHBondContact O-N 3.4Å; W232-R236 VanDerWaalsContact O-N 3.09Å |
| 233 | K | 73.8 | Confident | 81 | Confident | 113 Ų | 113 | 93.7 Ų | 93.7 | 49% | 0.491 | 42% | 0.424 | S | S | . | . | H | α-helix | trans | -68.2 | -43.5 | 172.7 | -66.8 | -172.4 | -177.7 | -175.9 | 0 | 110.4 | R230 R236 F237 | R230-K233 VanDerWaalsContact NH1-NZ 3.11Å; R230-K233 WeakPolarHBondContact O-CA 3.39Å; R230-K233 WeakPolarHBondContact O-CB 3.48Å; R230-K233 PolarHBondContact O-N 3.45Å; K233-R236 PolarHBondContact O-N 3.4Å; K233-F237 WeakPolarHBondContact O-CB 3.26Å; K233-F237 PolarHBondContact O-N 3.17Å |
| 234 | V | 73 | Confident | 80.4 | Confident | 76 Ų | 76 | 97.1 Ų | 97.1 | 46% | 0.461 | 43% | 0.429 | S | S | . | . | H | α-helix | trans | -63.4 | -47.6 | 177.3 | 179.2 | 0 | 0 | 0 | 0 | 111.1 | R230 A231 R236 F237 I238 | R230-V234 PolarHBondContact O-N 3.3Å; A231-V234 PolarHBondContact O-N 3.08Å; V234-R236 VanDerWaalsContact C-N 3.35Å; V234-R236 PolarHBondContact O-N 2.96Å; V234-F237 WeakPolarHBondContact O-CB 3.49Å; V234-F237 PolarHBondContact O-N 3.3Å; V234-F237 VanDerWaalsContact O-N 3.09Å; V234-I238 HydrophobicContact CG1-CD1 3.83Å; V234-I238 HydrophobicContact CG1-CG1 4.34Å; V234-I238 WeakPolarHBondContact O-CG1 3.28Å; V234-I238 PolarHBondContact O-N 3.02Å |
| 235 | A | 73.3 | Confident | 79.8 | Confident | 6 Ų | 6 | 101.1 Ų | 101.1 | 5% | 0.05 | 45% | 0.451 | C | S | . | . | H | α-helix | trans | -57.5 | -44.7 | 176.1 | 0 | 0 | 0 | 0 | 0 | 112.3 | A177 A231 F237 I238 K239 | A177-A235 HydrophobicContact CB-CB 3.79Å; A231-A235 WeakPolarHBondContact O-CB 3.48Å; A231-A235 PolarHBondContact O-N 2.88Å; A235-F237 VanDerWaalsContact C-N 3.34Å; A235-I238 PolarHBondContact O-N 3.3Å; A235-K239 WeakPolarHBondContact O-CB 3.37Å; A235-K239 WeakPolarHBondContact O-CG 3.49Å; A235-K239 PolarHBondContact O-N 3.44Å |
| 236 | R | 74.6 | Confident | 79.2 | Confident | 104 Ų | 104 | 109.5 Ų | 109.5 | 39% | 0.392 | 48% | 0.475 | S | S | . | . | H | α-helix | trans | -63.7 | -39.6 | 175 | -76.8 | -167.9 | -63.3 | 169.5 | -2.9 | 112.1 | W232 K233 V234 R240 | W232-R236 HydrophobicContact CD2-CG 4.45Å; W232-R236 VanDerWaalsContact CE3-CZ 3.42Å; W232-R236 HydrophobicContact CZ2-CG 4.49Å; W232-R236 VanDerWaalsContact CZ3-NH2 3.32Å; W232-R236 WeakPolarHBondContact O-CB 3.19Å; W232-R236 WeakPolarHBondContact O-CG 3.31Å; W232-R236 PolarHBondContact O-N 3.4Å; W232-R236 VanDerWaalsContact O-N 3.09Å; K233-R236 PolarHBondContact O-N 3.4Å; V234-R236 VanDerWaalsContact C-N 3.35Å; V234-R236 PolarHBondContact O-N 2.96Å; R236-R240 WeakPolarHBondContact O-CG 3.48Å; R236-R240 PolarHBondContact O-N 2.99Å |
| 237 | F | 77.2 | Confident | 78.7 | Confident | 137 Ų | 137 | 112.4 Ų | 112.4 | 60% | 0.601 | 49% | 0.485 | S | S | * | . | H | α-helix | trans | -63.5 | -50.2 | 176.4 | -179.8 | -101.8 | 0 | 0 | 0 | 111.6 | K233 V234 A235 K239 R240 V241 | K233-F237 WeakPolarHBondContact O-CB 3.26Å; K233-F237 PolarHBondContact O-N 3.17Å; V234-F237 WeakPolarHBondContact O-CB 3.49Å; V234-F237 PolarHBondContact O-N 3.3Å; V234-F237 VanDerWaalsContact O-N 3.09Å; A235-F237 VanDerWaalsContact C-N 3.34Å; F237-K239 VanDerWaalsContact C-N 3.32Å; F237-K239 PolarHBondContact O-N 3.31Å; F237-R240 WeakPolarHBondContact O-CB 3.4Å; F237-R240 PolarHBondContact O-N 3.44Å; F237-V241 HydrophobicContact CD1-CG2 4.26Å; F237-V241 HydrophobicContact CE1-CG2 3.87Å; F237-V241 HydrophobicContact CE2-CG2 4.21Å; F237-V241 HydrophobicContact CZ-CG2 3.84Å; F237-V241 WeakPolarHBondContact O-CG2 3.47Å; F237-V241 PolarHBondContact O-N 2.93Å |
| 238 | I | 76.8 | Confident | 78.1 | Confident | 49 Ų | 49 | 114.8 Ų | 114.8 | 25% | 0.251 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -57.4 | -44.8 | 177.1 | -67 | 170.5 | 0 | 0 | 0 | 110.9 | V234 A235 R240 V241 K242 | V234-I238 HydrophobicContact CG1-CD1 3.83Å; V234-I238 HydrophobicContact CG1-CG1 4.34Å; V234-I238 WeakPolarHBondContact O-CG1 3.28Å; V234-I238 PolarHBondContact O-N 3.02Å; A235-I238 PolarHBondContact O-N 3.3Å; I238-R240 VanDerWaalsContact C-N 3.35Å; I238-R240 PolarHBondContact O-N 2.88Å; I238-V241 PolarHBondContact O-N 3.07Å; I238-K242 HydrophobicContact CG2-CD 4.39Å; I238-K242 PolarHBondContact O-N 3.35Å |
| 239 | K | 76.4 | Confident | 77.4 | Confident | 123 Ų | 123 | 124.6 Ų | 124.6 | 54% | 0.535 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -61.2 | -40.9 | 176 | -76 | -177.4 | 179.9 | -179.1 | 0 | 112.3 | R176 A235 F237 R243 | R176-K239 VanDerWaalsContact O-CE 3.26Å; R176-K239 WeakPolarHBondContact O-CE 3.04Å; R176-K239 PolarHBondContact O-NZ 3.25Å; A235-K239 WeakPolarHBondContact O-CB 3.37Å; A235-K239 WeakPolarHBondContact O-CG 3.49Å; A235-K239 PolarHBondContact O-N 3.44Å; F237-K239 VanDerWaalsContact C-N 3.32Å; F237-K239 PolarHBondContact O-N 3.31Å; K239-R243 WeakPolarHBondContact O-CB 3.48Å; K239-R243 PolarHBondContact O-N 3.46Å |
| 240 | R | 79.6 | Confident | 76.3 | Confident | 166 Ų | 166 | 119.6 Ų | 119.6 | 63% | 0.626 | 53% | 0.527 | S | S | * | . | H | α-helix | trans | -63.9 | -42.6 | 175.7 | -76.1 | 176.9 | 179.1 | -172.3 | -1 | 111.8 | R236 F237 I238 R243 R244 | R236-R240 WeakPolarHBondContact O-CG 3.48Å; R236-R240 PolarHBondContact O-N 2.99Å; F237-R240 WeakPolarHBondContact O-CB 3.4Å; F237-R240 PolarHBondContact O-N 3.44Å; I238-R240 VanDerWaalsContact C-N 3.35Å; I238-R240 PolarHBondContact O-N 2.88Å; R240-R243 PolarHBondContact O-N 2.91Å; R240-R244 PolarHBondContact O-N 3.26Å; R240-R244 VanDerWaalsContact O-N 3.1Å |
| 241 | V | 82 | Confident | 74.9 | Confident | 58 Ų | 58 | 117.4 Ų | 117.4 | 35% | 0.352 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -65.1 | -48.7 | 177.6 | 174.9 | 0 | 0 | 0 | 0 | 111.1 | F237 I238 R243 R244 L245 | F237-V241 HydrophobicContact CD1-CG2 4.26Å; F237-V241 HydrophobicContact CE1-CG2 3.87Å; F237-V241 HydrophobicContact CE2-CG2 4.21Å; F237-V241 HydrophobicContact CZ-CG2 3.84Å; F237-V241 WeakPolarHBondContact O-CG2 3.47Å; F237-V241 PolarHBondContact O-N 2.93Å; I238-V241 PolarHBondContact O-N 3.07Å; V241-R243 VanDerWaalsContact C-N 3.28Å; V241-R243 PolarHBondContact O-N 3.37Å; V241-R244 PolarHBondContact O-N 2.8Å; V241-R244 VanDerWaalsContact O-N 3.08Å; V241-L245 HydrophobicContact CG1-CD1 4.26Å; V241-L245 PolarHBondContact O-N 3.39Å |
| 242 | K | 78.6 | Confident | 73.5 | Confident | 122 Ų | 122 | 121.6 Ų | 121.6 | 53% | 0.53 | 56% | 0.563 | S | S | . | * | H | α-helix | trans | -56.8 | -40 | 175.3 | -78.2 | -174.3 | 176.3 | -179.4 | 0 | 112.2 | I238 L245 R246 | I238-K242 HydrophobicContact CG2-CD 4.39Å; I238-K242 PolarHBondContact O-N 3.35Å; K242-L245 PolarHBondContact O-N 3.2Å; K242-R246 PolarHBondContact O-N 3.06Å |
| 243 | R | 79.3 | Confident | 72.7 | Confident | 187 Ų | 187 | 119.5 Ų | 119.5 | 71% | 0.706 | 57% | 0.57 | S | S | * | * | H | α-helix | trans | -64.3 | -39.3 | 176.4 | -165.9 | 177 | 79.3 | 177.6 | 6.6 | 112.4 | K239 R240 V241 R247 | K239-R243 WeakPolarHBondContact O-CB 3.48Å; K239-R243 PolarHBondContact O-N 3.46Å; R240-R243 PolarHBondContact O-N 2.91Å; V241-R243 VanDerWaalsContact C-N 3.28Å; V241-R243 PolarHBondContact O-N 3.37Å; R243-R247 PolarHBondContact O-N 3.17Å; R243-R247 VanDerWaalsContact O-N 3.14Å |
| 244 | R | 81.3 | Confident | 71.7 | Confident | 181 Ų | 181 | 121.1 Ų | 121.1 | 68% | 0.683 | 58% | 0.583 | S | S | * | * | H | α-helix | trans | -65.4 | -45.6 | 175.7 | -74 | -179.4 | 177.1 | -174.2 | -2.4 | 111.6 | R240 V241 R246 R247 N248 | R240-R244 PolarHBondContact O-N 3.26Å; R240-R244 VanDerWaalsContact O-N 3.1Å; V241-R244 PolarHBondContact O-N 2.8Å; V241-R244 VanDerWaalsContact O-N 3.08Å; R244-R246 VanDerWaalsContact C-N 3.34Å; R244-R246 PolarHBondContact O-N 3.2Å; R244-R247 PolarHBondContact O-N 3.27Å; R244-N248 PolarHBondContact O-N 3.49Å; R244-N248 PolarHBondContact O-OD1 2.93Å |
| 245 | L | 81.4 | Confident | 70.9 | Confident | 106 Ų | 106 | 125.5 Ų | 125.5 | 56% | 0.555 | 60% | 0.603 | S | S | * | * | H | α-helix | trans | -61.6 | -40.4 | 177.3 | -68.7 | 173.9 | 0 | 0 | 0 | 112.3 | V241 K242 R247 N248 R249 | V241-L245 HydrophobicContact CG1-CD1 4.26Å; V241-L245 PolarHBondContact O-N 3.39Å; K242-L245 PolarHBondContact O-N 3.2Å; L245-R247 PolarHBondContact O-N 2.86Å; L245-N248 PolarHBondContact O-N 2.78Å; L245-R249 PolarHBondContact O-N 2.89Å; L245-R249 VanDerWaalsContact O-N 3.09Å |
| 246 | R | 79.2 | Confident | 70 | Confident | 202 Ų | 202 | 131 Ų | 131 | 76% | 0.762 | 64% | 0.637 | S | S | * | * | H | α-helix | trans | -64.6 | -38.7 | 176.1 | -163 | 176 | 79.8 | -175.8 | 7.5 | 112.3 | K242 R244 R249 G250 | K242-R246 PolarHBondContact O-N 3.06Å; R244-R246 VanDerWaalsContact C-N 3.34Å; R244-R246 PolarHBondContact O-N 3.2Å; R246-R249 PolarHBondContact O-N 3.46Å; R246-G250 PolarHBondContact O-N 3.14Å |
| 247 | R | 76.9 | Confident | 69 | Low | 189 Ų | 189 | 139.3 Ų | 139.3 | 71% | 0.713 | 68% | 0.676 | S | S | * | * | H | α-helix | trans | -64.8 | -40.1 | 176.2 | -168.6 | 177.3 | 71 | 172.8 | 6.6 | 111.9 | R243 R244 L245 R249 G250 | R243-R247 PolarHBondContact O-N 3.17Å; R243-R247 VanDerWaalsContact O-N 3.14Å; R244-R247 PolarHBondContact O-N 3.27Å; L245-R247 PolarHBondContact O-N 2.86Å; R247-R249 VanDerWaalsContact C-N 3.34Å; R247-G250 PolarHBondContact O-N 2.87Å |
| 248 | N | 76 | Confident | 68.5 | Low | 119 Ų | 119 | 139.4 Ų | 139.4 | 64% | 0.636 | 68% | 0.679 | S | S | * | * | H | α-helix | trans | -70 | -30.8 | 178.4 | -69.3 | 9.6 | 0 | 0 | 0 | 112.5 | R244 L245 | R244-N248 PolarHBondContact O-N 3.49Å; R244-N248 PolarHBondContact O-OD1 2.93Å; L245-N248 PolarHBondContact O-N 2.78Å |
| 249 | R | 70 | Confident | 68.1 | Low | 230 Ų | 230 | 144.2 Ų | 144.2 | 87% | 0.868 | 70% | 0.702 | S | S | * | * | H | α-helix | trans | -75.1 | -25.7 | 175.2 | -77.7 | -175.2 | 171 | 179.6 | -3.5 | 114.2 | L245 R246 R247 G251 | L245-R249 PolarHBondContact O-N 2.89Å; L245-R249 VanDerWaalsContact O-N 3.09Å; R246-R249 PolarHBondContact O-N 3.46Å; R247-R249 VanDerWaalsContact C-N 3.34Å; R249-G251 VanDerWaalsContact C-N 3.29Å; R249-G251 PolarHBondContact O-N 3.2Å |
| 250 | G | 60 | Low | 67.6 | Low | 70 Ų | 70 | 145.3 Ų | 145.3 | 72% | 0.722 | 71% | 0.711 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -86 | 7.4 | 178.8 | 0 | 0 | 0 | 0 | 0 | 114.7 | R246 R247 | R246-G250 PolarHBondContact O-N 3.14Å; R247-G250 PolarHBondContact O-N 2.87Å |
| 251 | G | 53.9 | Low | 66.9 | Low | 54 Ų | 54 | 144.1 Ų | 144.1 | 56% | 0.557 | 72% | 0.716 | S | S | * | * | trans | -102.1 | 23 | -169 | 0 | 0 | 0 | 0 | 0 | 116.4 | R249 P253 | R249-G251 VanDerWaalsContact C-N 3.29Å; R249-G251 PolarHBondContact O-N 3.2Å; G251-P253 WeakPolarHBondContact O-CD 3.26Å | ||
| 252 | S | 50 | Low | 66 | Low | 110 Ų | 110 | 149.5 Ų | 149.5 | 77% | 0.769 | 74% | 0.739 | S | S | * | * | trans | -96.9 | 94.3 | 161.8 | -82.5 | 0 | 0 | 0 | 0 | 108.7 | N254 | S252-N254 PolarHBondContact O-N 3.37Š| ||
| 253 | P | 54.2 | Low | 65.2 | Low | 108 Ų | 108 | 151.3 Ų | 151.3 | 70% | 0.701 | 75% | 0.753 | S | S | * | * | trans | -65.9 | 119.2 | 162.2 | 6.8 | 6.7 | 0 | 0 | 0 | 106.7 | G251 L255 | G251-P253 WeakPolarHBondContact O-CD 3.26Å; P253-L255 PolarHBondContact O-N 3.25Å | ||
| 254 | N | 52.9 | Low | 64.2 | Low | 146 Ų | 146 | 148.8 Ų | 148.8 | 78% | 0.781 | 76% | 0.756 | S | S | * | * | trans | -54.3 | 107.5 | 163.3 | -82.8 | -22.3 | 0 | 0 | 0 | 107.7 | S252 T256 | S252-N254 PolarHBondContact O-N 3.37Å; N254-T256 PolarHBondContact O-N 3.42Å | ||
| 255 | L | 56.8 | Low | 62.8 | Low | 168 Ų | 168 | 146.3 Ų | 146.3 | 88% | 0.88 | 76% | 0.762 | S | S | * | * | trans | -75.7 | 75.3 | 165.8 | -67.6 | 172 | 0 | 0 | 0 | 107.5 | P253 | P253-L255 PolarHBondContact O-N 3.25Š| ||
| 256 | T | 52.6 | Low | 61.3 | Low | 123 Ų | 123 | 149.7 Ų | 149.7 | 76% | 0.755 | 78% | 0.779 | S | S | * | * | trans | -89 | 98.6 | 160.4 | 46.5 | 0 | 0 | 0 | 0 | 107 | N254 | N254-T256 PolarHBondContact O-N 3.42Š| ||
| 257 | K | 53.4 | Low | 59.7 | Low | 277 Ų | 277 | 144.9 Ų | 144.9 | 100% | 1.204 | 78% | 0.781 | S | S | * | * | trans | -68.4 | 0 | 147.2 | -77.3 | -174.5 | 175.6 | -177.3 | 0 | 108.6 |
Retrieved 257 of 257 residues in 332.1 ms
(Link to these results)