| 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 | 51.8 | Low | 69.8 | Low | 215 Ų | 215 | 79.5 Ų | 79.5 | 100% | 1.059 | 46% | 0.462 | S | S | * | . | 0 | 136.9 | 0 | -64.3 | 176.1 | -171.5 | 0 | 0 | 106.9 | |||||
| 2 | A | 58 | Low | 70.9 | Confident | 83 Ų | 83 | 82.6 Ų | 82.6 | 69% | 0.686 | 47% | 0.469 | S | S | * | . | P | Polyproline II helix | trans | -76.5 | 127.5 | -176.8 | 0 | 0 | 0 | 0 | 0 | 110 | ||
| 3 | P | 63.2 | Low | 72 | Confident | 41 Ų | 41 | 80.7 Ų | 80.7 | 27% | 0.266 | 46% | 0.462 | S | S | . | . | P | Polyproline II helix | trans | -65.1 | 146.6 | 175.4 | 25.9 | -32.8 | 0 | 0 | 0 | 110.9 | P6 Y309 | P3-P6 HydrophobicContact CB-CB 4.37Å; P3-P6 HydrophobicContact CG-CB 3.95Å; P3-P6 HydrophobicContact CG-CG 4.25Å; P3-Y309 HydrophobicContact CB-CD1 4.09Å; P3-Y309 HydrophobicContact CB-CD2 4.37Å; P3-Y309 HydrophobicContact CB-CG 3.8Å |
| 4 | V | 66.3 | Low | 72.8 | Confident | 57 Ų | 57 | 75.6 Ų | 75.6 | 35% | 0.345 | 43% | 0.431 | S | S | . | . | B | Isolated β-bridge | trans | -89.8 | 127.2 | 176.7 | -179.2 | 0 | 0 | 0 | 0 | 109.6 | L310 F311 G313 | V4-L310 PolarHBondContact O-N 3.09Å; V4-F311 HydrophobicContact CB-CB 4.31Å; V4-F311 HydrophobicContact CG2-CB 4.44Å; V4-F311 PolarHBondContact N-O 3.37Å; V4-F311 VanDerWaalsContact N-O 3.11Å; V4-G313 WeakPolarHBondContact CG2-O 3.36Å |
| 5 | L | 71.9 | Confident | 73.7 | Confident | 122 Ų | 122 | 73.9 Ų | 73.9 | 64% | 0.639 | 42% | 0.42 | S | S | * | . | S | Bend | trans | 53.6 | 56.7 | -177.9 | -158.3 | 68.5 | 0 | 0 | 0 | 113.4 | Y288 | L5-Y288 VanDerWaalsContact CD2-OH 3.22Å; L5-Y288 WeakPolarHBondContact CD2-OH 3.48Å; L5-Y288 WeakPolarHBondContact CG-OH 3.43Å; L5-Y288 WeakPolarHBondContact O-CE1 3.19Å; L5-Y288 PolarHBondContact O-OH 3.12Å |
| 6 | P | 73.9 | Confident | 74.8 | Confident | 68 Ų | 68 | 80.4 Ų | 80.4 | 44% | 0.442 | 44% | 0.435 | S | S | . | . | trans | -71.7 | 133.8 | 179.2 | 30.7 | -33.4 | 0 | 0 | 0 | 110.9 | P3 G308 | P3-P6 HydrophobicContact CB-CB 4.37Å; P3-P6 HydrophobicContact CG-CB 3.95Å; P3-P6 HydrophobicContact CG-CG 4.25Å; P6-G308 WeakPolarHBondContact CA-O 3.35Å | ||
| 7 | L | 76.9 | Confident | 75.6 | Confident | 96 Ų | 96 | 78.7 Ų | 78.7 | 50% | 0.503 | 43% | 0.426 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -119.5 | 124.8 | 173.5 | -160.7 | 90.1 | 0 | 0 | 0 | 108.8 | L9 Y288 Q307 G308 | L7-L9 HydrophobicContact CD2-CD1 4.46Å; L7-L9 HydrophobicContact CD2-CD2 3.97Å; L7-L9 HydrophobicContact CD2-CG 4.04Å; L7-L9 PolarHBondContact O-N 3.06Å; L7-Y288 HydrophobicContact CB-CD1 4.31Å; L7-Y288 HydrophobicContact CB-CE1 4.07Å; L7-Q307 WeakPolarHBondContact O-CA 3.36Å; L7-G308 PolarHBondContact N-O 2.97Å; L7-G308 PolarHBondContact O-N 3.34Å |
| 8 | V | 76.2 | Confident | 76.4 | Confident | 73 Ų | 73 | 74.4 Ų | 74.4 | 44% | 0.442 | 40% | 0.402 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -73.4 | 121.5 | 172.6 | -174.8 | 0 | 0 | 0 | 0 | 108.3 | P10 E305 T306 Q307 | V8-P10 WeakPolarHBondContact O-CD 3.39Å; V8-E305 HydrophobicContact CG1-CB 4.33Å; V8-T306 CarbonylContact C-O 3.59Å; V8-T306 WeakPolarHBondContact CA-O 3.26Å; V8-Q307 HydrophobicContact CG2-CG 4.35Å |
| 9 | L | 75.5 | Confident | 77.3 | Confident | 6 Ų | 6 | 75.9 Ų | 75.9 | 3% | 0.031 | 41% | 0.407 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -119.4 | 91 | -176.1 | -78.2 | 156.1 | 0 | 0 | 0 | 108.9 | L7 P13 L17 A292 T306 | L7-L9 HydrophobicContact CD2-CD1 4.46Å; L7-L9 HydrophobicContact CD2-CD2 3.97Å; L7-L9 HydrophobicContact CD2-CG 4.04Å; L7-L9 PolarHBondContact O-N 3.06Å; L9-P13 HydrophobicContact CD2-CB 4.45Å; L9-L17 HydrophobicContact CD2-CD2 4.14Å; L9-A292 HydrophobicContact CB-CB 4.4Å; L9-A292 HydrophobicContact CD1-CB 3.96Å; L9-T306 PolarHBondContact N-O 3.13Å; L9-T306 PolarHBondContact O-OG1 3.07Å |
| 10 | P | 76.2 | Confident | 78.2 | Confident | 57 Ų | 57 | 73.6 Ų | 73.6 | 37% | 0.37 | 40% | 0.402 | S | S | . | . | trans | -71.2 | 171.3 | 170.7 | 23.9 | -22.6 | 0 | 0 | 0 | 110.8 | V8 Q12 P13 R14 | V8-P10 WeakPolarHBondContact O-CD 3.39Å; P10-Q12 PolarHBondContact O-N 3.39Å; P10-P13 HydrophobicContact CG-CG 3.73Å; P10-P13 WeakPolarHBondContact O-CD 3.33Å; P10-R14 WeakPolarHBondContact O-CB 3.25Å; P10-R14 PolarHBondContact O-N 2.72Å | ||
| 11 | L | 77.5 | Confident | 79 | Confident | 56 Ų | 56 | 70.3 Ų | 70.3 | 29% | 0.293 | 38% | 0.384 | S | S | . | . | H | α-helix | trans | -51.9 | -49.1 | -171.3 | -163.6 | 103.1 | 0 | 0 | 0 | 113.4 | R14 I15 | L11-R14 VanDerWaalsContact CD1-NH2 3.25Å; L11-R14 PolarHBondContact O-N 2.97Å; L11-I15 HydrophobicContact CD2-CD1 4.17Å; L11-I15 HydrophobicContact CG-CD1 4.26Å; L11-I15 WeakPolarHBondContact O-CG1 3.32Å; L11-I15 PolarHBondContact O-N 3.08Å; L11-I15 VanDerWaalsContact O-N 3.09Å |
| 12 | Q | 83.8 | Confident | 81 | Confident | 117 Ų | 117 | 64.6 Ų | 64.6 | 55% | 0.547 | 35% | 0.35 | S | S | . | . | H | α-helix | trans | -65.9 | -52.3 | -176.9 | -77.7 | -68.8 | -25 | 0 | 0 | 113.3 | P10 R14 I15 R16 | P10-Q12 PolarHBondContact O-N 3.39Å; Q12-R14 VanDerWaalsContact C-N 3.28Å; Q12-R14 PolarHBondContact O-N 3.38Å; Q12-I15 PolarHBondContact O-N 3.35Å; Q12-R16 PolarHBondContact O-N 3.26Å; Q12-R16 VanDerWaalsContact O-N 3.08Å |
| 13 | P | 84.3 | Confident | 82.9 | Confident | 58 Ų | 58 | 65.5 Ų | 65.5 | 38% | 0.377 | 34% | 0.343 | S | S | . | . | H | α-helix | trans | -57.9 | -35.9 | 172.5 | -30.2 | 38.3 | 0 | 0 | 0 | 114.2 | L9 P10 R16 L17 | L9-P13 HydrophobicContact CD2-CB 4.45Å; P10-P13 HydrophobicContact CG-CG 3.73Å; P10-P13 WeakPolarHBondContact O-CD 3.33Å; P13-R16 PolarHBondContact O-N 3.09Å; P13-L17 WeakPolarHBondContact O-CB 3.42Å; P13-L17 PolarHBondContact O-N 3.35Å |
| 14 | R | 83.6 | Confident | 84.5 | Confident | 9 Ų | 9 | 66 Ų | 66 | 3% | 0.034 | 34% | 0.344 | C | S | . | . | H | α-helix | trans | -63.3 | -43.2 | 176.7 | -171.5 | -175.7 | 68.2 | -157.2 | 0.8 | 112 | P10 L11 Q12 L17 A18 L289 I300 | P10-R14 WeakPolarHBondContact O-CB 3.25Å; P10-R14 PolarHBondContact O-N 2.72Å; L11-R14 VanDerWaalsContact CD1-NH2 3.25Å; L11-R14 PolarHBondContact O-N 2.97Å; Q12-R14 VanDerWaalsContact C-N 3.28Å; Q12-R14 PolarHBondContact O-N 3.38Å; R14-L17 PolarHBondContact O-N 3.4Å; R14-A18 PolarHBondContact O-N 3.05Å; R14-L289 HydrophobicContact CG-CD1 3.57Å; R14-I300 PolarHBondContact NH2-O 3.39Å |
| 15 | I | 86.6 | Confident | 86 | Confident | 51 Ų | 51 | 63.3 Ų | 63.3 | 26% | 0.262 | 33% | 0.327 | S | S | . | . | H | α-helix | trans | -62.8 | -46 | 175.3 | -67.9 | 164.8 | 0 | 0 | 0 | 110.4 | L11 Q12 L17 A18 Q19 L88 | L11-I15 HydrophobicContact CD2-CD1 4.17Å; L11-I15 HydrophobicContact CG-CD1 4.26Å; L11-I15 WeakPolarHBondContact O-CG1 3.32Å; L11-I15 PolarHBondContact O-N 3.08Å; L11-I15 VanDerWaalsContact O-N 3.09Å; Q12-I15 PolarHBondContact O-N 3.35Å; I15-L17 VanDerWaalsContact C-N 3.33Å; I15-L17 PolarHBondContact O-N 3.3Å; I15-A18 PolarHBondContact O-N 3.44Å; I15-Q19 WeakPolarHBondContact O-CG 3.38Å; I15-Q19 PolarHBondContact O-N 3.31Å; I15-L88 HydrophobicContact CB-CD2 4.36Å; I15-L88 HydrophobicContact CG1-CD2 4.39Å; I15-L88 HydrophobicContact CG2-CD2 3.98Å |
| 16 | R | 90.4 | Very high | 87.2 | Confident | 177 Ų | 177 | 62.7 Ų | 62.7 | 67% | 0.668 | 32% | 0.316 | S | S | * | . | H | α-helix | trans | -62.2 | -40.3 | 177.3 | -67.6 | -172.1 | -169.2 | -171.3 | 3.5 | 112.3 | Q12 P13 Q19 G20 | Q12-R16 PolarHBondContact O-N 3.26Å; Q12-R16 VanDerWaalsContact O-N 3.08Å; P13-R16 PolarHBondContact O-N 3.09Å; R16-Q19 PolarHBondContact O-N 3.32Å; R16-G20 PolarHBondContact O-N 2.96Å |
| 17 | L | 88.9 | Confident | 88.4 | Confident | 52 Ų | 52 | 63.7 Ų | 63.7 | 27% | 0.272 | 32% | 0.317 | S | S | . | . | H | α-helix | trans | -61.9 | -47 | 175.9 | 179.2 | 65.4 | 0 | 0 | 0 | 111.1 | L9 P13 R14 I15 Q19 G20 L21 | L9-L17 HydrophobicContact CD2-CD2 4.14Å; P13-L17 WeakPolarHBondContact O-CB 3.42Å; P13-L17 PolarHBondContact O-N 3.35Å; R14-L17 PolarHBondContact O-N 3.4Å; I15-L17 VanDerWaalsContact C-N 3.33Å; I15-L17 PolarHBondContact O-N 3.3Å; L17-Q19 PolarHBondContact O-N 3.44Å; L17-G20 PolarHBondContact O-N 3.27Å; L17-L21 HydrophobicContact CD1-CD1 4.13Å; L17-L21 HydrophobicContact CD1-CG 4.32Å; L17-L21 HydrophobicContact CG-CD1 3.89Å; L17-L21 HydrophobicContact CG-CG 4.5Å; L17-L21 WeakPolarHBondContact O-CB 3.41Å; L17-L21 VanDerWaalsContact O-CG 3.32Å; L17-L21 WeakPolarHBondContact O-CG 3.41Å; L17-L21 PolarHBondContact O-N 3.46Å |
| 18 | A | 90.4 | Very high | 89.4 | Confident | 1 Ų | 1 | 59.1 Ų | 59.1 | 1% | 0.008 | 29% | 0.293 | C | S | . | . | H | α-helix | trans | -62.4 | -40.7 | 177.4 | 0 | 0 | 0 | 0 | 0 | 112.3 | R14 I15 L21 W22 L88 L289 | R14-A18 PolarHBondContact O-N 3.05Å; I15-A18 PolarHBondContact O-N 3.44Å; A18-L21 PolarHBondContact O-N 3.26Å; A18-W22 WeakPolarHBondContact O-CB 3.44Å; A18-W22 PolarHBondContact O-N 3.31Å; A18-L88 HydrophobicContact CB-CD1 4.47Å; A18-L88 HydrophobicContact CB-CD2 3.66Å; A18-L88 HydrophobicContact CB-CG 3.87Å; A18-L289 HydrophobicContact CB-CD2 4Å |
| 19 | Q | 93.4 | Very high | 90.4 | Very high | 103 Ų | 103 | 56.5 Ų | 56.5 | 48% | 0.481 | 28% | 0.278 | S | S | . | . | H | α-helix | trans | -63.8 | -43 | 173.4 | -71.4 | 173.1 | -13.4 | 0 | 0 | 112.4 | I15 R16 L17 W22 L23 L88 | I15-Q19 WeakPolarHBondContact O-CG 3.38Å; I15-Q19 PolarHBondContact O-N 3.31Å; R16-Q19 PolarHBondContact O-N 3.32Å; L17-Q19 PolarHBondContact O-N 3.44Å; Q19-W22 WeakPolarHBondContact O-CB 3.39Å; Q19-W22 PolarHBondContact O-N 2.93Å; Q19-L23 PolarHBondContact O-N 2.92Å; Q19-L23 VanDerWaalsContact O-N 3.15Å; Q19-L88 HydrophobicContact CG-CD1 4.39Å |
| 20 | G | 94.4 | Very high | 91.5 | Very high | 30 Ų | 30 | 61.3 Ų | 61.3 | 31% | 0.309 | 30% | 0.303 | S | S | . | . | H | α-helix | trans | -63.3 | -43.4 | 175.5 | 0 | 0 | 0 | 0 | 0 | 112.4 | R16 L17 W22 L23 L24 | R16-G20 PolarHBondContact O-N 2.96Å; L17-G20 PolarHBondContact O-N 3.27Å; G20-W22 VanDerWaalsContact C-N 3.31Å; G20-W22 PolarHBondContact O-N 3.31Å; G20-L23 PolarHBondContact O-N 3.42Å; G20-L24 WeakPolarHBondContact O-CG 3.38Å; G20-L24 PolarHBondContact O-N 3.03Å |
| 21 | L | 95.1 | Very high | 92.5 | Very high | 4 Ų | 4 | 59.1 Ų | 59.1 | 2% | 0.021 | 29% | 0.289 | C | S | . | . | H | α-helix | trans | -65.3 | -35.5 | 176 | -73.4 | 166 | 0 | 0 | 0 | 112.1 | L17 A18 L23 L24 S25 S84 L286 L289 | L17-L21 HydrophobicContact CD1-CD1 4.13Å; L17-L21 HydrophobicContact CD1-CG 4.32Å; L17-L21 HydrophobicContact CG-CD1 3.89Å; L17-L21 HydrophobicContact CG-CG 4.5Å; L17-L21 WeakPolarHBondContact O-CB 3.41Å; L17-L21 VanDerWaalsContact O-CG 3.32Å; L17-L21 WeakPolarHBondContact O-CG 3.41Å; L17-L21 PolarHBondContact O-N 3.46Å; A18-L21 PolarHBondContact O-N 3.26Å; L21-L23 VanDerWaalsContact C-N 3.34Å; L21-L23 PolarHBondContact O-N 3.5Å; L21-L24 PolarHBondContact O-N 3.25Å; L21-S25 WeakPolarHBondContact O-CB 3.45Å; L21-S25 PolarHBondContact O-N 3.5Å; L21-S25 PolarHBondContact O-OG 2.92Å; L21-S84 WeakPolarHBondContact CB-OG 3.22Å; L21-L286 HydrophobicContact CD1-CD2 4.48Å; L21-L289 HydrophobicContact CD1-CB 4.47Å; L21-L289 HydrophobicContact CD1-CD2 4.17Å |
| 22 | W | 95.4 | Very high | 93.5 | Very high | 96 Ų | 96 | 56.4 Ų | 56.4 | 36% | 0.364 | 28% | 0.275 | S | S | . | . | H | α-helix | trans | -60.8 | -44.3 | 173.5 | -179 | 85.2 | 0 | 0 | 0 | 111.5 | A18 Q19 G20 S25 W26 | A18-W22 WeakPolarHBondContact O-CB 3.44Å; A18-W22 PolarHBondContact O-N 3.31Å; Q19-W22 WeakPolarHBondContact O-CB 3.39Å; Q19-W22 PolarHBondContact O-N 2.93Å; G20-W22 VanDerWaalsContact C-N 3.31Å; G20-W22 PolarHBondContact O-N 3.31Å; W22-S25 PolarHBondContact O-N 2.89Å; W22-W26 AromaticContact CD2-CD1 3.92Å; W22-W26 AromaticContact CE2-CD1 3.66Å; W22-W26 AromaticContact CE2-NE1 3.34Å; W22-W26 VanDerWaalsContact CE2-NE1 3.34Å; W22-W26 AromaticContact CH2-CD1 3.97Å; W22-W26 AromaticContact CH2-NE1 3.87Å; W22-W26 AromaticContact CZ2-CD1 3.7Å; W22-W26 AromaticContact CZ2-NE1 3.22Å; W22-W26 AromaticContact NE1-NE1 3.62Å; W22-W26 VanDerWaalsContact O-CD1 3.32Å; W22-W26 PolarHBondContact O-N 3.13Å |
| 23 | L | 96.3 | Very high | 94.2 | Very high | 102 Ų | 102 | 51.8 Ų | 51.8 | 53% | 0.534 | 26% | 0.259 | S | S | . | . | H | α-helix | trans | -65.4 | -49.1 | 175.3 | -69.7 | 172 | 0 | 0 | 0 | 112.5 | Q19 G20 L21 S25 W26 L27 | Q19-L23 PolarHBondContact O-N 2.92Å; Q19-L23 VanDerWaalsContact O-N 3.15Å; G20-L23 PolarHBondContact O-N 3.42Å; L21-L23 VanDerWaalsContact C-N 3.34Å; L21-L23 PolarHBondContact O-N 3.5Å; L23-S25 PolarHBondContact O-N 3.23Å; L23-W26 PolarHBondContact O-N 3.46Å; L23-W26 VanDerWaalsContact O-N 3.15Å; L23-L27 PolarHBondContact O-N 2.96Å |
| 24 | L | 97.2 | Very high | 94.9 | Very high | 52 Ų | 52 | 53.1 Ų | 53.1 | 27% | 0.272 | 26% | 0.263 | S | S | . | . | H | α-helix | trans | -60.5 | -35.8 | 178.2 | -72.7 | 170.6 | 0 | 0 | 0 | 112 | G20 L21 L27 L28 L278 V282 | G20-L24 WeakPolarHBondContact O-CG 3.38Å; G20-L24 PolarHBondContact O-N 3.03Å; L21-L24 PolarHBondContact O-N 3.25Å; L24-L27 HydrophobicContact CD2-CD1 4.4Å; L24-L27 PolarHBondContact O-N 3.45Å; L24-L28 PolarHBondContact O-N 3.15Å; L24-L278 HydrophobicContact CD2-CD2 4.02Å; L24-V282 HydrophobicContact CB-CG2 3.79Å |
| 25 | S | 97.1 | Very high | 95.6 | Very high | 0 Ų | 0 | 52.7 Ų | 52.7 | 0% | 0 | 26% | 0.261 | C | S | . | . | H | α-helix | trans | -66.5 | -38.2 | 177 | -59 | 0 | 0 | 0 | 0 | 111.7 | L21 W22 L23 L28 V29 G77 | L21-S25 WeakPolarHBondContact O-CB 3.45Å; L21-S25 PolarHBondContact O-N 3.5Å; L21-S25 PolarHBondContact O-OG 2.92Å; W22-S25 PolarHBondContact O-N 2.89Å; L23-S25 PolarHBondContact O-N 3.23Å; S25-L28 WeakPolarHBondContact O-CB 3.28Å; S25-L28 PolarHBondContact O-N 3.21Å; S25-V29 WeakPolarHBondContact O-CG2 3.42Å; S25-V29 PolarHBondContact O-N 2.83Å; S25-G77 WeakPolarHBondContact CB-O 3.34Å |
| 26 | W | 98.1 | Very high | 96.1 | Very high | 108 Ų | 108 | 52.7 Ų | 52.7 | 41% | 0.409 | 26% | 0.261 | S | S | . | . | H | α-helix | trans | -66 | -40.2 | 171.4 | -84 | 115.3 | 0 | 0 | 0 | 112.8 | W22 L23 L28 V29 L30 V81 | W22-W26 AromaticContact CD2-CD1 3.92Å; W22-W26 AromaticContact CE2-CD1 3.66Å; W22-W26 AromaticContact CE2-NE1 3.34Å; W22-W26 VanDerWaalsContact CE2-NE1 3.34Å; W22-W26 AromaticContact CH2-CD1 3.97Å; W22-W26 AromaticContact CH2-NE1 3.87Å; W22-W26 AromaticContact CZ2-CD1 3.7Å; W22-W26 AromaticContact CZ2-NE1 3.22Å; W22-W26 AromaticContact NE1-NE1 3.62Å; W22-W26 VanDerWaalsContact O-CD1 3.32Å; W22-W26 PolarHBondContact O-N 3.13Å; L23-W26 PolarHBondContact O-N 3.46Å; L23-W26 VanDerWaalsContact O-N 3.15Å; W26-L28 VanDerWaalsContact C-N 3.27Å; W26-L28 PolarHBondContact O-N 3.33Å; W26-V29 HydrophobicContact CE3-CB 4.31Å; W26-V29 HydrophobicContact CE3-CG1 4.35Å; W26-V29 HydrophobicContact CZ3-CG1 4.35Å; W26-V29 WeakPolarHBondContact O-CB 3.25Å; W26-V29 PolarHBondContact O-N 3.47Å; W26-L30 WeakPolarHBondContact O-CG 3.32Å; W26-L30 PolarHBondContact O-N 3.41Å; W26-V81 HydrophobicContact CD2-CG2 3.99Å; W26-V81 HydrophobicContact CG-CG2 3.99Å; W26-V81 HydrophobicContact CZ2-CG1 4.13Å |
| 27 | L | 98.1 | Very high | 96.5 | Very high | 89 Ų | 89 | 50.2 Ų | 50.2 | 47% | 0.466 | 26% | 0.261 | S | S | . | . | H | α-helix | trans | -60.7 | -39 | 173.3 | -68.7 | 174.6 | 0 | 0 | 0 | 111.5 | L23 L24 L30 A31 L278 | L23-L27 PolarHBondContact O-N 2.96Å; L24-L27 HydrophobicContact CD2-CD1 4.4Å; L24-L27 PolarHBondContact O-N 3.45Å; L27-L30 PolarHBondContact O-N 3.32Å; L27-A31 WeakPolarHBondContact O-CB 3.43Å; L27-A31 PolarHBondContact O-N 3.48Å; L27-L278 HydrophobicContact CB-CD1 4.43Å; L27-L278 HydrophobicContact CB-CD2 4.38Å |
| 28 | L | 98.2 | Very high | 96.9 | Very high | 0 Ų | 0 | 50.5 Ų | 50.5 | 0% | 0 | 27% | 0.266 | C | S | . | . | H | α-helix | trans | -64.5 | -40 | 174.5 | -176.4 | 62.1 | 0 | 0 | 0 | 112.2 | L24 S25 W26 A31 G32 A73 T76 T275 L278 Q279 V282 | L24-L28 PolarHBondContact O-N 3.15Å; S25-L28 WeakPolarHBondContact O-CB 3.28Å; S25-L28 PolarHBondContact O-N 3.21Å; W26-L28 VanDerWaalsContact C-N 3.27Å; W26-L28 PolarHBondContact O-N 3.33Å; L28-A31 PolarHBondContact O-N 3.15Å; L28-G32 PolarHBondContact O-N 2.9Å; L28-A73 HydrophobicContact CD1-CB 4.16Å; L28-T76 HydrophobicContact CD2-CG2 4.18Å; L28-T275 HydrophobicContact CD1-CG2 3.79Å; L28-L278 HydrophobicContact CD1-CB 4.04Å; L28-Q279 HydrophobicContact CD1-CB 4.1Å; L28-Q279 HydrophobicContact CD2-CB 4.29Å; L28-V282 HydrophobicContact CD2-CB 4.47Å; L28-V282 HydrophobicContact CD2-CG2 4.39Å |
| 29 | V | 98.4 | Very high | 97.2 | Very high | 18 Ų | 18 | 50.5 Ų | 50.5 | 11% | 0.109 | 27% | 0.266 | C | S | . | . | H | α-helix | trans | -60.4 | -46.4 | 173.2 | 171.4 | 0 | 0 | 0 | 0 | 111.1 | S25 W26 G32 G33 L74 L78 | S25-V29 WeakPolarHBondContact O-CG2 3.42Å; S25-V29 PolarHBondContact O-N 2.83Å; W26-V29 HydrophobicContact CE3-CB 4.31Å; W26-V29 HydrophobicContact CE3-CG1 4.35Å; W26-V29 HydrophobicContact CZ3-CG1 4.35Å; W26-V29 WeakPolarHBondContact O-CB 3.25Å; W26-V29 PolarHBondContact O-N 3.47Å; V29-G32 PolarHBondContact O-N 3.22Å; V29-G33 PolarHBondContact O-N 3.26Å; V29-L74 HydrophobicContact CG1-CG 4.39Å; V29-L78 HydrophobicContact CG1-CD2 4.34Å; V29-L78 HydrophobicContact CG2-CD2 3.92Å; V29-L78 HydrophobicContact CG2-CG 3.98Å |
| 30 | L | 98.3 | Very high | 97.4 | Very high | 108 Ų | 108 | 46.8 Ų | 46.8 | 57% | 0.565 | 26% | 0.256 | S | S | * | . | H | α-helix | trans | -62.9 | -46 | 178.1 | -69 | 174.5 | 0 | 0 | 0 | 111.7 | W26 L27 G33 L34 | W26-L30 WeakPolarHBondContact O-CG 3.32Å; W26-L30 PolarHBondContact O-N 3.41Å; L27-L30 PolarHBondContact O-N 3.32Å; L30-G33 PolarHBondContact O-N 2.88Å; L30-L34 WeakPolarHBondContact O-CG 3.33Å; L30-L34 PolarHBondContact O-N 2.85Å |
| 31 | A | 97.9 | Very high | 97.5 | Very high | 10 Ų | 10 | 49.6 Ų | 49.6 | 8% | 0.083 | 26% | 0.261 | C | S | . | . | H | α-helix | trans | -61.8 | -45.1 | 177.6 | 0 | 0 | 0 | 0 | 0 | 112 | L27 L28 G33 L34 I35 L278 | L27-A31 WeakPolarHBondContact O-CB 3.43Å; L27-A31 PolarHBondContact O-N 3.48Å; L28-A31 PolarHBondContact O-N 3.15Å; A31-G33 PolarHBondContact O-N 2.98Å; A31-L34 PolarHBondContact O-N 2.96Å; A31-I35 WeakPolarHBondContact O-CG1 3.33Å; A31-I35 PolarHBondContact O-N 3.39Å; A31-L278 HydrophobicContact CB-CD1 4.2Å |
| 32 | G | 98 | Very high | 97.5 | Very high | 0 Ų | 0 | 49.6 Ų | 49.6 | 0% | 0 | 26% | 0.26 | C | S | . | . | H | α-helix | trans | -60.8 | -41.3 | 174.8 | 0 | 0 | 0 | 0 | 0 | 112.8 | L28 V29 I35 L36 | L28-G32 PolarHBondContact O-N 2.9Å; V29-G32 PolarHBondContact O-N 3.22Å; G32-I35 PolarHBondContact O-N 2.83Å; G32-L36 WeakPolarHBondContact O-CG 3.41Å; G32-L36 PolarHBondContact O-N 2.94Å |
| 33 | G | 98.3 | Very high | 97.6 | Very high | 20 Ų | 20 | 46.6 Ų | 46.6 | 21% | 0.206 | 25% | 0.252 | C | S | . | . | H | α-helix | trans | -63.4 | -42.9 | 174.8 | 0 | 0 | 0 | 0 | 0 | 113.3 | V29 L30 A31 L36 L37 | V29-G33 PolarHBondContact O-N 3.26Å; L30-G33 PolarHBondContact O-N 2.88Å; A31-G33 PolarHBondContact O-N 2.98Å; G33-L36 PolarHBondContact O-N 3.39Å; G33-L37 WeakPolarHBondContact O-CG 3.48Å; G33-L37 PolarHBondContact O-N 3.37Å; G33-L37 VanDerWaalsContact O-N 3.12Å |
| 34 | L | 98.1 | Very high | 97.5 | Very high | 86 Ų | 86 | 45 Ų | 45 | 45% | 0.45 | 25% | 0.246 | S | C | . | . | H | α-helix | trans | -64.1 | -40.4 | 175.6 | -71.7 | 172.5 | 0 | 0 | 0 | 111.9 | L30 A31 L36 L37 C38 M271 | L30-L34 WeakPolarHBondContact O-CG 3.33Å; L30-L34 PolarHBondContact O-N 2.85Å; A31-L34 PolarHBondContact O-N 2.96Å; L34-L36 PolarHBondContact O-N 3.43Å; L34-L37 PolarHBondContact O-N 2.86Å; L34-C38 WeakPolarHBondContact O-CB 3.5Å; L34-C38 PolarHBondContact O-N 2.89Å; L34-C38 PolarHBondContact O-SG 2.84Å; L34-C38 VanDerWaalsContact O-SG 3.36Å; L34-M271 HydrophobicContact CB-CE 3.72Å; L34-M271 HydrophobicContact CD1-CE 3.72Å; L34-M271 HydrophobicContact CG-CE 4.39Å |
| 35 | I | 98.3 | Very high | 97.3 | Very high | 0 Ų | 0 | 43.7 Ų | 43.7 | 0% | 0 | 24% | 0.238 | C | C | . | . | H | α-helix | trans | -58.8 | -47.8 | 173.9 | -72.6 | 164.8 | 0 | 0 | 0 | 110.5 | A31 G32 L37 C38 S39 A66 L268 M271 L272 T275 | A31-I35 WeakPolarHBondContact O-CG1 3.33Å; A31-I35 PolarHBondContact O-N 3.39Å; G32-I35 PolarHBondContact O-N 2.83Å; I35-L37 VanDerWaalsContact C-N 3.29Å; I35-L37 PolarHBondContact O-N 3.47Å; I35-C38 PolarHBondContact O-N 3.5Å; I35-S39 VanDerWaalsContact O-CB 3.25Å; I35-S39 WeakPolarHBondContact O-CB 3.41Å; I35-S39 PolarHBondContact O-N 2.8Å; I35-S39 PolarHBondContact O-OG 3.4Å; I35-A66 HydrophobicContact CG2-CB 4.37Å; I35-A66 VanDerWaalsContact CG2-O 3.26Å; I35-A66 WeakPolarHBondContact CG2-O 3.41Å; I35-L268 HydrophobicContact CG2-CD1 4.24Å; I35-M271 HydrophobicContact CG1-CB 4.06Å; I35-L272 HydrophobicContact CD1-CD2 3.94Å; I35-L272 HydrophobicContact CG2-CD2 4.35Å; I35-T275 HydrophobicContact CD1-CG2 3.94Å; I35-T275 WeakPolarHBondContact CD1-OG1 3.42Å |
| 36 | L | 98.3 | Very high | 97.2 | Very high | 51 Ų | 51 | 44.3 Ų | 44.3 | 27% | 0.267 | 24% | 0.241 | S | C | . | . | H | α-helix | trans | -56.9 | -43.1 | 178.4 | -71.2 | 172.9 | 0 | 0 | 0 | 112.3 | G32 G33 L34 G40 L67 A71 L74 | G32-L36 WeakPolarHBondContact O-CG 3.41Å; G32-L36 PolarHBondContact O-N 2.94Å; G33-L36 PolarHBondContact O-N 3.39Å; L34-L36 PolarHBondContact O-N 3.43Å; L36-G40 PolarHBondContact O-N 3.33Å; L36-L67 HydrophobicContact CD2-CD2 4.31Å; L36-L67 HydrophobicContact CD2-CG 3.94Å; L36-L67 WeakPolarHBondContact CD2-O 3.32Å; L36-A71 HydrophobicContact CD2-CB 4.22Å; L36-L74 HydrophobicContact CD1-CD1 4.19Å |
| 37 | L | 97.9 | Very high | 96.9 | Very high | 125 Ų | 125 | 48.6 Ų | 48.6 | 65% | 0.654 | 26% | 0.258 | S | S | * | . | H | α-helix | trans | -65.7 | -49.3 | 177.8 | -68.5 | 172.3 | 0 | 0 | 0 | 111.8 | G33 L34 I35 G40 H41 | G33-L37 WeakPolarHBondContact O-CG 3.48Å; G33-L37 PolarHBondContact O-N 3.37Å; G33-L37 VanDerWaalsContact O-N 3.12Å; L34-L37 PolarHBondContact O-N 2.86Å; I35-L37 VanDerWaalsContact C-N 3.29Å; I35-L37 PolarHBondContact O-N 3.47Å; L37-G40 PolarHBondContact O-N 3.1Å; L37-H41 WeakPolarHBondContact O-CB 3.21Å; L37-H41 PolarHBondContact O-N 3.48Å |
| 38 | C | 97.4 | Very high | 96.5 | Very high | 58 Ų | 58 | 49.6 Ų | 49.6 | 39% | 0.392 | 26% | 0.259 | S | S | . | . | H | α-helix | trans | -64.1 | -42.7 | 179.4 | -69.2 | 0 | 0 | 0 | 0 | 112 | L34 I35 H41 L42 L268 | L34-C38 WeakPolarHBondContact O-CB 3.5Å; L34-C38 PolarHBondContact O-N 2.89Å; L34-C38 PolarHBondContact O-SG 2.84Å; L34-C38 VanDerWaalsContact O-SG 3.36Å; I35-C38 PolarHBondContact O-N 3.5Å; C38-H41 PolarHBondContact O-N 3.3Å; C38-L42 WeakPolarHBondContact O-CB 3.19Å; C38-L42 PolarHBondContact O-N 3.15Å; C38-L268 HydrophobicContact CB-CD1 4.32Å |
| 39 | S | 97.6 | Very high | 96.2 | Very high | 0 Ų | 0 | 49.8 Ų | 49.8 | 0% | 0 | 26% | 0.261 | C | S | . | . | H | α-helix | trans | -63.3 | -42 | 175.4 | -62.7 | 0 | 0 | 0 | 0 | 111.8 | I35 L42 L43 A66 | I35-S39 VanDerWaalsContact O-CB 3.25Å; I35-S39 WeakPolarHBondContact O-CB 3.41Å; I35-S39 PolarHBondContact O-N 2.8Å; I35-S39 PolarHBondContact O-OG 3.4Å; S39-L42 PolarHBondContact O-N 3.19Å; S39-L43 WeakPolarHBondContact O-CB 3.43Å; S39-L43 WeakPolarHBondContact O-CG 3.47Å; S39-L43 PolarHBondContact O-N 2.69Å; S39-A66 VanDerWaalsContact OG-CB 3.29Å; S39-A66 WeakPolarHBondContact OG-CB 3.43Å |
| 40 | G | 97.3 | Very high | 95.8 | Very high | 26 Ų | 26 | 50.6 Ų | 50.6 | 27% | 0.268 | 27% | 0.273 | S | S | . | . | H | α-helix | trans | -61.9 | -45.1 | 173.8 | 0 | 0 | 0 | 0 | 0 | 112.4 | L36 L37 L43 V44 | L36-G40 PolarHBondContact O-N 3.33Å; L37-G40 PolarHBondContact O-N 3.1Å; G40-L43 PolarHBondContact O-N 3.27Å; G40-V44 WeakPolarHBondContact O-CG2 3.4Å; G40-V44 PolarHBondContact O-N 3.02Å |
| 41 | H | 96.1 | Very high | 95.4 | Very high | 89 Ų | 89 | 49.1 Ų | 49.1 | 41% | 0.412 | 27% | 0.268 | S | S | . | . | H | α-helix | trans | -59.9 | -47.6 | 175.3 | 176 | -100.7 | 0 | 0 | 0 | 111.7 | L37 C38 L43 V44 Q45 | L37-H41 WeakPolarHBondContact O-CB 3.21Å; L37-H41 PolarHBondContact O-N 3.48Å; C38-H41 PolarHBondContact O-N 3.3Å; H41-L43 VanDerWaalsContact C-N 3.34Å; H41-L43 PolarHBondContact O-N 3.19Å; H41-V44 PolarHBondContact O-N 3.42Å; H41-V44 VanDerWaalsContact O-N 3.14Å; H41-Q45 PolarHBondContact NE2-NE2 3.01Å; H41-Q45 VanDerWaalsContact NE2-NE2 3.19Å; H41-Q45 WeakPolarHBondContact O-CG 3.48Å; H41-Q45 PolarHBondContact O-N 2.96Å |
| 42 | L | 95.9 | Very high | 95.3 | Very high | 3 Ų | 3 | 49.1 Ų | 49.1 | 2% | 0.016 | 27% | 0.266 | C | S | . | . | H | α-helix | trans | -63 | -39.2 | 178.4 | -176.1 | 55 | 0 | 0 | 0 | 112 | C38 S39 V44 Q45 L46 F59 P63 L261 L264 L268 | C38-L42 WeakPolarHBondContact O-CB 3.19Å; C38-L42 PolarHBondContact O-N 3.15Å; S39-L42 PolarHBondContact O-N 3.19Å; L42-V44 VanDerWaalsContact C-N 3.32Å; L42-V44 PolarHBondContact O-N 3.33Å; L42-Q45 PolarHBondContact O-N 2.84Å; L42-L46 HydrophobicContact CD1-CD1 4.43Å; L42-L46 HydrophobicContact CD1-CG 4.27Å; L42-L46 HydrophobicContact CG-CD1 4.2Å; L42-L46 HydrophobicContact CG-CG 4.49Å; L42-L46 WeakPolarHBondContact O-CB 3.43Å; L42-L46 VanDerWaalsContact O-CG 3.31Å; L42-L46 WeakPolarHBondContact O-CG 3.43Å; L42-L46 PolarHBondContact O-N 3.48Å; L42-F59 HydrophobicContact CD1-CE1 4.38Å; L42-F59 HydrophobicContact CD2-CE1 4.48Å; L42-P63 HydrophobicContact CB-CB 4.18Å; L42-P63 HydrophobicContact CD2-CB 4.01Å; L42-P63 HydrophobicContact CD2-CG 4.11Å; L42-P63 HydrophobicContact CG-CB 4.13Å; L42-P63 HydrophobicContact CG-CG 4.11Å; L42-L261 HydrophobicContact CD1-CD2 4.16Å; L42-L264 HydrophobicContact CD1-CB 3.98Å; L42-L264 HydrophobicContact CD1-CD1 3.92Å; L42-L268 HydrophobicContact CD2-CD2 4.23Å |
| 43 | L | 96.4 | Very high | 95.1 | Very high | 34 Ų | 34 | 49.9 Ų | 49.9 | 18% | 0.178 | 27% | 0.27 | C | S | . | . | H | α-helix | trans | -61 | -40.4 | 173.3 | -78.9 | 167.1 | 0 | 0 | 0 | 112.5 | S39 G40 H41 L46 R47 P63 Q64 L67 | S39-L43 WeakPolarHBondContact O-CB 3.43Å; S39-L43 WeakPolarHBondContact O-CG 3.47Å; S39-L43 PolarHBondContact O-N 2.69Å; G40-L43 PolarHBondContact O-N 3.27Å; H41-L43 VanDerWaalsContact C-N 3.34Å; H41-L43 PolarHBondContact O-N 3.19Å; L43-L46 PolarHBondContact O-N 2.89Å; L43-R47 WeakPolarHBondContact O-CG 3.36Å; L43-R47 PolarHBondContact O-N 3.01Å; L43-P63 HydrophobicContact CD2-CB 4.33Å; L43-P63 HydrophobicContact CD2-CG 3.94Å; L43-P63 HydrophobicContact CG-CB 3.99Å; L43-P63 HydrophobicContact CG-CG 4.11Å; L43-Q64 HydrophobicContact CD2-CG 3.93Å; L43-L67 HydrophobicContact CD1-CD1 3.99Å |
| 44 | V | 95.2 | Very high | 94.9 | Very high | 68 Ų | 68 | 49.1 Ų | 49.1 | 41% | 0.412 | 26% | 0.262 | S | S | . | . | H | α-helix | trans | -65.3 | -44.2 | 176.4 | 172.1 | 0 | 0 | 0 | 0 | 110.6 | G40 H41 L42 L46 R47 H48 | G40-V44 WeakPolarHBondContact O-CG2 3.4Å; G40-V44 PolarHBondContact O-N 3.02Å; H41-V44 PolarHBondContact O-N 3.42Å; H41-V44 VanDerWaalsContact O-N 3.14Å; L42-V44 VanDerWaalsContact C-N 3.32Å; L42-V44 PolarHBondContact O-N 3.33Å; V44-L46 VanDerWaalsContact C-N 3.34Å; V44-L46 PolarHBondContact O-N 3.45Å; V44-R47 WeakPolarHBondContact O-CB 3.39Å; V44-R47 PolarHBondContact O-N 3.33Å; V44-H48 PolarHBondContact O-CD2 2.82Å; V44-H48 VanDerWaalsContact O-CD2 3.25Å; V44-H48 PolarHBondContact O-N 2.63Å |
| 45 | Q | 93.3 | Very high | 94.5 | Very high | 24 Ų | 24 | 51.4 Ų | 51.4 | 11% | 0.112 | 28% | 0.282 | C | S | . | . | H | α-helix | trans | -59 | -45.8 | 175.2 | -67 | -67.6 | -6.9 | 0 | 0 | 111.4 | H41 L42 R47 H48 L49 Y166 | H41-Q45 PolarHBondContact NE2-NE2 3.01Å; H41-Q45 VanDerWaalsContact NE2-NE2 3.19Å; H41-Q45 WeakPolarHBondContact O-CG 3.48Å; H41-Q45 PolarHBondContact O-N 2.96Å; L42-Q45 PolarHBondContact O-N 2.84Å; Q45-R47 VanDerWaalsContact C-N 3.27Å; Q45-R47 PolarHBondContact O-N 2.91Å; Q45-H48 PolarHBondContact O-N 3.47Å; Q45-L49 PolarHBondContact O-N 3.22Å; Q45-Y166 PolarHBondContact OE1-OH 3.28Å |
| 46 | L | 93.6 | Very high | 94 | Very high | 13 Ų | 13 | 55.8 Ų | 55.8 | 7% | 0.068 | 31% | 0.313 | C | S | . | . | H | α-helix | trans | -66.7 | -24.1 | 178.4 | -70.8 | 174.7 | 0 | 0 | 0 | 113.8 | L42 L43 V44 H48 G50 L53 F59 P60 P63 L261 | L42-L46 HydrophobicContact CD1-CD1 4.43Å; L42-L46 HydrophobicContact CD1-CG 4.27Å; L42-L46 HydrophobicContact CG-CD1 4.2Å; L42-L46 HydrophobicContact CG-CG 4.49Å; L42-L46 WeakPolarHBondContact O-CB 3.43Å; L42-L46 VanDerWaalsContact O-CG 3.31Å; L42-L46 WeakPolarHBondContact O-CG 3.43Å; L42-L46 PolarHBondContact O-N 3.48Å; L43-L46 PolarHBondContact O-N 2.89Å; V44-L46 VanDerWaalsContact C-N 3.34Å; V44-L46 PolarHBondContact O-N 3.45Å; L46-H48 VanDerWaalsContact C-N 3.3Å; L46-G50 WeakPolarHBondContact O-CA 3.34Å; L46-G50 PolarHBondContact O-N 3.31Å; L46-L53 HydrophobicContact CD2-CD1 4.02Å; L46-F59 HydrophobicContact CD1-CD1 3.74Å; L46-F59 HydrophobicContact CD1-CE1 3.96Å; L46-F59 HydrophobicContact CD2-CD1 3.65Å; L46-F59 HydrophobicContact CD2-CE1 3.84Å; L46-F59 HydrophobicContact CG-CD1 4.3Å; L46-F59 HydrophobicContact CG-CE1 4.36Å; L46-P60 HydrophobicContact CD1-CB 4.45Å; L46-P60 HydrophobicContact CD1-CG 4.49Å; L46-P63 HydrophobicContact CD1-CG 3.85Å; L46-L261 HydrophobicContact CD2-CD2 4.11Å |
| 47 | R | 92.4 | Very high | 93.7 | Very high | 199 Ų | 199 | 54.3 Ų | 54.3 | 75% | 0.751 | 31% | 0.307 | S | S | * | . | H | α-helix | trans | -66.7 | -34.6 | 171 | -75.5 | 173.7 | -176 | -179.8 | 1.8 | 112.2 | L43 V44 Q45 | L43-R47 WeakPolarHBondContact O-CG 3.36Å; L43-R47 PolarHBondContact O-N 3.01Å; V44-R47 WeakPolarHBondContact O-CB 3.39Å; V44-R47 PolarHBondContact O-N 3.33Å; Q45-R47 VanDerWaalsContact C-N 3.27Å; Q45-R47 PolarHBondContact O-N 2.91Å |
| 48 | H | 89.6 | Confident | 93.4 | Very high | 109 Ų | 109 | 54.9 Ų | 54.9 | 51% | 0.505 | 31% | 0.306 | S | S | . | . | H | α-helix | trans | -82.9 | -42.2 | 178.4 | -68.8 | -66.9 | 0 | 0 | 0 | 112 | V44 Q45 L46 | V44-H48 PolarHBondContact O-CD2 2.82Å; V44-H48 VanDerWaalsContact O-CD2 3.25Å; V44-H48 PolarHBondContact O-N 2.63Å; Q45-H48 PolarHBondContact O-N 3.47Å; L46-H48 VanDerWaalsContact C-N 3.3Å |
| 49 | L | 92.8 | Very high | 93.2 | Very high | 5 Ų | 5 | 52.1 Ų | 52.1 | 3% | 0.026 | 29% | 0.287 | C | S | . | . | H | α-helix | trans | -84.6 | -14.9 | -177.9 | -66 | 174.7 | 0 | 0 | 0 | 113.6 | Q45 T51 F52 L162 Y166 L257 L261 | Q45-L49 PolarHBondContact O-N 3.22Å; L49-T51 PolarHBondContact O-N 2.92Å; L49-T51 VanDerWaalsContact O-N 3.09Å; L49-F52 HydrophobicContact CD2-CD2 4.29Å; L49-F52 PolarHBondContact O-N 3.45Å; L49-L162 HydrophobicContact CD2-CD1 3.68Å; L49-Y166 HydrophobicContact CD2-CE2 3.8Å; L49-L257 HydrophobicContact CD1-CD2 3.9Å; L49-L257 HydrophobicContact CD2-CD1 4.29Å; L49-L257 HydrophobicContact CD2-CD2 3.58Å; L49-L257 HydrophobicContact CG-CD2 4.38Å; L49-L261 HydrophobicContact CD1-CD1 4.39Å; L49-L261 HydrophobicContact CD1-CD2 4.03Å; L49-L261 HydrophobicContact CD1-CG 4.36Å |
| 50 | G | 89.1 | Confident | 93 | Very high | 35 Ų | 35 | 54.3 Ų | 54.3 | 36% | 0.361 | 30% | 0.301 | S | S | . | . | G | 310 helix | trans | -60.7 | -21.4 | -176 | 0 | 0 | 0 | 0 | 0 | 114.5 | L46 F52 L53 | L46-G50 WeakPolarHBondContact O-CA 3.34Å; L46-G50 PolarHBondContact O-N 3.31Å; G50-F52 PolarHBondContact O-N 3.17Å; G50-L53 PolarHBondContact O-N 3.5Å |
| 51 | T | 90.5 | Very high | 92.9 | Very high | 77 Ų | 77 | 54.7 Ų | 54.7 | 47% | 0.472 | 30% | 0.302 | S | S | . | . | G | 310 helix | trans | -70 | -18 | 173.3 | 54.4 | 0 | 0 | 0 | 0 | 113.4 | L49 L158 | L49-T51 PolarHBondContact O-N 2.92Å; L49-T51 VanDerWaalsContact O-N 3.09Å; T51-L158 HydrophobicContact CG2-CD1 4.16Å |
| 52 | F | 94.9 | Very high | 92.9 | Very high | 9 Ų | 9 | 50.4 Ų | 50.4 | 4% | 0.039 | 28% | 0.282 | C | S | . | . | G | 310 helix | trans | -102.9 | 6.5 | 178.9 | -51.9 | -69.7 | 0 | 0 | 0 | 112.8 | L49 G50 G136 L137 A140 L158 V159 L162 | L49-F52 HydrophobicContact CD2-CD2 4.29Å; L49-F52 PolarHBondContact O-N 3.45Å; G50-F52 PolarHBondContact O-N 3.17Å; F52-G136 CarbonylContact O-C 3.53Å; F52-G136 WeakPolarHBondContact O-CA 3.42Å; F52-L137 HydrophobicContact CB-CD2 4.04Å; F52-L137 HydrophobicContact CB-CG 4.38Å; F52-L137 HydrophobicContact CD1-CD2 3.97Å; F52-L137 HydrophobicContact CG-CD2 4.18Å; F52-A140 HydrophobicContact CD1-CB 3.87Å; F52-A140 HydrophobicContact CE1-CB 4.11Å; F52-L158 HydrophobicContact CE1-CB 4.39Å; F52-L158 HydrophobicContact CZ-CB 3.89Å; F52-L158 WeakPolarHBondContact CZ-O 3.32Å; F52-V159 HydrophobicContact CE1-CG2 4.02Å; F52-L162 HydrophobicContact CD1-CD2 4.14Å; F52-L162 HydrophobicContact CD2-CD1 4.2Å; F52-L162 HydrophobicContact CD2-CD2 4.17Å; F52-L162 HydrophobicContact CE1-CD2 4.01Å; F52-L162 HydrophobicContact CE2-CB 4.01Å; F52-L162 HydrophobicContact CE2-CD1 3.98Å; F52-L162 HydrophobicContact CE2-CD2 4.05Å; F52-L162 HydrophobicContact CE2-CG 4.23Å; F52-L162 HydrophobicContact CG-CD2 4.22Å; F52-L162 HydrophobicContact CZ-CB 3.82Å; F52-L162 HydrophobicContact CZ-CD2 3.95Å; F52-L162 HydrophobicContact CZ-CG 4.32Å |
| 53 | L | 94.9 | Very high | 92.9 | Very high | 16 Ų | 16 | 50.3 Ų | 50.3 | 8% | 0.084 | 28% | 0.282 | C | S | . | . | S | Bend | trans | -104.9 | 144.9 | 174.7 | -69.8 | 168.4 | 0 | 0 | 0 | 109.6 | L46 G50 C57 L129 A132 L133 | L46-L53 HydrophobicContact CD2-CD1 4.02Å; G50-L53 PolarHBondContact O-N 3.5Å; L53-C57 HydrophobicContact CB-CB 4.33Å; L53-L129 HydrophobicContact CD2-CD1 3.53Å; L53-A132 HydrophobicContact CD2-CB 3.99Å; L53-L133 HydrophobicContact CD2-CD2 3.75Å; L53-L133 HydrophobicContact CD2-CG 3.8Å; L53-L133 HydrophobicContact CG-CD2 4.46Å |
| 54 | A | 93.8 | Very high | 93 | Very high | 5 Ų | 5 | 54 Ų | 54 | 4% | 0.041 | 30% | 0.298 | C | S | . | . | trans | -56.2 | 142.4 | 171.5 | 0 | 0 | 0 | 0 | 0 | 111.4 | S56 C57 A132 E135 | A54-S56 PolarHBondContact O-N 3.28Å; A54-S56 VanDerWaalsContact O-N 3.12Å; A54-C57 WeakPolarHBondContact O-CB 3.45Å; A54-C57 PolarHBondContact O-N 3.42Å; A54-A132 HydrophobicContact CB-CB 4.08Å; A54-A132 PolarHBondContact N-O 3.5Å; A54-E135 HydrophobicContact CB-CB 4.26Å; A54-E135 HydrophobicContact CB-CG 4.42Å; A54-E135 WeakPolarHBondContact CB-OE2 3.46Å | ||
| 55 | P | 89 | Confident | 93.1 | Very high | 133 Ų | 133 | 51.9 Ų | 51.9 | 86% | 0.864 | 29% | 0.287 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -59.6 | -24.5 | 179 | -24.5 | 33.5 | 0 | 0 | 0 | 114.5 | C57 | P55-C57 VanDerWaalsContact C-N 3.26Å; P55-C57 PolarHBondContact O-N 3.1Å |
| 56 | S | 88.4 | Confident | 93.3 | Very high | 92 Ų | 92 | 50.7 Ų | 50.7 | 64% | 0.643 | 28% | 0.282 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -76.9 | -8.5 | 176.6 | 53.4 | 0 | 0 | 0 | 0 | 113.5 | A54 Q58 | A54-S56 PolarHBondContact O-N 3.28Å; A54-S56 VanDerWaalsContact O-N 3.12Å; S56-Q58 PolarHBondContact O-N 3.14Å |
| 57 | C | 91.4 | Very high | 93.5 | Very high | 21 Ų | 21 | 53.3 Ų | 53.3 | 14% | 0.142 | 30% | 0.296 | C | S | . | . | trans | -67.3 | 119.8 | -174.9 | -171 | 0 | 0 | 0 | 0 | 111.8 | L53 A54 P55 F59 A132 | L53-C57 HydrophobicContact CB-CB 4.33Å; A54-C57 WeakPolarHBondContact O-CB 3.45Å; A54-C57 PolarHBondContact O-N 3.42Å; P55-C57 VanDerWaalsContact C-N 3.26Å; P55-C57 PolarHBondContact O-N 3.1Å; C57-F59 VanDerWaalsContact C-N 3.35Å; C57-F59 VanDerWaalsContact SG-CB 3.52Å; C57-A132 HydrophobicContact CB-CB 3.76Å | ||
| 58 | Q | 92.4 | Very high | 93.8 | Very high | 137 Ų | 137 | 47.5 Ų | 47.5 | 64% | 0.64 | 28% | 0.282 | S | S | * | . | trans | -91 | 3.3 | 179.5 | -62.1 | -174.9 | 6.1 | 0 | 0 | 113.5 | S56 P60 A61 L125 | S56-Q58 PolarHBondContact O-N 3.14Å; Q58-P60 VanDerWaalsContact C-N 3.29Å; Q58-A61 WeakPolarHBondContact O-CB 3.42Å; Q58-A61 PolarHBondContact O-N 2.84Å; Q58-L125 HydrophobicContact CB-CD2 3.87Å | ||
| 59 | F | 93.3 | Very high | 94.2 | Very high | 0 Ų | 0 | 42.4 Ų | 42.4 | 0% | 0 | 26% | 0.258 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -51.8 | -36.8 | -179.7 | -169.4 | -96.5 | 0 | 0 | 0 | 114.5 | L42 L46 C57 A61 L62 P63 L125 L129 L261 A265 | L42-F59 HydrophobicContact CD1-CE1 4.38Å; L42-F59 HydrophobicContact CD2-CE1 4.48Å; L46-F59 HydrophobicContact CD1-CD1 3.74Å; L46-F59 HydrophobicContact CD1-CE1 3.96Å; L46-F59 HydrophobicContact CD2-CD1 3.65Å; L46-F59 HydrophobicContact CD2-CE1 3.84Å; L46-F59 HydrophobicContact CG-CD1 4.3Å; L46-F59 HydrophobicContact CG-CE1 4.36Å; C57-F59 VanDerWaalsContact C-N 3.35Å; C57-F59 VanDerWaalsContact SG-CB 3.52Å; F59-A61 PolarHBondContact O-N 2.92Å; F59-A61 VanDerWaalsContact O-N 3.09Å; F59-L62 PolarHBondContact O-N 3.14Å; F59-L62 VanDerWaalsContact O-N 3.14Å; F59-P63 WeakPolarHBondContact O-CD 3.31Å; F59-L125 HydrophobicContact CD2-CB 4.25Å; F59-L129 HydrophobicContact CB-CD1 4.48Å; F59-L129 HydrophobicContact CD1-CD1 4.5Å; F59-L129 HydrophobicContact CD2-CD1 4.26Å; F59-L129 HydrophobicContact CE2-CD2 4.31Å; F59-L129 HydrophobicContact CG-CD1 4.18Å; F59-L261 HydrophobicContact CE1-CD2 4.47Å; F59-L261 HydrophobicContact CZ-CB 4.36Å; F59-A265 HydrophobicContact CE2-CB 4.06Å; F59-A265 HydrophobicContact CZ-CB 3.96Å |
| 60 | P | 93.3 | Very high | 94.4 | Very high | 45 Ų | 45 | 42.1 Ų | 42.1 | 29% | 0.292 | 26% | 0.257 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -60 | -19.8 | 175.6 | -25.3 | 35.9 | 0 | 0 | 0 | 115.2 | L46 Q58 L62 P63 Q64 | L46-P60 HydrophobicContact CD1-CB 4.45Å; L46-P60 HydrophobicContact CD1-CG 4.49Å; Q58-P60 VanDerWaalsContact C-N 3.29Å; P60-L62 VanDerWaalsContact C-N 3.26Å; P60-L62 PolarHBondContact O-N 3.29Å; P60-P63 WeakPolarHBondContact O-CD 3.4Å; P60-Q64 VanDerWaalsContact O-CG 3.24Å; P60-Q64 WeakPolarHBondContact O-CG 3.46Å; P60-Q64 PolarHBondContact O-N 3.48Å |
| 61 | A | 94.8 | Very high | 94.8 | Very high | 34 Ų | 34 | 42.8 Ų | 42.8 | 28% | 0.281 | 26% | 0.259 | S | S | . | . | H | α-helix | trans | -64.8 | -30.5 | 177 | 0 | 0 | 0 | 0 | 0 | 112.4 | Q58 F59 A65 L125 | Q58-A61 WeakPolarHBondContact O-CB 3.42Å; Q58-A61 PolarHBondContact O-N 2.84Å; F59-A61 PolarHBondContact O-N 2.92Å; F59-A61 VanDerWaalsContact O-N 3.09Å; A61-A65 VanDerWaalsContact O-CB 3.3Å; A61-A65 WeakPolarHBondContact O-CB 3.48Å; A61-A65 PolarHBondContact O-N 3.46Å; A61-L125 HydrophobicContact CB-CD1 4.39Å |
| 62 | L | 96.1 | Very high | 95.1 | Very high | 0 Ų | 0 | 41.6 Ų | 41.6 | 0% | 0 | 25% | 0.251 | C | S | . | . | H | α-helix | trans | -59.7 | -62.6 | 179.4 | 170.7 | 60 | 0 | 0 | 0 | 112.3 | F59 P60 Q64 A65 A66 L121 A122 L125 A265 L268 | F59-L62 PolarHBondContact O-N 3.14Å; F59-L62 VanDerWaalsContact O-N 3.14Å; P60-L62 VanDerWaalsContact C-N 3.26Å; P60-L62 PolarHBondContact O-N 3.29Å; L62-Q64 VanDerWaalsContact C-N 3.26Å; L62-Q64 PolarHBondContact O-N 2.93Å; L62-A65 PolarHBondContact O-N 3.29Å; L62-A66 WeakPolarHBondContact O-CB 3.33Å; L62-A66 PolarHBondContact O-N 3.46Å; L62-L121 HydrophobicContact CD1-CB 4.21Å; L62-A122 HydrophobicContact CD1-CB 3.71Å; L62-A122 HydrophobicContact CD2-CB 4.38Å; L62-L125 HydrophobicContact CB-CD1 3.9Å; L62-A265 HydrophobicContact CD2-CB 3.87Å; L62-L268 HydrophobicContact CD1-CD2 4.5Å; L62-L268 HydrophobicContact CG-CD2 4.19Å |
| 63 | P | 96.7 | Very high | 95.2 | Very high | 0 Ų | 0 | 41.1 Ų | 41.1 | 0% | 0 | 25% | 0.25 | C | C | . | . | H | α-helix | trans | -68.1 | -25.7 | -178.3 | 27.5 | -36.3 | 0 | 0 | 0 | 112.9 | L42 L43 L46 F59 P60 L67 | L42-P63 HydrophobicContact CB-CB 4.18Å; L42-P63 HydrophobicContact CD2-CB 4.01Å; L42-P63 HydrophobicContact CD2-CG 4.11Å; L42-P63 HydrophobicContact CG-CB 4.13Å; L42-P63 HydrophobicContact CG-CG 4.11Å; L43-P63 HydrophobicContact CD2-CB 4.33Å; L43-P63 HydrophobicContact CD2-CG 3.94Å; L43-P63 HydrophobicContact CG-CB 3.99Å; L43-P63 HydrophobicContact CG-CG 4.11Å; L46-P63 HydrophobicContact CD1-CG 3.85Å; F59-P63 WeakPolarHBondContact O-CD 3.31Å; P60-P63 WeakPolarHBondContact O-CD 3.4Å; P63-L67 WeakPolarHBondContact O-CB 3.4Å; P63-L67 PolarHBondContact O-N 2.98Å |
| 64 | Q | 96.8 | Very high | 95.4 | Very high | 113 Ų | 113 | 42.7 Ų | 42.7 | 53% | 0.528 | 26% | 0.258 | S | S | . | . | H | α-helix | trans | -63.7 | -49.9 | 172.1 | -72.7 | 177.1 | -24.7 | 0 | 0 | 111.5 | L43 P60 L62 L67 V68 | L43-Q64 HydrophobicContact CD2-CG 3.93Å; P60-Q64 VanDerWaalsContact O-CG 3.24Å; P60-Q64 WeakPolarHBondContact O-CG 3.46Å; P60-Q64 PolarHBondContact O-N 3.48Å; L62-Q64 VanDerWaalsContact C-N 3.26Å; L62-Q64 PolarHBondContact O-N 2.93Å; Q64-L67 WeakPolarHBondContact O-CB 3.25Å; Q64-L67 PolarHBondContact O-N 3.3Å; Q64-V68 PolarHBondContact O-N 3.28Å |
| 65 | A | 97.4 | Very high | 95.5 | Very high | 22 Ų | 22 | 43.9 Ų | 43.9 | 18% | 0.182 | 27% | 0.27 | C | S | . | . | H | α-helix | trans | -68.4 | -38.3 | 179.6 | 0 | 0 | 0 | 0 | 0 | 111.2 | A61 L62 L67 V68 A69 T118 L121 | A61-A65 VanDerWaalsContact O-CB 3.3Å; A61-A65 WeakPolarHBondContact O-CB 3.48Å; A61-A65 PolarHBondContact O-N 3.46Å; L62-A65 PolarHBondContact O-N 3.29Å; A65-L67 VanDerWaalsContact C-N 3.3Å; A65-L67 PolarHBondContact O-N 3.42Å; A65-V68 PolarHBondContact O-N 3.12Å; A65-A69 PolarHBondContact O-N 2.86Å; A65-T118 VanDerWaalsContact C-CG2 3.49Å; A65-T118 HydrophobicContact CB-CG2 3.56Å; A65-T118 WeakPolarHBondContact O-CG2 3.43Å; A65-L121 HydrophobicContact CB-CD1 4.04Å |
| 66 | A | 97.9 | Very high | 95.8 | Very high | 0 Ų | 0 | 38.1 Ų | 38.1 | 0% | 0 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -62.7 | -33.7 | 174.6 | 0 | 0 | 0 | 0 | 0 | 112.8 | I35 S39 L62 A69 G70 L268 L272 | I35-A66 HydrophobicContact CG2-CB 4.37Å; I35-A66 VanDerWaalsContact CG2-O 3.26Å; I35-A66 WeakPolarHBondContact CG2-O 3.41Å; S39-A66 VanDerWaalsContact OG-CB 3.29Å; S39-A66 WeakPolarHBondContact OG-CB 3.43Å; L62-A66 WeakPolarHBondContact O-CB 3.33Å; L62-A66 PolarHBondContact O-N 3.46Å; A66-A69 PolarHBondContact O-N 2.86Å; A66-G70 PolarHBondContact O-N 3.5Å; A66-L268 HydrophobicContact CB-CD1 4.21Å; A66-L268 HydrophobicContact CB-CD2 3.88Å; A66-L268 HydrophobicContact CB-CG 4.31Å; A66-L272 HydrophobicContact CB-CD1 4.24Å; A66-L272 HydrophobicContact CB-CD2 4.36Å |
| 67 | L | 98.1 | Very high | 96.2 | Very high | 68 Ų | 68 | 33.8 Ų | 33.8 | 36% | 0.356 | 20% | 0.202 | S | C | . | . | H | α-helix | trans | -63.1 | -44.1 | 174.1 | -168.6 | 151 | 0 | 0 | 0 | 111.2 | L36 L43 P63 Q64 A65 A71 | L36-L67 HydrophobicContact CD2-CD2 4.31Å; L36-L67 HydrophobicContact CD2-CG 3.94Å; L36-L67 WeakPolarHBondContact CD2-O 3.32Å; L43-L67 HydrophobicContact CD1-CD1 3.99Å; P63-L67 WeakPolarHBondContact O-CB 3.4Å; P63-L67 PolarHBondContact O-N 2.98Å; Q64-L67 WeakPolarHBondContact O-CB 3.25Å; Q64-L67 PolarHBondContact O-N 3.3Å; A65-L67 VanDerWaalsContact C-N 3.3Å; A65-L67 PolarHBondContact O-N 3.42Å; L67-A71 PolarHBondContact O-N 3Å |
| 68 | V | 98.1 | Very high | 96.4 | Very high | 77 Ų | 77 | 36.9 Ų | 36.9 | 47% | 0.467 | 22% | 0.217 | S | C | . | . | H | α-helix | trans | -64.9 | -44.7 | 174.9 | -174.4 | 0 | 0 | 0 | 0 | 110.5 | Q64 A65 G70 A71 V72 L114 | Q64-V68 PolarHBondContact O-N 3.28Å; A65-V68 PolarHBondContact O-N 3.12Å; V68-G70 PolarHBondContact O-N 3.42Å; V68-A71 PolarHBondContact O-N 2.96Å; V68-V72 WeakPolarHBondContact O-CG2 3.34Å; V68-V72 PolarHBondContact O-N 2.94Å; V68-L114 HydrophobicContact CB-CD2 4.16Å; V68-L114 HydrophobicContact CG1-CD2 3.69Å |
| 69 | A | 97.7 | Very high | 96.5 | Very high | 1 Ų | 1 | 32.7 Ų | 32.7 | 1% | 0.008 | 20% | 0.201 | C | C | . | . | H | α-helix | trans | -61.4 | -43.1 | 178.7 | 0 | 0 | 0 | 0 | 0 | 112.3 | A65 A66 V72 A73 L114 L115 T118 L272 | A65-A69 PolarHBondContact O-N 2.86Å; A66-A69 PolarHBondContact O-N 2.86Å; A69-V72 PolarHBondContact O-N 3.3Å; A69-A73 WeakPolarHBondContact O-CB 3.32Å; A69-A73 PolarHBondContact O-N 2.89Å; A69-L114 HydrophobicContact CB-CD2 4.1Å; A69-L114 HydrophobicContact CB-CG 4.03Å; A69-L115 HydrophobicContact CB-CD2 3.93Å; A69-L115 HydrophobicContact CB-CG 4.47Å; A69-T118 HydrophobicContact CB-CG2 3.95Å; A69-L272 HydrophobicContact CB-CD2 4.38Å |
| 70 | G | 97.8 | Very high | 96.5 | Very high | 0 Ų | 0 | 32.7 Ų | 32.7 | 0% | 0 | 20% | 0.201 | C | C | . | . | H | α-helix | trans | -62.3 | -41.6 | 175.7 | 0 | 0 | 0 | 0 | 0 | 112.5 | A66 V68 A73 L74 | A66-G70 PolarHBondContact O-N 3.5Å; V68-G70 PolarHBondContact O-N 3.42Å; G70-A73 PolarHBondContact O-N 3.44Å; G70-L74 VanDerWaalsContact O-CB 3.29Å; G70-L74 WeakPolarHBondContact O-CB 3.46Å; G70-L74 PolarHBondContact O-N 2.89Å |
| 71 | A | 98.2 | Very high | 96.6 | Very high | 48 Ų | 48 | 31.5 Ų | 31.5 | 40% | 0.397 | 19% | 0.192 | S | C | . | . | H | α-helix | trans | -63.8 | -43.2 | 175.4 | 0 | 0 | 0 | 0 | 0 | 112.1 | L36 L67 V68 L74 G75 | L36-A71 HydrophobicContact CD2-CB 4.22Å; L67-A71 PolarHBondContact O-N 3Å; V68-A71 PolarHBondContact O-N 2.96Å; A71-L74 PolarHBondContact O-N 3.33Å; A71-G75 PolarHBondContact O-N 3.49Å |
| 72 | V | 96.9 | Very high | 96.5 | Very high | 52 Ų | 52 | 31 Ų | 31 | 32% | 0.315 | 19% | 0.19 | S | C | . | . | H | α-helix | trans | -65.6 | -43 | 176.9 | 172.8 | 0 | 0 | 0 | 0 | 111.4 | V68 A69 G75 T76 L114 | V68-V72 WeakPolarHBondContact O-CG2 3.34Å; V68-V72 PolarHBondContact O-N 2.94Å; A69-V72 PolarHBondContact O-N 3.3Å; V72-G75 PolarHBondContact O-N 3.29Å; V72-T76 WeakPolarHBondContact O-CB 3.39Å; V72-T76 PolarHBondContact O-N 2.96Å; V72-T76 PolarHBondContact O-OG1 3.41Å; V72-L114 HydrophobicContact CG2-CD2 4.26Å |
| 73 | A | 97 | Very high | 96.2 | Very high | 0 Ų | 0 | 31.1 Ų | 31.1 | 0% | 0 | 19% | 0.192 | C | C | . | . | H | α-helix | trans | -62.4 | -44.4 | 176.4 | 0 | 0 | 0 | 0 | 0 | 111.5 | L28 A69 G70 T76 G77 T275 | L28-A73 HydrophobicContact CD1-CB 4.16Å; A69-A73 WeakPolarHBondContact O-CB 3.32Å; A69-A73 PolarHBondContact O-N 2.89Å; G70-A73 PolarHBondContact O-N 3.44Å; A73-T76 PolarHBondContact O-N 3.29Å; A73-G77 PolarHBondContact O-N 3.49Å; A73-T275 HydrophobicContact CB-CG2 3.62Å |
| 74 | L | 97.9 | Very high | 96 | Very high | 48 Ų | 48 | 31.1 Ų | 31.1 | 25% | 0.251 | 19% | 0.192 | S | C | . | . | H | α-helix | trans | -60.2 | -47.5 | 175.8 | -177 | 145.3 | 0 | 0 | 0 | 111.5 | V29 L36 G70 A71 T76 G77 L78 | V29-L74 HydrophobicContact CG1-CG 4.39Å; L36-L74 HydrophobicContact CD1-CD1 4.19Å; G70-L74 VanDerWaalsContact O-CB 3.29Å; G70-L74 WeakPolarHBondContact O-CB 3.46Å; G70-L74 PolarHBondContact O-N 2.89Å; A71-L74 PolarHBondContact O-N 3.33Å; L74-T76 PolarHBondContact O-N 3.37Å; L74-G77 PolarHBondContact O-N 3.14Å; L74-L78 HydrophobicContact CD2-CD1 3.74Å; L74-L78 HydrophobicContact CD2-CG 4.39Å; L74-L78 WeakPolarHBondContact O-CG 3.14Å; L74-L78 PolarHBondContact O-N 2.79Å |
| 75 | G | 96.4 | Very high | 95.7 | Very high | 30 Ų | 30 | 33.9 Ų | 33.9 | 31% | 0.309 | 20% | 0.197 | S | C | . | . | H | α-helix | trans | -60.9 | -44.5 | 175.6 | 0 | 0 | 0 | 0 | 0 | 112.4 | A71 V72 G77 L78 V79 | A71-G75 PolarHBondContact O-N 3.49Å; V72-G75 PolarHBondContact O-N 3.29Å; G75-G77 VanDerWaalsContact C-N 3.32Å; G75-G77 PolarHBondContact O-N 2.83Å; G75-L78 PolarHBondContact O-N 2.93Å; G75-V79 VanDerWaalsContact O-CG2 3.31Å; G75-V79 WeakPolarHBondContact O-CG2 3.27Å; G75-V79 PolarHBondContact O-N 3.37Å |
| 76 | T | 94.8 | Very high | 95.2 | Very high | 13 Ų | 13 | 33 Ų | 33 | 8% | 0.08 | 19% | 0.19 | C | C | . | . | H | α-helix | trans | -59.5 | -42.9 | 176.5 | -57.8 | 0 | 0 | 0 | 0 | 111.2 | L28 V72 A73 L74 G80 M103 Q279 L283 | L28-T76 HydrophobicContact CD2-CG2 4.18Å; V72-T76 WeakPolarHBondContact O-CB 3.39Å; V72-T76 PolarHBondContact O-N 2.96Å; V72-T76 PolarHBondContact O-OG1 3.41Å; A73-T76 PolarHBondContact O-N 3.29Å; L74-T76 PolarHBondContact O-N 3.37Å; T76-G80 PolarHBondContact O-N 3Å; T76-M103 HydrophobicContact CG2-CE 3.93Å; T76-Q279 HydrophobicContact CG2-CG 4.46Å; T76-L283 HydrophobicContact CG2-CD2 3.98Å; T76-L283 HydrophobicContact CG2-CG 4.45Å |
| 77 | G | 96.3 | Very high | 94.5 | Very high | 0 Ų | 0 | 33.2 Ų | 33.2 | 0% | 0 | 19% | 0.192 | C | C | . | . | H | α-helix | trans | -63.1 | -46.5 | 175.5 | 0 | 0 | 0 | 0 | 0 | 112.8 | S25 A73 L74 G75 V79 G80 V81 | S25-G77 WeakPolarHBondContact CB-O 3.34Å; A73-G77 PolarHBondContact O-N 3.49Å; L74-G77 PolarHBondContact O-N 3.14Å; G75-G77 VanDerWaalsContact C-N 3.32Å; G75-G77 PolarHBondContact O-N 2.83Å; G77-V79 VanDerWaalsContact C-N 3.34Å; G77-V79 PolarHBondContact O-N 2.92Å; G77-G80 CarbonylContact O-C 3.01Å; G77-G80 WeakPolarHBondContact O-CA 3.46Å; G77-G80 PolarHBondContact O-N 3.48Å; G77-G80 VanDerWaalsContact O-N 3.12Å; G77-V81 WeakPolarHBondContact O-CG2 3.45Å; G77-V81 PolarHBondContact O-N 2.91Å |
| 78 | L | 96.5 | Very high | 93.8 | Very high | 86 Ų | 86 | 33.7 Ų | 33.7 | 45% | 0.45 | 19% | 0.194 | S | C | . | . | H | α-helix | trans | -61.1 | -42.7 | 177.8 | -70.6 | 175.7 | 0 | 0 | 0 | 112.2 | V29 L74 G75 G80 V81 G82 | V29-L78 HydrophobicContact CG1-CD2 4.34Å; V29-L78 HydrophobicContact CG2-CD2 3.92Å; V29-L78 HydrophobicContact CG2-CG 3.98Å; L74-L78 HydrophobicContact CD2-CD1 3.74Å; L74-L78 HydrophobicContact CD2-CG 4.39Å; L74-L78 WeakPolarHBondContact O-CG 3.14Å; L74-L78 PolarHBondContact O-N 2.79Å; G75-L78 PolarHBondContact O-N 2.93Å; L78-G80 VanDerWaalsContact C-N 3.34Å; L78-V81 PolarHBondContact O-N 2.95Å; L78-G82 PolarHBondContact O-N 3.38Å; L78-G82 VanDerWaalsContact O-N 3.1Å |
| 79 | V | 93.9 | Very high | 92.9 | Very high | 50 Ų | 50 | 33.5 Ų | 33.5 | 30% | 0.303 | 19% | 0.191 | S | C | . | . | H | α-helix | trans | -65.6 | -40.1 | 175.1 | 177.7 | 0 | 0 | 0 | 0 | 110.5 | G75 G77 V81 G82 A83 W96 M103 | G75-V79 VanDerWaalsContact O-CG2 3.31Å; G75-V79 WeakPolarHBondContact O-CG2 3.27Å; G75-V79 PolarHBondContact O-N 3.37Å; G77-V79 VanDerWaalsContact C-N 3.34Å; G77-V79 PolarHBondContact O-N 2.92Å; V79-V81 PolarHBondContact O-N 2.87Å; V79-G82 PolarHBondContact O-N 3.44Å; V79-A83 WeakPolarHBondContact O-CB 3.35Å; V79-A83 PolarHBondContact O-N 3.04Å; V79-W96 HydrophobicContact CG1-CH2 3.93Å; V79-W96 HydrophobicContact CG1-CZ3 3.6Å; V79-W96 WeakPolarHBondContact O-CH2 3.33Å; V79-W96 WeakPolarHBondContact O-CZ3 3.37Å; V79-M103 HydrophobicContact CB-CE 3.7Å; V79-M103 HydrophobicContact CB-SD 4.34Å; V79-M103 HydrophobicContact CG1-CE 3.46Å; V79-M103 VanDerWaalsContact CG1-CE 3.46Å; V79-M103 HydrophobicContact CG1-CG 3.86Å; V79-M103 HydrophobicContact CG1-SD 3.43Å; V79-M103 WeakPolarHBondContact CG1-SD 3.13Å |
| 80 | G | 93.8 | Very high | 91.5 | Very high | 0 Ų | 0 | 35.4 Ų | 35.4 | 0% | 0 | 21% | 0.206 | C | C | . | . | H | α-helix | trans | -61.1 | -39.7 | 174.7 | 0 | 0 | 0 | 0 | 0 | 113.4 | T76 G77 L78 A83 S84 | T76-G80 PolarHBondContact O-N 3Å; G77-G80 CarbonylContact O-C 3.01Å; G77-G80 WeakPolarHBondContact O-CA 3.46Å; G77-G80 PolarHBondContact O-N 3.48Å; G77-G80 VanDerWaalsContact O-N 3.12Å; L78-G80 VanDerWaalsContact C-N 3.34Å; G80-A83 PolarHBondContact O-N 3.17Å; G80-S84 WeakPolarHBondContact O-CB 3.37Å; G80-S84 PolarHBondContact O-N 3.49Å; G80-S84 PolarHBondContact O-OG 3.47Å |
| 81 | V | 94.8 | Very high | 90.3 | Very high | 19 Ų | 19 | 39.2 Ų | 39.2 | 12% | 0.115 | 24% | 0.238 | C | C | . | . | H | α-helix | trans | -60.1 | -47 | 172.4 | 170.4 | 0 | 0 | 0 | 0 | 110.4 | W26 G77 L78 V79 R85 | W26-V81 HydrophobicContact CD2-CG2 3.99Å; W26-V81 HydrophobicContact CG-CG2 3.99Å; W26-V81 HydrophobicContact CZ2-CG1 4.13Å; G77-V81 WeakPolarHBondContact O-CG2 3.45Å; G77-V81 PolarHBondContact O-N 2.91Å; L78-V81 PolarHBondContact O-N 2.95Å; V79-V81 PolarHBondContact O-N 2.87Å; V81-R85 WeakPolarHBondContact O-CB 3.42Å; V81-R85 PolarHBondContact O-N 2.95Å |
| 82 | G | 92.6 | Very high | 89.3 | Confident | 23 Ų | 23 | 41 Ų | 41 | 24% | 0.237 | 24% | 0.24 | C | C | . | . | H | α-helix | trans | -61.5 | -50.1 | 177.8 | 0 | 0 | 0 | 0 | 0 | 112.7 | L78 V79 S84 R85 A86 W96 | L78-G82 PolarHBondContact O-N 3.38Å; L78-G82 VanDerWaalsContact O-N 3.1Å; V79-G82 PolarHBondContact O-N 3.44Å; G82-S84 PolarHBondContact O-N 3.21Å; G82-R85 PolarHBondContact O-N 3.34Å; G82-A86 WeakPolarHBondContact O-CB 3.34Å; G82-A86 PolarHBondContact O-N 2.88Å; G82-W96 VanDerWaalsContact C-CZ2 3.45Å |
| 83 | A | 90.8 | Very high | 88.4 | Confident | 3 Ų | 3 | 39.1 Ų | 39.1 | 3% | 0.025 | 23% | 0.228 | C | C | . | . | H | α-helix | trans | -61.4 | -43.8 | 179.1 | 0 | 0 | 0 | 0 | 0 | 112.1 | V79 G80 R85 A86 S87 W96 L100 L286 | V79-A83 WeakPolarHBondContact O-CB 3.35Å; V79-A83 PolarHBondContact O-N 3.04Å; G80-A83 PolarHBondContact O-N 3.17Å; A83-R85 VanDerWaalsContact C-N 3.31Å; A83-R85 PolarHBondContact O-N 2.92Å; A83-A86 PolarHBondContact O-N 3.33Å; A83-S87 WeakPolarHBondContact O-CB 3.32Å; A83-S87 PolarHBondContact O-N 3.12Å; A83-S87 PolarHBondContact O-OG 2.95Å; A83-W96 HydrophobicContact CB-CD2 4.38Å; A83-W96 HydrophobicContact CB-CE3 3.67Å; A83-W96 HydrophobicContact CB-CH2 4.27Å; A83-W96 HydrophobicContact CB-CZ3 3.59Å; A83-L100 HydrophobicContact CB-CD1 3.82Å; A83-L286 HydrophobicContact CB-CD2 3.86Å |
| 84 | S | 91.4 | Very high | 87.6 | Confident | 0 Ų | 0 | 43.3 Ų | 43.3 | 0% | 0 | 25% | 0.254 | C | S | . | . | H | α-helix | trans | -68.8 | -29.6 | 179.5 | -55.4 | 0 | 0 | 0 | 0 | 112.6 | L21 G80 G82 S87 | L21-S84 WeakPolarHBondContact CB-OG 3.22Å; G80-S84 WeakPolarHBondContact O-CB 3.37Å; G80-S84 PolarHBondContact O-N 3.49Å; G80-S84 PolarHBondContact O-OG 3.47Å; G82-S84 PolarHBondContact O-N 3.21Å; S84-S87 WeakPolarHBondContact CA-OG 3.34Å; S84-S87 PolarHBondContact O-OG 2.9Å |
| 85 | R | 90.6 | Very high | 87 | Confident | 171 Ų | 171 | 45.2 Ų | 45.2 | 65% | 0.645 | 27% | 0.27 | S | S | * | . | H | α-helix | trans | -76 | -40.5 | 172.6 | -174.8 | 178.6 | -180 | 134.4 | 0.8 | 111.5 | V81 G82 A83 S87 L88 | V81-R85 WeakPolarHBondContact O-CB 3.42Å; V81-R85 PolarHBondContact O-N 2.95Å; G82-R85 PolarHBondContact O-N 3.34Å; A83-R85 VanDerWaalsContact C-N 3.31Å; A83-R85 PolarHBondContact O-N 2.92Å; R85-S87 VanDerWaalsContact C-N 3.34Å; R85-L88 PolarHBondContact O-N 3.32Å |
| 86 | A | 87.4 | Confident | 86.4 | Confident | 3 Ų | 3 | 46.6 Ų | 46.6 | 3% | 0.025 | 27% | 0.266 | C | S | . | . | H | α-helix | trans | -66.9 | -35.4 | 179.2 | 0 | 0 | 0 | 0 | 0 | 112.1 | G82 A83 L88 N89 L92 Y93 W96 | G82-A86 WeakPolarHBondContact O-CB 3.34Å; G82-A86 PolarHBondContact O-N 2.88Å; A83-A86 PolarHBondContact O-N 3.33Å; A86-L88 PolarHBondContact O-N 3.29Å; A86-N89 CarbonylContact O-C 3.6Å; A86-N89 PolarHBondContact O-N 2.94Å; A86-L92 HydrophobicContact CB-CB 4.33Å; A86-Y93 HydrophobicContact CB-CD2 4.44Å; A86-W96 HydrophobicContact CB-CD2 4.37Å; A86-W96 HydrophobicContact CB-CG 3.88Å |
| 87 | S | 83.4 | Confident | 85.6 | Confident | 6 Ų | 6 | 51.1 Ų | 51.1 | 4% | 0.042 | 28% | 0.281 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -65.8 | -18.7 | 176.3 | 59.8 | 0 | 0 | 0 | 0 | 114.3 | A83 S84 R85 L289 | A83-S87 WeakPolarHBondContact O-CB 3.32Å; A83-S87 PolarHBondContact O-N 3.12Å; A83-S87 PolarHBondContact O-OG 2.95Å; S84-S87 WeakPolarHBondContact CA-OG 3.34Å; S84-S87 PolarHBondContact O-OG 2.9Å; R85-S87 VanDerWaalsContact C-N 3.34Å; S87-L289 VanDerWaalsContact CB-CD2 3.5Å; S87-L289 VanDerWaalsContact OG-CD2 3.28Å; S87-L289 WeakPolarHBondContact OG-CD2 3.45Å |
| 88 | L | 83.1 | Confident | 84.7 | Confident | 77 Ų | 77 | 53.9 Ų | 53.9 | 40% | 0.403 | 31% | 0.31 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -84.6 | -9.7 | 173.8 | -67.8 | 171.9 | 0 | 0 | 0 | 113.1 | I15 A18 Q19 R85 A86 | I15-L88 HydrophobicContact CB-CD2 4.36Å; I15-L88 HydrophobicContact CG1-CD2 4.39Å; I15-L88 HydrophobicContact CG2-CD2 3.98Å; A18-L88 HydrophobicContact CB-CD1 4.47Å; A18-L88 HydrophobicContact CB-CD2 3.66Å; A18-L88 HydrophobicContact CB-CG 3.87Å; Q19-L88 HydrophobicContact CG-CD1 4.39Å; R85-L88 PolarHBondContact O-N 3.32Å; A86-L88 PolarHBondContact O-N 3.29Å |
| 89 | N | 79.3 | Confident | 84.2 | Confident | 74 Ų | 74 | 53.7 Ų | 53.7 | 40% | 0.396 | 31% | 0.312 | S | S | . | . | trans | -136.3 | 113.9 | -176.8 | -173.2 | -15.4 | 0 | 0 | 0 | 112.1 | A86 A91 L92 Y93 | A86-N89 CarbonylContact O-C 3.6Å; A86-N89 PolarHBondContact O-N 2.94Å; N89-A91 PolarHBondContact O-N 3.31Å; N89-A91 VanDerWaalsContact O-N 3.13Å; N89-A91 PolarHBondContact OD1-N 3.07Å; N89-L92 HydrophobicContact CB-CB 4.28Å; N89-L92 HydrophobicContact CB-CD1 3.96Å; N89-L92 HydrophobicContact CB-CG 4.24Å; N89-L92 PolarHBondContact O-N 3.49Å; N89-Y93 PolarHBondContact O-N 2.96Å | ||
| 90 | A | 69.6 | Low | 83.7 | Confident | 40 Ų | 40 | 51.5 Ų | 51.5 | 33% | 0.331 | 30% | 0.299 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -53.2 | -34.4 | -180 | 0 | 0 | 0 | 0 | 0 | 114.2 | L92 P94 I300 | A90-L92 VanDerWaalsContact C-N 3.3Å; A90-L92 PolarHBondContact O-N 3.38Å; A90-P94 WeakPolarHBondContact O-CD 3.39Å; A90-I300 HydrophobicContact CB-CB 3.96Å; A90-I300 HydrophobicContact CB-CD1 4.21Å; A90-I300 HydrophobicContact CB-CG1 4.01Å |
| 91 | A | 70.9 | Confident | 83.3 | Confident | 81 Ų | 81 | 52.4 Ų | 52.4 | 67% | 0.669 | 31% | 0.308 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -72.4 | -23.5 | -179.8 | 0 | 0 | 0 | 0 | 0 | 113.2 | N89 | N89-A91 PolarHBondContact O-N 3.31Å; N89-A91 VanDerWaalsContact O-N 3.13Å; N89-A91 PolarHBondContact OD1-N 3.07Å |
| 92 | L | 78.1 | Confident | 83 | Confident | 86 Ų | 86 | 55.6 Ų | 55.6 | 45% | 0.45 | 33% | 0.33 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -100.9 | -17 | -172.3 | -65.7 | 174.3 | 0 | 0 | 0 | 113.6 | A86 N89 A90 P94 P95 | A86-L92 HydrophobicContact CB-CB 4.33Å; N89-L92 HydrophobicContact CB-CB 4.28Å; N89-L92 HydrophobicContact CB-CD1 3.96Å; N89-L92 HydrophobicContact CB-CG 4.24Å; N89-L92 PolarHBondContact O-N 3.49Å; A90-L92 VanDerWaalsContact C-N 3.3Å; A90-L92 PolarHBondContact O-N 3.38Å; L92-P94 VanDerWaalsContact C-CD 3.46Å; L92-P95 WeakPolarHBondContact O-CD 3.43Å |
| 93 | Y | 78.6 | Confident | 82.8 | Confident | 12 Ų | 12 | 55.8 Ų | 55.8 | 5% | 0.047 | 33% | 0.325 | C | S | . | . | S | Bend | trans | -75.7 | -28.3 | -177.2 | -166 | -108.7 | 0 | 0 | 0 | 117.2 | A86 N89 P95 W96 R97 L293 I300 | A86-Y93 HydrophobicContact CB-CD2 4.44Å; N89-Y93 PolarHBondContact O-N 2.96Å; Y93-P95 VanDerWaalsContact C-CD 3.49Å; Y93-W96 HydrophobicContact CD2-CB 4.15Å; Y93-W96 HydrophobicContact CE2-CB 4.29Å; Y93-W96 WeakPolarHBondContact O-CB 3.29Å; Y93-W96 PolarHBondContact O-N 2.91Å; Y93-R97 HydrophobicContact CE1-CB 4.49Å; Y93-R97 PolarHBondContact O-N 3.4Å; Y93-L293 HydrophobicContact CD1-CD1 4.49Å; Y93-L293 HydrophobicContact CD2-CD1 4.05Å; Y93-L293 HydrophobicContact CE1-CB 3.87Å; Y93-L293 HydrophobicContact CE1-CD1 3.99Å; Y93-L293 HydrophobicContact CE2-CD1 3.5Å; Y93-L293 VanDerWaalsContact CE2-CD1 3.5Å; Y93-L293 VanDerWaalsContact CZ-CD1 3.46Å; Y93-I300 HydrophobicContact CD1-CD1 4.4Å; Y93-I300 HydrophobicContact CG-CD1 4.19Å |
| 94 | P | 80.3 | Confident | 82.8 | Confident | 87 Ų | 87 | 56.1 Ų | 56.1 | 57% | 0.565 | 33% | 0.326 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -49.7 | -45.5 | -177.4 | -27.7 | 34.4 | 0 | 0 | 0 | 116 | A90 L92 W96 R97 | A90-P94 WeakPolarHBondContact O-CD 3.39Å; L92-P94 VanDerWaalsContact C-CD 3.46Å; P94-W96 VanDerWaalsContact C-N 3.29Å; P94-W96 PolarHBondContact O-N 3.44Å; P94-R97 PolarHBondContact O-N 3.46Å |
| 95 | P | 83.8 | Confident | 82.7 | Confident | 89 Ų | 89 | 60.8 Ų | 60.8 | 58% | 0.578 | 35% | 0.354 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -68.4 | -27.4 | 177.6 | 26.8 | -35.4 | 0 | 0 | 0 | 113.2 | L92 Y93 R97 | L92-P95 WeakPolarHBondContact O-CD 3.43Å; Y93-P95 VanDerWaalsContact C-CD 3.49Å; P95-R97 VanDerWaalsContact C-N 3.33Å; P95-R97 PolarHBondContact O-N 2.87Å |
| 96 | W | 83.7 | Confident | 82.8 | Confident | 58 Ų | 58 | 55.7 Ų | 55.7 | 22% | 0.22 | 35% | 0.348 | C | S | . | . | H | α-helix | trans | -73.9 | -23.9 | -178.9 | -75.8 | 88.7 | 0 | 0 | 0 | 113 | V79 G82 A83 A86 Y93 P94 G98 V99 L100 | V79-W96 HydrophobicContact CG1-CH2 3.93Å; V79-W96 HydrophobicContact CG1-CZ3 3.6Å; V79-W96 WeakPolarHBondContact O-CH2 3.33Å; V79-W96 WeakPolarHBondContact O-CZ3 3.37Å; G82-W96 VanDerWaalsContact C-CZ2 3.45Å; A83-W96 HydrophobicContact CB-CD2 4.38Å; A83-W96 HydrophobicContact CB-CE3 3.67Å; A83-W96 HydrophobicContact CB-CH2 4.27Å; A83-W96 HydrophobicContact CB-CZ3 3.59Å; A86-W96 HydrophobicContact CB-CD2 4.37Å; A86-W96 HydrophobicContact CB-CG 3.88Å; Y93-W96 HydrophobicContact CD2-CB 4.15Å; Y93-W96 HydrophobicContact CE2-CB 4.29Å; Y93-W96 WeakPolarHBondContact O-CB 3.29Å; Y93-W96 PolarHBondContact O-N 2.91Å; P94-W96 VanDerWaalsContact C-N 3.29Å; P94-W96 PolarHBondContact O-N 3.44Å; W96-G98 VanDerWaalsContact C-N 3.3Å; W96-G98 PolarHBondContact O-N 2.74Å; W96-V99 PolarHBondContact O-N 2.86Å; W96-V99 VanDerWaalsContact O-N 3.14Å; W96-L100 WeakPolarHBondContact O-CB 3.44Å; W96-L100 PolarHBondContact O-N 2.77Å |
| 97 | R | 78.5 | Confident | 82.9 | Confident | 108 Ų | 108 | 55.8 Ų | 55.8 | 41% | 0.408 | 35% | 0.35 | S | S | . | . | H | α-helix | trans | -58.3 | -38.1 | -178.5 | -166.9 | 175.5 | -175.5 | 160.8 | 2.4 | 113.2 | Y93 P94 P95 G297 | Y93-R97 HydrophobicContact CE1-CB 4.49Å; Y93-R97 PolarHBondContact O-N 3.4Å; P94-R97 PolarHBondContact O-N 3.46Å; P95-R97 VanDerWaalsContact C-N 3.33Å; P95-R97 PolarHBondContact O-N 2.87Å; R97-G297 PolarHBondContact NH1-O 2.78Å |
| 98 | G | 78.4 | Confident | 83.3 | Confident | 59 Ų | 59 | 59.2 Ų | 59.2 | 61% | 0.608 | 37% | 0.37 | S | S | * | . | H | α-helix | trans | -82.6 | -24.1 | 177.7 | 0 | 0 | 0 | 0 | 0 | 114.3 | W96 P102 | W96-G98 VanDerWaalsContact C-N 3.3Å; W96-G98 PolarHBondContact O-N 2.74Å; G98-P102 WeakPolarHBondContact O-CD 3.3Å |
| 99 | V | 84.6 | Confident | 83.7 | Confident | 81 Ų | 81 | 59 Ų | 59 | 49% | 0.491 | 38% | 0.38 | S | S | . | . | H | α-helix | trans | -91 | -33.3 | -172.9 | 178.1 | 0 | 0 | 0 | 0 | 112.1 | W96 G101 P102 M103 | W96-V99 PolarHBondContact O-N 2.86Å; W96-V99 VanDerWaalsContact O-N 3.14Å; V99-G101 PolarHBondContact O-N 3.3Å; V99-P102 WeakPolarHBondContact O-CD 3.26Å; V99-M103 VanDerWaalsContact O-CB 3.3Å; V99-M103 WeakPolarHBondContact O-CB 3.25Å; V99-M103 PolarHBondContact O-N 3.23Å; V99-M103 VanDerWaalsContact O-N 3.13Å |
| 100 | L | 84 | Confident | 84.3 | Confident | 4 Ų | 4 | 57.6 Ų | 57.6 | 2% | 0.021 | 38% | 0.383 | C | S | . | . | H | α-helix | trans | -66.5 | -38.5 | -170.7 | -162.1 | 61.9 | 0 | 0 | 0 | 112.6 | A83 W96 M103 L104 Q290 | A83-L100 HydrophobicContact CB-CD1 3.82Å; W96-L100 WeakPolarHBondContact O-CB 3.44Å; W96-L100 PolarHBondContact O-N 2.77Å; L100-M103 HydrophobicContact CD1-SD 4.13Å; L100-M103 PolarHBondContact O-N 3.23Å; L100-L104 HydrophobicContact CG-CD1 4.48Å; L100-L104 VanDerWaalsContact O-CG 3.26Å; L100-L104 WeakPolarHBondContact O-CG 3.46Å; L100-L104 PolarHBondContact O-N 3.41Å; L100-Q290 HydrophobicContact CD2-CB 3.58Å; L100-Q290 HydrophobicContact CD2-CG 3.82Å; L100-Q290 HydrophobicContact CG-CB 4.34Å; L100-Q290 HydrophobicContact CG-CG 4.37Å |
| 101 | G | 85.9 | Confident | 85.4 | Confident | 19 Ų | 19 | 55.9 Ų | 55.9 | 20% | 0.196 | 37% | 0.369 | C | S | . | . | H | α-helix | trans | -59.3 | -60.1 | 177.1 | 0 | 0 | 0 | 0 | 0 | 113.5 | V99 M103 L104 V105 | V99-G101 PolarHBondContact O-N 3.3Å; G101-M103 VanDerWaalsContact C-N 3.27Å; G101-M103 PolarHBondContact O-N 2.95Å; G101-L104 PolarHBondContact O-N 3.5Å; G101-V105 PolarHBondContact O-N 3.34Å |
| 102 | P | 88.3 | Confident | 86.6 | Confident | 87 Ų | 87 | 52.6 Ų | 52.6 | 57% | 0.565 | 34% | 0.343 | S | S | * | . | H | α-helix | trans | -56.5 | -39.2 | 175.8 | -26.5 | 34.5 | 0 | 0 | 0 | 113.3 | G98 V99 V105 A106 | G98-P102 WeakPolarHBondContact O-CD 3.3Å; V99-P102 WeakPolarHBondContact O-CD 3.26Å; P102-V105 PolarHBondContact O-N 3.44Å; P102-A106 WeakPolarHBondContact O-CB 3.36Å; P102-A106 PolarHBondContact O-N 3.13Å |
| 103 | M | 88.6 | Confident | 87.4 | Confident | 27 Ų | 27 | 49.9 Ų | 49.9 | 13% | 0.133 | 34% | 0.336 | C | S | . | . | H | α-helix | trans | -63.4 | -41.8 | 177.9 | 179.7 | -123.8 | 170.2 | 0 | 0 | 112.3 | T76 V79 V99 L100 G101 V105 A106 G107 L283 L286 | T76-M103 HydrophobicContact CG2-CE 3.93Å; V79-M103 HydrophobicContact CB-CE 3.7Å; V79-M103 HydrophobicContact CB-SD 4.34Å; V79-M103 HydrophobicContact CG1-CE 3.46Å; V79-M103 VanDerWaalsContact CG1-CE 3.46Å; V79-M103 HydrophobicContact CG1-CG 3.86Å; V79-M103 HydrophobicContact CG1-SD 3.43Å; V79-M103 WeakPolarHBondContact CG1-SD 3.13Å; V99-M103 VanDerWaalsContact O-CB 3.3Å; V99-M103 WeakPolarHBondContact O-CB 3.25Å; V99-M103 PolarHBondContact O-N 3.23Å; V99-M103 VanDerWaalsContact O-N 3.13Å; L100-M103 HydrophobicContact CD1-SD 4.13Å; L100-M103 PolarHBondContact O-N 3.23Å; G101-M103 VanDerWaalsContact C-N 3.27Å; G101-M103 PolarHBondContact O-N 2.95Å; M103-V105 PolarHBondContact O-N 3.43Å; M103-A106 PolarHBondContact O-N 3.36Å; M103-G107 PolarHBondContact O-N 3.28Å; M103-L283 HydrophobicContact CE-CD2 4.38Å; M103-L286 HydrophobicContact CE-CD1 4.47Å |
| 104 | L | 89.9 | Confident | 88.3 | Confident | 10 Ų | 10 | 51.4 Ų | 51.4 | 5% | 0.052 | 35% | 0.345 | C | S | . | . | H | α-helix | trans | -64.4 | -40.3 | 176.8 | -72 | 175 | 0 | 0 | 0 | 111.9 | L100 G101 T108 L283 L286 R287 | L100-L104 HydrophobicContact CG-CD1 4.48Å; L100-L104 VanDerWaalsContact O-CG 3.26Å; L100-L104 WeakPolarHBondContact O-CG 3.46Å; L100-L104 PolarHBondContact O-N 3.41Å; G101-L104 PolarHBondContact O-N 3.5Å; L104-T108 WeakPolarHBondContact O-CB 3.41Å; L104-T108 VanDerWaalsContact O-CG2 3.29Å; L104-T108 WeakPolarHBondContact O-CG2 3.37Å; L104-T108 PolarHBondContact O-N 2.91Å; L104-T108 PolarHBondContact O-OG1 2.97Å; L104-L283 HydrophobicContact CD2-CB 4.27Å; L104-L283 HydrophobicContact CD2-CD2 3.79Å; L104-L283 WeakPolarHBondContact CD2-O 3.43Å; L104-L286 HydrophobicContact CD2-CB 3.89Å; L104-R287 HydrophobicContact CD1-CB 3.92Å; L104-R287 HydrophobicContact CD1-CG 4.45Å |
| 105 | V | 90.1 | Very high | 89.1 | Confident | 98 Ų | 98 | 47.4 Ų | 47.4 | 59% | 0.594 | 32% | 0.318 | S | S | * | . | H | α-helix | trans | -64.5 | -48.1 | 175.2 | 177.4 | 0 | 0 | 0 | 0 | 110.9 | G101 P102 M103 G107 T108 A109 | G101-V105 PolarHBondContact O-N 3.34Å; P102-V105 PolarHBondContact O-N 3.44Å; M103-V105 PolarHBondContact O-N 3.43Å; V105-G107 PolarHBondContact O-N 2.97Å; V105-T108 PolarHBondContact O-N 3.06Å; V105-T108 PolarHBondContact O-OG1 2.96Å; V105-T108 VanDerWaalsContact O-OG1 3.13Å; V105-A109 WeakPolarHBondContact O-CB 3.23Å; V105-A109 PolarHBondContact O-N 3.14Å |
| 106 | A | 91.5 | Very high | 89.7 | Confident | 63 Ų | 63 | 46.9 Ų | 46.9 | 52% | 0.521 | 31% | 0.313 | S | S | . | . | I | π-helix | trans | -63.3 | -41.3 | 178 | 0 | 0 | 0 | 0 | 0 | 112.4 | P102 M103 G110 G111 | P102-A106 WeakPolarHBondContact O-CB 3.36Å; P102-A106 PolarHBondContact O-N 3.13Å; M103-A106 PolarHBondContact O-N 3.36Å; A106-G110 CarbonylContact O-C 3.53Å; A106-G110 WeakPolarHBondContact O-CA 3.29Å; A106-G110 PolarHBondContact O-N 2.79Å; A106-G111 PolarHBondContact O-N 3.05Å |
| 107 | G | 91.1 | Very high | 90.3 | Very high | 5 Ų | 5 | 49.2 Ų | 49.2 | 5% | 0.052 | 33% | 0.329 | C | S | . | . | I | π-helix | trans | -68 | -36.8 | 178.8 | 0 | 0 | 0 | 0 | 0 | 113.1 | M103 V105 G111 G112 Q279 L283 | M103-G107 PolarHBondContact O-N 3.28Å; V105-G107 PolarHBondContact O-N 2.97Å; G107-G111 CarbonylContact O-C 3.27Å; G107-G111 WeakPolarHBondContact O-CA 3.37Å; G107-G111 PolarHBondContact O-N 2.73Å; G107-G112 PolarHBondContact O-N 2.92Å; G107-Q279 PolarHBondContact O-NE2 3.4Å; G107-L283 VanDerWaalsContact C-CD1 3.42Å; G107-L283 WeakPolarHBondContact O-CD1 3.4Å |
| 108 | T | 91.1 | Very high | 91.2 | Very high | 78 Ų | 78 | 44.1 Ų | 44.1 | 48% | 0.479 | 31% | 0.31 | S | S | . | . | I | π-helix | trans | -78.5 | -56.5 | 178.4 | 50 | 0 | 0 | 0 | 0 | 112.1 | L104 V105 G112 G113 L283 | L104-T108 WeakPolarHBondContact O-CB 3.41Å; L104-T108 VanDerWaalsContact O-CG2 3.29Å; L104-T108 WeakPolarHBondContact O-CG2 3.37Å; L104-T108 PolarHBondContact O-N 2.91Å; L104-T108 PolarHBondContact O-OG1 2.97Å; V105-T108 PolarHBondContact O-N 3.06Å; V105-T108 PolarHBondContact O-OG1 2.96Å; V105-T108 VanDerWaalsContact O-OG1 3.13Å; T108-G112 WeakPolarHBondContact O-CA 3.35Å; T108-G112 PolarHBondContact O-N 3.48Å; T108-G113 PolarHBondContact O-N 2.7Å; T108-L283 HydrophobicContact CG2-CB 4.24Å; T108-L283 HydrophobicContact CG2-CD1 3.86Å |
| 109 | A | 91.9 | Very high | 92.1 | Very high | 74 Ų | 74 | 43.4 Ų | 43.4 | 61% | 0.612 | 29% | 0.292 | S | S | * | . | I | π-helix | trans | -74 | -47.2 | -175.8 | 0 | 0 | 0 | 0 | 0 | 112 | V105 G113 | V105-A109 WeakPolarHBondContact O-CB 3.23Å; V105-A109 PolarHBondContact O-N 3.14Å; A109-G113 PolarHBondContact O-N 3.49Å |
| 110 | G | 92.1 | Very high | 92.7 | Very high | 44 Ų | 44 | 41.3 Ų | 41.3 | 45% | 0.454 | 29% | 0.287 | S | S | . | . | I | π-helix | trans | -77.7 | -65 | 179.9 | 0 | 0 | 0 | 0 | 0 | 111.8 | A106 G113 L114 | A106-G110 CarbonylContact O-C 3.53Å; A106-G110 WeakPolarHBondContact O-CA 3.29Å; A106-G110 PolarHBondContact O-N 2.79Å; G110-G113 PolarHBondContact O-N 3.33Å; G110-L114 VanDerWaalsContact O-CB 3.31Å; G110-L114 WeakPolarHBondContact O-CB 3.28Å; G110-L114 PolarHBondContact O-N 3.26Å |
| 111 | G | 93.2 | Very high | 93.3 | Very high | 4 Ų | 4 | 43.4 Ų | 43.4 | 4% | 0.041 | 30% | 0.298 | C | S | . | . | I | π-helix | trans | -64.2 | -47.4 | -175.6 | 0 | 0 | 0 | 0 | 0 | 113.7 | A106 G107 L114 L115 | A106-G111 PolarHBondContact O-N 3.05Å; G107-G111 CarbonylContact O-C 3.27Å; G107-G111 WeakPolarHBondContact O-CA 3.37Å; G107-G111 PolarHBondContact O-N 2.73Å; G111-L114 PolarHBondContact O-N 3.29Å; G111-L115 WeakPolarHBondContact O-CG 3.43Å; G111-L115 PolarHBondContact O-N 3.49Å |
| 112 | G | 94.2 | Very high | 93.7 | Very high | 12 Ų | 12 | 42.9 Ų | 42.9 | 12% | 0.124 | 29% | 0.291 | C | S | . | . | I | π-helix | trans | -64.2 | -44 | 176.4 | 0 | 0 | 0 | 0 | 0 | 112.6 | G107 T108 L114 L115 V116 | G107-G112 PolarHBondContact O-N 2.92Å; T108-G112 WeakPolarHBondContact O-CA 3.35Å; T108-G112 PolarHBondContact O-N 3.48Å; G112-L114 PolarHBondContact O-N 2.86Å; G112-L115 PolarHBondContact O-N 3.34Å; G112-V116 WeakPolarHBondContact O-CG2 3.33Å; G112-V116 PolarHBondContact O-N 2.95Å |
| 113 | G | 95.8 | Very high | 94 | Very high | 29 Ų | 29 | 45.4 Ų | 45.4 | 30% | 0.299 | 30% | 0.299 | S | S | . | . | H | α-helix | trans | -59.8 | -44.8 | 175.3 | 0 | 0 | 0 | 0 | 0 | 112.6 | T108 A109 G110 V116 I117 | T108-G113 PolarHBondContact O-N 2.7Å; A109-G113 PolarHBondContact O-N 3.49Å; G110-G113 PolarHBondContact O-N 3.33Å; G113-V116 PolarHBondContact O-N 3.27Å; G113-I117 WeakPolarHBondContact O-CG1 3.47Å; G113-I117 PolarHBondContact O-N 3.36Å |
| 114 | L | 96.9 | Very high | 94.3 | Very high | 44 Ų | 44 | 47.4 Ų | 47.4 | 23% | 0.23 | 32% | 0.32 | C | S | . | . | H | α-helix | trans | -60.8 | -46.4 | 176 | -179.7 | 60.9 | 0 | 0 | 0 | 111.6 | V68 A69 V72 G110 G111 G112 V116 I117 T118 | V68-L114 HydrophobicContact CB-CD2 4.16Å; V68-L114 HydrophobicContact CG1-CD2 3.69Å; A69-L114 HydrophobicContact CB-CD2 4.1Å; A69-L114 HydrophobicContact CB-CG 4.03Å; V72-L114 HydrophobicContact CG2-CD2 4.26Å; G110-L114 VanDerWaalsContact O-CB 3.31Å; G110-L114 WeakPolarHBondContact O-CB 3.28Å; G110-L114 PolarHBondContact O-N 3.26Å; G111-L114 PolarHBondContact O-N 3.29Å; G112-L114 PolarHBondContact O-N 2.86Å; L114-V116 VanDerWaalsContact C-N 3.32Å; L114-V116 PolarHBondContact O-N 3.46Å; L114-I117 PolarHBondContact O-N 3.35Å; L114-T118 HydrophobicContact CD1-CG2 4.17Å; L114-T118 HydrophobicContact CG-CG2 4.43Å; L114-T118 WeakPolarHBondContact O-CG2 3.47Å; L114-T118 PolarHBondContact O-N 3.06Å; L114-T118 PolarHBondContact O-OG1 3.15Å |
| 115 | L | 97.1 | Very high | 94.4 | Very high | 2 Ų | 2 | 47.6 Ų | 47.6 | 1% | 0.01 | 32% | 0.321 | C | S | . | . | H | α-helix | trans | -58.6 | -42.9 | 177.1 | -78.5 | 166.7 | 0 | 0 | 0 | 112.1 | A69 G111 G112 T118 L119 L272 T275 F276 Q279 | A69-L115 HydrophobicContact CB-CD2 3.93Å; A69-L115 HydrophobicContact CB-CG 4.47Å; G111-L115 WeakPolarHBondContact O-CG 3.43Å; G111-L115 PolarHBondContact O-N 3.49Å; G112-L115 PolarHBondContact O-N 3.34Å; L115-T118 WeakPolarHBondContact CA-OG1 3.37Å; L115-T118 PolarHBondContact O-N 3.31Å; L115-T118 PolarHBondContact O-OG1 3.23Å; L115-L119 VanDerWaalsContact O-CB 3.31Å; L115-L119 WeakPolarHBondContact O-CB 3.41Å; L115-L119 PolarHBondContact O-N 3.11Å; L115-L272 HydrophobicContact CD2-CD2 3.95Å; L115-T275 HydrophobicContact CD1-CG2 4.39Å; L115-T275 HydrophobicContact CD2-CG2 4.21Å; L115-F276 HydrophobicContact CB-CB 4.43Å; L115-F276 HydrophobicContact CB-CD2 4.09Å; L115-F276 HydrophobicContact CD1-CB 4.48Å; L115-Q279 HydrophobicContact CD1-CB 4.23Å; L115-Q279 HydrophobicContact CD1-CG 4.43Å; L115-Q279 VanDerWaalsContact CD1-OE1 3.3Å |
| 116 | V | 97.3 | Very high | 94.3 | Very high | 78 Ų | 78 | 44 Ų | 44 | 47% | 0.473 | 30% | 0.3 | S | S | . | . | H | α-helix | trans | -62.4 | -45.1 | 176.1 | 171.5 | 0 | 0 | 0 | 0 | 111.5 | G112 G113 L114 L119 G120 F276 | G112-V116 WeakPolarHBondContact O-CG2 3.33Å; G112-V116 PolarHBondContact O-N 2.95Å; G113-V116 PolarHBondContact O-N 3.27Å; L114-V116 VanDerWaalsContact C-N 3.32Å; L114-V116 PolarHBondContact O-N 3.46Å; V116-L119 PolarHBondContact O-N 3.14Å; V116-G120 PolarHBondContact O-N 2.94Å; V116-F276 HydrophobicContact CG2-CD2 4.14Å; V116-F276 HydrophobicContact CG2-CE2 3.59Å; V116-F276 HydrophobicContact CG2-CZ 4.11Å |
| 117 | I | 96.9 | Very high | 94 | Very high | 108 Ų | 108 | 43.9 Ų | 43.9 | 55% | 0.554 | 31% | 0.305 | S | S | * | . | H | α-helix | trans | -60.4 | -48.5 | 176.6 | -67.8 | 165.2 | 0 | 0 | 0 | 110 | G113 L114 L119 G120 L121 | G113-I117 WeakPolarHBondContact O-CG1 3.47Å; G113-I117 PolarHBondContact O-N 3.36Å; L114-I117 PolarHBondContact O-N 3.35Å; I117-L119 VanDerWaalsContact C-N 3.3Å; I117-L119 PolarHBondContact O-N 3.43Å; I117-G120 PolarHBondContact O-N 2.98Å; I117-G120 VanDerWaalsContact O-N 3.15Å; I117-L121 HydrophobicContact CG2-CD1 4.47Å; I117-L121 WeakPolarHBondContact O-CG 3.29Å; I117-L121 PolarHBondContact O-N 2.89Å |
| 118 | T | 97.4 | Very high | 93.9 | Very high | 0 Ų | 0 | 45.6 Ų | 45.6 | 0% | 0 | 32% | 0.316 | C | S | . | . | H | α-helix | trans | -62.9 | -36.5 | 179.5 | 57.3 | 0 | 0 | 0 | 0 | 113.1 | A65 A69 L114 L115 L121 A122 | A65-T118 VanDerWaalsContact C-CG2 3.49Å; A65-T118 HydrophobicContact CB-CG2 3.56Å; A65-T118 WeakPolarHBondContact O-CG2 3.43Å; A69-T118 HydrophobicContact CB-CG2 3.95Å; L114-T118 HydrophobicContact CD1-CG2 4.17Å; L114-T118 HydrophobicContact CG-CG2 4.43Å; L114-T118 WeakPolarHBondContact O-CG2 3.47Å; L114-T118 PolarHBondContact O-N 3.06Å; L114-T118 PolarHBondContact O-OG1 3.15Å; L115-T118 WeakPolarHBondContact CA-OG1 3.37Å; L115-T118 PolarHBondContact O-N 3.31Å; L115-T118 PolarHBondContact O-OG1 3.23Å; T118-L121 PolarHBondContact O-N 2.94Å; T118-A122 PolarHBondContact O-N 2.94Å |
| 119 | L | 97.2 | Very high | 94 | Very high | 45 Ų | 45 | 41.9 Ų | 41.9 | 24% | 0.236 | 29% | 0.294 | C | S | . | . | H | α-helix | trans | -67.8 | -39.7 | 175.3 | -174.4 | 62.7 | 0 | 0 | 0 | 111 | L115 V116 I117 L121 A122 L123 L272 A273 | L115-L119 VanDerWaalsContact O-CB 3.31Å; L115-L119 WeakPolarHBondContact O-CB 3.41Å; L115-L119 PolarHBondContact O-N 3.11Å; V116-L119 PolarHBondContact O-N 3.14Å; I117-L119 VanDerWaalsContact C-N 3.3Å; I117-L119 PolarHBondContact O-N 3.43Å; L119-L121 VanDerWaalsContact C-N 3.34Å; L119-L121 PolarHBondContact O-N 2.97Å; L119-A122 WeakPolarHBondContact O-CB 3.48Å; L119-A122 PolarHBondContact O-N 3.43Å; L119-L123 WeakPolarHBondContact O-CG 3.39Å; L119-L123 PolarHBondContact O-N 3.21Å; L119-L272 HydrophobicContact CD1-CB 4.43Å; L119-A273 HydrophobicContact CD1-CB 4.19Å; L119-A273 HydrophobicContact CD2-CB 4.48Å |
| 120 | G | 96.4 | Very high | 94.2 | Very high | 37 Ų | 37 | 41.5 Ų | 41.5 | 38% | 0.381 | 28% | 0.281 | S | S | . | . | H | α-helix | trans | -59.7 | -43.3 | 172.2 | 0 | 0 | 0 | 0 | 0 | 112.4 | V116 I117 A122 L123 A124 | V116-G120 PolarHBondContact O-N 2.94Å; I117-G120 PolarHBondContact O-N 2.98Å; I117-G120 VanDerWaalsContact O-N 3.15Å; G120-A122 VanDerWaalsContact C-N 3.33Å; G120-A122 PolarHBondContact O-N 3.36Å; G120-L123 PolarHBondContact O-N 3.07Å; G120-A124 WeakPolarHBondContact O-CB 3.43Å; G120-A124 PolarHBondContact O-N 3.31Å |
| 121 | L | 95.9 | Very high | 94.3 | Very high | 47 Ų | 47 | 46.4 Ų | 46.4 | 25% | 0.246 | 29% | 0.292 | C | S | . | . | H | α-helix | trans | -61.5 | -40.9 | 173.7 | -67.4 | 176.7 | 0 | 0 | 0 | 112 | L62 A65 I117 T118 L119 L123 A124 L125 | L62-L121 HydrophobicContact CD1-CB 4.21Å; A65-L121 HydrophobicContact CB-CD1 4.04Å; I117-L121 HydrophobicContact CG2-CD1 4.47Å; I117-L121 WeakPolarHBondContact O-CG 3.29Å; I117-L121 PolarHBondContact O-N 2.89Å; T118-L121 PolarHBondContact O-N 2.94Å; L119-L121 VanDerWaalsContact C-N 3.34Å; L119-L121 PolarHBondContact O-N 2.97Å; L121-L123 PolarHBondContact O-N 3.34Å; L121-A124 PolarHBondContact O-N 3.04Å; L121-L125 HydrophobicContact CB-CD1 4.02Å; L121-L125 HydrophobicContact CD2-CD1 4.06Å; L121-L125 HydrophobicContact CD2-CG 4.36Å; L121-L125 WeakPolarHBondContact O-CB 3.37Å; L121-L125 WeakPolarHBondContact O-CG 3.49Å; L121-L125 PolarHBondContact O-N 3.35Å |
| 122 | A | 95.8 | Very high | 94.4 | Very high | 8 Ų | 8 | 46.4 Ų | 46.4 | 7% | 0.066 | 29% | 0.292 | C | S | . | . | H | α-helix | trans | -63 | -28.6 | 179.3 | 0 | 0 | 0 | 0 | 0 | 112.8 | L62 T118 L119 G120 P126 | L62-A122 HydrophobicContact CD1-CB 3.71Å; L62-A122 HydrophobicContact CD2-CB 4.38Å; T118-A122 PolarHBondContact O-N 2.94Å; L119-A122 WeakPolarHBondContact O-CB 3.48Å; L119-A122 PolarHBondContact O-N 3.43Å; G120-A122 VanDerWaalsContact C-N 3.33Å; G120-A122 PolarHBondContact O-N 3.36Å; A122-P126 VanDerWaalsContact O-CD 3.28Å; A122-P126 WeakPolarHBondContact O-CD 3.32Å; A122-P126 WeakPolarHBondContact O-CG 3.14Å |
| 123 | L | 94.3 | Very high | 94.5 | Very high | 140 Ų | 140 | 45.9 Ų | 45.9 | 73% | 0.733 | 29% | 0.286 | S | S | * | . | H | α-helix | trans | -87.3 | -34.3 | 177.3 | -63.5 | 173.8 | 0 | 0 | 0 | 112.8 | L119 G120 L121 | L119-L123 WeakPolarHBondContact O-CG 3.39Å; L119-L123 PolarHBondContact O-N 3.21Å; G120-L123 PolarHBondContact O-N 3.07Å; L121-L123 PolarHBondContact O-N 3.34Å |
| 124 | A | 93.9 | Very high | 94.6 | Very high | 69 Ų | 69 | 46.7 Ų | 46.7 | 57% | 0.57 | 28% | 0.282 | S | S | * | . | H | α-helix | trans | -87.5 | -44.9 | -173 | 0 | 0 | 0 | 0 | 0 | 113.7 | G120 L121 P126 G127 | G120-A124 WeakPolarHBondContact O-CB 3.43Å; G120-A124 PolarHBondContact O-N 3.31Å; L121-A124 PolarHBondContact O-N 3.04Å; A124-P126 VanDerWaalsContact C-CD 3.46Å; A124-G127 PolarHBondContact O-N 3.33Å |
| 125 | L | 92 | Very high | 94.5 | Very high | 14 Ų | 14 | 49.8 Ų | 49.8 | 7% | 0.073 | 30% | 0.296 | C | S | . | . | G | 310 helix | trans | -67.2 | -31.2 | -171.8 | -67.8 | 175.7 | 0 | 0 | 0 | 115.3 | Q58 F59 A61 L62 L121 G127 S128 | Q58-L125 HydrophobicContact CB-CD2 3.87Å; F59-L125 HydrophobicContact CD2-CB 4.25Å; A61-L125 HydrophobicContact CB-CD1 4.39Å; L62-L125 HydrophobicContact CB-CD1 3.9Å; L121-L125 HydrophobicContact CB-CD1 4.02Å; L121-L125 HydrophobicContact CD2-CD1 4.06Å; L121-L125 HydrophobicContact CD2-CG 4.36Å; L121-L125 WeakPolarHBondContact O-CB 3.37Å; L121-L125 WeakPolarHBondContact O-CG 3.49Å; L121-L125 PolarHBondContact O-N 3.35Å; L125-G127 PolarHBondContact O-N 3.27Å; L125-G127 VanDerWaalsContact O-N 3.15Å; L125-S128 PolarHBondContact O-N 3.4Å; L125-S128 PolarHBondContact O-OG 2.91Å |
| 126 | P | 88.6 | Confident | 94.5 | Very high | 23 Ų | 23 | 50.1 Ų | 50.1 | 15% | 0.149 | 30% | 0.299 | C | S | . | . | G | 310 helix | trans | -57.4 | -27.2 | 175.6 | -27.7 | 36.6 | 0 | 0 | 0 | 114.2 | A122 A124 S128 L129 Q262 A265 | A122-P126 VanDerWaalsContact O-CD 3.28Å; A122-P126 WeakPolarHBondContact O-CD 3.32Å; A122-P126 WeakPolarHBondContact O-CG 3.14Å; A124-P126 VanDerWaalsContact C-CD 3.46Å; P126-S128 VanDerWaalsContact C-N 3.3Å; P126-S128 PolarHBondContact O-N 2.97Å; P126-L129 WeakPolarHBondContact O-CB 3.46Å; P126-L129 PolarHBondContact O-N 2.99Å; P126-Q262 HydrophobicContact CB-CG 4.35Å; P126-A265 HydrophobicContact CG-CB 4.19Å |
| 127 | G | 85.9 | Confident | 94.4 | Very high | 60 Ų | 60 | 46.4 Ų | 46.4 | 62% | 0.619 | 28% | 0.277 | S | S | * | . | G | 310 helix | trans | -67.9 | -27.5 | 176.5 | 0 | 0 | 0 | 0 | 0 | 113.9 | A124 L125 L129 | A124-G127 PolarHBondContact O-N 3.33Å; L125-G127 PolarHBondContact O-N 3.27Å; L125-G127 VanDerWaalsContact O-N 3.15Å; G127-L129 VanDerWaalsContact C-N 3.32Å |
| 128 | S | 88.8 | Confident | 94.4 | Very high | 42 Ų | 42 | 42 Ų | 42 | 29% | 0.294 | 26% | 0.258 | S | S | . | . | G | 310 helix | trans | -83.8 | -7.9 | 177.7 | 66.8 | 0 | 0 | 0 | 0 | 114 | L125 P126 A132 | L125-S128 PolarHBondContact O-N 3.4Å; L125-S128 PolarHBondContact O-OG 2.91Å; P126-S128 VanDerWaalsContact C-N 3.3Å; P126-S128 PolarHBondContact O-N 2.97Å; S128-A132 WeakPolarHBondContact O-CB 3.35Å; S128-A132 PolarHBondContact O-N 3.33Å |
| 129 | L | 93.4 | Very high | 94.3 | Very high | 0 Ų | 0 | 45.3 Ų | 45.3 | 0% | 0 | 28% | 0.278 | C | S | . | . | H | α-helix | trans | -74.4 | -34.2 | -173.2 | -172.1 | 66.2 | 0 | 0 | 0 | 112.2 | L53 F59 P126 G127 A132 L133 L258 L261 Q262 | L53-L129 HydrophobicContact CD2-CD1 3.53Å; F59-L129 HydrophobicContact CB-CD1 4.48Å; F59-L129 HydrophobicContact CD1-CD1 4.5Å; F59-L129 HydrophobicContact CD2-CD1 4.26Å; F59-L129 HydrophobicContact CE2-CD2 4.31Å; F59-L129 HydrophobicContact CG-CD1 4.18Å; P126-L129 WeakPolarHBondContact O-CB 3.46Å; P126-L129 PolarHBondContact O-N 2.99Å; G127-L129 VanDerWaalsContact C-N 3.32Å; L129-A132 PolarHBondContact O-N 3.46Å; L129-L133 HydrophobicContact CD1-CD1 4.41Å; L129-L133 HydrophobicContact CD1-CG 4.44Å; L129-L133 HydrophobicContact CD2-CD1 4.48Å; L129-L133 HydrophobicContact CG-CD1 3.98Å; L129-L133 HydrophobicContact CG-CG 4.41Å; L129-L133 WeakPolarHBondContact O-CB 3.37Å; L129-L133 WeakPolarHBondContact O-CG 3.4Å; L129-L133 PolarHBondContact O-N 3.19Å; L129-L258 HydrophobicContact CB-CD1 4Å; L129-L258 HydrophobicContact CD2-CD1 3.86Å; L129-L258 HydrophobicContact CG-CD1 3.89Å; L129-L261 HydrophobicContact CD1-CD1 3.96Å; L129-L261 HydrophobicContact CD2-CB 3.47Å; L129-L261 VanDerWaalsContact CD2-CB 3.47Å; L129-L261 HydrophobicContact CD2-CD1 4.01Å; L129-L261 HydrophobicContact CD2-CG 4.4Å; L129-L261 HydrophobicContact CG-CD1 4.49Å; L129-Q262 HydrophobicContact CD2-CG 4.23Å |
| 130 | D | 94.6 | Very high | 94.1 | Very high | 65 Ų | 65 | 43.8 Ų | 43.8 | 35% | 0.348 | 27% | 0.273 | S | S | . | . | H | α-helix | trans | -59.3 | -56.2 | 179.6 | -176.2 | 76 | 0 | 0 | 0 | 111.7 | A132 L133 E134 H254 L258 | D130-A132 VanDerWaalsContact C-N 3.32Å; D130-A132 PolarHBondContact O-N 2.91Å; D130-L133 PolarHBondContact O-N 2.88Å; D130-E134 PolarHBondContact O-N 3.27Å; D130-H254 PolarHBondContact O-NE2 3Å; D130-H254 IonicContact OD1-CE1 3.32Å; D130-H254 PolarHBondContact OD1-CE1 3.04Å; D130-H254 IonicContact OD1-NE2 2.8Å; D130-H254 PolarHBondContact OD1-NE2 3.37Å; D130-H254 VanDerWaalsContact OD1-NE2 3.16Å; D130-L258 HydrophobicContact CB-CD1 4.26Å; D130-L258 HydrophobicContact CB-CD2 4.43Å; D130-L258 WeakPolarHBondContact OD1-CD2 3.2Å |
| 131 | E | 94.9 | Very high | 94.1 | Very high | 147 Ų | 147 | 42.3 Ų | 42.3 | 69% | 0.687 | 26% | 0.256 | S | S | * | . | H | α-helix | trans | -61.6 | -40.1 | 177.3 | -65.6 | 179 | 174.1 | 0 | 0 | 111.9 | E134 E135 | E131-E134 PolarHBondContact O-N 2.9Å; E131-E135 PolarHBondContact O-N 3.02Å |
| 132 | A | 95.4 | Very high | 94 | Very high | 5 Ų | 5 | 42.5 Ų | 42.5 | 4% | 0.041 | 26% | 0.264 | C | S | . | . | H | α-helix | trans | -65.9 | -39.2 | 179.9 | 0 | 0 | 0 | 0 | 0 | 112.8 | L53 A54 C57 S128 L129 D130 G136 | L53-A132 HydrophobicContact CD2-CB 3.99Å; A54-A132 HydrophobicContact CB-CB 4.08Å; A54-A132 PolarHBondContact N-O 3.5Å; C57-A132 HydrophobicContact CB-CB 3.76Å; S128-A132 WeakPolarHBondContact O-CB 3.35Å; S128-A132 PolarHBondContact O-N 3.33Å; L129-A132 PolarHBondContact O-N 3.46Å; D130-A132 VanDerWaalsContact C-N 3.32Å; D130-A132 PolarHBondContact O-N 2.91Å; A132-G136 PolarHBondContact O-N 3.34Å |
| 133 | L | 96.6 | Very high | 93.9 | Very high | 1 Ų | 1 | 44.8 Ų | 44.8 | 1% | 0.005 | 27% | 0.273 | C | S | . | . | H | α-helix | trans | -71 | -39 | 174.6 | -78.2 | 170.7 | 0 | 0 | 0 | 111.2 | L53 L129 D130 G136 L137 L257 L258 | L53-L133 HydrophobicContact CD2-CD2 3.75Å; L53-L133 HydrophobicContact CD2-CG 3.8Å; L53-L133 HydrophobicContact CG-CD2 4.46Å; L129-L133 HydrophobicContact CD1-CD1 4.41Å; L129-L133 HydrophobicContact CD1-CG 4.44Å; L129-L133 HydrophobicContact CD2-CD1 4.48Å; L129-L133 HydrophobicContact CG-CD1 3.98Å; L129-L133 HydrophobicContact CG-CG 4.41Å; L129-L133 WeakPolarHBondContact O-CB 3.37Å; L129-L133 WeakPolarHBondContact O-CG 3.4Å; L129-L133 PolarHBondContact O-N 3.19Å; D130-L133 PolarHBondContact O-N 2.88Å; L133-G136 PolarHBondContact O-N 2.79Å; L133-L137 HydrophobicContact CB-CD1 4.49Å; L133-L137 WeakPolarHBondContact O-CB 3.29Å; L133-L137 WeakPolarHBondContact O-CG 3.26Å; L133-L137 PolarHBondContact O-N 3.03Å; L133-L257 HydrophobicContact CD1-CB 4.07Å; L133-L257 HydrophobicContact CD2-CB 4.16Å; L133-L257 HydrophobicContact CD2-CD1 4Å; L133-L258 HydrophobicContact CD1-CB 3.95Å; L133-L258 HydrophobicContact CD1-CD1 4.15Å |
| 134 | E | 96.4 | Very high | 93.9 | Very high | 46 Ų | 46 | 38.1 Ų | 38.1 | 22% | 0.215 | 24% | 0.238 | C | C | . | . | H | α-helix | trans | -57 | -51.6 | 176.8 | -90.8 | -53.5 | 108.1 | 0 | 0 | 112.1 | D130 E131 G138 R171 H172 H254 | D130-E134 PolarHBondContact O-N 3.27Å; E131-E134 PolarHBondContact O-N 2.9Å; E134-G138 PolarHBondContact O-N 3.42Å; E134-G138 VanDerWaalsContact O-N 3.11Å; E134-R171 IonicContact OE2-NH1 3.38Å; E134-H172 IonicContact OE1-CD2 3.38Å; E134-H172 IonicContact OE1-CE1 3.83Å; E134-H172 PolarHBondContact OE1-CE1 3.45Å; E134-H172 IonicContact OE1-NE2 3.16Å; E134-H172 PolarHBondContact OE1-NE2 3.33Å; E134-H172 IonicContact OE2-CE1 3.78Å; E134-H172 IonicContact OE2-NE2 2.98Å; E134-H172 PolarHBondContact OE2-NE2 2.92Å; E134-H254 IonicContact OE1-CD2 3.92Å; E134-H254 PolarHBondContact OE1-CD2 3.33Å; E134-H254 IonicContact OE1-CG 3.48Å; E134-H254 IonicContact OE1-NE2 3.06Å; E134-H254 PolarHBondContact OE1-NE2 2.73Å |
| 135 | E | 96.3 | Very high | 93.9 | Very high | 109 Ų | 109 | 37 Ų | 37 | 51% | 0.509 | 22% | 0.221 | S | C | . | . | H | α-helix | trans | -67.2 | -46.9 | 179.5 | -175.5 | -176.9 | 167.3 | 0 | 0 | 111.5 | A54 E131 G138 T139 | A54-E135 HydrophobicContact CB-CB 4.26Å; A54-E135 HydrophobicContact CB-CG 4.42Å; A54-E135 WeakPolarHBondContact CB-OE2 3.46Å; E131-E135 PolarHBondContact O-N 3.02Å; E135-G138 PolarHBondContact O-N 3.48Å; E135-T139 WeakPolarHBondContact O-CB 3.32Å; E135-T139 PolarHBondContact O-N 2.92Å; E135-T139 PolarHBondContact O-OG1 3.42Å |
| 136 | G | 95.7 | Very high | 93.9 | Very high | 8 Ų | 8 | 38 Ų | 38 | 8% | 0.082 | 23% | 0.226 | C | C | . | . | H | α-helix | trans | -67.7 | -45.5 | -175.7 | 0 | 0 | 0 | 0 | 0 | 113.4 | F52 A132 L133 T139 A140 | F52-G136 CarbonylContact O-C 3.53Å; F52-G136 WeakPolarHBondContact O-CA 3.42Å; A132-G136 PolarHBondContact O-N 3.34Å; L133-G136 PolarHBondContact O-N 2.79Å; G136-T139 PolarHBondContact O-N 3.38Å; G136-A140 WeakPolarHBondContact O-CB 3.48Å; G136-A140 PolarHBondContact O-N 3.28Å |
| 137 | L | 96.9 | Very high | 93.8 | Very high | 1 Ų | 1 | 38.6 Ų | 38.6 | 1% | 0.005 | 23% | 0.229 | C | C | . | . | H | α-helix | trans | -66.4 | -40.4 | 174.7 | -73.4 | 168.5 | 0 | 0 | 0 | 111.6 | F52 L133 T139 A140 L141 L162 R171 C253 H254 L257 | F52-L137 HydrophobicContact CB-CD2 4.04Å; F52-L137 HydrophobicContact CB-CG 4.38Å; F52-L137 HydrophobicContact CD1-CD2 3.97Å; F52-L137 HydrophobicContact CG-CD2 4.18Å; L133-L137 HydrophobicContact CB-CD1 4.49Å; L133-L137 WeakPolarHBondContact O-CB 3.29Å; L133-L137 WeakPolarHBondContact O-CG 3.26Å; L133-L137 PolarHBondContact O-N 3.03Å; L137-T139 VanDerWaalsContact C-N 3.32Å; L137-T139 PolarHBondContact O-N 2.92Å; L137-A140 PolarHBondContact O-N 3.48Å; L137-L141 VanDerWaalsContact O-CD1 3.24Å; L137-L141 WeakPolarHBondContact O-CD1 3.38Å; L137-L141 PolarHBondContact O-N 3.12Å; L137-L162 HydrophobicContact CD2-CD2 3.68Å; L137-R171 HydrophobicContact CB-CB 4.33Å; L137-R171 HydrophobicContact CB-CG 4.11Å; L137-C253 HydrophobicContact CD1-CB 4.34Å; L137-C253 HydrophobicContact CD2-CB 4.35Å; L137-H254 HydrophobicContact CD1-CB 3.79Å; L137-L257 HydrophobicContact CD2-CD1 4.5Å |
| 138 | G | 95.9 | Very high | 93.8 | Very high | 16 Ų | 16 | 42.2 Ų | 42.2 | 17% | 0.165 | 23% | 0.23 | C | C | . | . | H | α-helix | trans | -57.4 | -46.3 | 175.6 | 0 | 0 | 0 | 0 | 0 | 112 | E134 E135 L141 A142 | E134-G138 PolarHBondContact O-N 3.42Å; E134-G138 VanDerWaalsContact O-N 3.11Å; E135-G138 PolarHBondContact O-N 3.48Å; G138-L141 PolarHBondContact O-N 3.48Å; G138-A142 PolarHBondContact O-N 2.95Å |
| 139 | T | 94.4 | Very high | 93.5 | Very high | 68 Ų | 68 | 43.2 Ų | 43.2 | 42% | 0.417 | 23% | 0.234 | S | C | . | . | H | α-helix | trans | -64 | -42.7 | 176.4 | -56.5 | 0 | 0 | 0 | 0 | 111.8 | E135 G136 L137 L141 A142 H143 | E135-T139 WeakPolarHBondContact O-CB 3.32Å; E135-T139 PolarHBondContact O-N 2.92Å; E135-T139 PolarHBondContact O-OG1 3.42Å; G136-T139 PolarHBondContact O-N 3.38Å; L137-T139 VanDerWaalsContact C-N 3.32Å; L137-T139 PolarHBondContact O-N 2.92Å; T139-L141 PolarHBondContact O-N 3.09Å; T139-A142 PolarHBondContact O-N 3.2Å; T139-H143 PolarHBondContact O-CD2 3.13Å; T139-H143 PolarHBondContact O-N 2.95Å; T139-H143 VanDerWaalsContact O-N 3.17Å |
| 140 | A | 94.9 | Very high | 93.2 | Very high | 14 Ų | 14 | 48.9 Ų | 48.9 | 12% | 0.116 | 27% | 0.271 | C | S | . | . | H | α-helix | trans | -63.2 | -40.6 | 178.4 | 0 | 0 | 0 | 0 | 0 | 112.5 | F52 G136 L137 Y144 V159 | F52-A140 HydrophobicContact CD1-CB 3.87Å; F52-A140 HydrophobicContact CE1-CB 4.11Å; G136-A140 WeakPolarHBondContact O-CB 3.48Å; G136-A140 PolarHBondContact O-N 3.28Å; L137-A140 PolarHBondContact O-N 3.48Å; A140-Y144 PolarHBondContact O-N 2.86Å; A140-V159 HydrophobicContact CB-CG2 3.94Å |
| 141 | L | 95.6 | Very high | 92.7 | Very high | 5 Ų | 5 | 49.5 Ų | 49.5 | 3% | 0.026 | 29% | 0.293 | C | S | . | . | H | α-helix | trans | -65.3 | -44.5 | 175.1 | -94.7 | 70.6 | 0 | 0 | 0 | 111.5 | L137 G138 T139 H143 Y144 R171 D176 W177 | L137-L141 VanDerWaalsContact O-CD1 3.24Å; L137-L141 WeakPolarHBondContact O-CD1 3.38Å; L137-L141 PolarHBondContact O-N 3.12Å; G138-L141 PolarHBondContact O-N 3.48Å; T139-L141 PolarHBondContact O-N 3.09Å; L141-H143 VanDerWaalsContact C-N 3.27Å; L141-H143 PolarHBondContact O-N 3.2Å; L141-Y144 WeakPolarHBondContact O-CB 3.31Å; L141-Y144 PolarHBondContact O-N 2.94Å; L141-Y144 VanDerWaalsContact O-N 3.13Å; L141-R171 HydrophobicContact CD2-CB 4.23Å; L141-D176 HydrophobicContact CD2-CB 3.98Å; L141-W177 HydrophobicContact CG-CH2 4.17Å; L141-W177 HydrophobicContact CG-CZ2 4.39Å; L141-W177 HydrophobicContact CG-CZ3 4.41Å |
| 142 | A | 93.3 | Very high | 92.3 | Very high | 51 Ų | 51 | 45.8 Ų | 45.8 | 42% | 0.421 | 28% | 0.276 | S | S | . | . | H | α-helix | trans | -59.7 | -38.2 | -179.2 | 0 | 0 | 0 | 0 | 0 | 112.7 | G138 T139 | G138-A142 PolarHBondContact O-N 2.95Å; T139-A142 PolarHBondContact O-N 3.2Å |
| 143 | H | 94 | Very high | 92 | Very high | 56 Ų | 56 | 48.2 Ų | 48.2 | 26% | 0.259 | 29% | 0.292 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -91.5 | 6.8 | 179.5 | -69.8 | -61.6 | 0 | 0 | 0 | 114.4 | T139 L141 K145 D146 H152 A155 | T139-H143 PolarHBondContact O-CD2 3.13Å; T139-H143 PolarHBondContact O-N 2.95Å; T139-H143 VanDerWaalsContact O-N 3.17Å; L141-H143 VanDerWaalsContact C-N 3.27Å; L141-H143 PolarHBondContact O-N 3.2Å; H143-K145 PolarHBondContact O-N 3.24Å; H143-D146 IonicContact CE1-OD2 3.82Å; H143-D146 IonicContact CG-OD2 3.65Å; H143-D146 IonicContact ND1-OD2 2.78Å; H143-D146 PolarHBondContact ND1-OD2 3.38Å; H143-D146 WeakPolarHBondContact O-CB 3.19Å; H143-D146 PolarHBondContact O-N 3.46Å; H143-H152 HydrophobicContact CB-CB 4.16Å; H143-H152 AromaticContact CD2-CE1 3.62Å; H143-H152 AromaticContact CD2-ND1 3.68Å; H143-H152 AromaticContact CG-CE1 3.88Å; H143-H152 AromaticContact CG-CG 3.87Å; H143-H152 AromaticContact CG-ND1 3.55Å; H143-H152 AromaticContact ND1-CG 3.97Å; H143-H152 AromaticContact NE2-CE1 3.77Å; H143-A155 HydrophobicContact CB-CB 4.31Å; H143-A155 WeakPolarHBondContact O-CB 3.38Å |
| 144 | Y | 95.3 | Very high | 91.7 | Very high | 1 Ų | 1 | 52.9 Ų | 52.9 | 0% | 0.004 | 31% | 0.313 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -57.6 | -35.8 | -178 | -177.6 | -92.4 | 0 | 0 | 0 | 113.2 | A140 L141 D146 K156 V159 D160 W177 W182 P213 | A140-Y144 PolarHBondContact O-N 2.86Å; L141-Y144 WeakPolarHBondContact O-CB 3.31Å; L141-Y144 PolarHBondContact O-N 2.94Å; L141-Y144 VanDerWaalsContact O-N 3.13Å; Y144-D146 VanDerWaalsContact C-N 3.27Å; Y144-D146 PolarHBondContact O-N 3.14Å; Y144-K156 HydrophobicContact CD2-CB 4.4Å; Y144-K156 HydrophobicContact CD2-CG 4.44Å; Y144-K156 HydrophobicContact CE1-CD 4.41Å; Y144-K156 HydrophobicContact CE1-CG 4.18Å; Y144-K156 HydrophobicContact CE2-CB 4.3Å; Y144-K156 HydrophobicContact CE2-CG 3.9Å; Y144-K156 WeakPolarHBondContact O-CB 3.31Å; Y144-K156 PolarHBondContact OH-NZ 2.91Å; Y144-V159 HydrophobicContact CD2-CB 3.76Å; Y144-V159 HydrophobicContact CD2-CG1 3.85Å; Y144-V159 HydrophobicContact CD2-CG2 4.19Å; Y144-V159 HydrophobicContact CE2-CB 3.93Å; Y144-V159 HydrophobicContact CE2-CG1 3.9Å; Y144-D160 VanDerWaalsContact CE2-OD1 3.3Å; Y144-D160 WeakPolarHBondContact CE2-OD1 3.38Å; Y144-D160 VanDerWaalsContact OH-CG 3.31Å; Y144-D160 PolarHBondContact OH-OD1 3.29Å; Y144-D160 PolarHBondContact OH-OD2 3.46Å; Y144-W177 AromaticContact CD1-CH2 3.99Å; Y144-W177 HydrophobicContact CD1-CH2 3.99Å; Y144-W177 AromaticContact CD1-CZ3 3.86Å; Y144-W177 HydrophobicContact CD1-CZ3 3.86Å; Y144-W177 AromaticContact CD2-CH2 3.51Å; Y144-W177 HydrophobicContact CD2-CH2 3.51Å; Y144-W177 HydrophobicContact CD2-CZ2 4.48Å; Y144-W177 HydrophobicContact CD2-CZ3 4.17Å; Y144-W177 HydrophobicContact CE1-CH2 4.26Å; Y144-W177 HydrophobicContact CE1-CZ3 4.33Å; Y144-W177 AromaticContact CE2-CH2 3.81Å; Y144-W177 HydrophobicContact CE2-CH2 3.81Å; Y144-W177 HydrophobicContact CE2-CZ2 4.46Å; Y144-W177 AromaticContact CG-CH2 3.57Å; Y144-W177 HydrophobicContact CG-CH2 3.57Å; Y144-W177 AromaticContact CG-CZ3 3.74Å; Y144-W177 HydrophobicContact CG-CZ3 3.74Å; Y144-W182 HydrophobicContact CD1-CB 3.73Å; Y144-W182 HydrophobicContact CE1-CB 4.23Å; Y144-W182 HydrophobicContact CE1-CE3 4.08Å; Y144-P213 HydrophobicContact CE1-CB 4.28Å; Y144-P213 WeakPolarHBondContact OH-CB 3.45Å |
| 145 | K | 93.4 | Very high | 91.5 | Very high | 46 Ų | 46 | 51.3 Ų | 51.3 | 20% | 0.2 | 31% | 0.308 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -73.6 | -15.3 | 179.2 | 65.1 | 164.4 | 171.7 | -169.6 | 0 | 114.2 | H143 T147 Q181 S184 | H143-K145 PolarHBondContact O-N 3.24Å; K145-T147 VanDerWaalsContact C-N 3.27Å; K145-T147 PolarHBondContact O-N 3.46Å; K145-Q181 HydrophobicContact CD-CG 4.26Å; K145-Q181 VanDerWaalsContact CD-O 3.26Å; K145-Q181 WeakPolarHBondContact CD-O 3.31Å; K145-Q181 WeakPolarHBondContact CG-O 3.07Å; K145-S184 WeakPolarHBondContact O-CB 3.37Å; K145-S184 PolarHBondContact O-OG 3.47Å; K145-S184 VanDerWaalsContact O-OG 3.05Å |
| 146 | D | 91.3 | Very high | 91.5 | Very high | 33 Ų | 33 | 49.3 Ų | 49.3 | 18% | 0.176 | 30% | 0.298 | C | S | . | . | trans | -85.5 | 57.4 | -166.2 | -66.1 | -25.1 | 0 | 0 | 0 | 112.7 | H143 Y144 E148 V149 H152 C153 | H143-D146 IonicContact CE1-OD2 3.82Å; H143-D146 IonicContact CG-OD2 3.65Å; H143-D146 IonicContact ND1-OD2 2.78Å; H143-D146 PolarHBondContact ND1-OD2 3.38Å; H143-D146 WeakPolarHBondContact O-CB 3.19Å; H143-D146 PolarHBondContact O-N 3.46Å; Y144-D146 VanDerWaalsContact C-N 3.27Å; Y144-D146 PolarHBondContact O-N 3.14Å; D146-E148 PolarHBondContact O-N 3.46Å; D146-V149 HydrophobicContact CB-CB 4.01Å; D146-V149 HydrophobicContact CB-CG2 3.76Å; D146-H152 HydrophobicContact CB-CB 4Å; D146-H152 CarbonylContact O-C 3.57Å; D146-C153 WeakPolarHBondContact O-CA 3.44Å; D146-C153 PolarHBondContact O-N 2.8Å | ||
| 147 | T | 86.7 | Confident | 91.4 | Very high | 37 Ų | 37 | 55.9 Ų | 55.9 | 23% | 0.227 | 32% | 0.32 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -68.9 | -13.9 | -177.2 | 55.5 | 0 | 0 | 0 | 0 | 115.1 | K145 C153 K156 | K145-T147 VanDerWaalsContact C-N 3.27Å; K145-T147 PolarHBondContact O-N 3.46Å; T147-C153 WeakPolarHBondContact O-CB 3.38Å; T147-K156 HydrophobicContact CG2-CB 4.02Å; T147-K156 HydrophobicContact CG2-CD 3.82Å |
| 148 | E | 85.1 | Confident | 91.4 | Very high | 135 Ų | 135 | 58.4 Ų | 58.4 | 63% | 0.631 | 33% | 0.334 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -118.4 | -1.3 | -177.1 | -65.6 | 179.3 | -167.9 | 0 | 0 | 113.3 | D146 R186 | D146-E148 PolarHBondContact O-N 3.46Å; E148-R186 WeakPolarHBondContact OE1-CD 3.36Å; E148-R186 IonicContact OE1-CZ 3.4Å; E148-R186 IonicContact OE1-NE 3.67Å; E148-R186 IonicContact OE1-NH1 2.65Å; E148-R186 PolarHBondContact OE1-NH1 3.37Å |
| 149 | V | 83.4 | Confident | 91.4 | Very high | 64 Ų | 64 | 57.8 Ų | 57.8 | 39% | 0.388 | 33% | 0.326 | S | S | . | . | S | Bend | trans | -84.8 | 124.4 | -179.1 | -175.9 | 0 | 0 | 0 | 0 | 109.2 | D146 G151 H152 C153 | D146-V149 HydrophobicContact CB-CB 4.01Å; D146-V149 HydrophobicContact CB-CG2 3.76Å; V149-G151 PolarHBondContact O-N 3.32Å; V149-H152 HydrophobicContact CB-CB 4.47Å; V149-H152 PolarHBondContact O-N 3.03Å; V149-C153 PolarHBondContact O-N 2.83Å |
| 150 | P | 86.4 | Confident | 91.5 | Very high | 119 Ų | 119 | 55.2 Ų | 55.2 | 77% | 0.773 | 31% | 0.31 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -53 | 133.4 | 173.9 | -25.6 | 34.5 | 0 | 0 | 0 | 111.1 | H152 | P150-H152 VanDerWaalsContact C-N 3.32Å; P150-H152 PolarHBondContact O-N 3.49Å |
| 151 | G | 83.9 | Confident | 91.6 | Very high | 78 Ų | 78 | 59 Ų | 59 | 80% | 0.804 | 33% | 0.325 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 90.2 | -29.3 | -175.2 | 0 | 0 | 0 | 0 | 0 | 114.9 | V149 | V149-G151 PolarHBondContact O-N 3.32Š|
| 152 | H | 86.7 | Confident | 91.7 | Very high | 69 Ų | 69 | 59 Ų | 59 | 32% | 0.319 | 33% | 0.326 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -116.2 | -4.3 | -176.1 | -60.6 | -70.8 | 0 | 0 | 0 | 114.7 | H143 D146 V149 P150 Q154 A155 | H143-H152 HydrophobicContact CB-CB 4.16Å; H143-H152 AromaticContact CD2-CE1 3.62Å; H143-H152 AromaticContact CD2-ND1 3.68Å; H143-H152 AromaticContact CG-CE1 3.88Å; H143-H152 AromaticContact CG-CG 3.87Å; H143-H152 AromaticContact CG-ND1 3.55Å; H143-H152 AromaticContact ND1-CG 3.97Å; H143-H152 AromaticContact NE2-CE1 3.77Å; D146-H152 HydrophobicContact CB-CB 4Å; D146-H152 CarbonylContact O-C 3.57Å; V149-H152 HydrophobicContact CB-CB 4.47Å; V149-H152 PolarHBondContact O-N 3.03Å; P150-H152 VanDerWaalsContact C-N 3.32Å; P150-H152 PolarHBondContact O-N 3.49Å; H152-Q154 PolarHBondContact O-N 3.43Å; H152-A155 WeakPolarHBondContact O-CB 3.34Å; H152-A155 PolarHBondContact O-N 2.62Å |
| 153 | C | 89.1 | Confident | 91.9 | Very high | 56 Ų | 56 | 56.7 Ų | 56.7 | 38% | 0.378 | 31% | 0.306 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -53.7 | -25.5 | -178.2 | 64.5 | 0 | 0 | 0 | 0 | 115.7 | D146 T147 V149 | D146-C153 WeakPolarHBondContact O-CA 3.44Å; D146-C153 PolarHBondContact O-N 2.8Å; T147-C153 WeakPolarHBondContact O-CB 3.38Å; V149-C153 PolarHBondContact O-N 2.83Å |
| 154 | Q | 91 | Very high | 91.9 | Very high | 98 Ų | 98 | 58.1 Ų | 58.1 | 46% | 0.458 | 32% | 0.315 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -91.9 | -6.4 | 178.1 | -61.5 | -61.2 | -39.9 | 0 | 0 | 113.8 | H152 K156 R157 L158 | H152-Q154 PolarHBondContact O-N 3.43Å; Q154-K156 VanDerWaalsContact C-N 3.31Å; Q154-K156 PolarHBondContact O-N 3.36Å; Q154-R157 PolarHBondContact O-N 2.91Å; Q154-R157 VanDerWaalsContact O-N 3.11Å; Q154-L158 HydrophobicContact CB-CD1 4.15Å; Q154-L158 HydrophobicContact CB-CG 4.36Å; Q154-L158 WeakPolarHBondContact O-CG 3.47Å; Q154-L158 PolarHBondContact O-N 2.94Å |
| 155 | A | 92.7 | Very high | 91.9 | Very high | 14 Ų | 14 | 65.6 Ų | 65.6 | 12% | 0.116 | 34% | 0.343 | C | S | . | . | H | α-helix | trans | -56 | -46.3 | -174.9 | 0 | 0 | 0 | 0 | 0 | 111.6 | H143 H152 R157 L158 V159 | H143-A155 HydrophobicContact CB-CB 4.31Å; H143-A155 WeakPolarHBondContact O-CB 3.38Å; H152-A155 WeakPolarHBondContact O-CB 3.34Å; H152-A155 PolarHBondContact O-N 2.62Å; A155-R157 PolarHBondContact O-N 3.08Å; A155-L158 PolarHBondContact O-N 3.09Å; A155-V159 WeakPolarHBondContact O-CB 3.44Å; A155-V159 VanDerWaalsContact O-CG2 3.32Å; A155-V159 WeakPolarHBondContact O-CG2 3.34Å; A155-V159 PolarHBondContact O-N 3.45Å |
| 156 | K | 95.3 | Very high | 92.1 | Very high | 66 Ų | 66 | 65 Ų | 65 | 29% | 0.287 | 34% | 0.34 | S | S | . | . | H | α-helix | trans | -53.5 | -53.3 | 175 | -178.7 | 168.2 | 174 | 55.2 | 0 | 112.4 | Y144 T147 Q154 L158 V159 D160 | Y144-K156 HydrophobicContact CD2-CB 4.4Å; Y144-K156 HydrophobicContact CD2-CG 4.44Å; Y144-K156 HydrophobicContact CE1-CD 4.41Å; Y144-K156 HydrophobicContact CE1-CG 4.18Å; Y144-K156 HydrophobicContact CE2-CB 4.3Å; Y144-K156 HydrophobicContact CE2-CG 3.9Å; Y144-K156 WeakPolarHBondContact O-CB 3.31Å; Y144-K156 PolarHBondContact OH-NZ 2.91Å; T147-K156 HydrophobicContact CG2-CB 4.02Å; T147-K156 HydrophobicContact CG2-CD 3.82Å; Q154-K156 VanDerWaalsContact C-N 3.31Å; Q154-K156 PolarHBondContact O-N 3.36Å; K156-L158 PolarHBondContact O-N 2.77Å; K156-V159 PolarHBondContact O-N 2.9Å; K156-D160 IonicContact NZ-OD2 3.67Å; K156-D160 PolarHBondContact NZ-OD2 3.2Å; K156-D160 WeakPolarHBondContact O-CB 3.22Å; K156-D160 PolarHBondContact O-N 2.88Å |
| 157 | R | 94.9 | Very high | 92.3 | Very high | 147 Ų | 147 | 68 Ų | 68 | 56% | 0.555 | 35% | 0.353 | S | S | * | . | H | α-helix | trans | -61.4 | -45.7 | -178.2 | 179.1 | -175.4 | 170.3 | -175.1 | -3.2 | 111.3 | Q154 A155 D160 E161 | Q154-R157 PolarHBondContact O-N 2.91Å; Q154-R157 VanDerWaalsContact O-N 3.11Å; A155-R157 PolarHBondContact O-N 3.08Å; R157-D160 PolarHBondContact O-N 3.06Å; R157-E161 HydrophobicContact CG-CG 4.5Å; R157-E161 IonicContact CZ-OE1 2.77Å; R157-E161 IonicContact NE-OE1 2.86Å; R157-E161 PolarHBondContact NE-OE1 3.43Å; R157-E161 IonicContact NH2-OE1 2.98Å; R157-E161 PolarHBondContact NH2-OE1 3.33Å; R157-E161 WeakPolarHBondContact O-CB 3.35Å; R157-E161 WeakPolarHBondContact O-CG 3.39Å; R157-E161 PolarHBondContact O-N 3.44Å |
| 158 | L | 95.3 | Very high | 92.8 | Very high | 54 Ų | 54 | 66.3 Ų | 66.3 | 28% | 0.283 | 34% | 0.342 | S | S | . | . | H | α-helix | trans | -65 | -46.1 | -177.8 | -69.2 | 171.4 | 0 | 0 | 0 | 111.3 | T51 F52 Q154 A155 K156 D160 E161 L162 | T51-L158 HydrophobicContact CG2-CD1 4.16Å; F52-L158 HydrophobicContact CE1-CB 4.39Å; F52-L158 HydrophobicContact CZ-CB 3.89Å; F52-L158 WeakPolarHBondContact CZ-O 3.32Å; Q154-L158 HydrophobicContact CB-CD1 4.15Å; Q154-L158 HydrophobicContact CB-CG 4.36Å; Q154-L158 WeakPolarHBondContact O-CG 3.47Å; Q154-L158 PolarHBondContact O-N 2.94Å; A155-L158 PolarHBondContact O-N 3.09Å; K156-L158 PolarHBondContact O-N 2.77Å; L158-D160 VanDerWaalsContact C-N 3.35Å; L158-E161 PolarHBondContact O-N 3.02Å; L158-L162 WeakPolarHBondContact O-CB 3.41Å; L158-L162 PolarHBondContact O-N 3.25Å |
| 159 | V | 96.8 | Very high | 93.3 | Very high | 2 Ų | 2 | 59.9 Ų | 59.9 | 1% | 0.012 | 31% | 0.312 | C | S | . | . | H | α-helix | trans | -63.7 | -41.5 | 176.7 | 173.9 | 0 | 0 | 0 | 0 | 110.9 | F52 A140 Y144 A155 K156 L162 Q163 W177 | F52-V159 HydrophobicContact CE1-CG2 4.02Å; A140-V159 HydrophobicContact CB-CG2 3.94Å; Y144-V159 HydrophobicContact CD2-CB 3.76Å; Y144-V159 HydrophobicContact CD2-CG1 3.85Å; Y144-V159 HydrophobicContact CD2-CG2 4.19Å; Y144-V159 HydrophobicContact CE2-CB 3.93Å; Y144-V159 HydrophobicContact CE2-CG1 3.9Å; A155-V159 WeakPolarHBondContact O-CB 3.44Å; A155-V159 VanDerWaalsContact O-CG2 3.32Å; A155-V159 WeakPolarHBondContact O-CG2 3.34Å; A155-V159 PolarHBondContact O-N 3.45Å; K156-V159 PolarHBondContact O-N 2.9Å; V159-L162 WeakPolarHBondContact O-CB 3.45Å; V159-L162 PolarHBondContact O-N 2.89Å; V159-Q163 HydrophobicContact CG1-CG 4.38Å; V159-Q163 WeakPolarHBondContact O-CG 3.46Å; V159-Q163 PolarHBondContact O-N 3.44Å; V159-W177 HydrophobicContact CG1-CH2 4.04Å; V159-W177 HydrophobicContact CG1-CZ2 3.95Å |
| 160 | D | 97 | Very high | 94 | Very high | 15 Ų | 15 | 56.8 Ų | 56.8 | 8% | 0.08 | 29% | 0.294 | C | S | . | . | H | α-helix | trans | -62.6 | -44.8 | 177 | -71.5 | -17.3 | 0 | 0 | 0 | 111.4 | Y144 K156 R157 L158 L162 L164 S215 | Y144-D160 VanDerWaalsContact CE2-OD1 3.3Å; Y144-D160 WeakPolarHBondContact CE2-OD1 3.38Å; Y144-D160 VanDerWaalsContact OH-CG 3.31Å; Y144-D160 PolarHBondContact OH-OD1 3.29Å; Y144-D160 PolarHBondContact OH-OD2 3.46Å; K156-D160 IonicContact NZ-OD2 3.67Å; K156-D160 PolarHBondContact NZ-OD2 3.2Å; K156-D160 WeakPolarHBondContact O-CB 3.22Å; K156-D160 PolarHBondContact O-N 2.88Å; R157-D160 PolarHBondContact O-N 3.06Å; L158-D160 VanDerWaalsContact C-N 3.35Å; D160-L162 VanDerWaalsContact C-N 3.35Å; D160-L162 PolarHBondContact O-N 3.31Å; D160-L164 WeakPolarHBondContact O-CB 3.46Å; D160-L164 WeakPolarHBondContact O-CD1 3.41Å; D160-L164 VanDerWaalsContact O-CG 3.22Å; D160-L164 WeakPolarHBondContact O-CG 3.35Å; D160-L164 PolarHBondContact O-N 3.1Å; D160-L164 VanDerWaalsContact O-N 3.1Å; D160-S215 VanDerWaalsContact OD1-CB 3.29Å; D160-S215 WeakPolarHBondContact OD1-CB 3.16Å; D160-S215 PolarHBondContact OD1-OG 2.8Å |
| 161 | E | 96.4 | Very high | 94.5 | Very high | 92 Ų | 92 | 54.7 Ų | 54.7 | 43% | 0.43 | 27% | 0.27 | S | S | . | . | H | α-helix | trans | -62.5 | -40 | 175.1 | -77.1 | -179.8 | -169.3 | 0 | 0 | 111.9 | R157 L158 R165 | R157-E161 HydrophobicContact CG-CG 4.5Å; R157-E161 IonicContact CZ-OE1 2.77Å; R157-E161 IonicContact NE-OE1 2.86Å; R157-E161 PolarHBondContact NE-OE1 3.43Å; R157-E161 IonicContact NH2-OE1 2.98Å; R157-E161 PolarHBondContact NH2-OE1 3.33Å; R157-E161 WeakPolarHBondContact O-CB 3.35Å; R157-E161 WeakPolarHBondContact O-CG 3.39Å; R157-E161 PolarHBondContact O-N 3.44Å; L158-E161 PolarHBondContact O-N 3.02Å; E161-R165 WeakPolarHBondContact O-CB 3.49Å; E161-R165 PolarHBondContact O-N 2.89Å |
| 162 | L | 96.9 | Very high | 95.1 | Very high | 7 Ų | 7 | 56 Ų | 56 | 4% | 0.037 | 26% | 0.255 | C | S | . | . | H | α-helix | trans | -61.3 | -53.8 | 177.1 | 178.2 | 73.6 | 0 | 0 | 0 | 111.3 | L49 F52 L137 L158 V159 D160 L164 R165 Y166 C253 L257 | L49-L162 HydrophobicContact CD2-CD1 3.68Å; F52-L162 HydrophobicContact CD1-CD2 4.14Å; F52-L162 HydrophobicContact CD2-CD1 4.2Å; F52-L162 HydrophobicContact CD2-CD2 4.17Å; F52-L162 HydrophobicContact CE1-CD2 4.01Å; F52-L162 HydrophobicContact CE2-CB 4.01Å; F52-L162 HydrophobicContact CE2-CD1 3.98Å; F52-L162 HydrophobicContact CE2-CD2 4.05Å; F52-L162 HydrophobicContact CE2-CG 4.23Å; F52-L162 HydrophobicContact CG-CD2 4.22Å; F52-L162 HydrophobicContact CZ-CB 3.82Å; F52-L162 HydrophobicContact CZ-CD2 3.95Å; F52-L162 HydrophobicContact CZ-CG 4.32Å; L137-L162 HydrophobicContact CD2-CD2 3.68Å; L158-L162 WeakPolarHBondContact O-CB 3.41Å; L158-L162 PolarHBondContact O-N 3.25Å; V159-L162 WeakPolarHBondContact O-CB 3.45Å; V159-L162 PolarHBondContact O-N 2.89Å; D160-L162 VanDerWaalsContact C-N 3.35Å; D160-L162 PolarHBondContact O-N 3.31Å; L162-L164 PolarHBondContact O-N 3.44Å; L162-R165 PolarHBondContact O-N 3.28Å; L162-Y166 HydrophobicContact CD1-CD2 3.56Å; L162-Y166 HydrophobicContact CD1-CE2 3.97Å; L162-Y166 HydrophobicContact CD1-CG 4.36Å; L162-Y166 HydrophobicContact CG-CD2 4.48Å; L162-Y166 WeakPolarHBondContact O-CB 3.09Å; L162-Y166 PolarHBondContact O-N 2.89Å; L162-C253 HydrophobicContact CD2-CB 4.07Å; L162-L257 HydrophobicContact CD1-CD1 3.78Å; L162-L257 HydrophobicContact CD1-CD2 3.98Å; L162-L257 HydrophobicContact CD1-CG 4.25Å; L162-L257 HydrophobicContact CD2-CD1 4.16Å |
| 163 | Q | 97.3 | Very high | 95.5 | Very high | 1 Ų | 1 | 53.1 Ų | 53.1 | 1% | 0.005 | 25% | 0.245 | C | C | . | . | H | α-helix | trans | -62.2 | -42.7 | -176.3 | -73.5 | -177.6 | -15.8 | 0 | 0 | 112.1 | V159 Q167 C168 W177 S215 C216 | V159-Q163 HydrophobicContact CG1-CG 4.38Å; V159-Q163 WeakPolarHBondContact O-CG 3.46Å; V159-Q163 PolarHBondContact O-N 3.44Å; Q163-Q167 WeakPolarHBondContact O-CA 3.3Å; Q163-Q167 PolarHBondContact O-N 3.25Å; Q163-C168 WeakPolarHBondContact CA-O 3.48Å; Q163-C168 VanDerWaalsContact CB-O 3.23Å; Q163-C168 WeakPolarHBondContact CB-O 3.31Å; Q163-C168 WeakPolarHBondContact CG-O 2.99Å; Q163-C168 PolarHBondContact O-N 2.96Å; Q163-W177 VanDerWaalsContact NE2-CZ2 3.33Å; Q163-S215 PolarHBondContact OE1-OG 3.32Å; Q163-C216 PolarHBondContact OE1-SG 2.99Å |
| 164 | L | 95.8 | Very high | 95.7 | Very high | 86 Ų | 86 | 52.3 Ų | 52.3 | 45% | 0.45 | 23% | 0.234 | S | C | . | . | H | α-helix | trans | -67.7 | -39.2 | 177.2 | -69.2 | 170.8 | 0 | 0 | 0 | 112.4 | D160 L162 F214 | D160-L164 WeakPolarHBondContact O-CB 3.46Å; D160-L164 WeakPolarHBondContact O-CD1 3.41Å; D160-L164 VanDerWaalsContact O-CG 3.22Å; D160-L164 WeakPolarHBondContact O-CG 3.35Å; D160-L164 PolarHBondContact O-N 3.1Å; D160-L164 VanDerWaalsContact O-N 3.1Å; L162-L164 PolarHBondContact O-N 3.44Å; L164-F214 HydrophobicContact CD1-CE2 4.19Å; L164-F214 HydrophobicContact CD1-CZ 4.5Å |
| 165 | R | 95.3 | Very high | 95.8 | Very high | 159 Ų | 159 | 53.8 Ų | 53.8 | 60% | 0.6 | 24% | 0.238 | S | C | * | . | H | α-helix | trans | -77.2 | -41.1 | -176.1 | -173.3 | 173 | -167.3 | 170.9 | 2.2 | 113 | E161 L162 | E161-R165 WeakPolarHBondContact O-CB 3.49Å; E161-R165 PolarHBondContact O-N 2.89Å; L162-R165 PolarHBondContact O-N 3.28Å |
| 166 | Y | 95.8 | Very high | 96 | Very high | 34 Ų | 34 | 55 Ų | 55 | 13% | 0.133 | 24% | 0.243 | C | C | . | . | H | α-helix | trans | -99.1 | 4.6 | -176.3 | -69.9 | -88.3 | 0 | 0 | 0 | 113.2 | Q45 L49 L162 C168 V256 L257 H260 | Q45-Y166 PolarHBondContact OE1-OH 3.28Å; L49-Y166 HydrophobicContact CD2-CE2 3.8Å; L162-Y166 HydrophobicContact CD1-CD2 3.56Å; L162-Y166 HydrophobicContact CD1-CE2 3.97Å; L162-Y166 HydrophobicContact CD1-CG 4.36Å; L162-Y166 HydrophobicContact CG-CD2 4.48Å; L162-Y166 WeakPolarHBondContact O-CB 3.09Å; L162-Y166 PolarHBondContact O-N 2.89Å; Y166-C168 VanDerWaalsContact C-N 3.26Å; Y166-C168 PolarHBondContact O-N 2.9Å; Y166-V256 HydrophobicContact CD1-CG1 4.38Å; Y166-L257 HydrophobicContact CD1-CD2 3.87Å; Y166-L257 HydrophobicContact CD2-CD2 4.19Å; Y166-L257 HydrophobicContact CE1-CD2 3.89Å; Y166-L257 HydrophobicContact CE2-CD2 4.21Å; Y166-L257 HydrophobicContact CG-CD2 4.02Å; Y166-H260 AromaticContact CE1-CD2 3.9Å |
| 167 | Q | 95.9 | Very high | 96 | Very high | 96 Ų | 96 | 51.9 Ų | 51.9 | 45% | 0.449 | 23% | 0.229 | S | C | . | . | T | Hydrogen-bonded Turn | trans | 56.2 | 43.4 | 173.3 | -56.6 | -179.9 | 10.4 | 0 | 0 | 112.3 | Q163 W249 | Q163-Q167 WeakPolarHBondContact O-CA 3.3Å; Q163-Q167 PolarHBondContact O-N 3.25Å; Q167-W249 VanDerWaalsContact C-CG 3.41Å; Q167-W249 HydrophobicContact CB-CD2 3.77Å; Q167-W249 HydrophobicContact CB-CE3 3.79Å; Q167-W249 HydrophobicContact CB-CG 4.48Å; Q167-W249 HydrophobicContact CB-CH2 3.73Å; Q167-W249 HydrophobicContact CB-CZ2 3.71Å; Q167-W249 HydrophobicContact CB-CZ3 3.78Å; Q167-W249 HydrophobicContact CG-CH2 3.69Å; Q167-W249 HydrophobicContact CG-CZ2 3.58Å; Q167-W249 HydrophobicContact CG-CZ3 4.24Å; Q167-W249 WeakPolarHBondContact O-CB 3.35Å |
| 168 | C | 97 | Very high | 95.9 | Very high | 0 Ų | 0 | 46.7 Ų | 46.7 | 0% | 0 | 21% | 0.211 | C | C | . | . | trans | -130.3 | 163.2 | -176.2 | 64.5 | 0 | 0 | 0 | 0 | 109.9 | Q163 Y166 Q251 C253 V256 | Q163-C168 WeakPolarHBondContact CA-O 3.48Å; Q163-C168 VanDerWaalsContact CB-O 3.23Å; Q163-C168 WeakPolarHBondContact CB-O 3.31Å; Q163-C168 WeakPolarHBondContact CG-O 2.99Å; Q163-C168 PolarHBondContact O-N 2.96Å; Y166-C168 VanDerWaalsContact C-N 3.26Å; Y166-C168 PolarHBondContact O-N 2.9Å; C168-Q251 CarbonylContact C-O 3.42Å; C168-Q251 WeakPolarHBondContact CA-O 3.31Å; C168-C253 VanDerWaalsContact C-SG 3.57Å; C168-C253 HydrophobicContact CB-CB 3.85Å; C168-C253 WeakPolarHBondContact CB-SG 2.97Å; C168-C253 WeakPolarHBondContact SG-CA 3.26Å; C168-C253 WeakPolarHBondContact SG-CB 3.41Å; C168-C253 CovalentContact SG-SG 2.04Å; C168-C253 PolarHBondContact SG-SG 2.89Å; C168-V256 HydrophobicContact CB-CB 4.41Å; C168-V256 HydrophobicContact CB-CG2 4.09Å | ||
| 169 | C | 97 | Very high | 95.8 | Very high | 0 Ų | 0 | 46.8 Ų | 46.8 | 0% | 0 | 23% | 0.225 | C | C | . | . | trans | -143.8 | 136.9 | 176.9 | 179.5 | 0 | 0 | 0 | 0 | 111.3 | G173 Y174 C216 W249 Q251 | C169-G173 CarbonylContact O-C 3.58Å; C169-G173 WeakPolarHBondContact O-CA 3.28Å; C169-Y174 PolarHBondContact O-N 3.48Å; C169-Y174 WeakPolarHBondContact SG-CA 3.4Å; C169-Y174 WeakPolarHBondContact SG-CB 3.43Å; C169-C216 HydrophobicContact CB-CB 3.67Å; C169-C216 WeakPolarHBondContact CB-SG 3.17Å; C169-C216 WeakPolarHBondContact SG-CB 3.24Å; C169-C216 CovalentContact SG-SG 2.01Å; C169-C216 PolarHBondContact SG-SG 2.9Å; C169-W249 HydrophobicContact CB-CB 4.15Å; C169-W249 WeakPolarHBondContact CB-O 3.3Å; C169-Q251 PolarHBondContact N-O 3.49Å | ||
| 170 | G | 96.9 | Very high | 95.6 | Very high | 0 Ų | 0 | 48 Ų | 48 | 0% | 0 | 23% | 0.233 | C | C | . | . | S | Bend | trans | 66.5 | -161.1 | -174.8 | 0 | 0 | 0 | 0 | 0 | 112.4 | C253 | G170-C253 VanDerWaalsContact O-CB 3.26Å; G170-C253 WeakPolarHBondContact O-CB 3.47Å; G170-C253 PolarHBondContact O-N 3.37Å; G170-C253 PolarHBondContact O-SG 3.32Å; G170-C253 VanDerWaalsContact O-SG 3.36Å |
| 171 | R | 97 | Very high | 95.4 | Very high | 74 Ų | 74 | 48.1 Ų | 48.1 | 28% | 0.279 | 23% | 0.232 | S | C | . | . | S | Bend | trans | -90.6 | -60.1 | 176.5 | 169.8 | 177.2 | 39.3 | 175.5 | -8 | 110 | E134 L137 L141 D176 G252 C253 H254 | E134-R171 IonicContact OE2-NH1 3.38Å; L137-R171 HydrophobicContact CB-CB 4.33Å; L137-R171 HydrophobicContact CB-CG 4.11Å; L141-R171 HydrophobicContact CD2-CB 4.23Å; R171-D176 WeakPolarHBondContact CA-OD2 3.22Å; R171-D176 WeakPolarHBondContact CB-OD2 3.35Å; R171-D176 PolarHBondContact N-OD2 2.99Å; R171-G252 CarbonylContact O-C 3.44Å; R171-G252 VanDerWaalsContact O-C 3.27Å; R171-G252 WeakPolarHBondContact O-CA 3.36Å; R171-C253 PolarHBondContact O-N 2.86Å; R171-H254 HydrophobicContact CG-CB 4.32Å; R171-H254 VanDerWaalsContact O-CB 3.22Å; R171-H254 WeakPolarHBondContact O-CB 3.39Å; R171-H254 PolarHBondContact O-N 3.45Å |
| 172 | H | 97.2 | Very high | 95.2 | Very high | 106 Ų | 106 | 45.5 Ų | 45.5 | 49% | 0.491 | 22% | 0.218 | S | C | . | . | S | Bend | trans | -98.8 | -18.6 | 174 | -69.4 | -65.2 | 0 | 0 | 0 | 112.7 | E134 D176 G252 | E134-H172 IonicContact OE1-CD2 3.38Å; E134-H172 IonicContact OE1-CE1 3.83Å; E134-H172 PolarHBondContact OE1-CE1 3.45Å; E134-H172 IonicContact OE1-NE2 3.16Å; E134-H172 PolarHBondContact OE1-NE2 3.33Å; E134-H172 IonicContact OE2-CE1 3.78Å; E134-H172 IonicContact OE2-NE2 2.98Å; E134-H172 PolarHBondContact OE2-NE2 2.92Å; H172-D176 PolarHBondContact N-OD2 3.06Å; H172-G252 WeakPolarHBondContact O-CA 3.21Å; H172-G252 PolarHBondContact O-N 3.39Å |
| 173 | G | 95.1 | Very high | 95 | Very high | 9 Ų | 9 | 46.5 Ų | 46.5 | 9% | 0.093 | 23% | 0.225 | C | C | . | . | S | Bend | trans | 169.2 | 178.3 | 173.6 | 0 | 0 | 0 | 0 | 0 | 112.1 | C169 K175 D176 | C169-G173 CarbonylContact O-C 3.58Å; C169-G173 WeakPolarHBondContact O-CA 3.28Å; G173-K175 PolarHBondContact O-N 2.94Å; G173-D176 PolarHBondContact N-OD2 3.3Å; G173-D176 WeakPolarHBondContact O-CB 3.07Å; G173-D176 VanDerWaalsContact O-CG 3.26Å; G173-D176 PolarHBondContact O-N 3.29Å; G173-D176 VanDerWaalsContact O-N 3.08Å |
| 174 | Y | 93.9 | Very high | 94.7 | Very high | 39 Ų | 39 | 47.4 Ų | 47.4 | 15% | 0.153 | 23% | 0.232 | C | C | . | . | G | 310 helix | trans | -60.5 | -24.8 | -174.1 | 75 | -88 | 0 | 0 | 0 | 114.9 | C169 D176 W177 F178 V212 L230 P244 L248 | C169-Y174 PolarHBondContact O-N 3.48Å; C169-Y174 WeakPolarHBondContact SG-CA 3.4Å; C169-Y174 WeakPolarHBondContact SG-CB 3.43Å; Y174-D176 PolarHBondContact O-N 2.02Å; Y174-W177 PolarHBondContact O-N 3.35Å; Y174-F178 HydrophobicContact CD2-CE1 4.49Å; Y174-F178 AromaticContact CD2-CZ 3.99Å; Y174-F178 HydrophobicContact CD2-CZ 3.99Å; Y174-F178 HydrophobicContact CE2-CE2 4.32Å; Y174-F178 AromaticContact CE2-CZ 3.84Å; Y174-F178 HydrophobicContact CE2-CZ 3.84Å; Y174-V212 HydrophobicContact CD2-CG1 4.16Å; Y174-L230 HydrophobicContact CD2-CD1 4.27Å; Y174-L230 HydrophobicContact CE2-CD1 4.41Å; Y174-P244 HydrophobicContact CE1-CB 4.23Å; Y174-L248 HydrophobicContact CD2-CD1 4.02Å; Y174-L248 HydrophobicContact CG-CD1 4.21Å |
| 175 | K | 93.3 | Very high | 94.3 | Very high | 128 Ų | 128 | 46.8 Ų | 46.8 | 56% | 0.557 | 23% | 0.234 | S | C | * | . | G | 310 helix | trans | -69.1 | -16.6 | 179.4 | -66.1 | -174.8 | 178.1 | 178 | 0 | 113.4 | G173 W177 F178 | G173-K175 PolarHBondContact O-N 2.94Å; K175-W177 PolarHBondContact O-N 3.28Å; K175-F178 HydrophobicContact CB-CD2 4.2Å; K175-F178 HydrophobicContact CB-CE2 4.27Å; K175-F178 HydrophobicContact CG-CD2 4.26Å; K175-F178 HydrophobicContact CG-CE2 3.87Å; K175-F178 HydrophobicContact CG-CZ 4.45Å; K175-F178 WeakPolarHBondContact O-CB 3.34Å; K175-F178 PolarHBondContact O-N 2.94Å |
| 176 | D | 95.5 | Very high | 94 | Very high | 40 Ų | 40 | 46 Ų | 46 | 21% | 0.214 | 23% | 0.231 | C | C | . | . | G | 310 helix | trans | -58.7 | -31.5 | 175.1 | -65.1 | -27.1 | 0 | 0 | 0 | 111.7 | L141 R171 H172 G173 Y174 F178 G179 | L141-D176 HydrophobicContact CD2-CB 3.98Å; R171-D176 WeakPolarHBondContact CA-OD2 3.22Å; R171-D176 WeakPolarHBondContact CB-OD2 3.35Å; R171-D176 PolarHBondContact N-OD2 2.99Å; H172-D176 PolarHBondContact N-OD2 3.06Å; G173-D176 PolarHBondContact N-OD2 3.3Å; G173-D176 WeakPolarHBondContact O-CB 3.07Å; G173-D176 VanDerWaalsContact O-CG 3.26Å; G173-D176 PolarHBondContact O-N 3.29Å; G173-D176 VanDerWaalsContact O-N 3.08Å; Y174-D176 PolarHBondContact O-N 2.02Å; D176-F178 PolarHBondContact O-N 3.38Å; D176-G179 PolarHBondContact O-N 3.41Å |
| 177 | W | 95.8 | Very high | 93.7 | Very high | 0 Ų | 0 | 51.2 Ų | 51.2 | 0% | 0 | 25% | 0.252 | C | S | . | . | G | 310 helix | trans | -64.9 | -20.3 | 176.5 | -68.1 | 115 | 0 | 0 | 0 | 113.7 | L141 Y144 V159 Q163 Y174 K175 G179 V180 W182 V212 P213 C216 | L141-W177 HydrophobicContact CG-CH2 4.17Å; L141-W177 HydrophobicContact CG-CZ2 4.39Å; L141-W177 HydrophobicContact CG-CZ3 4.41Å; Y144-W177 AromaticContact CD1-CH2 3.99Å; Y144-W177 HydrophobicContact CD1-CH2 3.99Å; Y144-W177 AromaticContact CD1-CZ3 3.86Å; Y144-W177 HydrophobicContact CD1-CZ3 3.86Å; Y144-W177 AromaticContact CD2-CH2 3.51Å; Y144-W177 HydrophobicContact CD2-CH2 3.51Å; Y144-W177 HydrophobicContact CD2-CZ2 4.48Å; Y144-W177 HydrophobicContact CD2-CZ3 4.17Å; Y144-W177 HydrophobicContact CE1-CH2 4.26Å; Y144-W177 HydrophobicContact CE1-CZ3 4.33Å; Y144-W177 AromaticContact CE2-CH2 3.81Å; Y144-W177 HydrophobicContact CE2-CH2 3.81Å; Y144-W177 HydrophobicContact CE2-CZ2 4.46Å; Y144-W177 AromaticContact CG-CH2 3.57Å; Y144-W177 HydrophobicContact CG-CH2 3.57Å; Y144-W177 AromaticContact CG-CZ3 3.74Å; Y144-W177 HydrophobicContact CG-CZ3 3.74Å; V159-W177 HydrophobicContact CG1-CH2 4.04Å; V159-W177 HydrophobicContact CG1-CZ2 3.95Å; Q163-W177 VanDerWaalsContact NE2-CZ2 3.33Å; Y174-W177 PolarHBondContact O-N 3.35Å; K175-W177 PolarHBondContact O-N 3.28Å; W177-G179 VanDerWaalsContact C-N 3.3Å; W177-V180 PolarHBondContact O-N 3.44Å; W177-V180 VanDerWaalsContact O-O 3.07Å; W177-W182 HydrophobicContact CE3-CB 3.53Å; W177-W182 AromaticContact CE3-CD1 3.74Å; W177-W182 AromaticContact CE3-CG 3.7Å; W177-W182 HydrophobicContact CE3-CG 3.7Å; W177-W182 HydrophobicContact CZ3-CB 3.47Å; W177-W182 VanDerWaalsContact CZ3-CB 3.47Å; W177-W182 HydrophobicContact CZ3-CG 4.1Å; W177-V212 HydrophobicContact CB-CG1 4.16Å; W177-V212 HydrophobicContact CG-CG1 4.37Å; W177-P213 VanDerWaalsContact CD2-CD 3.5Å; W177-P213 HydrophobicContact CD2-CG 3.98Å; W177-P213 VanDerWaalsContact CE2-CD 3.48Å; W177-P213 VanDerWaalsContact CE2-CG 3.5Å; W177-P213 HydrophobicContact CE3-CG 4.44Å; W177-P213 HydrophobicContact CH2-CG 4.08Å; W177-P213 HydrophobicContact CZ2-CG 3.54Å; W177-C216 PolarHBondContact NE1-SG 3.38Å |
| 178 | F | 93.5 | Very high | 93.5 | Very high | 39 Ų | 39 | 47.9 Ų | 47.9 | 17% | 0.171 | 24% | 0.237 | C | C | . | . | G | 310 helix | trans | -75.4 | -25.9 | 178.6 | -55.2 | -11.3 | 0 | 0 | 0 | 111.6 | Y174 K175 D176 D210 V212 L230 S231 | Y174-F178 HydrophobicContact CD2-CE1 4.49Å; Y174-F178 AromaticContact CD2-CZ 3.99Å; Y174-F178 HydrophobicContact CD2-CZ 3.99Å; Y174-F178 HydrophobicContact CE2-CE2 4.32Å; Y174-F178 AromaticContact CE2-CZ 3.84Å; Y174-F178 HydrophobicContact CE2-CZ 3.84Å; K175-F178 HydrophobicContact CB-CD2 4.2Å; K175-F178 HydrophobicContact CB-CE2 4.27Å; K175-F178 HydrophobicContact CG-CD2 4.26Å; K175-F178 HydrophobicContact CG-CE2 3.87Å; K175-F178 HydrophobicContact CG-CZ 4.45Å; K175-F178 WeakPolarHBondContact O-CB 3.34Å; K175-F178 PolarHBondContact O-N 2.94Å; D176-F178 PolarHBondContact O-N 3.38Å; F178-D210 WeakPolarHBondContact CE2-OD1 3.42Å; F178-D210 WeakPolarHBondContact CZ-OD1 3.45Å; F178-V212 HydrophobicContact CE1-CG1 4.06Å; F178-L230 HydrophobicContact CE1-CD1 4.02Å; F178-L230 HydrophobicContact CZ-CB 3.87Å; F178-L230 HydrophobicContact CZ-CD1 3.97Å; F178-S231 WeakPolarHBondContact CE2-OG 3.45Å |
| 179 | G | 91.9 | Very high | 93.2 | Very high | 55 Ų | 55 | 51.9 Ų | 51.9 | 57% | 0.567 | 26% | 0.258 | S | S | * | . | G | 310 helix | trans | -91.2 | 0.2 | 176.8 | 0 | 0 | 0 | 0 | 0 | 114.1 | D176 W177 | D176-G179 PolarHBondContact O-N 3.41Å; W177-G179 VanDerWaalsContact C-N 3.3Å |
| 180 | V | 92.6 | Very high | 92.7 | Very high | 29 Ų | 29 | 57 Ų | 57 | 18% | 0.176 | 29% | 0.291 | C | S | . | . | S | Bend | trans | -123.2 | 130 | -176.5 | 178.8 | 0 | 0 | 0 | 0 | 109.8 | W177 W182 | W177-V180 PolarHBondContact O-N 3.44Å; W177-V180 VanDerWaalsContact O-O 3.07Å; V180-W182 VanDerWaalsContact C-N 3.32Å; V180-W182 VanDerWaalsContact O-CD1 3.32Å; V180-W182 PolarHBondContact O-N 3.47Å |
| 181 | Q | 92.8 | Very high | 92.4 | Very high | 16 Ų | 16 | 61.1 Ų | 61.1 | 8% | 0.075 | 32% | 0.32 | C | S | . | . | trans | -73.1 | 90.5 | 167.6 | -177.8 | -172.3 | 0.1 | 0 | 0 | 109.1 | K145 V183 L206 Y207 L208 | K145-Q181 HydrophobicContact CD-CG 4.26Å; K145-Q181 VanDerWaalsContact CD-O 3.26Å; K145-Q181 WeakPolarHBondContact CD-O 3.31Å; K145-Q181 WeakPolarHBondContact CG-O 3.07Å; Q181-V183 PolarHBondContact NE2-O 2.96Å; Q181-L206 HydrophobicContact CB-CB 4.31Å; Q181-L206 HydrophobicContact CB-CD2 4.39Å; Q181-Y207 WeakPolarHBondContact CG-O 3.33Å; Q181-L208 HydrophobicContact CB-CD2 4.49Å | ||
| 182 | W | 93.6 | Very high | 92.3 | Very high | 37 Ų | 37 | 60.9 Ų | 60.9 | 14% | 0.14 | 32% | 0.324 | C | S | . | . | trans | -92.3 | -16.1 | 179.6 | 63.6 | -97.3 | 0 | 0 | 0 | 113 | Y144 W177 V180 G211 P213 | Y144-W182 HydrophobicContact CD1-CB 3.73Å; Y144-W182 HydrophobicContact CE1-CB 4.23Å; Y144-W182 HydrophobicContact CE1-CE3 4.08Å; W177-W182 HydrophobicContact CE3-CB 3.53Å; W177-W182 AromaticContact CE3-CD1 3.74Å; W177-W182 AromaticContact CE3-CG 3.7Å; W177-W182 HydrophobicContact CE3-CG 3.7Å; W177-W182 HydrophobicContact CZ3-CB 3.47Å; W177-W182 VanDerWaalsContact CZ3-CB 3.47Å; W177-W182 HydrophobicContact CZ3-CG 4.1Å; V180-W182 VanDerWaalsContact C-N 3.32Å; V180-W182 VanDerWaalsContact O-CD1 3.32Å; V180-W182 PolarHBondContact O-N 3.47Å; W182-G211 PolarHBondContact NE1-O 2.98Å; W182-P213 HydrophobicContact CE3-CB 4.36Å; W182-P213 HydrophobicContact CZ3-CB 4.27Å | ||
| 183 | V | 92.3 | Very high | 92 | Very high | 29 Ų | 29 | 61.8 Ų | 61.8 | 18% | 0.176 | 33% | 0.329 | C | S | . | . | S | Bend | trans | -78.9 | 119.5 | 170.6 | -176.1 | 0 | 0 | 0 | 0 | 109.2 | Q181 L188 Y207 | Q181-V183 PolarHBondContact NE2-O 2.96Å; V183-L188 HydrophobicContact CG1-CD2 3.92Å; V183-L188 HydrophobicContact CG1-CG 4.42Å; V183-Y207 HydrophobicContact CB-CD1 4.3Å; V183-Y207 HydrophobicContact CB-CE1 4.49Å |
| 184 | S | 90.2 | Very high | 91.7 | Very high | 20 Ų | 20 | 66.5 Ų | 66.5 | 14% | 0.14 | 35% | 0.352 | C | S | . | . | trans | -66.3 | 138.7 | -178.9 | -166.4 | 0 | 0 | 0 | 0 | 111.8 | K145 R186 Y187 | K145-S184 WeakPolarHBondContact O-CB 3.37Å; K145-S184 PolarHBondContact O-OG 3.47Å; K145-S184 VanDerWaalsContact O-OG 3.05Å; S184-R186 PolarHBondContact O-N 3.19Å; S184-Y187 PolarHBondContact O-N 3.36Å | ||
| 185 | S | 88.2 | Confident | 91.5 | Very high | 72 Ų | 72 | 65.1 Ų | 65.1 | 50% | 0.503 | 35% | 0.348 | S | S | . | . | G | 310 helix | trans | -57.4 | -23.9 | -178.7 | -52.3 | 0 | 0 | 0 | 0 | 113.3 | Y187 L188 | S185-Y187 PolarHBondContact O-N 3.38Å; S185-L188 PolarHBondContact O-N 3.34Å; S185-L188 VanDerWaalsContact O-N 3.14Å |
| 186 | R | 88.4 | Confident | 91.3 | Very high | 142 Ų | 142 | 60.8 Ų | 60.8 | 54% | 0.536 | 33% | 0.332 | S | S | . | . | G | 310 helix | trans | -63.8 | -20.9 | 174.2 | 64.2 | 174.6 | -84.3 | -175.1 | -7.7 | 114.5 | E148 S184 | E148-R186 WeakPolarHBondContact OE1-CD 3.36Å; E148-R186 IonicContact OE1-CZ 3.4Å; E148-R186 IonicContact OE1-NE 3.67Å; E148-R186 IonicContact OE1-NH1 2.65Å; E148-R186 PolarHBondContact OE1-NH1 3.37Å; S184-R186 PolarHBondContact O-N 3.19Å |
| 187 | Y | 89.2 | Confident | 91 | Very high | 144 Ų | 144 | 63 Ų | 63 | 57% | 0.565 | 34% | 0.344 | S | S | * | . | G | 310 helix | trans | -97.2 | -1.2 | 178.3 | -55.9 | -64.1 | 0 | 0 | 0 | 112.2 | S184 S185 | S184-Y187 PolarHBondContact O-N 3.36Å; S185-Y187 PolarHBondContact O-N 3.38Å |
| 188 | L | 91.2 | Very high | 90.7 | Very high | 26 Ų | 26 | 68 Ų | 68 | 14% | 0.136 | 36% | 0.363 | C | S | . | . | S | Bend | trans | -99.3 | 123.5 | 179.5 | -58.9 | -179 | 0 | 0 | 0 | 108.7 | V183 S185 P190 V195 Y207 | V183-L188 HydrophobicContact CG1-CD2 3.92Å; V183-L188 HydrophobicContact CG1-CG 4.42Å; S185-L188 PolarHBondContact O-N 3.34Å; S185-L188 VanDerWaalsContact O-N 3.14Å; L188-P190 WeakPolarHBondContact O-CD 3.19Å; L188-V195 HydrophobicContact CB-CG1 4Å; L188-Y207 HydrophobicContact CD1-CD1 3.97Å; L188-Y207 HydrophobicContact CD1-CD2 4.04Å; L188-Y207 HydrophobicContact CD1-CG 3.6Å; L188-Y207 HydrophobicContact CD2-CD1 3.73Å; L188-Y207 HydrophobicContact CD2-CD2 4.09Å; L188-Y207 HydrophobicContact CD2-CE1 3.64Å; L188-Y207 HydrophobicContact CD2-CE2 4Å; L188-Y207 HydrophobicContact CD2-CG 3.96Å; L188-Y207 HydrophobicContact CG-CG 4.46Å |
| 189 | D | 91.6 | Very high | 90.4 | Very high | 84 Ų | 84 | 68.9 Ų | 68.9 | 45% | 0.449 | 37% | 0.368 | S | S | . | . | trans | -82.7 | 114 | 173.4 | -172.7 | -15.6 | 0 | 0 | 0 | 109.1 | S191 D192 | D189-S191 PolarHBondContact O-N 2.87Å; D189-S191 WeakPolarHBondContact OD1-CB 3.31Å; D189-S191 PolarHBondContact OD1-N 2.79Å; D189-S191 PolarHBondContact OD1-OG 3.24Å; D189-S191 PolarHBondContact OD2-OG 3.35Å; D189-D192 HydrophobicContact CB-CB 4.19Å; D189-D192 PolarHBondContact O-N 2.87Å | ||
| 190 | P | 87.1 | Confident | 90.2 | Very high | 107 Ų | 107 | 73.1 Ų | 73.1 | 70% | 0.695 | 37% | 0.373 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -71.1 | -9.5 | 179.9 | 31.6 | -36.4 | 0 | 0 | 0 | 113.2 | L188 V196 | L188-P190 WeakPolarHBondContact O-CD 3.19Å; P190-V196 WeakPolarHBondContact O-CG2 3.45Å |
| 191 | S | 91.3 | Very high | 89.8 | Confident | 88 Ų | 88 | 75.9 Ų | 75.9 | 62% | 0.615 | 39% | 0.394 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -87.9 | -13.7 | 175.1 | 72.5 | 0 | 0 | 0 | 0 | 113.5 | D189 | D189-S191 PolarHBondContact O-N 2.87Å; D189-S191 WeakPolarHBondContact OD1-CB 3.31Å; D189-S191 PolarHBondContact OD1-N 2.79Å; D189-S191 PolarHBondContact OD1-OG 3.24Å; D189-S191 PolarHBondContact OD2-OG 3.35Å |
| 192 | D | 93.1 | Very high | 89.4 | Confident | 68 Ų | 68 | 77.2 Ų | 77.2 | 36% | 0.364 | 40% | 0.402 | S | S | . | . | trans | -78.1 | 121.2 | 176.5 | -171.5 | -13.1 | 0 | 0 | 0 | 110.6 | D189 D194 V195 V196 | D189-D192 HydrophobicContact CB-CB 4.19Å; D189-D192 PolarHBondContact O-N 2.87Å; D192-D194 VanDerWaalsContact C-N 3.26Å; D192-D194 PolarHBondContact O-N 2.99Å; D192-D194 PolarHBondContact OD1-N 2.92Å; D192-V195 HydrophobicContact CB-CB 4.19Å; D192-V195 HydrophobicContact CB-CG2 3.86Å; D192-V195 WeakPolarHBondContact O-CB 3.49Å; D192-V195 PolarHBondContact O-N 3.15Å; D192-V195 VanDerWaalsContact O-N 3.15Å; D192-V196 WeakPolarHBondContact O-CG2 3.47Å; D192-V196 PolarHBondContact O-N 2.95Å; D192-V196 VanDerWaalsContact O-N 3.09Å | ||
| 193 | Q | 91.7 | Very high | 88.3 | Confident | 126 Ų | 126 | 82.6 Ų | 82.6 | 59% | 0.589 | 44% | 0.439 | S | S | * | . | H | α-helix | trans | -61.2 | -35.8 | 179.6 | -65.8 | -64.9 | -48.8 | 0 | 0 | 111.5 | V195 V196 D197 | Q193-V195 PolarHBondContact O-N 3.39Å; Q193-V196 PolarHBondContact O-N 2.97Å; Q193-D197 VanDerWaalsContact O-CB 3.28Å; Q193-D197 WeakPolarHBondContact O-CB 3.25Å; Q193-D197 PolarHBondContact O-N 3.21Å |
| 194 | D | 88.5 | Confident | 87.6 | Confident | 107 Ų | 107 | 88.5 Ų | 88.5 | 57% | 0.572 | 46% | 0.464 | S | S | * | . | H | α-helix | trans | -66.5 | -28.4 | 179.9 | -74.6 | -18.7 | 0 | 0 | 0 | 112 | D192 R198 | D192-D194 VanDerWaalsContact C-N 3.26Å; D192-D194 PolarHBondContact O-N 2.99Å; D192-D194 PolarHBondContact OD1-N 2.92Å; D194-R198 VanDerWaalsContact O-CB 3.29Å; D194-R198 WeakPolarHBondContact O-CB 3.41Å; D194-R198 PolarHBondContact O-N 3.25Å |
| 195 | V | 89.8 | Confident | 87.3 | Confident | 11 Ų | 11 | 89.7 Ų | 89.7 | 7% | 0.067 | 48% | 0.479 | C | S | . | . | H | α-helix | trans | -75.7 | -47.6 | 175.1 | 174.6 | 0 | 0 | 0 | 0 | 110.2 | L188 D192 Q193 R198 I199 Y207 | L188-V195 HydrophobicContact CB-CG1 4Å; D192-V195 HydrophobicContact CB-CB 4.19Å; D192-V195 HydrophobicContact CB-CG2 3.86Å; D192-V195 WeakPolarHBondContact O-CB 3.49Å; D192-V195 PolarHBondContact O-N 3.15Å; D192-V195 VanDerWaalsContact O-N 3.15Å; Q193-V195 PolarHBondContact O-N 3.39Å; V195-R198 PolarHBondContact O-N 3.31Å; V195-I199 HydrophobicContact CG1-CD1 3.94Å; V195-I199 WeakPolarHBondContact O-CG1 3.19Å; V195-I199 PolarHBondContact O-N 2.95Å; V195-Y207 HydrophobicContact CB-CE2 4.39Å; V195-Y207 HydrophobicContact CG1-CD2 4.18Å; V195-Y207 HydrophobicContact CG1-CE2 4.19Å; V195-Y207 HydrophobicContact CG2-CE2 4.26Å |
| 196 | V | 89.1 | Confident | 87.3 | Confident | 36 Ų | 36 | 88.1 Ų | 88.1 | 22% | 0.218 | 47% | 0.465 | C | S | . | . | H | α-helix | trans | -61.9 | -49.7 | 179.8 | 174.6 | 0 | 0 | 0 | 0 | 111 | P190 D192 Q193 R198 I199 Q200 | P190-V196 WeakPolarHBondContact O-CG2 3.45Å; D192-V196 WeakPolarHBondContact O-CG2 3.47Å; D192-V196 PolarHBondContact O-N 2.95Å; D192-V196 VanDerWaalsContact O-N 3.09Å; Q193-V196 PolarHBondContact O-N 2.97Å; V196-R198 VanDerWaalsContact C-N 3.26Å; V196-R198 PolarHBondContact O-N 2.94Å; V196-I199 PolarHBondContact O-N 3.12Å; V196-Q200 HydrophobicContact CG1-CG 4.39Å; V196-Q200 VanDerWaalsContact CG1-NE2 3.31Å; V196-Q200 WeakPolarHBondContact O-CG 3.47Å; V196-Q200 PolarHBondContact O-N 3.42Å |
| 197 | D | 89.4 | Confident | 87.4 | Confident | 87 Ų | 87 | 83.3 Ų | 83.3 | 47% | 0.465 | 45% | 0.448 | S | S | . | . | H | α-helix | trans | -58.9 | -40.5 | 179.5 | -74.3 | -12 | 0 | 0 | 0 | 111 | Q193 Q200 S201 | Q193-D197 VanDerWaalsContact O-CB 3.28Å; Q193-D197 WeakPolarHBondContact O-CB 3.25Å; Q193-D197 PolarHBondContact O-N 3.21Å; D197-Q200 PolarHBondContact O-N 2.78Å; D197-S201 VanDerWaalsContact O-CB 3.23Å; D197-S201 WeakPolarHBondContact O-CB 3.21Å; D197-S201 PolarHBondContact O-N 2.96Å; D197-S201 PolarHBondContact O-OG 2.97Å |
| 198 | R | 88.4 | Confident | 87.5 | Confident | 106 Ų | 106 | 78.3 Ų | 78.3 | 40% | 0.4 | 43% | 0.43 | S | S | . | . | H | α-helix | trans | -67.2 | -44.2 | 178.6 | -164.9 | 168.6 | -47 | -89.1 | -12.5 | 112.2 | D194 V195 V196 Q200 S201 N202 Y207 L208 | D194-R198 VanDerWaalsContact O-CB 3.29Å; D194-R198 WeakPolarHBondContact O-CB 3.41Å; D194-R198 PolarHBondContact O-N 3.25Å; V195-R198 PolarHBondContact O-N 3.31Å; V196-R198 VanDerWaalsContact C-N 3.26Å; V196-R198 PolarHBondContact O-N 2.94Å; R198-Q200 VanDerWaalsContact C-N 3.33Å; R198-Q200 PolarHBondContact O-N 3.08Å; R198-S201 WeakPolarHBondContact CA-OG 3.28Å; R198-S201 PolarHBondContact O-N 3.1Å; R198-S201 PolarHBondContact O-OG 3.04Å; R198-N202 PolarHBondContact O-ND2 3.44Å; R198-Y207 HydrophobicContact CB-CD2 4.19Å; R198-Y207 HydrophobicContact CB-CE2 4.11Å; R198-Y207 HydrophobicContact CG-CD2 4.22Å; R198-Y207 HydrophobicContact CG-CE2 4.19Å; R198-L208 WeakPolarHBondContact CD-O 3.46Å |
| 199 | I | 88 | Confident | 87.4 | Confident | 56 Ų | 56 | 78.2 Ų | 78.2 | 29% | 0.287 | 43% | 0.431 | S | S | . | . | H | α-helix | trans | -59.6 | -45.5 | 174.8 | -72.9 | 170 | 0 | 0 | 0 | 110.5 | V195 V196 S201 N202 G205 Y207 | V195-I199 HydrophobicContact CG1-CD1 3.94Å; V195-I199 WeakPolarHBondContact O-CG1 3.19Å; V195-I199 PolarHBondContact O-N 2.95Å; V196-I199 PolarHBondContact O-N 3.12Å; I199-S201 PolarHBondContact O-N 3.4Å; I199-N202 PolarHBondContact O-N 3.45Å; I199-G205 WeakPolarHBondContact CG2-O 2.97Å; I199-G205 WeakPolarHBondContact O-CA 3.3Å; I199-Y207 HydrophobicContact CG1-CD2 4.13Å |
| 200 | Q | 87.4 | Confident | 87.4 | Confident | 144 Ų | 144 | 76.4 Ų | 76.4 | 67% | 0.673 | 42% | 0.421 | S | S | * | . | H | α-helix | trans | -69.5 | -31.5 | -178.7 | -70.4 | -179.8 | 8.2 | 0 | 0 | 113.5 | V196 D197 R198 N202 | V196-Q200 HydrophobicContact CG1-CG 4.39Å; V196-Q200 VanDerWaalsContact CG1-NE2 3.31Å; V196-Q200 WeakPolarHBondContact O-CG 3.47Å; V196-Q200 PolarHBondContact O-N 3.42Å; D197-Q200 PolarHBondContact O-N 2.78Å; R198-Q200 VanDerWaalsContact C-N 3.33Å; R198-Q200 PolarHBondContact O-N 3.08Å; Q200-N202 VanDerWaalsContact C-N 3.3Å; Q200-N202 PolarHBondContact O-N 3.34Å |
| 201 | S | 84.6 | Confident | 87.6 | Confident | 88 Ų | 88 | 71.3 Ų | 71.3 | 62% | 0.615 | 39% | 0.388 | S | S | * | . | H | α-helix | trans | -73.3 | -17.4 | -179.7 | 69.5 | 0 | 0 | 0 | 0 | 114.5 | D197 R198 I199 | D197-S201 VanDerWaalsContact O-CB 3.23Å; D197-S201 WeakPolarHBondContact O-CB 3.21Å; D197-S201 PolarHBondContact O-N 2.96Å; D197-S201 PolarHBondContact O-OG 2.97Å; R198-S201 WeakPolarHBondContact CA-OG 3.28Å; R198-S201 PolarHBondContact O-N 3.1Å; R198-S201 PolarHBondContact O-OG 3.04Å; I199-S201 PolarHBondContact O-N 3.4Å |
| 202 | N | 84.3 | Confident | 87.8 | Confident | 44 Ų | 44 | 67.1 Ų | 67.1 | 24% | 0.235 | 36% | 0.359 | C | S | . | . | S | Bend | trans | -97.2 | 144.9 | -175 | -77.1 | -57 | 0 | 0 | 0 | 112.2 | R198 I199 Q200 E204 G205 L206 L208 | R198-N202 PolarHBondContact O-ND2 3.44Å; I199-N202 PolarHBondContact O-N 3.45Å; Q200-N202 VanDerWaalsContact C-N 3.3Å; Q200-N202 PolarHBondContact O-N 3.34Å; N202-E204 PolarHBondContact O-N 3Å; N202-G205 PolarHBondContact O-N 3.35Å; N202-G205 VanDerWaalsContact O-N 3.14Å; N202-L206 WeakPolarHBondContact CB-O 3.31Å; N202-L206 PolarHBondContact ND2-O 3.17Å; N202-L208 HydrophobicContact CB-CD1 4.49Å |
| 203 | V | 69.5 | Low | 88 | Confident | 150 Ų | 150 | 64 Ų | 64 | 91% | 0.909 | 34% | 0.342 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -59.9 | -19.8 | -168.2 | -174.5 | 0 | 0 | 0 | 0 | 113.8 | ||
| 204 | E | 79.1 | Confident | 88.1 | Confident | 152 Ų | 152 | 63.1 Ų | 63.1 | 71% | 0.71 | 34% | 0.336 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -120.8 | 9.1 | -175.6 | -63.1 | -176.3 | 171.4 | 0 | 0 | 114 | N202 L206 | N202-E204 PolarHBondContact O-N 3Å; E204-L206 HydrophobicContact CB-CD1 3.94Å; E204-L206 HydrophobicContact CB-CG 3.82Å; E204-L206 PolarHBondContact O-N 2.91Å; E204-L206 WeakPolarHBondContact OE2-CD1 3.37Å |
| 205 | G | 82.9 | Confident | 88.5 | Confident | 45 Ų | 45 | 58 Ų | 58 | 46% | 0.464 | 31% | 0.309 | S | S | . | . | S | Bend | trans | 64.8 | 24.6 | -173.1 | 0 | 0 | 0 | 0 | 0 | 112.9 | I199 N202 | I199-G205 WeakPolarHBondContact CG2-O 2.97Å; I199-G205 WeakPolarHBondContact O-CA 3.3Å; N202-G205 PolarHBondContact O-N 3.35Å; N202-G205 VanDerWaalsContact O-N 3.14Å |
| 206 | L | 87.8 | Confident | 88.8 | Confident | 39 Ų | 39 | 57.5 Ų | 57.5 | 20% | 0.204 | 31% | 0.306 | C | S | . | . | trans | -94.7 | 146.3 | 178.5 | -65.6 | 179.7 | 0 | 0 | 0 | 110.6 | Q181 N202 E204 L208 | Q181-L206 HydrophobicContact CB-CB 4.31Å; Q181-L206 HydrophobicContact CB-CD2 4.39Å; N202-L206 WeakPolarHBondContact CB-O 3.31Å; N202-L206 PolarHBondContact ND2-O 3.17Å; E204-L206 HydrophobicContact CB-CD1 3.94Å; E204-L206 HydrophobicContact CB-CG 3.82Å; E204-L206 PolarHBondContact O-N 2.91Å; E204-L206 WeakPolarHBondContact OE2-CD1 3.37Å; L206-L208 VanDerWaalsContact C-N 3.32Å; L206-L208 HydrophobicContact CB-CD2 4.06Å; L206-L208 HydrophobicContact CB-CG 4.08Å; L206-L208 HydrophobicContact CD1-CD2 4.43Å; L206-L208 PolarHBondContact O-N 3.27Å | ||
| 207 | Y | 90.4 | Very high | 89 | Confident | 42 Ų | 42 | 56.6 Ų | 56.6 | 17% | 0.165 | 30% | 0.301 | C | S | . | . | trans | -80 | 80.9 | 169.7 | -172.4 | -94.2 | 0 | 0 | 0 | 109.9 | Q181 V183 L188 V195 R198 I199 T209 | Q181-Y207 WeakPolarHBondContact CG-O 3.33Å; V183-Y207 HydrophobicContact CB-CD1 4.3Å; V183-Y207 HydrophobicContact CB-CE1 4.49Å; L188-Y207 HydrophobicContact CD1-CD1 3.97Å; L188-Y207 HydrophobicContact CD1-CD2 4.04Å; L188-Y207 HydrophobicContact CD1-CG 3.6Å; L188-Y207 HydrophobicContact CD2-CD1 3.73Å; L188-Y207 HydrophobicContact CD2-CD2 4.09Å; L188-Y207 HydrophobicContact CD2-CE1 3.64Å; L188-Y207 HydrophobicContact CD2-CE2 4Å; L188-Y207 HydrophobicContact CD2-CG 3.96Å; L188-Y207 HydrophobicContact CG-CG 4.46Å; V195-Y207 HydrophobicContact CB-CE2 4.39Å; V195-Y207 HydrophobicContact CG1-CD2 4.18Å; V195-Y207 HydrophobicContact CG1-CE2 4.19Å; V195-Y207 HydrophobicContact CG2-CE2 4.26Å; R198-Y207 HydrophobicContact CB-CD2 4.19Å; R198-Y207 HydrophobicContact CB-CE2 4.11Å; R198-Y207 HydrophobicContact CG-CD2 4.22Å; R198-Y207 HydrophobicContact CG-CE2 4.19Å; I199-Y207 HydrophobicContact CG1-CD2 4.13Å; Y207-T209 HydrophobicContact CD1-CG2 3.83Å; Y207-T209 HydrophobicContact CE1-CG2 3.31Å | ||
| 208 | L | 91.9 | Very high | 89.2 | Confident | 38 Ų | 38 | 53.4 Ų | 53.4 | 20% | 0.199 | 28% | 0.284 | C | S | . | . | trans | -85.3 | 141.8 | 175.3 | -58.3 | -178.4 | 0 | 0 | 0 | 110.6 | Q181 R198 N202 L206 | Q181-L208 HydrophobicContact CB-CD2 4.49Å; R198-L208 WeakPolarHBondContact CD-O 3.46Å; N202-L208 HydrophobicContact CB-CD1 4.49Å; L206-L208 VanDerWaalsContact C-N 3.32Å; L206-L208 HydrophobicContact CB-CD2 4.06Å; L206-L208 HydrophobicContact CB-CG 4.08Å; L206-L208 HydrophobicContact CD1-CD2 4.43Å; L206-L208 PolarHBondContact O-N 3.27Å | ||
| 209 | T | 90 | Very high | 89.3 | Confident | 24 Ų | 24 | 53.3 Ų | 53.3 | 15% | 0.147 | 30% | 0.297 | C | S | . | . | trans | -131.2 | 145.5 | 179.9 | 60.1 | 0 | 0 | 0 | 0 | 110.4 | Y207 G211 | Y207-T209 HydrophobicContact CD1-CG2 3.83Å; Y207-T209 HydrophobicContact CE1-CG2 3.31Å; T209-G211 PolarHBondContact O-N 2.99Å | ||
| 210 | D | 90.4 | Very high | 89.3 | Confident | 47 Ų | 47 | 57.4 Ų | 57.4 | 25% | 0.251 | 32% | 0.315 | S | S | . | . | S | Bend | trans | -76.9 | 64.8 | 168.4 | 179.4 | 28.3 | 0 | 0 | 0 | 109.2 | F178 N228 R229 L230 S231 | F178-D210 WeakPolarHBondContact CE2-OD1 3.42Å; F178-D210 WeakPolarHBondContact CZ-OD1 3.45Å; D210-N228 CarbonylContact O-C 3.38Å; D210-N228 WeakPolarHBondContact O-CA 2.94Å; D210-R229 PolarHBondContact O-N 3.29Å; D210-R229 WeakPolarHBondContact OD2-CA 3.41Å; D210-L230 PolarHBondContact OD1-N 2.9Å; D210-L230 PolarHBondContact OD2-N 3.39Å; D210-S231 VanDerWaalsContact CG-N 3.35Å; D210-S231 WeakPolarHBondContact OD1-CB 3.33Å; D210-S231 PolarHBondContact OD1-N 3Å; D210-S231 PolarHBondContact OD1-OG 3.45Å; D210-S231 WeakPolarHBondContact OD2-CB 3.41Å; D210-S231 PolarHBondContact OD2-N 3.15Å |
| 211 | G | 92.4 | Very high | 89.3 | Confident | 0 Ų | 0 | 51.7 Ų | 51.7 | 0% | 0 | 29% | 0.291 | C | S | . | . | B | Isolated β-bridge | trans | -162.4 | 168.9 | -176.6 | 0 | 0 | 0 | 0 | 0 | 115 | W182 T209 Q227 | W182-G211 PolarHBondContact NE1-O 2.98Å; T209-G211 PolarHBondContact O-N 2.99Å; G211-Q227 CarbonylContact C-O 3.6Å; G211-Q227 WeakPolarHBondContact CA-O 3.08Å |
| 212 | V | 95.5 | Very high | 89.2 | Confident | 0 Ų | 0 | 52.8 Ų | 52.8 | 0% | 0 | 30% | 0.296 | C | S | . | . | trans | -128.7 | 155.2 | -173.6 | -59.1 | 0 | 0 | 0 | 0 | 110.6 | Y174 W177 F178 C216 Q227 L230 L248 | Y174-V212 HydrophobicContact CD2-CG1 4.16Å; W177-V212 HydrophobicContact CB-CG1 4.16Å; W177-V212 HydrophobicContact CG-CG1 4.37Å; F178-V212 HydrophobicContact CE1-CG1 4.06Å; V212-C216 HydrophobicContact CB-CB 4.17Å; V212-C216 HydrophobicContact CG2-CB 4.03Å; V212-Q227 HydrophobicContact CG2-CB 4.44Å; V212-Q227 HydrophobicContact CG2-CG 4.39Å; V212-Q227 PolarHBondContact N-O 2.97Å; V212-L230 HydrophobicContact CB-CD1 4.46Å; V212-L230 HydrophobicContact CG1-CD1 3.74Å; V212-L230 HydrophobicContact CG2-CD1 4.03Å; V212-L248 HydrophobicContact CG1-CD1 4.4Å; V212-L248 HydrophobicContact CG2-CD1 3.96Å; V212-L248 HydrophobicContact CG2-CD2 3.82Å | ||
| 213 | P | 96.1 | Very high | 89.2 | Confident | 1 Ų | 1 | 57.4 Ų | 57.4 | 1% | 0.006 | 31% | 0.31 | C | S | . | . | trans | -67 | 157.7 | 170.1 | 29.4 | -35.2 | 0 | 0 | 0 | 111.8 | Y144 W177 W182 S215 C216 | Y144-P213 HydrophobicContact CE1-CB 4.28Å; Y144-P213 WeakPolarHBondContact OH-CB 3.45Å; W177-P213 VanDerWaalsContact CD2-CD 3.5Å; W177-P213 HydrophobicContact CD2-CG 3.98Å; W177-P213 VanDerWaalsContact CE2-CD 3.48Å; W177-P213 VanDerWaalsContact CE2-CG 3.5Å; W177-P213 HydrophobicContact CE3-CG 4.44Å; W177-P213 HydrophobicContact CH2-CG 4.08Å; W177-P213 HydrophobicContact CZ2-CG 3.54Å; W182-P213 HydrophobicContact CE3-CB 4.36Å; W182-P213 HydrophobicContact CZ3-CB 4.27Å; P213-S215 PolarHBondContact O-N 3.06Å; P213-S215 VanDerWaalsContact O-N 3.11Å; P213-C216 WeakPolarHBondContact O-CB 3.39Å; P213-C216 PolarHBondContact O-N 3.13Å; P213-C216 VanDerWaalsContact O-N 3.13Å | ||
| 214 | F | 94.4 | Very high | 90.1 | Very high | 108 Ų | 108 | 55.8 Ų | 55.8 | 47% | 0.474 | 30% | 0.302 | S | S | . | . | G | 310 helix | trans | -58.6 | -27 | -178.6 | 86 | -87.1 | 0 | 0 | 0 | 113.7 | L164 C216 C217 | L164-F214 HydrophobicContact CD1-CE2 4.19Å; L164-F214 HydrophobicContact CD1-CZ 4.5Å; F214-C216 PolarHBondContact O-N 3.06Å; F214-C217 WeakPolarHBondContact O-CB 3.45Å; F214-C217 PolarHBondContact O-N 3.07Å; F214-C217 PolarHBondContact O-SG 2.98Å |
| 215 | S | 96.3 | Very high | 90.6 | Very high | 0 Ų | 0 | 50.3 Ų | 50.3 | 0% | 0 | 28% | 0.28 | C | S | . | . | G | 310 helix | trans | -64.4 | -18.6 | -179.4 | 40.3 | 0 | 0 | 0 | 0 | 113.3 | D160 Q163 P213 C217 | D160-S215 VanDerWaalsContact OD1-CB 3.29Å; D160-S215 WeakPolarHBondContact OD1-CB 3.16Å; D160-S215 PolarHBondContact OD1-OG 2.8Å; Q163-S215 PolarHBondContact OE1-OG 3.32Å; P213-S215 PolarHBondContact O-N 3.06Å; P213-S215 VanDerWaalsContact O-N 3.11Å; S215-C217 VanDerWaalsContact C-N 3.32Å |
| 216 | C | 96 | Very high | 91 | Very high | 0 Ų | 0 | 50.5 Ų | 50.5 | 0% | 0 | 27% | 0.271 | C | S | . | . | G | 310 helix | trans | -79.3 | -10.7 | 172.5 | -72.3 | 0 | 0 | 0 | 0 | 114.6 | Q163 C169 W177 V212 P213 F214 L248 W249 | Q163-C216 PolarHBondContact OE1-SG 2.99Å; C169-C216 HydrophobicContact CB-CB 3.67Å; C169-C216 WeakPolarHBondContact CB-SG 3.17Å; C169-C216 WeakPolarHBondContact SG-CB 3.24Å; C169-C216 CovalentContact SG-SG 2.01Å; C169-C216 PolarHBondContact SG-SG 2.9Å; W177-C216 PolarHBondContact NE1-SG 3.38Å; V212-C216 HydrophobicContact CB-CB 4.17Å; V212-C216 HydrophobicContact CG2-CB 4.03Å; P213-C216 WeakPolarHBondContact O-CB 3.39Å; P213-C216 PolarHBondContact O-N 3.13Å; P213-C216 VanDerWaalsContact O-N 3.13Å; F214-C216 PolarHBondContact O-N 3.06Å; C216-L248 HydrophobicContact CB-CD2 4.39Å; C216-L248 CarbonylContact O-C 3.52Å; C216-L248 VanDerWaalsContact O-CA 3.28Å; C216-L248 WeakPolarHBondContact O-CA 3.29Å; C216-W249 PolarHBondContact O-N 3.26Å |
| 217 | C | 94.6 | Very high | 91.2 | Very high | 18 Ų | 18 | 51.8 Ų | 51.8 | 12% | 0.122 | 28% | 0.276 | C | S | . | . | B | Isolated β-bridge | trans | -69 | 134.5 | -177.2 | -68.5 | 0 | 0 | 0 | 0 | 112.1 | F214 S215 P219 C225 W249 | F214-C217 WeakPolarHBondContact O-CB 3.45Å; F214-C217 PolarHBondContact O-N 3.07Å; F214-C217 PolarHBondContact O-SG 2.98Å; S215-C217 VanDerWaalsContact C-N 3.32Å; C217-P219 WeakPolarHBondContact O-CD 3.23Å; C217-C225 VanDerWaalsContact CA-SG 3.58Å; C217-C225 HydrophobicContact CB-CB 3.57Å; C217-C225 WeakPolarHBondContact CB-SG 3.4Å; C217-C225 WeakPolarHBondContact SG-CB 3.45Å; C217-C225 CovalentContact SG-SG 2.02Å; C217-C225 PolarHBondContact SG-SG 3.29Å; C217-W249 PolarHBondContact O-NE1 3.4Å |
| 218 | N | 93.2 | Very high | 91.2 | Very high | 20 Ų | 20 | 54.4 Ų | 54.4 | 11% | 0.107 | 29% | 0.292 | C | S | . | . | trans | -80.8 | 115.6 | 172.3 | -176.8 | -6.6 | 0 | 0 | 0 | 109.6 | H220 S221 N245 N247 W249 | N218-H220 PolarHBondContact O-N 2.94Å; N218-H220 WeakPolarHBondContact OD1-CB 3.35Å; N218-H220 PolarHBondContact OD1-N 2.91Å; N218-H220 PolarHBondContact OD1-ND1 2.8Å; N218-H220 VanDerWaalsContact OD1-ND1 3.14Å; N218-S221 VanDerWaalsContact O-CB 3.31Å; N218-S221 WeakPolarHBondContact O-CB 3.37Å; N218-S221 PolarHBondContact O-N 3.01Å; N218-S221 VanDerWaalsContact O-N 3.09Å; N218-N245 PolarHBondContact ND2-O 3.48Å; N218-N247 PolarHBondContact N-O 2.93Å; N218-W249 HydrophobicContact CB-CD2 4.31Å; N218-W249 HydrophobicContact CB-CE3 4.46Å; N218-W249 HydrophobicContact CB-CH2 4.49Å; N218-W249 HydrophobicContact CB-CZ2 4.33Å; N218-W249 WeakPolarHBondContact OD1-CH2 3.43Å | ||
| 219 | P | 90.7 | Very high | 91.1 | Very high | 103 Ų | 103 | 59.6 Ų | 59.6 | 67% | 0.669 | 31% | 0.309 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -67.9 | -16 | -179.5 | 29.6 | -35.6 | 0 | 0 | 0 | 113.3 | C217 S221 W249 | C217-P219 WeakPolarHBondContact O-CD 3.23Å; P219-S221 PolarHBondContact O-N 2.62Å; P219-W249 HydrophobicContact CG-CZ2 4.38Å |
| 220 | H | 88.6 | Confident | 91 | Very high | 143 Ų | 143 | 59.4 Ų | 59.4 | 66% | 0.662 | 31% | 0.307 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -83.6 | 1 | 175.8 | -54.4 | 95 | 0 | 0 | 0 | 112.8 | N218 | N218-H220 PolarHBondContact O-N 2.94Å; N218-H220 WeakPolarHBondContact OD1-CB 3.35Å; N218-H220 PolarHBondContact OD1-N 2.91Å; N218-H220 PolarHBondContact OD1-ND1 2.8Å; N218-H220 VanDerWaalsContact OD1-ND1 3.14Å |
| 221 | S | 86.1 | Confident | 90.7 | Very high | 24 Ų | 24 | 60.7 Ų | 60.7 | 17% | 0.168 | 32% | 0.32 | C | S | . | . | trans | -60.7 | 132.8 | 177.1 | -169.7 | 0 | 0 | 0 | 0 | 110.6 | N218 P219 R223 Q246 | N218-S221 VanDerWaalsContact O-CB 3.31Å; N218-S221 WeakPolarHBondContact O-CB 3.37Å; N218-S221 PolarHBondContact O-N 3.01Å; N218-S221 VanDerWaalsContact O-N 3.09Å; P219-S221 PolarHBondContact O-N 2.62Å; S221-R223 PolarHBondContact O-N 3.11Å; S221-R223 VanDerWaalsContact O-N 3.12Å; S221-R223 PolarHBondContact OG-N 3.22Å; S221-R223 PolarHBondContact OG-O 3.02Å; S221-Q246 WeakPolarHBondContact CA-O 3.3Å; S221-Q246 WeakPolarHBondContact CB-O 3.48Å; S221-Q246 PolarHBondContact OG-O 2.87Å | ||
| 222 | P | 83.6 | Confident | 90.2 | Very high | 111 Ų | 111 | 63.4 Ų | 63.4 | 72% | 0.721 | 33% | 0.334 | S | S | * | . | S | Bend | trans | -71.2 | -1.9 | 175.8 | 29.7 | -35.2 | 0 | 0 | 0 | 113.2 | ||
| 223 | R | 84.3 | Confident | 89.2 | Confident | 141 Ų | 141 | 67.2 Ų | 67.2 | 53% | 0.532 | 36% | 0.361 | S | S | . | . | S | Bend | trans | -135.6 | 162.2 | -175 | -63.1 | -170.1 | -176.4 | -156.6 | 5.9 | 111 | S221 C225 L238 | S221-R223 PolarHBondContact O-N 3.11Å; S221-R223 VanDerWaalsContact O-N 3.12Å; S221-R223 PolarHBondContact OG-N 3.22Å; S221-R223 PolarHBondContact OG-O 3.02Å; R223-C225 PolarHBondContact O-N 3.3Å; R223-L238 VanDerWaalsContact NH1-CD1 3.34Å |
| 224 | P | 88.2 | Confident | 88.4 | Confident | 115 Ų | 115 | 77.1 Ų | 77.1 | 75% | 0.747 | 40% | 0.4 | S | S | * | . | P | Polyproline II helix | trans | -56 | 135.4 | 172 | -24.1 | 34.5 | 0 | 0 | 0 | 111.2 | L226 | P224-L226 PolarHBondContact O-N 3.13Š|
| 225 | C | 89.9 | Confident | 87.7 | Confident | 37 Ų | 37 | 73.1 Ų | 73.1 | 25% | 0.25 | 39% | 0.386 | C | S | . | . | P | Polyproline II helix | trans | -63.9 | 125.9 | -177.8 | 178.9 | 0 | 0 | 0 | 0 | 111.7 | C217 R223 N247 | C217-C225 VanDerWaalsContact CA-SG 3.58Å; C217-C225 HydrophobicContact CB-CB 3.57Å; C217-C225 WeakPolarHBondContact CB-SG 3.4Å; C217-C225 WeakPolarHBondContact SG-CB 3.45Å; C217-C225 CovalentContact SG-SG 2.02Å; C217-C225 PolarHBondContact SG-SG 3.29Å; R223-C225 PolarHBondContact O-N 3.3Å; C225-N247 VanDerWaalsContact CA-OD1 3.3Å; C225-N247 WeakPolarHBondContact CA-OD1 3.2Å |
| 226 | L | 89.9 | Confident | 87 | Confident | 50 Ų | 50 | 75.2 Ų | 75.2 | 26% | 0.262 | 40% | 0.396 | S | S | . | . | P | Polyproline II helix | trans | -86.4 | 120.9 | 172.4 | -54.9 | 172.3 | 0 | 0 | 0 | 108.9 | P224 L230 H236 F239 N247 | P224-L226 PolarHBondContact O-N 3.13Å; L226-L230 HydrophobicContact CB-CD2 4.35Å; L226-L230 WeakPolarHBondContact O-CD2 3.48Å; L226-H236 HydrophobicContact CD1-CB 3.95Å; L226-F239 HydrophobicContact CD1-CB 4.05Å; L226-F239 HydrophobicContact CD1-CD2 4.33Å; L226-F239 HydrophobicContact CD1-CG 4.14Å; L226-N247 PolarHBondContact N-OD1 2.58Å; L226-N247 PolarHBondContact O-ND2 3.49Å |
| 227 | Q | 92.7 | Very high | 86 | Confident | 66 Ų | 66 | 80.7 Ų | 80.7 | 31% | 0.308 | 43% | 0.432 | S | S | . | . | trans | -108.5 | -19.7 | -178.5 | -74.2 | 167.8 | 66.3 | 0 | 0 | 113.4 | G211 V212 | G211-Q227 CarbonylContact C-O 3.6Å; G211-Q227 WeakPolarHBondContact CA-O 3.08Å; V212-Q227 HydrophobicContact CG2-CB 4.44Å; V212-Q227 HydrophobicContact CG2-CG 4.39Å; V212-Q227 PolarHBondContact N-O 2.97Å | ||
| 228 | N | 91.3 | Very high | 85 | Confident | 96 Ų | 96 | 86.2 Ų | 86.2 | 51% | 0.513 | 46% | 0.46 | S | S | . | . | B | Isolated β-bridge | trans | -126.9 | 156.3 | -171.1 | -62.9 | -29 | 0 | 0 | 0 | 111.4 | D210 L230 H236 | D210-N228 CarbonylContact O-C 3.38Å; D210-N228 WeakPolarHBondContact O-CA 2.94Å; N228-L230 VanDerWaalsContact C-N 3.29Å; N228-L230 PolarHBondContact O-N 3.14Å; N228-H236 PolarHBondContact O-NE2 3.3Å |
| 229 | R | 88.1 | Confident | 84 | Confident | 148 Ų | 148 | 87.5 Ų | 87.5 | 56% | 0.558 | 46% | 0.464 | S | S | * | . | trans | 55.2 | 44.7 | -177.7 | -59.3 | -150.7 | -71.5 | 168.4 | -8.8 | 112.1 | D210 D232 A235 H236 | D210-R229 PolarHBondContact O-N 3.29Å; D210-R229 WeakPolarHBondContact OD2-CA 3.41Å; R229-D232 HydrophobicContact CB-CB 4.35Å; R229-D232 IonicContact NH1-OD2 2.98Å; R229-A235 HydrophobicContact CB-CB 3.85Å; R229-H236 PolarHBondContact O-CD2 2.89Å; R229-H236 VanDerWaalsContact O-CD2 3.3Å; R229-H236 PolarHBondContact O-NE2 2.01Å | ||
| 230 | L | 88 | Confident | 83.2 | Confident | 20 Ų | 20 | 85.9 Ų | 85.9 | 11% | 0.105 | 45% | 0.45 | C | S | . | . | trans | -76.3 | -23.7 | -174.9 | -66 | 175.5 | 0 | 0 | 0 | 113.1 | Y174 F178 D210 V212 L226 N228 L248 | Y174-L230 HydrophobicContact CD2-CD1 4.27Å; Y174-L230 HydrophobicContact CE2-CD1 4.41Å; F178-L230 HydrophobicContact CE1-CD1 4.02Å; F178-L230 HydrophobicContact CZ-CB 3.87Å; F178-L230 HydrophobicContact CZ-CD1 3.97Å; D210-L230 PolarHBondContact OD1-N 2.9Å; D210-L230 PolarHBondContact OD2-N 3.39Å; V212-L230 HydrophobicContact CB-CD1 4.46Å; V212-L230 HydrophobicContact CG1-CD1 3.74Å; V212-L230 HydrophobicContact CG2-CD1 4.03Å; L226-L230 HydrophobicContact CB-CD2 4.35Å; L226-L230 WeakPolarHBondContact O-CD2 3.48Å; N228-L230 VanDerWaalsContact C-N 3.29Å; N228-L230 PolarHBondContact O-N 3.14Å; L230-L248 HydrophobicContact CD1-CD1 3.68Å; L230-L248 HydrophobicContact CD2-CD1 4.21Å | ||
| 231 | S | 84.3 | Confident | 82.3 | Confident | 73 Ų | 73 | 82.6 Ų | 82.6 | 51% | 0.51 | 44% | 0.441 | S | S | . | . | S | Bend | trans | -86.3 | -20.7 | 177.1 | -55.9 | 0 | 0 | 0 | 0 | 112.2 | F178 D210 S233 | F178-S231 WeakPolarHBondContact CE2-OG 3.45Å; D210-S231 VanDerWaalsContact CG-N 3.35Å; D210-S231 WeakPolarHBondContact OD1-CB 3.33Å; D210-S231 PolarHBondContact OD1-N 3Å; D210-S231 PolarHBondContact OD1-OG 3.45Å; D210-S231 WeakPolarHBondContact OD2-CB 3.41Å; D210-S231 PolarHBondContact OD2-N 3.15Å; S231-S233 PolarHBondContact O-N 3.09Å |
| 232 | D | 83.6 | Confident | 81.5 | Confident | 57 Ų | 57 | 91.9 Ų | 91.9 | 31% | 0.305 | 47% | 0.473 | S | S | . | . | trans | -80.8 | 103.5 | 178.6 | -174.2 | -5.1 | 0 | 0 | 0 | 111.3 | R229 Y234 A235 | R229-D232 HydrophobicContact CB-CB 4.35Å; R229-D232 IonicContact NH1-OD2 2.98Å; D232-Y234 PolarHBondContact O-N 2.95Å; D232-Y234 PolarHBondContact OD1-N 2.91Å; D232-A235 HydrophobicContact CB-CB 3.76Å; D232-A235 PolarHBondContact O-N 3.49Å; D232-A235 PolarHBondContact OD1-N 2.88Å | ||
| 233 | S | 73.6 | Confident | 81.1 | Confident | 81 Ų | 81 | 91.3 Ų | 91.3 | 57% | 0.566 | 46% | 0.46 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -66.2 | -17.4 | 179.6 | -59.8 | 0 | 0 | 0 | 0 | 113.7 | S231 | S231-S233 PolarHBondContact O-N 3.09Š|
| 234 | Y | 79.2 | Confident | 80.6 | Confident | 209 Ų | 209 | 86 Ų | 86 | 82% | 0.82 | 44% | 0.444 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -94.5 | -20 | 178.1 | -61.3 | -79.2 | 0 | 0 | 0 | 112.7 | D232 H236 | D232-Y234 PolarHBondContact O-N 2.95Å; D232-Y234 PolarHBondContact OD1-N 2.91Å; Y234-H236 PolarHBondContact O-N 2.83Å |
| 235 | A | 80.7 | Confident | 80.1 | Confident | 23 Ų | 23 | 84.6 Ų | 84.6 | 19% | 0.19 | 43% | 0.43 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -64.7 | -30.8 | 178.6 | 0 | 0 | 0 | 0 | 0 | 112.4 | R229 D232 | R229-A235 HydrophobicContact CB-CB 3.85Å; D232-A235 HydrophobicContact CB-CB 3.76Å; D232-A235 PolarHBondContact O-N 3.49Å; D232-A235 PolarHBondContact OD1-N 2.88Å |
| 236 | H | 80.8 | Confident | 79.7 | Confident | 44 Ų | 44 | 87.3 Ų | 87.3 | 20% | 0.204 | 44% | 0.439 | C | S | . | . | trans | -131.2 | 75.8 | -175.5 | -56.3 | -63.6 | 0 | 0 | 0 | 111.7 | L226 N228 R229 Y234 L238 F239 | L226-H236 HydrophobicContact CD1-CB 3.95Å; N228-H236 PolarHBondContact O-NE2 3.3Å; R229-H236 PolarHBondContact O-CD2 2.89Å; R229-H236 VanDerWaalsContact O-CD2 3.3Å; R229-H236 PolarHBondContact O-NE2 2.01Å; Y234-H236 PolarHBondContact O-N 2.83Å; H236-L238 PolarHBondContact O-N 2.87Å; H236-F239 HydrophobicContact CB-CB 3.78Å; H236-F239 PolarHBondContact O-N 2.04Å | ||
| 237 | P | 73.8 | Confident | 79.6 | Confident | 116 Ų | 116 | 85.1 Ų | 85.1 | 75% | 0.753 | 43% | 0.428 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -60.7 | -20.2 | -172.2 | -23.1 | 32.4 | 0 | 0 | 0 | 115.1 | ||
| 238 | L | 74.7 | Confident | 79.6 | Confident | 134 Ų | 134 | 82.2 Ų | 82.2 | 70% | 0.702 | 41% | 0.414 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -99.8 | 1.7 | -178.2 | -60.1 | 166.8 | 0 | 0 | 0 | 113 | R223 H236 | R223-L238 VanDerWaalsContact NH1-CD1 3.34Å; H236-L238 PolarHBondContact O-N 2.87Å |
| 239 | F | 72.9 | Confident | 79.7 | Confident | 47 Ų | 47 | 78.8 Ų | 78.8 | 21% | 0.206 | 39% | 0.394 | C | S | . | . | trans | -102.8 | 126 | 178.2 | -179.1 | -109 | 0 | 0 | 0 | 109.2 | L226 H236 P241 N247 | L226-F239 HydrophobicContact CD1-CB 4.05Å; L226-F239 HydrophobicContact CD1-CD2 4.33Å; L226-F239 HydrophobicContact CD1-CG 4.14Å; H236-F239 HydrophobicContact CB-CB 3.78Å; H236-F239 PolarHBondContact O-N 2.04Å; F239-P241 VanDerWaalsContact O-CD 3.3Å; F239-P241 WeakPolarHBondContact O-CD 3.37Å; F239-N247 HydrophobicContact CD2-CB 4.14Å; F239-N247 HydrophobicContact CE2-CB 3.31Å; F239-N247 HydrophobicContact CZ-CB 3.87Å | ||
| 240 | D | 72.5 | Confident | 79.8 | Confident | 69 Ų | 69 | 73 Ų | 73 | 37% | 0.369 | 38% | 0.378 | S | S | . | . | trans | -86.6 | 111.7 | 175.6 | -175 | -0.3 | 0 | 0 | 0 | 109.6 | R242 Q243 | D240-R242 PolarHBondContact O-N 3.36Å; D240-R242 VanDerWaalsContact OD1-CB 3.31Å; D240-R242 WeakPolarHBondContact OD1-CB 3.19Å; D240-R242 PolarHBondContact OD1-N 3.29Å; D240-Q243 PolarHBondContact O-N 3.31Å | ||
| 241 | P | 69.3 | Low | 80.1 | Confident | 73 Ų | 73 | 76.8 Ų | 76.8 | 47% | 0.474 | 40% | 0.395 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -62.2 | -17.2 | 178.7 | -18.3 | 31.8 | 0 | 0 | 0 | 113.1 | F239 Q243 | F239-P241 VanDerWaalsContact O-CD 3.3Å; F239-P241 WeakPolarHBondContact O-CD 3.37Å; P241-Q243 VanDerWaalsContact C-N 3.29Å |
| 242 | R | 70.6 | Confident | 80.7 | Confident | 220 Ų | 220 | 73.4 Ų | 73.4 | 83% | 0.83 | 37% | 0.372 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -78.1 | -13.3 | 177.9 | -61.4 | -179.4 | 175.1 | 159.2 | 0.1 | 113.3 | D240 P244 | D240-R242 PolarHBondContact O-N 3.36Å; D240-R242 VanDerWaalsContact OD1-CB 3.31Å; D240-R242 WeakPolarHBondContact OD1-CB 3.19Å; D240-R242 PolarHBondContact OD1-N 3.29Å; R242-P244 WeakPolarHBondContact O-CD 3.34Å |
| 243 | Q | 74.9 | Confident | 81.4 | Confident | 98 Ų | 98 | 70.7 Ų | 70.7 | 46% | 0.458 | 36% | 0.357 | S | S | . | . | trans | -126.5 | 62.8 | -179.6 | -57.8 | -166.2 | 31.2 | 0 | 0 | 111.7 | D240 P241 N245 Q246 | D240-Q243 PolarHBondContact O-N 3.31Å; P241-Q243 VanDerWaalsContact C-N 3.29Å; Q243-N245 PolarHBondContact O-N 2.97Å; Q243-N245 VanDerWaalsContact O-N 3.13Å; Q243-Q246 HydrophobicContact CB-CG 4.19Å; Q243-Q246 PolarHBondContact O-N 3.39Å; Q243-Q246 VanDerWaalsContact O-N 3.1Å | ||
| 244 | P | 74.1 | Confident | 82.5 | Confident | 29 Ų | 29 | 67.5 Ų | 67.5 | 19% | 0.188 | 33% | 0.333 | C | S | . | . | G | 310 helix | trans | -58.4 | -30.9 | -176.7 | 23.7 | -33.6 | 0 | 0 | 0 | 113.2 | Y174 R242 Q246 N247 L248 A250 | Y174-P244 HydrophobicContact CE1-CB 4.23Å; R242-P244 WeakPolarHBondContact O-CD 3.34Å; P244-Q246 PolarHBondContact O-N 3.36Å; P244-Q246 VanDerWaalsContact O-N 3.08Å; P244-N247 PolarHBondContact O-N 3.41Å; P244-L248 CarbonylContact C-O 3.57Å; P244-L248 PolarHBondContact O-N 3.3Å; P244-L248 VanDerWaalsContact O-O 3.06Å; P244-A250 HydrophobicContact CB-CB 4.06Å; P244-A250 HydrophobicContact CG-CB 3.73Å |
| 245 | N | 77.6 | Confident | 83.3 | Confident | 86 Ų | 86 | 62.9 Ų | 62.9 | 46% | 0.46 | 32% | 0.319 | S | S | . | . | G | 310 helix | trans | -57.4 | -20.8 | 177.5 | -75.2 | -22.2 | 0 | 0 | 0 | 114.7 | N218 Q243 N247 L248 A250 | N218-N245 PolarHBondContact ND2-O 3.48Å; Q243-N245 PolarHBondContact O-N 2.97Å; Q243-N245 VanDerWaalsContact O-N 3.13Å; N245-N247 PolarHBondContact O-N 2.92Å; N245-L248 WeakPolarHBondContact CA-O 3.02Å; N245-A250 WeakPolarHBondContact OD1-CB 3.26Å; N245-A250 PolarHBondContact OD1-N 3.06Å |
| 246 | Q | 81.1 | Confident | 84.1 | Confident | 95 Ų | 95 | 63 Ų | 63 | 44% | 0.444 | 32% | 0.318 | S | S | . | . | G | 310 helix | trans | -72.8 | -16.5 | 175.4 | -67 | -170.6 | 30.2 | 0 | 0 | 113.3 | S221 Q243 P244 | S221-Q246 WeakPolarHBondContact CA-O 3.3Å; S221-Q246 WeakPolarHBondContact CB-O 3.48Å; S221-Q246 PolarHBondContact OG-O 2.87Å; Q243-Q246 HydrophobicContact CB-CG 4.19Å; Q243-Q246 PolarHBondContact O-N 3.39Å; Q243-Q246 VanDerWaalsContact O-N 3.1Å; P244-Q246 PolarHBondContact O-N 3.36Å; P244-Q246 VanDerWaalsContact O-N 3.08Å |
| 247 | N | 88.3 | Confident | 84.9 | Confident | 4 Ų | 4 | 61 Ų | 61 | 2% | 0.021 | 31% | 0.308 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -122.4 | -45.4 | -177.8 | 178.9 | 58.6 | 0 | 0 | 0 | 112.4 | N218 C225 L226 F239 P244 N245 | N218-N247 PolarHBondContact N-O 2.93Å; C225-N247 VanDerWaalsContact CA-OD1 3.3Å; C225-N247 WeakPolarHBondContact CA-OD1 3.2Å; L226-N247 PolarHBondContact N-OD1 2.58Å; L226-N247 PolarHBondContact O-ND2 3.49Å; F239-N247 HydrophobicContact CD2-CB 4.14Å; F239-N247 HydrophobicContact CE2-CB 3.31Å; F239-N247 HydrophobicContact CZ-CB 3.87Å; P244-N247 PolarHBondContact O-N 3.41Å; N245-N247 PolarHBondContact O-N 2.92Å |
| 248 | L | 92.7 | Very high | 85.9 | Confident | 4 Ų | 4 | 56.6 Ų | 56.6 | 2% | 0.021 | 28% | 0.279 | C | S | . | . | B | Isolated β-bridge | trans | -124.8 | 159.5 | -177.7 | -55.9 | 174 | 0 | 0 | 0 | 110.1 | Y174 V212 C216 L230 P244 N245 A250 | Y174-L248 HydrophobicContact CD2-CD1 4.02Å; Y174-L248 HydrophobicContact CG-CD1 4.21Å; V212-L248 HydrophobicContact CG1-CD1 4.4Å; V212-L248 HydrophobicContact CG2-CD1 3.96Å; V212-L248 HydrophobicContact CG2-CD2 3.82Å; C216-L248 HydrophobicContact CB-CD2 4.39Å; C216-L248 CarbonylContact O-C 3.52Å; C216-L248 VanDerWaalsContact O-CA 3.28Å; C216-L248 WeakPolarHBondContact O-CA 3.29Å; L230-L248 HydrophobicContact CD1-CD1 3.68Å; L230-L248 HydrophobicContact CD2-CD1 4.21Å; P244-L248 CarbonylContact C-O 3.57Å; P244-L248 PolarHBondContact O-N 3.3Å; P244-L248 VanDerWaalsContact O-O 3.06Å; N245-L248 WeakPolarHBondContact CA-O 3.02Å; L248-A250 PolarHBondContact O-N 3.37Å |
| 249 | W | 93.9 | Very high | 86.9 | Confident | 25 Ų | 25 | 55.6 Ų | 55.6 | 10% | 0.095 | 27% | 0.27 | C | S | . | . | trans | -68 | 114 | 162.3 | -57.3 | 119.7 | 0 | 0 | 0 | 109.3 | Q167 C169 C216 C217 N218 P219 | Q167-W249 VanDerWaalsContact C-CG 3.41Å; Q167-W249 HydrophobicContact CB-CD2 3.77Å; Q167-W249 HydrophobicContact CB-CE3 3.79Å; Q167-W249 HydrophobicContact CB-CG 4.48Å; Q167-W249 HydrophobicContact CB-CH2 3.73Å; Q167-W249 HydrophobicContact CB-CZ2 3.71Å; Q167-W249 HydrophobicContact CB-CZ3 3.78Å; Q167-W249 HydrophobicContact CG-CH2 3.69Å; Q167-W249 HydrophobicContact CG-CZ2 3.58Å; Q167-W249 HydrophobicContact CG-CZ3 4.24Å; Q167-W249 WeakPolarHBondContact O-CB 3.35Å; C169-W249 HydrophobicContact CB-CB 4.15Å; C169-W249 WeakPolarHBondContact CB-O 3.3Å; C216-W249 PolarHBondContact O-N 3.26Å; C217-W249 PolarHBondContact O-NE1 3.4Å; N218-W249 HydrophobicContact CB-CD2 4.31Å; N218-W249 HydrophobicContact CB-CE3 4.46Å; N218-W249 HydrophobicContact CB-CH2 4.49Å; N218-W249 HydrophobicContact CB-CZ2 4.33Å; N218-W249 WeakPolarHBondContact OD1-CH2 3.43Å; P219-W249 HydrophobicContact CG-CZ2 4.38Å | ||
| 250 | A | 89.2 | Confident | 88 | Confident | 27 Ų | 27 | 56.3 Ų | 56.3 | 22% | 0.223 | 27% | 0.274 | C | S | . | . | trans | -82.4 | -24.4 | -179.4 | 0 | 0 | 0 | 0 | 0 | 113.1 | P244 N245 L248 | P244-A250 HydrophobicContact CB-CB 4.06Å; P244-A250 HydrophobicContact CG-CB 3.73Å; N245-A250 WeakPolarHBondContact OD1-CB 3.26Å; N245-A250 PolarHBondContact OD1-N 3.06Å; L248-A250 PolarHBondContact O-N 3.37Å | ||
| 251 | Q | 94.3 | Very high | 89.1 | Confident | 99 Ų | 99 | 53 Ų | 53 | 46% | 0.463 | 26% | 0.257 | S | S | . | . | S | Bend | trans | -71.1 | 139.5 | 179.4 | -72.9 | 176.5 | -47.4 | 0 | 0 | 111.4 | C168 C169 V256 | C168-Q251 CarbonylContact C-O 3.42Å; C168-Q251 WeakPolarHBondContact CA-O 3.31Å; C169-Q251 PolarHBondContact N-O 3.49Å; Q251-V256 HydrophobicContact CB-CG2 4.12Å |
| 252 | G | 96.7 | Very high | 90.3 | Very high | 1 Ų | 1 | 53.1 Ų | 53.1 | 1% | 0.01 | 25% | 0.251 | C | S | . | . | trans | -71.3 | 146.9 | 172.6 | 0 | 0 | 0 | 0 | 0 | 112.2 | R171 H172 H254 V256 | R171-G252 CarbonylContact O-C 3.44Å; R171-G252 VanDerWaalsContact O-C 3.27Å; R171-G252 WeakPolarHBondContact O-CA 3.36Å; H172-G252 WeakPolarHBondContact O-CA 3.21Å; H172-G252 PolarHBondContact O-N 3.39Å; G252-H254 PolarHBondContact O-N 3.44Å; G252-V256 WeakPolarHBondContact O-CG2 3.24Å; G252-V256 PolarHBondContact O-N 3.49Å | ||
| 253 | C | 97.9 | Very high | 91.5 | Very high | 1 Ų | 1 | 47.4 Ų | 47.4 | 1% | 0.007 | 24% | 0.237 | C | C | . | . | H | α-helix | trans | -68.9 | -23 | 176.5 | -65.9 | 0 | 0 | 0 | 0 | 113.4 | L137 L162 C168 G170 R171 L257 | L137-C253 HydrophobicContact CD1-CB 4.34Å; L137-C253 HydrophobicContact CD2-CB 4.35Å; L162-C253 HydrophobicContact CD2-CB 4.07Å; C168-C253 VanDerWaalsContact C-SG 3.57Å; C168-C253 HydrophobicContact CB-CB 3.85Å; C168-C253 WeakPolarHBondContact CB-SG 2.97Å; C168-C253 WeakPolarHBondContact SG-CA 3.26Å; C168-C253 WeakPolarHBondContact SG-CB 3.41Å; C168-C253 CovalentContact SG-SG 2.04Å; C168-C253 PolarHBondContact SG-SG 2.89Å; G170-C253 VanDerWaalsContact O-CB 3.26Å; G170-C253 WeakPolarHBondContact O-CB 3.47Å; G170-C253 PolarHBondContact O-N 3.37Å; G170-C253 PolarHBondContact O-SG 3.32Å; G170-C253 VanDerWaalsContact O-SG 3.36Å; R171-C253 PolarHBondContact O-N 2.86Å; C253-L257 VanDerWaalsContact O-CB 3.26Å; C253-L257 WeakPolarHBondContact O-CB 3.39Å; C253-L257 WeakPolarHBondContact O-CG 3.18Å; C253-L257 PolarHBondContact O-N 2.94Å |
| 254 | H | 97.6 | Very high | 92.4 | Very high | 13 Ų | 13 | 44.4 Ų | 44.4 | 6% | 0.06 | 22% | 0.223 | C | C | . | . | H | α-helix | trans | -60.9 | -56.5 | 175 | 172.4 | -82.2 | 0 | 0 | 0 | 110.9 | D130 E134 L137 R171 G252 V256 L257 L258 | D130-H254 PolarHBondContact O-NE2 3Å; D130-H254 IonicContact OD1-CE1 3.32Å; D130-H254 PolarHBondContact OD1-CE1 3.04Å; D130-H254 IonicContact OD1-NE2 2.8Å; D130-H254 PolarHBondContact OD1-NE2 3.37Å; D130-H254 VanDerWaalsContact OD1-NE2 3.16Å; E134-H254 IonicContact OE1-CD2 3.92Å; E134-H254 PolarHBondContact OE1-CD2 3.33Å; E134-H254 IonicContact OE1-CG 3.48Å; E134-H254 IonicContact OE1-NE2 3.06Å; E134-H254 PolarHBondContact OE1-NE2 2.73Å; L137-H254 HydrophobicContact CD1-CB 3.79Å; R171-H254 HydrophobicContact CG-CB 4.32Å; R171-H254 VanDerWaalsContact O-CB 3.22Å; R171-H254 WeakPolarHBondContact O-CB 3.39Å; R171-H254 PolarHBondContact O-N 3.45Å; G252-H254 PolarHBondContact O-N 3.44Å; H254-V256 PolarHBondContact O-N 3.48Å; H254-L257 PolarHBondContact O-N 3.33Å; H254-L258 WeakPolarHBondContact O-CB 3.36Å; H254-L258 PolarHBondContact O-N 3.15Å |
| 255 | E | 96.7 | Very high | 93.4 | Very high | 112 Ų | 112 | 43 Ų | 43 | 52% | 0.523 | 21% | 0.214 | S | C | . | . | H | α-helix | trans | -58.3 | -48 | -178.4 | -174.8 | 179.9 | -174.4 | 0 | 0 | 111.5 | L257 L258 E259 | E255-L257 PolarHBondContact O-N 2.92Å; E255-L258 PolarHBondContact O-N 3.42Å; E255-E259 WeakPolarHBondContact O-CB 3.46Å; E255-E259 PolarHBondContact O-N 3.11Å |
| 256 | V | 96.9 | Very high | 94.3 | Very high | 27 Ų | 27 | 40.8 Ų | 40.8 | 16% | 0.164 | 21% | 0.212 | C | C | . | . | H | α-helix | trans | -62.8 | -43.2 | -178.8 | 177.1 | 0 | 0 | 0 | 0 | 111.9 | Y166 C168 Q251 G252 H254 H260 | Y166-V256 HydrophobicContact CD1-CG1 4.38Å; C168-V256 HydrophobicContact CB-CB 4.41Å; C168-V256 HydrophobicContact CB-CG2 4.09Å; Q251-V256 HydrophobicContact CB-CG2 4.12Å; G252-V256 WeakPolarHBondContact O-CG2 3.24Å; G252-V256 PolarHBondContact O-N 3.49Å; H254-V256 PolarHBondContact O-N 3.48Å; V256-H260 WeakPolarHBondContact O-CB 3.22Å; V256-H260 PolarHBondContact O-N 3.3Å; V256-H260 VanDerWaalsContact O-N 3.12Å |
| 257 | L | 96.6 | Very high | 95 | Very high | 0 Ų | 0 | 40.2 Ų | 40.2 | 0% | 0 | 22% | 0.215 | C | C | . | . | H | α-helix | trans | -72.4 | -37.4 | 179.1 | -72.4 | 179.2 | 0 | 0 | 0 | 112.3 | L49 L133 L137 L162 Y166 C253 H254 E255 H260 L261 | L49-L257 HydrophobicContact CD1-CD2 3.9Å; L49-L257 HydrophobicContact CD2-CD1 4.29Å; L49-L257 HydrophobicContact CD2-CD2 3.58Å; L49-L257 HydrophobicContact CG-CD2 4.38Å; L133-L257 HydrophobicContact CD1-CB 4.07Å; L133-L257 HydrophobicContact CD2-CB 4.16Å; L133-L257 HydrophobicContact CD2-CD1 4Å; L137-L257 HydrophobicContact CD2-CD1 4.5Å; L162-L257 HydrophobicContact CD1-CD1 3.78Å; L162-L257 HydrophobicContact CD1-CD2 3.98Å; L162-L257 HydrophobicContact CD1-CG 4.25Å; L162-L257 HydrophobicContact CD2-CD1 4.16Å; Y166-L257 HydrophobicContact CD1-CD2 3.87Å; Y166-L257 HydrophobicContact CD2-CD2 4.19Å; Y166-L257 HydrophobicContact CE1-CD2 3.89Å; Y166-L257 HydrophobicContact CE2-CD2 4.21Å; Y166-L257 HydrophobicContact CG-CD2 4.02Å; C253-L257 VanDerWaalsContact O-CB 3.26Å; C253-L257 WeakPolarHBondContact O-CB 3.39Å; C253-L257 WeakPolarHBondContact O-CG 3.18Å; C253-L257 PolarHBondContact O-N 2.94Å; H254-L257 PolarHBondContact O-N 3.33Å; E255-L257 PolarHBondContact O-N 2.92Å; L257-H260 PolarHBondContact O-N 3.09Å; L257-L261 WeakPolarHBondContact O-CB 3.48Å; L257-L261 WeakPolarHBondContact O-CG 3.34Å; L257-L261 PolarHBondContact O-N 3.03Å |
| 258 | L | 96.1 | Very high | 95.4 | Very high | 25 Ų | 25 | 40.2 Ų | 40.2 | 13% | 0.131 | 22% | 0.215 | C | C | . | . | H | α-helix | trans | -61.5 | -53.1 | 178.5 | -176.1 | 66.8 | 0 | 0 | 0 | 110.1 | L129 D130 L133 H254 E255 H260 L261 Q262 | L129-L258 HydrophobicContact CB-CD1 4Å; L129-L258 HydrophobicContact CD2-CD1 3.86Å; L129-L258 HydrophobicContact CG-CD1 3.89Å; D130-L258 HydrophobicContact CB-CD1 4.26Å; D130-L258 HydrophobicContact CB-CD2 4.43Å; D130-L258 WeakPolarHBondContact OD1-CD2 3.2Å; L133-L258 HydrophobicContact CD1-CB 3.95Å; L133-L258 HydrophobicContact CD1-CD1 4.15Å; H254-L258 WeakPolarHBondContact O-CB 3.36Å; H254-L258 PolarHBondContact O-N 3.15Å; E255-L258 PolarHBondContact O-N 3.42Å; L258-H260 PolarHBondContact O-N 3.38Å; L258-L261 PolarHBondContact O-N 2.92Å; L258-Q262 HydrophobicContact CD1-CG 4.24Å; L258-Q262 HydrophobicContact CG-CG 4.45Å; L258-Q262 VanDerWaalsContact O-CB 3.25Å; L258-Q262 WeakPolarHBondContact O-CB 3.32Å; L258-Q262 WeakPolarHBondContact O-CG 3.14Å; L258-Q262 PolarHBondContact O-N 3.38Å |
| 259 | E | 96 | Very high | 95.7 | Very high | 113 Ų | 113 | 40.4 Ų | 40.4 | 53% | 0.528 | 22% | 0.218 | S | C | . | . | H | α-helix | trans | -57.7 | -48.8 | 177.1 | -173 | 178.4 | -169.8 | 0 | 0 | 110.7 | E255 L261 Q262 D263 | E255-E259 WeakPolarHBondContact O-CB 3.46Å; E255-E259 PolarHBondContact O-N 3.11Å; E259-L261 PolarHBondContact O-N 3.19Å; E259-Q262 PolarHBondContact O-N 3.38Å; E259-D263 WeakPolarHBondContact O-CB 3.38Å; E259-D263 PolarHBondContact O-N 3.22Å |
| 260 | H | 95.3 | Very high | 95.8 | Very high | 62 Ų | 62 | 43 Ų | 43 | 29% | 0.287 | 24% | 0.24 | S | C | . | . | H | α-helix | trans | -59.2 | -46.2 | -179.1 | -176.6 | 65.8 | 0 | 0 | 0 | 113.5 | Y166 V256 L257 L258 L264 | Y166-H260 AromaticContact CE1-CD2 3.9Å; V256-H260 WeakPolarHBondContact O-CB 3.22Å; V256-H260 PolarHBondContact O-N 3.3Å; V256-H260 VanDerWaalsContact O-N 3.12Å; L257-H260 PolarHBondContact O-N 3.09Å; L258-H260 PolarHBondContact O-N 3.38Å; H260-L264 WeakPolarHBondContact O-CG 3.37Å; H260-L264 PolarHBondContact O-N 3.29Å |
| 261 | L | 94.7 | Very high | 96.2 | Very high | 0 Ų | 0 | 44.3 Ų | 44.3 | 0% | 0 | 24% | 0.242 | C | C | . | . | H | α-helix | trans | -75.6 | -34.1 | -178.5 | -72.1 | 176.1 | 0 | 0 | 0 | 112.1 | L42 L46 L49 F59 L129 L257 L258 E259 L264 A265 | L42-L261 HydrophobicContact CD1-CD2 4.16Å; L46-L261 HydrophobicContact CD2-CD2 4.11Å; L49-L261 HydrophobicContact CD1-CD1 4.39Å; L49-L261 HydrophobicContact CD1-CD2 4.03Å; L49-L261 HydrophobicContact CD1-CG 4.36Å; F59-L261 HydrophobicContact CE1-CD2 4.47Å; F59-L261 HydrophobicContact CZ-CB 4.36Å; L129-L261 HydrophobicContact CD1-CD1 3.96Å; L129-L261 HydrophobicContact CD2-CB 3.47Å; L129-L261 VanDerWaalsContact CD2-CB 3.47Å; L129-L261 HydrophobicContact CD2-CD1 4.01Å; L129-L261 HydrophobicContact CD2-CG 4.4Å; L129-L261 HydrophobicContact CG-CD1 4.49Å; L257-L261 WeakPolarHBondContact O-CB 3.48Å; L257-L261 WeakPolarHBondContact O-CG 3.34Å; L257-L261 PolarHBondContact O-N 3.03Å; L258-L261 PolarHBondContact O-N 2.92Å; E259-L261 PolarHBondContact O-N 3.19Å; L261-L264 PolarHBondContact O-N 3.48Å; L261-A265 WeakPolarHBondContact O-CB 3.32Å; L261-A265 PolarHBondContact O-N 2.92Å |
| 262 | Q | 95 | Very high | 96.4 | Very high | 75 Ų | 75 | 39.6 Ų | 39.6 | 35% | 0.35 | 22% | 0.22 | S | C | . | . | H | α-helix | trans | -65.5 | -41.1 | 173.8 | -74.8 | -179.2 | -10.5 | 0 | 0 | 111.5 | P126 L129 L258 E259 A265 G266 | P126-Q262 HydrophobicContact CB-CG 4.35Å; L129-Q262 HydrophobicContact CD2-CG 4.23Å; L258-Q262 HydrophobicContact CD1-CG 4.24Å; L258-Q262 HydrophobicContact CG-CG 4.45Å; L258-Q262 VanDerWaalsContact O-CB 3.25Å; L258-Q262 WeakPolarHBondContact O-CB 3.32Å; L258-Q262 WeakPolarHBondContact O-CG 3.14Å; L258-Q262 PolarHBondContact O-N 3.38Å; E259-Q262 PolarHBondContact O-N 3.38Å; Q262-A265 PolarHBondContact O-N 3.06Å; Q262-G266 PolarHBondContact O-N 3.41Å |
| 263 | D | 95.3 | Very high | 96.5 | Very high | 100 Ų | 100 | 41.3 Ų | 41.3 | 54% | 0.535 | 23% | 0.234 | S | C | . | . | H | α-helix | trans | -62.4 | -44 | 175 | -80.5 | -10.8 | 0 | 0 | 0 | 111.9 | E259 A265 G266 T267 | E259-D263 WeakPolarHBondContact O-CB 3.38Å; E259-D263 PolarHBondContact O-N 3.22Å; D263-A265 VanDerWaalsContact C-N 3.34Å; D263-A265 PolarHBondContact O-N 3.41Å; D263-G266 PolarHBondContact O-N 3.32Å; D263-T267 WeakPolarHBondContact O-CB 3.48Å; D263-T267 VanDerWaalsContact O-CG2 3.29Å; D263-T267 WeakPolarHBondContact O-CG2 3.2Å; D263-T267 PolarHBondContact O-N 2.87Å; D263-T267 PolarHBondContact O-OG1 3.46Å |
| 264 | L | 94.8 | Very high | 96.5 | Very high | 34 Ų | 34 | 45 Ų | 45 | 18% | 0.178 | 26% | 0.256 | C | S | . | . | H | α-helix | trans | -63.1 | -39.2 | 174.8 | -70.7 | 173.6 | 0 | 0 | 0 | 112.1 | L42 H260 L261 T267 L268 | L42-L264 HydrophobicContact CD1-CB 3.98Å; L42-L264 HydrophobicContact CD1-CD1 3.92Å; H260-L264 WeakPolarHBondContact O-CG 3.37Å; H260-L264 PolarHBondContact O-N 3.29Å; L261-L264 PolarHBondContact O-N 3.48Å; L264-T267 WeakPolarHBondContact CA-OG1 3.41Å; L264-T267 PolarHBondContact O-OG1 2.77Å; L264-L268 WeakPolarHBondContact O-CB 3.48Å; L264-L268 PolarHBondContact O-N 3.32Å; L264-L268 VanDerWaalsContact O-N 3.14Å |
| 265 | A | 95.1 | Very high | 96.5 | Very high | 0 Ų | 0 | 44.4 Ų | 44.4 | 0% | 0 | 25% | 0.253 | C | S | . | . | H | α-helix | trans | -68.4 | -42.3 | 175.3 | 0 | 0 | 0 | 0 | 0 | 112.3 | F59 L62 P126 L261 Q262 D263 L268 G269 | F59-A265 HydrophobicContact CE2-CB 4.06Å; F59-A265 HydrophobicContact CZ-CB 3.96Å; L62-A265 HydrophobicContact CD2-CB 3.87Å; P126-A265 HydrophobicContact CG-CB 4.19Å; L261-A265 WeakPolarHBondContact O-CB 3.32Å; L261-A265 PolarHBondContact O-N 2.92Å; Q262-A265 PolarHBondContact O-N 3.06Å; D263-A265 VanDerWaalsContact C-N 3.34Å; D263-A265 PolarHBondContact O-N 3.41Å; A265-L268 PolarHBondContact O-N 3.06Å; A265-G269 PolarHBondContact O-N 3.3Å |
| 266 | G | 95.9 | Very high | 96.5 | Very high | 39 Ų | 39 | 42.6 Ų | 42.6 | 40% | 0.402 | 24% | 0.244 | S | C | . | . | H | α-helix | trans | -67.3 | -40.8 | -179.8 | 0 | 0 | 0 | 0 | 0 | 112.8 | Q262 D263 G269 S270 | Q262-G266 PolarHBondContact O-N 3.41Å; D263-G266 PolarHBondContact O-N 3.32Å; G266-G269 PolarHBondContact O-N 3.21Å; G266-S270 WeakPolarHBondContact O-CB 3.08Å; G266-S270 PolarHBondContact O-N 2.71Å; G266-S270 PolarHBondContact O-OG 2.76Å |
| 267 | T | 96.4 | Very high | 96.6 | Very high | 83 Ų | 83 | 46.5 Ų | 46.5 | 51% | 0.509 | 26% | 0.264 | S | S | . | . | H | α-helix | trans | -63.1 | -45.2 | 172.3 | 51.4 | 0 | 0 | 0 | 0 | 111.4 | D263 L264 G269 S270 M271 | D263-T267 WeakPolarHBondContact O-CB 3.48Å; D263-T267 VanDerWaalsContact O-CG2 3.29Å; D263-T267 WeakPolarHBondContact O-CG2 3.2Å; D263-T267 PolarHBondContact O-N 2.87Å; D263-T267 PolarHBondContact O-OG1 3.46Å; L264-T267 WeakPolarHBondContact CA-OG1 3.41Å; L264-T267 PolarHBondContact O-OG1 2.77Å; T267-G269 PolarHBondContact O-N 2.74Å; T267-S270 PolarHBondContact O-N 3.48Å; T267-M271 WeakPolarHBondContact O-CG 2.89Å; T267-M271 PolarHBondContact O-N 3.01Å |
| 268 | L | 97.3 | Very high | 96.6 | Very high | 4 Ų | 4 | 47.8 Ų | 47.8 | 2% | 0.021 | 27% | 0.27 | C | S | . | . | H | α-helix | trans | -61.2 | -43.9 | 174.3 | -177.4 | 62.1 | 0 | 0 | 0 | 111.9 | I35 C38 L42 L62 A66 L264 A265 S270 M271 L272 | I35-L268 HydrophobicContact CG2-CD1 4.24Å; C38-L268 HydrophobicContact CB-CD1 4.32Å; L42-L268 HydrophobicContact CD2-CD2 4.23Å; L62-L268 HydrophobicContact CD1-CD2 4.5Å; L62-L268 HydrophobicContact CG-CD2 4.19Å; A66-L268 HydrophobicContact CB-CD1 4.21Å; A66-L268 HydrophobicContact CB-CD2 3.88Å; A66-L268 HydrophobicContact CB-CG 4.31Å; L264-L268 WeakPolarHBondContact O-CB 3.48Å; L264-L268 PolarHBondContact O-N 3.32Å; L264-L268 VanDerWaalsContact O-N 3.14Å; A265-L268 PolarHBondContact O-N 3.06Å; L268-S270 VanDerWaalsContact C-N 3.34Å; L268-S270 PolarHBondContact O-N 3.33Å; L268-M271 PolarHBondContact O-N 3.08Å; L268-L272 HydrophobicContact CG-CD1 4.23Å; L268-L272 VanDerWaalsContact O-CG 3.31Å; L268-L272 WeakPolarHBondContact O-CG 3.33Å; L268-L272 PolarHBondContact O-N 3.25Å |
| 269 | G | 97.1 | Very high | 96.6 | Very high | 9 Ų | 9 | 46.7 Ų | 46.7 | 9% | 0.093 | 26% | 0.264 | C | S | . | . | H | α-helix | trans | -60.1 | -41.7 | 176.3 | 0 | 0 | 0 | 0 | 0 | 112.8 | A265 G266 T267 L272 A273 | A265-G269 PolarHBondContact O-N 3.3Å; G266-G269 PolarHBondContact O-N 3.21Å; T267-G269 PolarHBondContact O-N 2.74Å; G269-L272 PolarHBondContact O-N 2.98Å; G269-A273 PolarHBondContact O-N 2.77Å |
| 270 | S | 97.4 | Very high | 96.6 | Very high | 78 Ų | 78 | 43.5 Ų | 43.5 | 55% | 0.545 | 26% | 0.258 | S | S | . | . | H | α-helix | trans | -63.2 | -43.4 | 175.7 | -60.2 | 0 | 0 | 0 | 0 | 111.7 | G266 T267 L268 L272 A273 V274 | G266-S270 WeakPolarHBondContact O-CB 3.08Å; G266-S270 PolarHBondContact O-N 2.71Å; G266-S270 PolarHBondContact O-OG 2.76Å; T267-S270 PolarHBondContact O-N 3.48Å; L268-S270 VanDerWaalsContact C-N 3.34Å; L268-S270 PolarHBondContact O-N 3.33Å; S270-L272 PolarHBondContact O-N 2.98Å; S270-A273 PolarHBondContact O-N 2.98Å; S270-V274 WeakPolarHBondContact O-CG2 3.24Å; S270-V274 PolarHBondContact O-N 2.86Å |
| 271 | M | 97.6 | Very high | 96.7 | Very high | 55 Ų | 55 | 45.1 Ų | 45.1 | 27% | 0.271 | 27% | 0.268 | S | S | . | . | H | α-helix | trans | -63.5 | -39.9 | 175.2 | -68 | -62.9 | -67.8 | 0 | 0 | 112.2 | L34 I35 T267 L268 V274 T275 | L34-M271 HydrophobicContact CB-CE 3.72Å; L34-M271 HydrophobicContact CD1-CE 3.72Å; L34-M271 HydrophobicContact CG-CE 4.39Å; I35-M271 HydrophobicContact CG1-CB 4.06Å; T267-M271 WeakPolarHBondContact O-CG 2.89Å; T267-M271 PolarHBondContact O-N 3.01Å; L268-M271 PolarHBondContact O-N 3.08Å; M271-V274 PolarHBondContact O-N 3.48Å; M271-T275 WeakPolarHBondContact O-CB 3.43Å; M271-T275 PolarHBondContact O-N 3.16Å; M271-T275 PolarHBondContact O-OG1 3.22Å |
| 272 | L | 98.3 | Very high | 96.7 | Very high | 1 Ų | 1 | 45.1 Ų | 45.1 | 1% | 0.005 | 27% | 0.268 | C | S | . | . | H | α-helix | trans | -63.2 | -42.6 | 174.9 | -72.1 | 167.4 | 0 | 0 | 0 | 111.6 | I35 A66 A69 L115 L119 L268 G269 S270 T275 F276 | I35-L272 HydrophobicContact CD1-CD2 3.94Å; I35-L272 HydrophobicContact CG2-CD2 4.35Å; A66-L272 HydrophobicContact CB-CD1 4.24Å; A66-L272 HydrophobicContact CB-CD2 4.36Å; A69-L272 HydrophobicContact CB-CD2 4.38Å; L115-L272 HydrophobicContact CD2-CD2 3.95Å; L119-L272 HydrophobicContact CD1-CB 4.43Å; L268-L272 HydrophobicContact CG-CD1 4.23Å; L268-L272 VanDerWaalsContact O-CG 3.31Å; L268-L272 WeakPolarHBondContact O-CG 3.33Å; L268-L272 PolarHBondContact O-N 3.25Å; G269-L272 PolarHBondContact O-N 2.98Å; S270-L272 PolarHBondContact O-N 2.98Å; L272-T275 PolarHBondContact O-N 3.25Å; L272-F276 WeakPolarHBondContact O-CB 3.22Å; L272-F276 PolarHBondContact O-N 3.31Å |
| 273 | A | 98.1 | Very high | 96.7 | Very high | 37 Ų | 37 | 42 Ų | 42 | 31% | 0.306 | 25% | 0.253 | S | S | . | . | H | α-helix | trans | -62.5 | -45.6 | 177.3 | 0 | 0 | 0 | 0 | 0 | 112.2 | L119 G269 S270 T275 F276 L277 | L119-A273 HydrophobicContact CD1-CB 4.19Å; L119-A273 HydrophobicContact CD2-CB 4.48Å; G269-A273 PolarHBondContact O-N 2.77Å; S270-A273 PolarHBondContact O-N 2.98Å; A273-T275 VanDerWaalsContact C-N 3.32Å; A273-T275 PolarHBondContact O-N 2.94Å; A273-F276 PolarHBondContact O-N 2.96Å; A273-L277 WeakPolarHBondContact O-CG 3.35Å; A273-L277 PolarHBondContact O-N 3.21Å; A273-L277 VanDerWaalsContact O-N 3.15Å |
| 274 | V | 97.9 | Very high | 96.6 | Very high | 78 Ų | 78 | 40.7 Ų | 40.7 | 47% | 0.473 | 25% | 0.246 | S | C | . | . | H | α-helix | trans | -61.3 | -42.5 | 174.8 | 172.9 | 0 | 0 | 0 | 0 | 111 | S270 M271 F276 L277 L278 | S270-V274 WeakPolarHBondContact O-CG2 3.24Å; S270-V274 PolarHBondContact O-N 2.86Å; M271-V274 PolarHBondContact O-N 3.48Å; V274-F276 PolarHBondContact O-N 2.94Å; V274-L277 PolarHBondContact O-N 3.33Å; V274-L278 HydrophobicContact CG1-CD1 4.01Å; V274-L278 HydrophobicContact CG1-CG 4.48Å; V274-L278 WeakPolarHBondContact O-CG 3.19Å; V274-L278 PolarHBondContact O-N 3.31Å |
| 275 | T | 97.8 | Very high | 96.4 | Very high | 0 Ų | 0 | 39.5 Ų | 39.5 | 0% | 0 | 24% | 0.242 | C | C | . | . | H | α-helix | trans | -64.7 | -39.5 | 179 | -58.7 | 0 | 0 | 0 | 0 | 111.9 | L28 I35 A73 L115 M271 L272 A273 L278 Q279 | L28-T275 HydrophobicContact CD1-CG2 3.79Å; I35-T275 HydrophobicContact CD1-CG2 3.94Å; I35-T275 WeakPolarHBondContact CD1-OG1 3.42Å; A73-T275 HydrophobicContact CB-CG2 3.62Å; L115-T275 HydrophobicContact CD1-CG2 4.39Å; L115-T275 HydrophobicContact CD2-CG2 4.21Å; M271-T275 WeakPolarHBondContact O-CB 3.43Å; M271-T275 PolarHBondContact O-N 3.16Å; M271-T275 PolarHBondContact O-OG1 3.22Å; L272-T275 PolarHBondContact O-N 3.25Å; A273-T275 VanDerWaalsContact C-N 3.32Å; A273-T275 PolarHBondContact O-N 2.94Å; T275-L278 PolarHBondContact O-N 3.45Å; T275-Q279 VanDerWaalsContact O-CB 3.28Å; T275-Q279 WeakPolarHBondContact O-CB 3.43Å; T275-Q279 PolarHBondContact O-N 2.86Å |
| 276 | F | 97.9 | Very high | 96.2 | Very high | 74 Ų | 74 | 39.6 Ų | 39.6 | 33% | 0.325 | 24% | 0.243 | S | C | . | . | H | α-helix | trans | -59.7 | -46 | 173.7 | 174.1 | -101.2 | 0 | 0 | 0 | 112.2 | L115 V116 L272 A273 V274 Q279 A280 | L115-F276 HydrophobicContact CB-CB 4.43Å; L115-F276 HydrophobicContact CB-CD2 4.09Å; L115-F276 HydrophobicContact CD1-CB 4.48Å; V116-F276 HydrophobicContact CG2-CD2 4.14Å; V116-F276 HydrophobicContact CG2-CE2 3.59Å; V116-F276 HydrophobicContact CG2-CZ 4.11Å; L272-F276 WeakPolarHBondContact O-CB 3.22Å; L272-F276 PolarHBondContact O-N 3.31Å; A273-F276 PolarHBondContact O-N 2.96Å; V274-F276 PolarHBondContact O-N 2.94Å; F276-Q279 PolarHBondContact O-N 3.44Å; F276-A280 WeakPolarHBondContact O-CB 3.4Å; F276-A280 PolarHBondContact O-N 3.02Å |
| 277 | L | 97.8 | Very high | 96 | Very high | 110 Ų | 110 | 40.5 Ų | 40.5 | 58% | 0.576 | 23% | 0.234 | S | C | * | . | H | α-helix | trans | -63.2 | -45.8 | 176.6 | -66.2 | 175 | 0 | 0 | 0 | 111.8 | A273 V274 Q279 A280 L281 | A273-L277 WeakPolarHBondContact O-CG 3.35Å; A273-L277 PolarHBondContact O-N 3.21Å; A273-L277 VanDerWaalsContact O-N 3.15Å; V274-L277 PolarHBondContact O-N 3.33Å; L277-Q279 PolarHBondContact O-N 3.03Å; L277-A280 PolarHBondContact O-N 3.19Å; L277-L281 WeakPolarHBondContact O-CG 3.39Å; L277-L281 PolarHBondContact O-N 2.92Å |
| 278 | L | 97.3 | Very high | 95.6 | Very high | 26 Ų | 26 | 37.8 Ų | 37.8 | 14% | 0.136 | 21% | 0.214 | C | C | . | . | H | α-helix | trans | -60.1 | -45.9 | 176.4 | -76.1 | 170.5 | 0 | 0 | 0 | 111.7 | L24 L27 L28 A31 V274 T275 A280 L281 V282 | L24-L278 HydrophobicContact CD2-CD2 4.02Å; L27-L278 HydrophobicContact CB-CD1 4.43Å; L27-L278 HydrophobicContact CB-CD2 4.38Å; L28-L278 HydrophobicContact CD1-CB 4.04Å; A31-L278 HydrophobicContact CB-CD1 4.2Å; V274-L278 HydrophobicContact CG1-CD1 4.01Å; V274-L278 HydrophobicContact CG1-CG 4.48Å; V274-L278 WeakPolarHBondContact O-CG 3.19Å; V274-L278 PolarHBondContact O-N 3.31Å; T275-L278 PolarHBondContact O-N 3.45Å; L278-A280 PolarHBondContact O-N 2.96Å; L278-L281 PolarHBondContact O-N 3.13Å; L278-V282 WeakPolarHBondContact O-CG2 3.39Å; L278-V282 PolarHBondContact O-N 3.02Å |
| 279 | Q | 96.8 | Very high | 95 | Very high | 2 Ų | 2 | 37.9 Ų | 37.9 | 1% | 0.009 | 22% | 0.215 | C | C | . | . | H | α-helix | trans | -62.9 | -42.4 | 178.8 | -179.1 | 155.2 | -28.3 | 0 | 0 | 111.6 | L28 T76 G107 L115 T275 F276 L277 V282 L283 | L28-Q279 HydrophobicContact CD1-CB 4.1Å; L28-Q279 HydrophobicContact CD2-CB 4.29Å; T76-Q279 HydrophobicContact CG2-CG 4.46Å; G107-Q279 PolarHBondContact O-NE2 3.4Å; L115-Q279 HydrophobicContact CD1-CB 4.23Å; L115-Q279 HydrophobicContact CD1-CG 4.43Å; L115-Q279 VanDerWaalsContact CD1-OE1 3.3Å; T275-Q279 VanDerWaalsContact O-CB 3.28Å; T275-Q279 WeakPolarHBondContact O-CB 3.43Å; T275-Q279 PolarHBondContact O-N 2.86Å; F276-Q279 PolarHBondContact O-N 3.44Å; L277-Q279 PolarHBondContact O-N 3.03Å; Q279-V282 PolarHBondContact O-N 3.24Å; Q279-L283 HydrophobicContact CG-CD1 3.65Å; Q279-L283 HydrophobicContact CG-CG 4.25Å; Q279-L283 WeakPolarHBondContact O-CB 3.32Å; Q279-L283 VanDerWaalsContact O-CG 3.23Å; Q279-L283 WeakPolarHBondContact O-CG 3.32Å; Q279-L283 PolarHBondContact O-N 3.17Å |
| 280 | A | 95.9 | Very high | 94.6 | Very high | 47 Ų | 47 | 37.8 Ų | 37.8 | 39% | 0.388 | 21% | 0.212 | S | C | . | . | H | α-helix | trans | -60.6 | -45.9 | 175.2 | 0 | 0 | 0 | 0 | 0 | 111.8 | F276 L277 L278 L284 | F276-A280 WeakPolarHBondContact O-CB 3.4Å; F276-A280 PolarHBondContact O-N 3.02Å; L277-A280 PolarHBondContact O-N 3.19Å; L278-A280 PolarHBondContact O-N 2.96Å; A280-L284 WeakPolarHBondContact O-CB 3.38Å; A280-L284 PolarHBondContact O-N 3.33Å |
| 281 | L | 95.9 | Very high | 93.9 | Very high | 96 Ų | 96 | 34.1 Ų | 34.1 | 50% | 0.503 | 19% | 0.186 | S | C | . | . | H | α-helix | trans | -62.9 | -44.6 | 178.2 | -70.9 | 172.9 | 0 | 0 | 0 | 112.4 | L277 L278 G285 | L277-L281 WeakPolarHBondContact O-CG 3.39Å; L277-L281 PolarHBondContact O-N 2.92Å; L278-L281 PolarHBondContact O-N 3.13Å; L281-G285 PolarHBondContact O-N 3.48Å |
| 282 | V | 95.7 | Very high | 93.2 | Very high | 0 Ų | 0 | 31.5 Ų | 31.5 | 0% | 0 | 17% | 0.174 | C | C | . | . | H | α-helix | trans | -63.4 | -50.4 | 178.6 | 169.1 | 0 | 0 | 0 | 0 | 110.7 | L24 L28 L278 Q279 L284 G285 L286 | L24-V282 HydrophobicContact CB-CG2 3.79Å; L28-V282 HydrophobicContact CD2-CB 4.47Å; L28-V282 HydrophobicContact CD2-CG2 4.39Å; L278-V282 WeakPolarHBondContact O-CG2 3.39Å; L278-V282 PolarHBondContact O-N 3.02Å; Q279-V282 PolarHBondContact O-N 3.24Å; V282-L284 PolarHBondContact O-N 3.04Å; V282-G285 PolarHBondContact O-N 3.42Å; V282-L286 HydrophobicContact CG1-CD1 3.75Å; V282-L286 HydrophobicContact CG1-CG 4.33Å; V282-L286 WeakPolarHBondContact O-CB 3.33Å; V282-L286 VanDerWaalsContact O-CG 3.25Å; V282-L286 WeakPolarHBondContact O-CG 3.19Å; V282-L286 PolarHBondContact O-N 3.32Å |
| 283 | L | 94.5 | Very high | 92.3 | Very high | 8 Ų | 8 | 31.7 Ų | 31.7 | 4% | 0.042 | 17% | 0.174 | C | C | . | . | H | α-helix | trans | -65.6 | -40.2 | -178.7 | -67.3 | 172 | 0 | 0 | 0 | 111.8 | T76 M103 L104 G107 T108 Q279 R287 | T76-L283 HydrophobicContact CG2-CD2 3.98Å; T76-L283 HydrophobicContact CG2-CG 4.45Å; M103-L283 HydrophobicContact CE-CD2 4.38Å; L104-L283 HydrophobicContact CD2-CB 4.27Å; L104-L283 HydrophobicContact CD2-CD2 3.79Å; L104-L283 WeakPolarHBondContact CD2-O 3.43Å; G107-L283 VanDerWaalsContact C-CD1 3.42Å; G107-L283 WeakPolarHBondContact O-CD1 3.4Å; T108-L283 HydrophobicContact CG2-CB 4.24Å; T108-L283 HydrophobicContact CG2-CD1 3.86Å; Q279-L283 HydrophobicContact CG-CD1 3.65Å; Q279-L283 HydrophobicContact CG-CG 4.25Å; Q279-L283 WeakPolarHBondContact O-CB 3.32Å; Q279-L283 VanDerWaalsContact O-CG 3.23Å; Q279-L283 WeakPolarHBondContact O-CG 3.32Å; Q279-L283 PolarHBondContact O-N 3.17Å; L283-R287 WeakPolarHBondContact O-CB 3.38Å; L283-R287 PolarHBondContact O-N 3.43Å |
| 284 | L | 92.9 | Very high | 91.4 | Very high | 74 Ų | 74 | 32.8 Ų | 32.8 | 39% | 0.387 | 17% | 0.173 | S | C | . | . | H | α-helix | trans | -63 | -48.9 | 176 | -172.7 | 68.7 | 0 | 0 | 0 | 110.9 | A280 V282 L286 R287 Y288 L310 | A280-L284 WeakPolarHBondContact O-CB 3.38Å; A280-L284 PolarHBondContact O-N 3.33Å; V282-L284 PolarHBondContact O-N 3.04Å; L284-L286 PolarHBondContact O-N 2.95Å; L284-R287 WeakPolarHBondContact O-CB 3.49Å; L284-R287 PolarHBondContact O-N 2.96Å; L284-Y288 HydrophobicContact CD1-CD2 4.32Å; L284-Y288 HydrophobicContact CD1-CE2 3.9Å; L284-Y288 HydrophobicContact CG-CD2 4.09Å; L284-Y288 HydrophobicContact CG-CE2 3.96Å; L284-Y288 VanDerWaalsContact O-CD2 3.27Å; L284-Y288 WeakPolarHBondContact O-CD2 3.22Å; L284-Y288 PolarHBondContact O-N 3.49Å; L284-L310 HydrophobicContact CD1-CD1 3.33Å; L284-L310 HydrophobicContact CD1-CD2 4.31Å; L284-L310 HydrophobicContact CD1-CG 4.41Å |
| 285 | G | 91.3 | Very high | 90.2 | Very high | 9 Ų | 9 | 32 Ų | 32 | 9% | 0.093 | 18% | 0.181 | C | C | . | . | H | α-helix | trans | -65.4 | -39.6 | 179.5 | 0 | 0 | 0 | 0 | 0 | 112.9 | L281 V282 R287 Y288 L289 | L281-G285 PolarHBondContact O-N 3.48Å; V282-G285 PolarHBondContact O-N 3.42Å; G285-R287 VanDerWaalsContact C-N 3.28Å; G285-R287 PolarHBondContact O-N 2.92Å; G285-Y288 PolarHBondContact O-N 3.24Å; G285-L289 WeakPolarHBondContact O-CB 3.32Å; G285-L289 PolarHBondContact O-N 2.9Å |
| 286 | L | 91.3 | Very high | 88.9 | Confident | 2 Ų | 2 | 33.2 Ų | 33.2 | 1% | 0.01 | 19% | 0.187 | C | C | . | . | H | α-helix | trans | -62.1 | -36.4 | 173.2 | -74.4 | 173.5 | 0 | 0 | 0 | 111.6 | L21 A83 M103 L104 V282 L284 L289 Q290 | L21-L286 HydrophobicContact CD1-CD2 4.48Å; A83-L286 HydrophobicContact CB-CD2 3.86Å; M103-L286 HydrophobicContact CE-CD1 4.47Å; L104-L286 HydrophobicContact CD2-CB 3.89Å; V282-L286 HydrophobicContact CG1-CD1 3.75Å; V282-L286 HydrophobicContact CG1-CG 4.33Å; V282-L286 WeakPolarHBondContact O-CB 3.33Å; V282-L286 VanDerWaalsContact O-CG 3.25Å; V282-L286 WeakPolarHBondContact O-CG 3.19Å; V282-L286 PolarHBondContact O-N 3.32Å; L284-L286 PolarHBondContact O-N 2.95Å; L286-L289 PolarHBondContact O-N 3.32Å; L286-Q290 WeakPolarHBondContact O-CB 3.39Å; L286-Q290 PolarHBondContact O-N 3.43Å |
| 287 | R | 91.4 | Very high | 87.3 | Confident | 57 Ų | 57 | 32.4 Ų | 32.4 | 22% | 0.215 | 20% | 0.199 | C | C | . | . | H | α-helix | trans | -64 | -45.2 | 174.6 | -179.5 | 57 | 175.7 | 178.6 | -0.5 | 112.4 | L104 L283 L284 G285 L289 Q290 T291 L310 | L104-R287 HydrophobicContact CD1-CB 3.92Å; L104-R287 HydrophobicContact CD1-CG 4.45Å; L283-R287 WeakPolarHBondContact O-CB 3.38Å; L283-R287 PolarHBondContact O-N 3.43Å; L284-R287 WeakPolarHBondContact O-CB 3.49Å; L284-R287 PolarHBondContact O-N 2.96Å; G285-R287 VanDerWaalsContact C-N 3.28Å; G285-R287 PolarHBondContact O-N 2.92Å; R287-L289 VanDerWaalsContact C-N 3.31Å; R287-L289 PolarHBondContact O-N 3.45Å; R287-Q290 PolarHBondContact O-N 2.98Å; R287-T291 PolarHBondContact O-N 2.83Å; R287-T291 VanDerWaalsContact O-N 3.14Å; R287-T291 PolarHBondContact O-OG1 2.69Å; R287-L310 HydrophobicContact CG-CD1 4.06Å; R287-L310 PolarHBondContact NE-O 3.15Å; R287-L310 PolarHBondContact NH2-O 3.24Å |
| 288 | Y | 87.4 | Confident | 85.3 | Confident | 27 Ų | 27 | 29 Ų | 29 | 11% | 0.106 | 19% | 0.192 | C | C | . | . | H | α-helix | trans | -61.6 | -41.9 | 174.7 | -87.3 | -77.6 | 0 | 0 | 0 | 111.7 | L5 L7 L284 G285 T291 A292 | L5-Y288 VanDerWaalsContact CD2-OH 3.22Å; L5-Y288 WeakPolarHBondContact CD2-OH 3.48Å; L5-Y288 WeakPolarHBondContact CG-OH 3.43Å; L5-Y288 WeakPolarHBondContact O-CE1 3.19Å; L5-Y288 PolarHBondContact O-OH 3.12Å; L7-Y288 HydrophobicContact CB-CD1 4.31Å; L7-Y288 HydrophobicContact CB-CE1 4.07Å; L284-Y288 HydrophobicContact CD1-CD2 4.32Å; L284-Y288 HydrophobicContact CD1-CE2 3.9Å; L284-Y288 HydrophobicContact CG-CD2 4.09Å; L284-Y288 HydrophobicContact CG-CE2 3.96Å; L284-Y288 VanDerWaalsContact O-CD2 3.27Å; L284-Y288 WeakPolarHBondContact O-CD2 3.22Å; L284-Y288 PolarHBondContact O-N 3.49Å; G285-Y288 PolarHBondContact O-N 3.24Å; Y288-T291 PolarHBondContact O-OG1 2.95Å; Y288-A292 WeakPolarHBondContact O-CB 3.46Å; Y288-A292 PolarHBondContact O-N 3.19Å; Y288-A292 VanDerWaalsContact O-N 3.1Å |
| 289 | L | 85.7 | Confident | 83.6 | Confident | 5 Ų | 5 | 32.4 Ų | 32.4 | 3% | 0.026 | 21% | 0.213 | C | C | . | . | H | α-helix | trans | -68.3 | -41.7 | 179.2 | -169 | 60.7 | 0 | 0 | 0 | 112 | R14 A18 L21 S87 G285 L286 R287 L293 | R14-L289 HydrophobicContact CG-CD1 3.57Å; A18-L289 HydrophobicContact CB-CD2 4Å; L21-L289 HydrophobicContact CD1-CB 4.47Å; L21-L289 HydrophobicContact CD1-CD2 4.17Å; S87-L289 VanDerWaalsContact CB-CD2 3.5Å; S87-L289 VanDerWaalsContact OG-CD2 3.28Å; S87-L289 WeakPolarHBondContact OG-CD2 3.45Å; G285-L289 WeakPolarHBondContact O-CB 3.32Å; G285-L289 PolarHBondContact O-N 2.9Å; L286-L289 PolarHBondContact O-N 3.32Å; R287-L289 VanDerWaalsContact C-N 3.31Å; R287-L289 PolarHBondContact O-N 3.45Å; L289-L293 HydrophobicContact CD1-CD1 4.33Å; L289-L293 HydrophobicContact CG-CD1 4.04Å; L289-L293 WeakPolarHBondContact O-CB 3.35Å; L289-L293 VanDerWaalsContact O-CG 3.25Å; L289-L293 WeakPolarHBondContact O-CG 3.46Å; L289-L293 PolarHBondContact O-N 2.98Å |
| 290 | Q | 87.1 | Confident | 81.8 | Confident | 7 Ų | 7 | 32.9 Ų | 32.9 | 3% | 0.033 | 22% | 0.215 | C | C | . | . | H | α-helix | trans | -56.9 | -54.1 | 176.5 | -178.6 | -177.1 | 4.7 | 0 | 0 | 111.2 | L100 L286 R287 A292 L293 E294 | L100-Q290 HydrophobicContact CD2-CB 3.58Å; L100-Q290 HydrophobicContact CD2-CG 3.82Å; L100-Q290 HydrophobicContact CG-CB 4.34Å; L100-Q290 HydrophobicContact CG-CG 4.37Å; L286-Q290 WeakPolarHBondContact O-CB 3.39Å; L286-Q290 PolarHBondContact O-N 3.43Å; R287-Q290 PolarHBondContact O-N 2.98Å; Q290-A292 VanDerWaalsContact C-N 3.35Å; Q290-A292 PolarHBondContact O-N 3.46Å; Q290-L293 PolarHBondContact O-N 3.23Å; Q290-E294 HydrophobicContact CG-CG 4.43Å; Q290-E294 VanDerWaalsContact CG-OE1 3.32Å; Q290-E294 WeakPolarHBondContact CG-OE1 3.36Å; Q290-E294 PolarHBondContact NE2-OE1 3.06Å; Q290-E294 WeakPolarHBondContact O-CG 3.34Å; Q290-E294 PolarHBondContact O-N 3.11Å |
| 291 | T | 84.5 | Confident | 80 | Confident | 2 Ų | 2 | 37.1 Ų | 37.1 | 1% | 0.012 | 23% | 0.231 | C | C | . | . | H | α-helix | trans | -66.8 | -37.4 | -174.9 | 47.6 | 0 | 0 | 0 | 0 | 111.8 | R287 Y288 E294 G295 G308 Y309 | R287-T291 PolarHBondContact O-N 2.83Å; R287-T291 VanDerWaalsContact O-N 3.14Å; R287-T291 PolarHBondContact O-OG1 2.69Å; Y288-T291 PolarHBondContact O-OG1 2.95Å; T291-E294 PolarHBondContact O-N 3.21Å; T291-G295 PolarHBondContact O-N 2.65Å; T291-G295 VanDerWaalsContact O-N 3.17Å; T291-G308 WeakPolarHBondContact OG1-CA 3.4Å; T291-Y309 HydrophobicContact CG2-CD2 3.98Å; T291-Y309 HydrophobicContact CG2-CE1 4.33Å; T291-Y309 HydrophobicContact CG2-CE2 3.7Å; T291-Y309 HydrophobicContact CG2-CG 4.41Å; T291-Y309 WeakPolarHBondContact CG2-O 3.37Å; T291-Y309 PolarHBondContact OG1-N 3.05Å; T291-Y309 PolarHBondContact OG1-O 3.35Å |
| 292 | A | 82.5 | Confident | 78.1 | Confident | 0 Ų | 0 | 33.6 Ų | 33.6 | 0% | 0 | 22% | 0.219 | C | C | . | . | H | α-helix | trans | -61.3 | -45.3 | 172.2 | 0 | 0 | 0 | 0 | 0 | 112 | L9 Y288 Q290 G295 | L9-A292 HydrophobicContact CB-CB 4.4Å; L9-A292 HydrophobicContact CD1-CB 3.96Å; Y288-A292 WeakPolarHBondContact O-CB 3.46Å; Y288-A292 PolarHBondContact O-N 3.19Å; Y288-A292 VanDerWaalsContact O-N 3.1Å; Q290-A292 VanDerWaalsContact C-N 3.35Å; Q290-A292 PolarHBondContact O-N 3.46Å; A292-G295 PolarHBondContact O-N 3.04Å |
| 293 | L | 79.4 | Confident | 76.1 | Confident | 4 Ų | 4 | 42.7 Ų | 42.7 | 2% | 0.021 | 26% | 0.261 | C | S | . | . | H | α-helix | trans | -70.2 | -35.2 | 180 | -70.7 | 172.1 | 0 | 0 | 0 | 113.3 | Y93 L289 Q290 G295 L296 I300 | Y93-L293 HydrophobicContact CD1-CD1 4.49Å; Y93-L293 HydrophobicContact CD2-CD1 4.05Å; Y93-L293 HydrophobicContact CE1-CB 3.87Å; Y93-L293 HydrophobicContact CE1-CD1 3.99Å; Y93-L293 HydrophobicContact CE2-CD1 3.5Å; Y93-L293 VanDerWaalsContact CE2-CD1 3.5Å; Y93-L293 VanDerWaalsContact CZ-CD1 3.46Å; L289-L293 HydrophobicContact CD1-CD1 4.33Å; L289-L293 HydrophobicContact CG-CD1 4.04Å; L289-L293 WeakPolarHBondContact O-CB 3.35Å; L289-L293 VanDerWaalsContact O-CG 3.25Å; L289-L293 WeakPolarHBondContact O-CG 3.46Å; L289-L293 PolarHBondContact O-N 2.98Å; Q290-L293 PolarHBondContact O-N 3.23Å; L293-G295 VanDerWaalsContact C-N 3.26Å; L293-G295 PolarHBondContact O-N 3.35Å; L293-L296 HydrophobicContact CD2-CD1 4.48Å; L293-L296 PolarHBondContact O-N 3.14Å; L293-I300 HydrophobicContact CD2-CD1 4.17Å; L293-I300 HydrophobicContact CD2-CG1 4.27Å; L293-I300 HydrophobicContact CD2-CG2 4.25Å |
| 294 | E | 79.5 | Confident | 74.4 | Confident | 60 Ų | 60 | 44.2 Ų | 44.2 | 28% | 0.28 | 28% | 0.279 | S | S | . | . | H | α-helix | trans | -63.1 | -34.8 | 173.4 | -76.4 | 172.8 | -176 | 0 | 0 | 111.7 | Q290 T291 L296 G297 | Q290-E294 HydrophobicContact CG-CG 4.43Å; Q290-E294 VanDerWaalsContact CG-OE1 3.32Å; Q290-E294 WeakPolarHBondContact CG-OE1 3.36Å; Q290-E294 PolarHBondContact NE2-OE1 3.06Å; Q290-E294 WeakPolarHBondContact O-CG 3.34Å; Q290-E294 PolarHBondContact O-N 3.11Å; T291-E294 PolarHBondContact O-N 3.21Å; E294-L296 PolarHBondContact O-N 3.26Å; E294-G297 PolarHBondContact O-N 2.93Å; E294-G297 VanDerWaalsContact O-N 3.15Å |
| 295 | G | 72.5 | Confident | 73 | Confident | 61 Ų | 61 | 48.7 Ų | 48.7 | 63% | 0.629 | 30% | 0.298 | S | S | * | . | H | α-helix | trans | -63.2 | -23.3 | 174.2 | 0 | 0 | 0 | 0 | 0 | 114.9 | T291 A292 L293 G297 | T291-G295 PolarHBondContact O-N 2.65Å; T291-G295 VanDerWaalsContact O-N 3.17Å; A292-G295 PolarHBondContact O-N 3.04Å; L293-G295 VanDerWaalsContact C-N 3.26Å; L293-G295 PolarHBondContact O-N 3.35Å; G295-G297 VanDerWaalsContact C-N 3.29Å; G295-G297 PolarHBondContact O-N 3.05Å |
| 296 | L | 68.9 | Low | 71.9 | Confident | 27 Ų | 27 | 48.7 Ų | 48.7 | 14% | 0.141 | 30% | 0.296 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -83.4 | 1.2 | 175 | -78.3 | 130.3 | 0 | 0 | 0 | 114 | L293 E294 G298 V299 T306 | L293-L296 HydrophobicContact CD2-CD1 4.48Å; L293-L296 PolarHBondContact O-N 3.14Å; E294-L296 PolarHBondContact O-N 3.26Å; L296-G298 PolarHBondContact O-N 3.34Å; L296-V299 VanDerWaalsContact CD2-O 3.25Å; L296-V299 WeakPolarHBondContact CD2-O 3.48Å; L296-V299 PolarHBondContact O-N 2.84Å; L296-V299 VanDerWaalsContact O-N 3.13Å; L296-T306 HydrophobicContact CB-CG2 4.49Å; L296-T306 HydrophobicContact CD1-CG2 3.33Å; L296-T306 HydrophobicContact CD2-CG2 4.02Å; L296-T306 HydrophobicContact CG-CG2 3.32Å |
| 297 | G | 64.1 | Low | 71.1 | Confident | 56 Ų | 56 | 53.5 Ų | 53.5 | 58% | 0.577 | 32% | 0.318 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 65 | 1.7 | -179.1 | 0 | 0 | 0 | 0 | 0 | 114.8 | R97 E294 G295 | R97-G297 PolarHBondContact NH1-O 2.78Å; E294-G297 PolarHBondContact O-N 2.93Å; E294-G297 VanDerWaalsContact O-N 3.15Å; G295-G297 VanDerWaalsContact C-N 3.29Å; G295-G297 PolarHBondContact O-N 3.05Å |
| 298 | G | 57.7 | Low | 70.3 | Confident | 40 Ų | 40 | 50.8 Ų | 50.8 | 41% | 0.412 | 31% | 0.308 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 108.8 | 0.7 | -175.8 | 0 | 0 | 0 | 0 | 0 | 115.3 | L296 | L296-G298 PolarHBondContact O-N 3.34Š|
| 299 | V | 60.8 | Low | 69.8 | Low | 97 Ų | 97 | 52.3 Ų | 52.3 | 59% | 0.588 | 31% | 0.314 | S | S | * | . | trans | -97.3 | 91.3 | 175.1 | -176.7 | 0 | 0 | 0 | 0 | 109.5 | L296 D301 G302 | L296-V299 VanDerWaalsContact CD2-O 3.25Å; L296-V299 WeakPolarHBondContact CD2-O 3.48Å; L296-V299 PolarHBondContact O-N 2.84Å; L296-V299 VanDerWaalsContact O-N 3.13Å; V299-D301 VanDerWaalsContact C-N 3.32Å; V299-D301 PolarHBondContact O-N 3.04Å; V299-G302 PolarHBondContact O-N 3.24Å | ||
| 300 | I | 59.4 | Low | 69.2 | Low | 11 Ų | 11 | 54.2 Ų | 54.2 | 6% | 0.056 | 32% | 0.324 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -68.1 | -29.6 | -173.3 | -54 | -164.7 | 0 | 0 | 0 | 112.4 | R14 A90 Y93 L293 G302 | R14-I300 PolarHBondContact NH2-O 3.39Å; A90-I300 HydrophobicContact CB-CB 3.96Å; A90-I300 HydrophobicContact CB-CD1 4.21Å; A90-I300 HydrophobicContact CB-CG1 4.01Å; Y93-I300 HydrophobicContact CD1-CD1 4.4Å; Y93-I300 HydrophobicContact CG-CD1 4.19Å; L293-I300 HydrophobicContact CD2-CD1 4.17Å; L293-I300 HydrophobicContact CD2-CG1 4.27Å; L293-I300 HydrophobicContact CD2-CG2 4.25Å; I300-G302 VanDerWaalsContact C-N 3.29Å; I300-G302 PolarHBondContact O-N 3.2Å |
| 301 | D | 56.7 | Low | 68.4 | Low | 136 Ų | 136 | 57 Ų | 57 | 73% | 0.727 | 34% | 0.336 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -83.2 | 4.4 | -179.4 | -68.7 | -26 | 0 | 0 | 0 | 114.6 | V299 E303 | V299-D301 VanDerWaalsContact C-N 3.32Å; V299-D301 PolarHBondContact O-N 3.04Å; D301-E303 PolarHBondContact O-N 2.86Å |
| 302 | G | 56.3 | Low | 67.2 | Low | 23 Ų | 23 | 59.9 Ų | 59.9 | 24% | 0.237 | 36% | 0.355 | C | S | . | . | trans | -66.3 | 125.5 | 173 | 0 | 0 | 0 | 0 | 0 | 110.9 | V299 I300 G304 | V299-G302 PolarHBondContact O-N 3.24Å; I300-G302 VanDerWaalsContact C-N 3.29Å; I300-G302 PolarHBondContact O-N 3.2Å; G302-G304 PolarHBondContact O-N 2.64Å | ||
| 303 | E | 55.1 | Low | 66.1 | Low | 190 Ų | 190 | 60.5 Ų | 60.5 | 89% | 0.888 | 36% | 0.361 | S | S | * | . | trans | -65.3 | 6.7 | 170.1 | -70.4 | -169.7 | 149.5 | 0 | 0 | 113.6 | D301 | D301-E303 PolarHBondContact O-N 2.86Š| ||
| 304 | G | 58.2 | Low | 64.8 | Low | 41 Ų | 41 | 61.5 Ų | 61.5 | 42% | 0.423 | 37% | 0.372 | S | S | . | . | trans | -65 | 137.6 | -177.8 | 0 | 0 | 0 | 0 | 0 | 113 | G302 T306 | G302-G304 PolarHBondContact O-N 2.64Å; G304-T306 PolarHBondContact O-N 3.23Å | ||
| 305 | E | 62.4 | Low | 63.5 | Low | 168 Ų | 168 | 64 Ų | 64 | 79% | 0.785 | 39% | 0.387 | S | S | * | . | trans | -62.9 | 122.9 | 169.3 | -65.2 | -166.5 | 159.5 | 0 | 0 | 109.9 | V8 | V8-E305 HydrophobicContact CG1-CB 4.33Š| ||
| 306 | T | 68.2 | Low | 62.7 | Low | 8 Ų | 8 | 68.6 Ų | 68.6 | 5% | 0.049 | 39% | 0.39 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -114.9 | 153.8 | 174.8 | 56.2 | 0 | 0 | 0 | 0 | 112.3 | V8 L9 L296 G304 | V8-T306 CarbonylContact C-O 3.59Å; V8-T306 WeakPolarHBondContact CA-O 3.26Å; L9-T306 PolarHBondContact N-O 3.13Å; L9-T306 PolarHBondContact O-OG1 3.07Å; L296-T306 HydrophobicContact CB-CG2 4.49Å; L296-T306 HydrophobicContact CD1-CG2 3.33Å; L296-T306 HydrophobicContact CD2-CG2 4.02Å; L296-T306 HydrophobicContact CG-CG2 3.32Å; G304-T306 PolarHBondContact O-N 3.23Å |
| 307 | Q | 74.3 | Confident | 62.3 | Low | 103 Ų | 103 | 71.7 Ų | 71.7 | 48% | 0.481 | 41% | 0.406 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -111.2 | 120.2 | 175.8 | -66.2 | -174.3 | -2.9 | 0 | 0 | 109.6 | L7 V8 | L7-Q307 WeakPolarHBondContact O-CA 3.36Å; V8-Q307 HydrophobicContact CG2-CG 4.35Å |
| 308 | G | 75 | Confident | 61.9 | Low | 0 Ų | 0 | 73.4 Ų | 73.4 | 0% | 0 | 40% | 0.401 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -89.3 | 140.9 | 163.6 | 0 | 0 | 0 | 0 | 0 | 109.7 | P6 L7 T291 | P6-G308 WeakPolarHBondContact CA-O 3.35Å; L7-G308 PolarHBondContact N-O 2.97Å; L7-G308 PolarHBondContact O-N 3.34Å; T291-G308 WeakPolarHBondContact OG1-CA 3.4Å |
| 309 | Y | 76.5 | Confident | 61.9 | Low | 60 Ų | 60 | 77.3 Ų | 77.3 | 24% | 0.235 | 41% | 0.412 | C | S | . | . | trans | -145 | 155.3 | -179.9 | 54.8 | -96.4 | 0 | 0 | 0 | 111.7 | P3 T291 F311 P312 | P3-Y309 HydrophobicContact CB-CD1 4.09Å; P3-Y309 HydrophobicContact CB-CD2 4.37Å; P3-Y309 HydrophobicContact CB-CG 3.8Å; T291-Y309 HydrophobicContact CG2-CD2 3.98Å; T291-Y309 HydrophobicContact CG2-CE1 4.33Å; T291-Y309 HydrophobicContact CG2-CE2 3.7Å; T291-Y309 HydrophobicContact CG2-CG 4.41Å; T291-Y309 WeakPolarHBondContact CG2-O 3.37Å; T291-Y309 PolarHBondContact OG1-N 3.05Å; T291-Y309 PolarHBondContact OG1-O 3.35Å; Y309-F311 VanDerWaalsContact CD2-C 3.44Å; Y309-F311 WeakPolarHBondContact CD2-O 3.42Å; Y309-P312 HydrophobicContact CE2-CB 3.79Å | ||
| 310 | L | 74.7 | Confident | 62.2 | Low | 44 Ų | 44 | 78.4 Ų | 78.4 | 23% | 0.23 | 41% | 0.408 | C | S | . | . | S | Bend | trans | -76.4 | -50.8 | 179.8 | -170.5 | 58.3 | 0 | 0 | 0 | 111.1 | V4 L284 R287 | V4-L310 PolarHBondContact O-N 3.09Å; L284-L310 HydrophobicContact CD1-CD1 3.33Å; L284-L310 HydrophobicContact CD1-CD2 4.31Å; L284-L310 HydrophobicContact CD1-CG 4.41Å; R287-L310 HydrophobicContact CG-CD1 4.06Å; R287-L310 PolarHBondContact NE-O 3.15Å; R287-L310 PolarHBondContact NH2-O 3.24Å |
| 311 | F | 69.5 | Low | 62.3 | Low | 66 Ų | 66 | 81.3 Ų | 81.3 | 29% | 0.289 | 43% | 0.427 | S | S | . | . | B | Isolated β-bridge | trans | -127 | 139.8 | 179.2 | -59.1 | -75.4 | 0 | 0 | 0 | 111.5 | V4 Y309 G313 L315 M318 | V4-F311 HydrophobicContact CB-CB 4.31Å; V4-F311 HydrophobicContact CG2-CB 4.44Å; V4-F311 PolarHBondContact N-O 3.37Å; V4-F311 VanDerWaalsContact N-O 3.11Å; Y309-F311 VanDerWaalsContact CD2-C 3.44Å; Y309-F311 WeakPolarHBondContact CD2-O 3.42Å; F311-G313 WeakPolarHBondContact CB-O 3.48Å; F311-G313 PolarHBondContact O-N 3.02Å; F311-L315 HydrophobicContact CE2-CD1 4.49Å; F311-L315 HydrophobicContact CZ-CD1 4.4Å; F311-M318 HydrophobicContact CD1-SD 3.99Å |
| 312 | P | 58.5 | Low | 62.4 | Low | 63 Ų | 63 | 77.9 Ų | 77.9 | 41% | 0.409 | 42% | 0.417 | S | S | . | . | S | Bend | trans | -69 | -11.3 | 177.9 | 27.7 | -33.4 | 0 | 0 | 0 | 113.6 | Y309 | Y309-P312 HydrophobicContact CE2-CB 3.79Š|
| 313 | G | 60 | Low | 62.6 | Low | 12 Ų | 12 | 86.8 Ų | 86.8 | 12% | 0.124 | 44% | 0.444 | C | S | . | . | S | Bend | trans | -161.6 | 175.4 | 176.2 | 0 | 0 | 0 | 0 | 0 | 111.8 | V4 F311 | V4-G313 WeakPolarHBondContact CG2-O 3.36Å; F311-G313 WeakPolarHBondContact CB-O 3.48Å; F311-G313 PolarHBondContact O-N 3.02Å |
| 314 | G | 53 | Low | 62.9 | Low | 25 Ų | 25 | 83 Ų | 83 | 26% | 0.258 | 43% | 0.429 | S | S | . | . | trans | -63.3 | 141.8 | -177.3 | 0 | 0 | 0 | 0 | 0 | 113.8 | K316 D317 M318 | G314-K316 PolarHBondContact O-N 3.28Å; G314-K316 VanDerWaalsContact O-N 3.09Å; G314-D317 PolarHBondContact O-N 2.81Å; G314-M318 PolarHBondContact O-N 3.4Å; G314-M318 VanDerWaalsContact O-N 3.08Å | ||
| 315 | L | 51.2 | Low | 62.6 | Low | 113 Ų | 113 | 88.8 Ų | 88.8 | 59% | 0.592 | 45% | 0.445 | S | S | * | . | H | α-helix | trans | -50.9 | -37.6 | -178.3 | -164 | 82.8 | 0 | 0 | 0 | 112.9 | F311 M318 L319 | F311-L315 HydrophobicContact CE2-CD1 4.49Å; F311-L315 HydrophobicContact CZ-CD1 4.4Å; L315-M318 PolarHBondContact O-N 3.23Å; L315-L319 PolarHBondContact O-N 3.23Å |
| 316 | K | 56.1 | Low | 61.7 | Low | 157 Ų | 157 | 83.6 Ų | 83.6 | 68% | 0.683 | 44% | 0.437 | S | S | * | . | H | α-helix | trans | -66.6 | -36.4 | 178.6 | -174.2 | 175.5 | 179.9 | 178.8 | 0 | 113.2 | G314 K320 | G314-K316 PolarHBondContact O-N 3.28Å; G314-K316 VanDerWaalsContact O-N 3.09Å; K316-K320 WeakPolarHBondContact O-CG 3.43Å; K316-K320 PolarHBondContact O-N 3.32Å; K316-K320 VanDerWaalsContact O-N 3.15Å |
| 317 | D | 59.7 | Low | 60.3 | Low | 92 Ų | 92 | 86 Ų | 86 | 49% | 0.492 | 46% | 0.463 | S | S | . | . | H | α-helix | trans | -80.9 | -29 | 179.7 | -61.5 | -36.6 | 0 | 0 | 0 | 111.2 | G314 T321 | G314-D317 PolarHBondContact O-N 2.81Å; D317-T321 WeakPolarHBondContact O-CG2 3.28Å; D317-T321 PolarHBondContact O-N 2.84Å; D317-T321 PolarHBondContact O-OG1 3.22Å |
| 318 | M | 56.5 | Low | 58.6 | Low | 92 Ų | 92 | 87 Ų | 87 | 45% | 0.453 | 48% | 0.476 | S | S | . | . | H | α-helix | trans | -69.3 | -41.3 | 172.2 | -142.8 | 177.3 | 171.9 | 0 | 0 | 112 | F311 G314 L315 T321 A322 | F311-M318 HydrophobicContact CD1-SD 3.99Å; G314-M318 PolarHBondContact O-N 3.4Å; G314-M318 VanDerWaalsContact O-N 3.08Å; L315-M318 PolarHBondContact O-N 3.23Å; M318-T321 VanDerWaalsContact CA-OG1 3.31Å; M318-T321 WeakPolarHBondContact CA-OG1 3.29Å; M318-T321 PolarHBondContact O-N 3.39Å; M318-T321 PolarHBondContact O-OG1 2.88Å; M318-A322 WeakPolarHBondContact O-CB 3.47Å; M318-A322 PolarHBondContact O-N 3.49Å |
| 319 | L | 58.7 | Low | 56.6 | Low | 123 Ų | 123 | 91.3 Ų | 91.3 | 64% | 0.644 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -65.9 | -38.9 | 173 | -114.9 | 124.9 | 0 | 0 | 0 | 112 | L315 W323 | L315-L319 PolarHBondContact O-N 3.23Å; L319-W323 VanDerWaalsContact O-CB 3.24Å; L319-W323 WeakPolarHBondContact O-CB 3.23Å; L319-W323 PolarHBondContact O-N 3.41Å |
| 320 | K | 66.6 | Low | 54.5 | Low | 119 Ų | 119 | 94.2 Ų | 94.2 | 52% | 0.517 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -63.1 | -44.3 | 173.9 | -85.4 | 180 | 173.8 | -177.2 | 0 | 112.5 | K316 W323 L324 | K316-K320 WeakPolarHBondContact O-CG 3.43Å; K316-K320 PolarHBondContact O-N 3.32Å; K316-K320 VanDerWaalsContact O-N 3.15Å; K320-W323 PolarHBondContact O-N 2.83Å; K320-L324 VanDerWaalsContact O-CB 3.32Å; K320-L324 WeakPolarHBondContact O-CB 3.39Å; K320-L324 WeakPolarHBondContact O-CD1 3.34Å; K320-L324 WeakPolarHBondContact O-CG 3.39Å; K320-L324 PolarHBondContact O-N 3.3Å |
| 321 | T | 61.9 | Low | 52.3 | Low | 73 Ų | 73 | 103.3 Ų | 103.3 | 45% | 0.448 | 57% | 0.571 | S | S | . | * | H | α-helix | trans | -68.5 | -39.7 | 179.1 | 41.1 | 0 | 0 | 0 | 0 | 112 | D317 M318 L324 Q325 | D317-T321 WeakPolarHBondContact O-CG2 3.28Å; D317-T321 PolarHBondContact O-N 2.84Å; D317-T321 PolarHBondContact O-OG1 3.22Å; M318-T321 VanDerWaalsContact CA-OG1 3.31Å; M318-T321 WeakPolarHBondContact CA-OG1 3.29Å; M318-T321 PolarHBondContact O-N 3.39Å; M318-T321 PolarHBondContact O-OG1 2.88Å; T321-L324 PolarHBondContact O-N 3.45Å; T321-Q325 WeakPolarHBondContact O-CB 3.42Å; T321-Q325 PolarHBondContact O-N 2.93Å |
| 322 | A | 57.4 | Low | 50.4 | Low | 63 Ų | 63 | 106.2 Ų | 106.2 | 52% | 0.521 | 60% | 0.596 | S | S | . | * | H | α-helix | trans | -63.2 | -40 | 172.1 | 0 | 0 | 0 | 0 | 0 | 112.5 | M318 G326 | M318-A322 WeakPolarHBondContact O-CB 3.47Å; M318-A322 PolarHBondContact O-N 3.49Å; A322-G326 PolarHBondContact O-N 3.49Å |
| 323 | W | 61 | Low | 49 | Very low | 210 Ų | 210 | 107.7 Ų | 107.7 | 80% | 0.795 | 61% | 0.614 | S | S | * | * | H | α-helix | trans | -69.2 | -37.7 | 176.5 | -159.2 | 75.6 | 0 | 0 | 0 | 112.2 | L319 K320 G326 G327 | L319-W323 VanDerWaalsContact O-CB 3.24Å; L319-W323 WeakPolarHBondContact O-CB 3.23Å; L319-W323 PolarHBondContact O-N 3.41Å; K320-W323 PolarHBondContact O-N 2.83Å; W323-G326 PolarHBondContact O-N 3.48Å; W323-G327 PolarHBondContact O-N 3.14Å |
| 324 | L | 61.1 | Low | 47.8 | Very low | 112 Ų | 112 | 113.1 Ų | 113.1 | 59% | 0.586 | 65% | 0.646 | S | S | * | * | H | α-helix | trans | -69.2 | -38.2 | 174.8 | -74.3 | 163.8 | 0 | 0 | 0 | 112.4 | K320 T321 V328 | K320-L324 VanDerWaalsContact O-CB 3.32Å; K320-L324 WeakPolarHBondContact O-CB 3.39Å; K320-L324 WeakPolarHBondContact O-CD1 3.34Å; K320-L324 WeakPolarHBondContact O-CG 3.39Å; K320-L324 PolarHBondContact O-N 3.3Å; T321-L324 PolarHBondContact O-N 3.45Å; L324-V328 WeakPolarHBondContact O-CG2 3.2Å |
| 325 | Q | 53 | Low | 46.7 | Very low | 161 Ų | 161 | 121.4 Ų | 121.4 | 75% | 0.752 | 68% | 0.678 | S | S | * | * | H | α-helix | trans | -73.2 | -32.2 | 174.3 | -87.4 | 170.5 | -37.8 | 0 | 0 | 112.7 | T321 | T321-Q325 WeakPolarHBondContact O-CB 3.42Å; T321-Q325 PolarHBondContact O-N 2.93Å |
| 326 | G | 41.7 | Very low | 45.8 | Very low | 59 Ų | 59 | 125.3 Ų | 125.3 | 61% | 0.608 | 69% | 0.694 | S | S | * | * | H | α-helix | trans | -72.6 | -23.6 | 173 | 0 | 0 | 0 | 0 | 0 | 114.3 | A322 W323 | A322-G326 PolarHBondContact O-N 3.49Å; W323-G326 PolarHBondContact O-N 3.48Å |
| 327 | G | 39.8 | Very low | 44.7 | Very low | 59 Ų | 59 | 122.1 Ų | 122.1 | 61% | 0.608 | 70% | 0.697 | S | S | * | * | G | 310 helix | trans | -84 | -8.8 | -179.3 | 0 | 0 | 0 | 0 | 0 | 116 | W323 | W323-G327 PolarHBondContact O-N 3.14Š|
| 328 | V | 38.8 | Very low | 43.5 | Very low | 124 Ų | 124 | 123.6 Ų | 123.6 | 75% | 0.752 | 71% | 0.711 | S | S | * | * | G | 310 helix | trans | -90.8 | -5 | -175.7 | 174.8 | 0 | 0 | 0 | 0 | 113 | L324 C330 | L324-V328 WeakPolarHBondContact O-CG2 3.2Å; V328-C330 PolarHBondContact O-N 2.97Å |
| 329 | A | 32.4 | Very low | 42.6 | Very low | 90 Ų | 90 | 125.5 Ų | 125.5 | 74% | 0.744 | 73% | 0.73 | S | S | * | * | G | 310 helix | trans | -82.2 | 1.6 | -177.8 | 0 | 0 | 0 | 0 | 0 | 115.9 | ||
| 330 | C | 32.8 | Very low | 41.3 | Very low | 121 Ų | 121 | 123.3 Ų | 123.3 | 82% | 0.818 | 74% | 0.738 | S | S | * | * | trans | -131.5 | 85.3 | 176.2 | -78.5 | 0 | 0 | 0 | 0 | 112.5 | V328 | V328-C330 PolarHBondContact O-N 2.97Š| ||
| 331 | R | 27.5 | Very low | 39.6 | Very low | 236 Ų | 236 | 127.2 Ų | 127.2 | 89% | 0.891 | 76% | 0.758 | S | S | * | * | trans | -131.5 | 121.4 | 148.3 | -107.3 | -175 | 176.7 | 170.8 | -0.7 | 108.4 | ||||
| 332 | P | 30.5 | Very low | 38.3 | Very low | 127 Ų | 127 | 128.2 Ų | 128.2 | 83% | 0.825 | 77% | 0.773 | S | S | * | * | P | Polyproline II helix | trans | -70.7 | 141.5 | 171.3 | 26.1 | -24.5 | 0 | 0 | 0 | 109.6 | ||
| 333 | A | 28.7 | Very low | 37.3 | Very low | 94 Ų | 94 | 130.9 Ų | 130.9 | 78% | 0.777 | 79% | 0.786 | S | S | * | * | P | Polyproline II helix | trans | -67.1 | 148 | 179.2 | 0 | 0 | 0 | 0 | 0 | 111.6 | ||
| 334 | P | 34.6 | Very low | 36.3 | Very low | 125 Ų | 125 | 127 Ų | 127 | 81% | 0.812 | 79% | 0.787 | S | S | * | * | P | Polyproline II helix | trans | -75.8 | 143.1 | 170.8 | -5.4 | 23 | 0 | 0 | 0 | 111.7 | ||
| 335 | E | 30.6 | Very low | 35 | Very low | 199 Ų | 199 | 131.4 Ų | 131.4 | 93% | 0.93 | 80% | 0.802 | S | S | * | * | P | Polyproline II helix | trans | -52.3 | 129.8 | 179.6 | -149.2 | 157.5 | 137.2 | 0 | 0 | 113.6 | ||
| 336 | E | 32.3 | Very low | 34.2 | Very low | 195 Ų | 195 | 132.7 Ų | 132.7 | 91% | 0.911 | 81% | 0.808 | S | S | * | * | P | Polyproline II helix | trans | -74 | 130.6 | 174.1 | -78.3 | -178.8 | 152 | 0 | 0 | 111.3 | ||
| 337 | A | 32 | Very low | 33.8 | Very low | 91 Ų | 91 | 137.7 Ų | 137.7 | 75% | 0.752 | 82% | 0.821 | S | S | * | * | P | Polyproline II helix | trans | -82.9 | 150.6 | 167.5 | 0 | 0 | 0 | 0 | 0 | 110.9 | ||
| 338 | P | 34.8 | Very low | 33.5 | Very low | 122 Ų | 122 | 143.1 Ų | 143.1 | 79% | 0.792 | 84% | 0.835 | S | S | * | * | P | Polyproline II helix | trans | -80.6 | 151.6 | -170.1 | 32 | -33.4 | 0 | 0 | 0 | 113 | ||
| 339 | P | 37.8 | Very low | 33.2 | Very low | 132 Ų | 132 | 142 Ų | 142 | 86% | 0.857 | 83% | 0.832 | S | S | * | * | P | Polyproline II helix | trans | -85.7 | 137.2 | -178 | 26.4 | -19.4 | 0 | 0 | 0 | 113 | ||
| 340 | G | 31.8 | Very low | 33.4 | Very low | 77 Ų | 77 | 146.8 Ų | 146.8 | 79% | 0.794 | 84% | 0.839 | S | S | * | * | P | Polyproline II helix | trans | -79 | 154.8 | 173.8 | 0 | 0 | 0 | 0 | 0 | 114.1 | ||
| 341 | E | 31.3 | Very low | 33.4 | Very low | 201 Ų | 201 | 149.6 Ų | 149.6 | 94% | 0.939 | 87% | 0.871 | S | S | * | * | P | Polyproline II helix | trans | -59.7 | 149.1 | -174.8 | -72.7 | 163.1 | 132.2 | 0 | 0 | 115.7 | ||
| 342 | A | 33.9 | Very low | 33.7 | Very low | 94 Ų | 94 | 145.3 Ų | 145.3 | 78% | 0.777 | 87% | 0.87 | S | S | * | * | trans | -110.2 | 143.3 | 161.7 | 0 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 343 | P | 37.7 | Very low | 33.9 | Very low | 120 Ų | 120 | 146.3 Ų | 146.3 | 78% | 0.779 | 87% | 0.873 | S | S | * | * | P | Polyproline II helix | trans | -83.8 | 164.6 | -173.1 | 34.9 | -34.7 | 0 | 0 | 0 | 113.1 | ||
| 344 | P | 38.2 | Very low | 34.1 | Very low | 128 Ų | 128 | 149.2 Ų | 149.2 | 83% | 0.831 | 88% | 0.878 | S | S | * | * | P | Polyproline II helix | trans | -84.7 | 154.6 | -161.9 | 33.9 | -34.1 | 0 | 0 | 0 | 113.9 | ||
| 345 | K | 34 | Very low | 34.1 | Very low | 205 Ų | 205 | 150.6 Ų | 150.6 | 89% | 0.891 | 88% | 0.882 | S | S | * | * | P | Polyproline II helix | trans | -92.5 | 125.8 | 166.7 | -75.3 | 179.1 | 174.8 | 180 | 0 | 109.3 | ||
| 346 | E | 36.4 | Very low | 34.3 | Very low | 188 Ų | 188 | 147.6 Ų | 147.6 | 88% | 0.879 | 88% | 0.879 | S | S | * | * | P | Polyproline II helix | trans | -90.1 | 127.4 | 161.4 | -85.7 | 179.1 | 148.8 | 0 | 0 | 109.5 | ||
| 347 | D | 33 | Very low | 34.5 | Very low | 164 Ų | 164 | 144.4 Ų | 144.4 | 88% | 0.877 | 88% | 0.877 | S | S | * | * | P | Polyproline II helix | trans | -75.8 | 140.1 | 164.3 | -82 | -41.2 | 0 | 0 | 0 | 109.8 | ||
| 348 | L | 35 | Very low | 34.6 | Very low | 173 Ų | 173 | 148.2 Ų | 148.2 | 91% | 0.906 | 89% | 0.886 | S | S | * | * | trans | -116.2 | 121.5 | 163.6 | -122 | 107.9 | 0 | 0 | 0 | 109.7 | ||||
| 349 | S | 32.5 | Very low | 34.6 | Very low | 99 Ų | 99 | 150.2 Ų | 150.2 | 69% | 0.692 | 89% | 0.893 | S | S | * | * | trans | -79.2 | 147.8 | 173.7 | 50.2 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 350 | E | 35 | Very low | 34.4 | Very low | 192 Ų | 192 | 151.8 Ų | 151.8 | 90% | 0.897 | 90% | 0.896 | S | S | * | * | trans | 42 | 117.3 | 148 | -70.5 | -179.2 | 126.2 | 0 | 0 | 121 | ||||
| 351 | A | 33.6 | Very low | 34.6 | Very low | 180 Ų | 180 | 158.5 Ų | 158.5 | 100% | 1.488 | 91% | 0.905 | S | S | * | * | -170.8 | 0 | 110.8 | 0 | 0 | 0 | 0 | 0 | 111.1 |
Retrieved 351 of 351 residues in 658.4 ms
(Link to these results)