| 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 | 84.8 | Confident | 89.3 | Confident | 40 Ų | 40 | 69.9 Ų | 69.9 | 20% | 0.197 | 40% | 0.403 | C | S | . | . | 0 | -43.4 | 0 | -60.3 | -47.9 | -84.5 | 0 | 0 | 114.2 | L13 G14 F17 F214 R229 A232 | M1-L13 HydrophobicContact CB-CB 3.78Å; M1-L13 HydrophobicContact CB-CD1 4.46Å; M1-L13 HydrophobicContact CG-CB 3.87Å; M1-G14 VanDerWaalsContact CG-N 3.29Å; M1-F17 HydrophobicContact CE-CB 4.08Å; M1-F17 HydrophobicContact CE-CD1 3.96Å; M1-F17 HydrophobicContact CE-CD2 4.29Å; M1-F17 HydrophobicContact CE-CG 3.83Å; M1-F214 HydrophobicContact CG-CE2 4.45Å; M1-F214 HydrophobicContact CG-CZ 4.22Å; M1-F214 VanDerWaalsContact N-CE1 3.34Å; M1-F214 VanDerWaalsContact N-CZ 3.26Å; M1-F214 HydrophobicContact SD-CE2 4.26Å; M1-F214 HydrophobicContact SD-CZ 3.87Å; M1-R229 HydrophobicContact SD-CG 4.06Å; M1-A232 HydrophobicContact SD-CB 4.07Å | |||
| 2 | L | 88.1 | Confident | 89.9 | Confident | 98 Ų | 98 | 69.3 Ų | 69.3 | 51% | 0.513 | 40% | 0.397 | S | S | . | . | trans | -125.5 | 128.9 | 177.1 | -66.9 | 174.5 | 0 | 0 | 0 | 109.6 | Y5 Q10 L13 | L2-Y5 HydrophobicContact CB-CD2 3.85Å; L2-Y5 HydrophobicContact CB-CE2 3.95Å; L2-Y5 HydrophobicContact CD1-CE2 4.22Å; L2-Y5 WeakPolarHBondContact O-CD2 3.5Å; L2-Q10 VanDerWaalsContact N-OE1 3.11Å; L2-Q10 VanDerWaalsContact O-CD 3.28Å; L2-Q10 PolarHBondContact O-NE2 3.33Å; L2-Q10 PolarHBondContact O-OE1 3.34Å; L2-L13 HydrophobicContact CD1-CD1 4.33Å; L2-L13 HydrophobicContact CG-CD1 4.48Å | ||
| 3 | E | 82.8 | Confident | 90.4 | Very high | 150 Ų | 150 | 68.5 Ų | 68.5 | 70% | 0.701 | 39% | 0.39 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -58.3 | 151.4 | -177.9 | -68.9 | -177.3 | -169.3 | 0 | 0 | 113.3 | Y5 F225 | E3-Y5 PolarHBondContact O-N 2.88Å; E3-F225 HydrophobicContact CG-CD1 4.16Å; E3-F225 HydrophobicContact CG-CE1 3.67Å; E3-F225 HydrophobicContact CG-CZ 3.94Å |
| 4 | G | 82.2 | Confident | 90.7 | Very high | 88 Ų | 88 | 63.6 Ų | 63.6 | 91% | 0.907 | 36% | 0.362 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 86.6 | -6.1 | 174.7 | 0 | 0 | 0 | 0 | 0 | 116.5 | ||
| 5 | Y | 90.2 | Very high | 91.1 | Very high | 129 Ų | 129 | 59.4 Ų | 59.4 | 51% | 0.506 | 34% | 0.338 | S | S | . | . | S | Bend | trans | -90.8 | 156.3 | 174.7 | -70.2 | -87 | 0 | 0 | 0 | 113.3 | L2 E3 I9 Q10 | L2-Y5 HydrophobicContact CB-CD2 3.85Å; L2-Y5 HydrophobicContact CB-CE2 3.95Å; L2-Y5 HydrophobicContact CD1-CE2 4.22Å; L2-Y5 WeakPolarHBondContact O-CD2 3.5Å; E3-Y5 PolarHBondContact O-N 2.88Å; Y5-I9 HydrophobicContact CD1-CD1 4.17Å; Y5-I9 HydrophobicContact CD1-CG2 3.85Å; Y5-I9 HydrophobicContact CG-CG2 4.07Å; Y5-Q10 PolarHBondContact O-NE2 3.24Å; Y5-Q10 VanDerWaalsContact O-NE2 3.16Å |
| 6 | S | 90.8 | Very high | 91.5 | Very high | 57 Ų | 57 | 60.1 Ų | 60.1 | 40% | 0.399 | 34% | 0.34 | S | S | . | . | trans | -64.6 | 151.1 | 179.1 | 71.2 | 0 | 0 | 0 | 0 | 112.3 | V8 I9 Q10 | S6-V8 PolarHBondContact O-N 3.36Å; S6-V8 VanDerWaalsContact O-N 3.09Å; S6-I9 PolarHBondContact O-N 2.89Å; S6-I9 WeakPolarHBondContact OG-CD1 3.24Å; S6-I9 WeakPolarHBondContact OG-CG1 3.43Å; S6-Q10 WeakPolarHBondContact O-CG 3.26Å; S6-Q10 PolarHBondContact O-N 3.1Å | ||
| 7 | P | 89.2 | Confident | 91.8 | Very high | 61 Ų | 61 | 60.8 Ų | 60.8 | 40% | 0.396 | 34% | 0.339 | S | S | . | . | H | α-helix | trans | -51.1 | -37.7 | -178.3 | -31.1 | 36.7 | 0 | 0 | 0 | 114.8 | Q10 A11 F214 | P7-Q10 WeakPolarHBondContact O-CB 3.35Å; P7-Q10 PolarHBondContact O-N 2.89Å; P7-A11 WeakPolarHBondContact O-CB 3.27Å; P7-A11 PolarHBondContact O-N 3.31Å; P7-F214 WeakPolarHBondContact CB-O 3.12Å |
| 8 | V | 91.9 | Very high | 92 | Very high | 69 Ų | 69 | 57.4 Ų | 57.4 | 42% | 0.418 | 32% | 0.32 | S | S | . | . | H | α-helix | trans | -67.4 | -41.3 | 177.9 | -179.3 | 0 | 0 | 0 | 0 | 111.7 | S6 Q10 A11 L12 L276 | S6-V8 PolarHBondContact O-N 3.36Å; S6-V8 VanDerWaalsContact O-N 3.09Å; V8-Q10 VanDerWaalsContact C-N 3.34Å; V8-A11 PolarHBondContact O-N 2.9Å; V8-L12 WeakPolarHBondContact O-CB 3.46Å; V8-L12 PolarHBondContact O-N 2.92Å; V8-L276 HydrophobicContact CG1-CD2 3.7Å |
| 9 | I | 93.4 | Very high | 92.2 | Very high | 71 Ų | 71 | 57.8 Ų | 57.8 | 36% | 0.364 | 32% | 0.316 | S | S | . | . | H | α-helix | trans | -67.6 | -39.1 | 175.8 | -65.8 | 171.8 | 0 | 0 | 0 | 109.9 | Y5 S6 L12 L13 | Y5-I9 HydrophobicContact CD1-CD1 4.17Å; Y5-I9 HydrophobicContact CD1-CG2 3.85Å; Y5-I9 HydrophobicContact CG-CG2 4.07Å; S6-I9 PolarHBondContact O-N 2.89Å; S6-I9 WeakPolarHBondContact OG-CD1 3.24Å; S6-I9 WeakPolarHBondContact OG-CG1 3.43Å; I9-L12 PolarHBondContact O-N 2.74Å; I9-L13 HydrophobicContact CG2-CD1 4Å; I9-L13 HydrophobicContact CG2-CG 4.26Å; I9-L13 WeakPolarHBondContact O-CB 3.19Å; I9-L13 VanDerWaalsContact O-CG 3.3Å; I9-L13 WeakPolarHBondContact O-CG 3.4Å; I9-L13 PolarHBondContact O-N 3.1Å |
| 10 | Q | 94.5 | Very high | 92.5 | Very high | 6 Ų | 6 | 56.4 Ų | 56.4 | 3% | 0.028 | 32% | 0.315 | C | S | . | . | H | α-helix | trans | -62.1 | -44.8 | 176.1 | -58.8 | -72.1 | 4.9 | 0 | 0 | 112.1 | L2 Y5 S6 P7 V8 L13 G14 F214 | L2-Q10 VanDerWaalsContact N-OE1 3.11Å; L2-Q10 VanDerWaalsContact O-CD 3.28Å; L2-Q10 PolarHBondContact O-NE2 3.33Å; L2-Q10 PolarHBondContact O-OE1 3.34Å; Y5-Q10 PolarHBondContact O-NE2 3.24Å; Y5-Q10 VanDerWaalsContact O-NE2 3.16Å; S6-Q10 WeakPolarHBondContact O-CG 3.26Å; S6-Q10 PolarHBondContact O-N 3.1Å; P7-Q10 WeakPolarHBondContact O-CB 3.35Å; P7-Q10 PolarHBondContact O-N 2.89Å; V8-Q10 VanDerWaalsContact C-N 3.34Å; Q10-L13 PolarHBondContact O-N 3.27Å; Q10-G14 PolarHBondContact O-N 2.83Å; Q10-F214 HydrophobicContact CB-CB 3.83Å; Q10-F214 HydrophobicContact CB-CD1 3.39Å; Q10-F214 HydrophobicContact CB-CD2 4.22Å; Q10-F214 HydrophobicContact CB-CE1 4Å; Q10-F214 HydrophobicContact CB-CG 3.54Å; Q10-F214 HydrophobicContact CG-CD1 4.14Å |
| 11 | A | 94.5 | Very high | 92.6 | Very high | 0 Ų | 0 | 55.8 Ų | 55.8 | 0% | 0 | 31% | 0.311 | C | S | . | . | H | α-helix | trans | -60.5 | -44.1 | 175.5 | 0 | 0 | 0 | 0 | 0 | 111.6 | P7 V8 G14 T15 F214 A279 | P7-A11 WeakPolarHBondContact O-CB 3.27Å; P7-A11 PolarHBondContact O-N 3.31Å; V8-A11 PolarHBondContact O-N 2.9Å; A11-G14 PolarHBondContact O-N 3.47Å; A11-T15 WeakPolarHBondContact O-CB 3.32Å; A11-T15 WeakPolarHBondContact O-CG2 3.42Å; A11-T15 PolarHBondContact O-N 2.92Å; A11-T15 PolarHBondContact O-OG1 3.09Å; A11-F214 HydrophobicContact CB-CB 4.23Å; A11-A279 HydrophobicContact CB-CB 3.51Å |
| 12 | L | 96.1 | Very high | 93 | Very high | 63 Ų | 63 | 53.9 Ų | 53.9 | 33% | 0.33 | 30% | 0.301 | S | S | . | . | H | α-helix | trans | -62.3 | -46.7 | 175.3 | -178.8 | 61 | 0 | 0 | 0 | 111.7 | V8 I9 G14 T15 L16 L276 | V8-L12 WeakPolarHBondContact O-CB 3.46Å; V8-L12 PolarHBondContact O-N 2.92Å; I9-L12 PolarHBondContact O-N 2.74Å; L12-G14 VanDerWaalsContact C-N 3.33Å; L12-G14 PolarHBondContact O-N 3.18Å; L12-T15 PolarHBondContact O-N 3.34Å; L12-T15 PolarHBondContact O-OG1 2.86Å; L12-L16 HydrophobicContact CD1-CD1 3.96Å; L12-L16 HydrophobicContact CD1-CG 4.02Å; L12-L16 HydrophobicContact CG-CD1 3.87Å; L12-L16 HydrophobicContact CG-CG 4.34Å; L12-L16 VanDerWaalsContact O-CB 3.27Å; L12-L16 WeakPolarHBondContact O-CB 3.36Å; L12-L16 WeakPolarHBondContact O-CG 3.46Å; L12-L16 PolarHBondContact O-N 2.92Å; L12-L276 HydrophobicContact CB-CD2 4.01Å; L12-L276 HydrophobicContact CD1-CD1 4.21Å; L12-L276 HydrophobicContact CD1-CD2 4.38Å; L12-L276 HydrophobicContact CD1-CG 4.32Å |
| 13 | L | 96.5 | Very high | 93.4 | Very high | 59 Ų | 59 | 50 Ų | 50 | 31% | 0.309 | 28% | 0.284 | S | S | . | . | H | α-helix | trans | -64.5 | -39.2 | 178.2 | -70.9 | 174.4 | 0 | 0 | 0 | 111.9 | M1 L2 I9 Q10 F17 | M1-L13 HydrophobicContact CB-CB 3.78Å; M1-L13 HydrophobicContact CB-CD1 4.46Å; M1-L13 HydrophobicContact CG-CB 3.87Å; L2-L13 HydrophobicContact CD1-CD1 4.33Å; L2-L13 HydrophobicContact CG-CD1 4.48Å; I9-L13 HydrophobicContact CG2-CD1 4Å; I9-L13 HydrophobicContact CG2-CG 4.26Å; I9-L13 WeakPolarHBondContact O-CB 3.19Å; I9-L13 VanDerWaalsContact O-CG 3.3Å; I9-L13 WeakPolarHBondContact O-CG 3.4Å; I9-L13 PolarHBondContact O-N 3.1Å; Q10-L13 PolarHBondContact O-N 3.27Å; L13-F17 WeakPolarHBondContact O-CB 3.46Å; L13-F17 PolarHBondContact O-N 3.09Å |
| 14 | G | 95.6 | Very high | 94 | Very high | 0 Ų | 0 | 44.7 Ų | 44.7 | 0% | 0 | 27% | 0.266 | C | S | . | . | H | α-helix | trans | -63.6 | -48.2 | 176.7 | 0 | 0 | 0 | 0 | 0 | 111.3 | M1 Q10 A11 L12 F17 T18 | M1-G14 VanDerWaalsContact CG-N 3.29Å; Q10-G14 PolarHBondContact O-N 2.83Å; A11-G14 PolarHBondContact O-N 3.47Å; L12-G14 VanDerWaalsContact C-N 3.33Å; L12-G14 PolarHBondContact O-N 3.18Å; G14-F17 WeakPolarHBondContact O-CB 3.33Å; G14-F17 PolarHBondContact O-N 2.93Å; G14-F17 VanDerWaalsContact O-N 3.17Å; G14-T18 WeakPolarHBondContact O-CG2 3.48Å; G14-T18 PolarHBondContact O-N 3.28Å; G14-T18 PolarHBondContact O-OG1 2.84Å |
| 15 | T | 96.3 | Very high | 94.4 | Very high | 0 Ų | 0 | 40.5 Ų | 40.5 | 0% | 0 | 22% | 0.222 | C | C | . | . | H | α-helix | trans | -76.4 | -26.9 | -178.4 | 50.2 | 0 | 0 | 0 | 0 | 114.2 | A11 L12 F17 T18 W19 V210 E271 P272 | A11-T15 WeakPolarHBondContact O-CB 3.32Å; A11-T15 WeakPolarHBondContact O-CG2 3.42Å; A11-T15 PolarHBondContact O-N 2.92Å; A11-T15 PolarHBondContact O-OG1 3.09Å; L12-T15 PolarHBondContact O-N 3.34Å; L12-T15 PolarHBondContact O-OG1 2.86Å; T15-F17 VanDerWaalsContact C-N 3.3Å; T15-T18 VanDerWaalsContact CA-OG1 3.3Å; T15-T18 WeakPolarHBondContact CA-OG1 3.16Å; T15-T18 PolarHBondContact O-OG1 3.43Å; T15-W19 VanDerWaalsContact O-CB 3.29Å; T15-W19 WeakPolarHBondContact O-CB 3.42Å; T15-W19 PolarHBondContact O-N 3.26Å; T15-V210 HydrophobicContact CG2-CB 3.81Å; T15-V210 HydrophobicContact CG2-CG1 3.71Å; T15-E271 WeakPolarHBondContact CG2-O 3.23Å; T15-P272 WeakPolarHBondContact OG1-CA 3.47Å |
| 16 | L | 97.4 | Very high | 94.5 | Very high | 70 Ų | 70 | 34.4 Ų | 34.4 | 37% | 0.366 | 20% | 0.198 | S | C | . | . | H | α-helix | trans | -68.4 | -32.9 | 166.7 | -74.8 | 173.9 | 0 | 0 | 0 | 111.7 | L12 W19 G20 P272 | L12-L16 HydrophobicContact CD1-CD1 3.96Å; L12-L16 HydrophobicContact CD1-CG 4.02Å; L12-L16 HydrophobicContact CG-CD1 3.87Å; L12-L16 HydrophobicContact CG-CG 4.34Å; L12-L16 VanDerWaalsContact O-CB 3.27Å; L12-L16 WeakPolarHBondContact O-CB 3.36Å; L12-L16 WeakPolarHBondContact O-CG 3.46Å; L12-L16 PolarHBondContact O-N 2.92Å; L16-W19 HydrophobicContact CD2-CE3 3.84Å; L16-W19 HydrophobicContact CD2-CZ3 4.01Å; L16-G20 WeakPolarHBondContact O-CA 3.25Å; L16-G20 PolarHBondContact O-N 3.46Å; L16-P272 HydrophobicContact CD2-CB 4.48Å; L16-P272 HydrophobicContact CD2-CG 4.23Å |
| 17 | F | 96.4 | Very high | 94.7 | Very high | 73 Ų | 73 | 33.3 Ų | 33.3 | 32% | 0.32 | 19% | 0.193 | S | C | . | . | H | α-helix | trans | -67.3 | -47.8 | 174 | 168.2 | -92.1 | 0 | 0 | 0 | 111.2 | M1 L13 G14 T15 G20 L21 I233 | M1-F17 HydrophobicContact CE-CB 4.08Å; M1-F17 HydrophobicContact CE-CD1 3.96Å; M1-F17 HydrophobicContact CE-CD2 4.29Å; M1-F17 HydrophobicContact CE-CG 3.83Å; L13-F17 WeakPolarHBondContact O-CB 3.46Å; L13-F17 PolarHBondContact O-N 3.09Å; G14-F17 WeakPolarHBondContact O-CB 3.33Å; G14-F17 PolarHBondContact O-N 2.93Å; G14-F17 VanDerWaalsContact O-N 3.17Å; T15-F17 VanDerWaalsContact C-N 3.3Å; F17-G20 PolarHBondContact O-N 3.25Å; F17-L21 HydrophobicContact CE1-CD1 4.03Å; F17-L21 HydrophobicContact CE1-CG 4.45Å; F17-L21 HydrophobicContact CE2-CD1 4.3Å; F17-L21 HydrophobicContact CE2-CG 4.39Å; F17-L21 HydrophobicContact CZ-CD1 3.67Å; F17-L21 HydrophobicContact CZ-CG 4.17Å; F17-L21 PolarHBondContact O-N 3.01Å; F17-I233 HydrophobicContact CE1-CG1 4.44Å |
| 18 | T | 95.1 | Very high | 94.6 | Very high | 0 Ų | 0 | 32 Ų | 32 | 0% | 0 | 18% | 0.182 | C | C | . | . | H | α-helix | trans | -62.7 | -49.9 | 179.2 | 55.9 | 0 | 0 | 0 | 0 | 111.5 | G14 T15 G20 L21 T22 V210 A232 I235 E271 | G14-T18 WeakPolarHBondContact O-CG2 3.48Å; G14-T18 PolarHBondContact O-N 3.28Å; G14-T18 PolarHBondContact O-OG1 2.84Å; T15-T18 VanDerWaalsContact CA-OG1 3.3Å; T15-T18 WeakPolarHBondContact CA-OG1 3.16Å; T15-T18 PolarHBondContact O-OG1 3.43Å; T18-G20 VanDerWaalsContact C-N 3.26Å; T18-G20 PolarHBondContact O-N 3.07Å; T18-L21 PolarHBondContact O-N 3.49Å; T18-T22 PolarHBondContact O-N 3.44Å; T18-T22 VanDerWaalsContact O-N 3.11Å; T18-T22 PolarHBondContact O-OG1 3.49Å; T18-V210 HydrophobicContact CG2-CG2 4.27Å; T18-A232 VanDerWaalsContact CG2-O 3.23Å; T18-A232 WeakPolarHBondContact CG2-O 3.28Å; T18-I235 HydrophobicContact CG2-CB 4.11Å; T18-I235 HydrophobicContact CG2-CG2 3.79Å; T18-E271 WeakPolarHBondContact CB-OE2 3.36Å; T18-E271 PolarHBondContact OG1-OE2 2.89Å |
| 19 | W | 96.7 | Very high | 94.4 | Very high | 65 Ų | 65 | 28.7 Ų | 28.7 | 25% | 0.246 | 16% | 0.162 | C | C | . | . | H | α-helix | trans | -58.1 | -38.8 | 172.7 | 167 | 63.2 | 0 | 0 | 0 | 112.6 | T15 L16 L21 T22 A23 Q265 E271 P272 | T15-W19 VanDerWaalsContact O-CB 3.29Å; T15-W19 WeakPolarHBondContact O-CB 3.42Å; T15-W19 PolarHBondContact O-N 3.26Å; L16-W19 HydrophobicContact CD2-CE3 3.84Å; L16-W19 HydrophobicContact CD2-CZ3 4.01Å; W19-L21 PolarHBondContact O-N 3.17Å; W19-T22 WeakPolarHBondContact O-CB 3.27Å; W19-T22 PolarHBondContact O-N 3.34Å; W19-T22 VanDerWaalsContact O-N 3.16Å; W19-A23 PolarHBondContact O-N 3.48Å; W19-Q265 VanDerWaalsContact CZ2-OE1 3.31Å; W19-Q265 PolarHBondContact NE1-O 2.83Å; W19-Q265 VanDerWaalsContact NE1-O 3.09Å; W19-E271 PolarHBondContact N-OE2 2.91Å; W19-E271 VanDerWaalsContact N-OE2 3.16Å; W19-P272 HydrophobicContact CB-CG 4.04Å; W19-P272 HydrophobicContact CG-CG 4.4Å |
| 20 | G | 97 | Very high | 94.2 | Very high | 29 Ų | 29 | 29.7 Ų | 29.7 | 30% | 0.299 | 16% | 0.164 | S | C | . | . | H | α-helix | trans | -60 | -35.2 | 176.5 | 0 | 0 | 0 | 0 | 0 | 112.5 | L16 F17 T18 A23 A24 | L16-G20 WeakPolarHBondContact O-CA 3.25Å; L16-G20 PolarHBondContact O-N 3.46Å; F17-G20 PolarHBondContact O-N 3.25Å; T18-G20 VanDerWaalsContact C-N 3.26Å; T18-G20 PolarHBondContact O-N 3.07Å; G20-A23 PolarHBondContact O-N 3.2Å; G20-A24 WeakPolarHBondContact O-CB 3.29Å; G20-A24 PolarHBondContact O-N 2.71Å |
| 21 | L | 95 | Very high | 93.8 | Very high | 43 Ų | 43 | 35.4 Ų | 35.4 | 23% | 0.225 | 19% | 0.193 | C | C | . | . | H | α-helix | trans | -74.3 | -36.2 | 173.7 | -68 | -159.1 | 0 | 0 | 0 | 112.5 | F17 T18 W19 A23 A24 G25 G236 F240 | F17-L21 HydrophobicContact CE1-CD1 4.03Å; F17-L21 HydrophobicContact CE1-CG 4.45Å; F17-L21 HydrophobicContact CE2-CD1 4.3Å; F17-L21 HydrophobicContact CE2-CG 4.39Å; F17-L21 HydrophobicContact CZ-CD1 3.67Å; F17-L21 HydrophobicContact CZ-CG 4.17Å; F17-L21 PolarHBondContact O-N 3.01Å; T18-L21 PolarHBondContact O-N 3.49Å; W19-L21 PolarHBondContact O-N 3.17Å; L21-A23 VanDerWaalsContact C-N 3.32Å; L21-A23 PolarHBondContact O-N 2.9Å; L21-A24 PolarHBondContact O-N 2.81Å; L21-G25 PolarHBondContact O-N 3.4Å; L21-G236 WeakPolarHBondContact CB-O 2.98Å; L21-G236 WeakPolarHBondContact CD1-O 3.3Å; L21-F240 HydrophobicContact CB-CB 4.36Å; L21-F240 WeakPolarHBondContact O-CA 3.44Å |
| 22 | T | 93.9 | Very high | 92.8 | Very high | 0 Ų | 0 | 38.9 Ų | 38.9 | 0% | 0 | 21% | 0.209 | C | C | . | . | H | α-helix | trans | -55.9 | -48.1 | 167.4 | -35.8 | 0 | 0 | 0 | 0 | 111.1 | T18 W19 A24 G25 A26 N239 G243 E271 | T18-T22 PolarHBondContact O-N 3.44Å; T18-T22 VanDerWaalsContact O-N 3.11Å; T18-T22 PolarHBondContact O-OG1 3.49Å; W19-T22 WeakPolarHBondContact O-CB 3.27Å; W19-T22 PolarHBondContact O-N 3.34Å; W19-T22 VanDerWaalsContact O-N 3.16Å; T22-A24 PolarHBondContact O-N 2.85Å; T22-G25 PolarHBondContact O-N 3.49Å; T22-A26 WeakPolarHBondContact O-CB 3.21Å; T22-A26 PolarHBondContact O-N 3.36Å; T22-N239 WeakPolarHBondContact CA-O 3.13Å; T22-N239 WeakPolarHBondContact OG1-CB 3.33Å; T22-G243 WeakPolarHBondContact O-CA 3.49Å; T22-E271 PolarHBondContact OG1-OE1 3.3Å |
| 23 | A | 96.1 | Very high | 91.3 | Very high | 17 Ų | 17 | 38.3 Ų | 38.3 | 14% | 0.14 | 21% | 0.21 | C | C | . | . | H | α-helix | trans | -64 | -40.3 | 178.3 | 0 | 0 | 0 | 0 | 0 | 112.1 | W19 G20 L21 A26 A27 Q265 | W19-A23 PolarHBondContact O-N 3.48Å; G20-A23 PolarHBondContact O-N 3.2Å; L21-A23 VanDerWaalsContact C-N 3.32Å; L21-A23 PolarHBondContact O-N 2.9Å; A23-A26 PolarHBondContact O-N 2.89Å; A23-A27 WeakPolarHBondContact O-CB 3.38Å; A23-A27 PolarHBondContact O-N 3.31Å; A23-Q265 HydrophobicContact CB-CB 3.8Å |
| 24 | A | 94.6 | Very high | 89.7 | Confident | 39 Ų | 39 | 37.4 Ų | 37.4 | 32% | 0.322 | 21% | 0.209 | S | C | . | . | H | α-helix | trans | -64.4 | -41.2 | 176.2 | 0 | 0 | 0 | 0 | 0 | 112 | G20 L21 T22 A27 L28 F240 | G20-A24 WeakPolarHBondContact O-CB 3.29Å; G20-A24 PolarHBondContact O-N 2.71Å; L21-A24 PolarHBondContact O-N 2.81Å; T22-A24 PolarHBondContact O-N 2.85Å; A24-A27 PolarHBondContact O-N 3.41Å; A24-L28 PolarHBondContact O-N 2.96Å; A24-F240 HydrophobicContact CB-CD2 3.94Å; A24-F240 HydrophobicContact CB-CE2 3.85Å |
| 25 | G | 90.8 | Very high | 88.3 | Confident | 0 Ų | 0 | 48.3 Ų | 48.3 | 0% | 0 | 25% | 0.25 | C | C | . | . | H | α-helix | trans | -60.2 | -48.2 | 172.2 | 0 | 0 | 0 | 0 | 0 | 112.2 | L21 T22 A27 L28 F240 | L21-G25 PolarHBondContact O-N 3.4Å; T22-G25 PolarHBondContact O-N 3.49Å; G25-A27 VanDerWaalsContact C-N 3.27Å; G25-A27 PolarHBondContact O-N 3.45Å; G25-L28 VanDerWaalsContact O-CB 3.3Å; G25-L28 WeakPolarHBondContact O-CB 3.36Å; G25-L28 PolarHBondContact O-N 2.83Å; G25-L28 VanDerWaalsContact O-N 3.13Å; G25-F240 VanDerWaalsContact CA-O 3.23Å; G25-F240 WeakPolarHBondContact CA-O 3.16Å |
| 26 | A | 92.6 | Very high | 87.2 | Confident | 0 Ų | 0 | 53.8 Ų | 53.8 | 0% | 0 | 28% | 0.276 | C | S | . | . | H | α-helix | trans | -61.3 | -34.8 | 176.1 | 0 | 0 | 0 | 0 | 0 | 112.4 | T22 A23 L28 V29 G243 S247 F261 | T22-A26 WeakPolarHBondContact O-CB 3.21Å; T22-A26 PolarHBondContact O-N 3.36Å; A23-A26 PolarHBondContact O-N 2.89Å; A26-L28 PolarHBondContact O-N 3.42Å; A26-V29 VanDerWaalsContact O-CB 3.26Å; A26-V29 WeakPolarHBondContact O-CB 3.13Å; A26-V29 WeakPolarHBondContact O-CG1 3.31Å; A26-V29 PolarHBondContact O-N 2.89Å; A26-G243 WeakPolarHBondContact CA-O 3.36Å; A26-S247 WeakPolarHBondContact CA-OG 3.46Å; A26-S247 PolarHBondContact O-OG 3.21Å; A26-F261 HydrophobicContact CB-CD2 3.99Å; A26-F261 HydrophobicContact CB-CE2 4.41Å |
| 27 | A | 94.2 | Very high | 86.4 | Confident | 34 Ų | 34 | 56.1 Ų | 56.1 | 28% | 0.281 | 28% | 0.283 | S | S | . | . | H | α-helix | trans | -67.2 | -18.3 | 178.5 | 0 | 0 | 0 | 0 | 0 | 113.4 | A23 A24 G25 V29 F30 F261 | A23-A27 WeakPolarHBondContact O-CB 3.38Å; A23-A27 PolarHBondContact O-N 3.31Å; A24-A27 PolarHBondContact O-N 3.41Å; G25-A27 VanDerWaalsContact C-N 3.27Å; G25-A27 PolarHBondContact O-N 3.45Å; A27-V29 PolarHBondContact O-N 3.23Å; A27-F30 HydrophobicContact CB-CD2 4.33Å; A27-F30 WeakPolarHBondContact O-CD2 3.32Å; A27-F30 PolarHBondContact O-N 3.37Å; A27-F261 HydrophobicContact CB-CD2 4.2Å; A27-F261 HydrophobicContact CB-CE2 3.97Å |
| 28 | L | 88.6 | Confident | 85.7 | Confident | 33 Ų | 33 | 61.2 Ų | 61.2 | 17% | 0.173 | 30% | 0.3 | C | S | . | . | G | 310 helix | trans | -61.2 | -18.1 | 173.5 | -71.9 | -174 | 0 | 0 | 0 | 112.9 | A24 G25 A26 F30 I31 F32 F240 L244 | A24-L28 PolarHBondContact O-N 2.96Å; G25-L28 VanDerWaalsContact O-CB 3.3Å; G25-L28 WeakPolarHBondContact O-CB 3.36Å; G25-L28 PolarHBondContact O-N 2.83Å; G25-L28 VanDerWaalsContact O-N 3.13Å; A26-L28 PolarHBondContact O-N 3.42Å; L28-F30 PolarHBondContact O-N 3.01Å; L28-F30 VanDerWaalsContact O-N 3.17Å; L28-I31 HydrophobicContact CD2-CD1 4Å; L28-I31 PolarHBondContact O-N 3.34Å; L28-F32 HydrophobicContact CB-CD2 3.92Å; L28-F32 HydrophobicContact CB-CE2 4.19Å; L28-F32 HydrophobicContact CD1-CD2 4.4Å; L28-F32 HydrophobicContact CD1-CE2 3.97Å; L28-F32 HydrophobicContact CD2-CE2 4.03Å; L28-F32 HydrophobicContact CG-CE2 4.31Å; L28-F32 PolarHBondContact O-N 2.86Å; L28-F240 HydrophobicContact CD1-CE1 3.45Å; L28-F240 VanDerWaalsContact CD1-CE1 3.45Å; L28-F240 HydrophobicContact CD1-CZ 3.38Å; L28-F240 HydrophobicContact CD2-CZ 4.37Å; L28-F240 HydrophobicContact CG-CE1 4.36Å; L28-F240 HydrophobicContact CG-CZ 3.84Å; L28-L244 HydrophobicContact CB-CD1 4.05Å; L28-L244 HydrophobicContact CD1-CD1 3.58Å; L28-L244 HydrophobicContact CG-CD1 4.47Å |
| 29 | V | 88.1 | Confident | 85 | Confident | 0 Ų | 0 | 64.5 Ų | 64.5 | 0% | 0 | 32% | 0.316 | C | S | . | . | G | 310 helix | trans | -59.4 | -20.7 | 171.1 | 81.1 | 0 | 0 | 0 | 0 | 113 | A26 A27 L248 R251 T257 A260 F261 | A26-V29 VanDerWaalsContact O-CB 3.26Å; A26-V29 WeakPolarHBondContact O-CB 3.13Å; A26-V29 WeakPolarHBondContact O-CG1 3.31Å; A26-V29 PolarHBondContact O-N 2.89Å; A27-V29 PolarHBondContact O-N 3.23Å; V29-L248 HydrophobicContact CG2-CD2 4.33Å; V29-R251 HydrophobicContact CG2-CB 3.67Å; V29-R251 HydrophobicContact CG2-CG 4.17Å; V29-R251 PolarHBondContact O-NH1 2.76Å; V29-T257 HydrophobicContact CG1-CG2 3.87Å; V29-T257 HydrophobicContact CG2-CG2 4.36Å; V29-T257 WeakPolarHBondContact O-CG2 3.34Å; V29-A260 HydrophobicContact CG2-CB 4.24Å; V29-F261 HydrophobicContact CG1-CB 4.02Å |
| 30 | F | 89.3 | Confident | 84.1 | Confident | 93 Ų | 93 | 63 Ų | 63 | 41% | 0.408 | 31% | 0.313 | S | S | . | . | G | 310 helix | trans | -76.9 | -28.3 | 172.7 | -65 | -74.4 | 0 | 0 | 0 | 112.8 | A27 L28 T257 W258 F261 | A27-F30 HydrophobicContact CB-CD2 4.33Å; A27-F30 WeakPolarHBondContact O-CD2 3.32Å; A27-F30 PolarHBondContact O-N 3.37Å; L28-F30 PolarHBondContact O-N 3.01Å; L28-F30 VanDerWaalsContact O-N 3.17Å; F30-T257 HydrophobicContact CD1-CG2 3.37Å; F30-T257 HydrophobicContact CE1-CG2 3.47Å; F30-T257 VanDerWaalsContact CE1-CG2 3.47Å; F30-T257 HydrophobicContact CG-CG2 4.04Å; F30-T257 HydrophobicContact CZ-CG2 4.19Å; F30-W258 AromaticContact CE1-CE3 3.8Å; F30-W258 HydrophobicContact CE1-CE3 3.8Å; F30-W258 HydrophobicContact CE1-CZ3 4.23Å; F30-W258 HydrophobicContact CE2-CE3 4.44Å; F30-W258 HydrophobicContact CE2-CZ3 4.29Å; F30-W258 AromaticContact CZ-CE3 3.37Å; F30-W258 HydrophobicContact CZ-CE3 3.37Å; F30-W258 AromaticContact CZ-CZ3 3.59Å; F30-W258 HydrophobicContact CZ-CZ3 3.59Å; F30-F261 HydrophobicContact CE2-CB 3.73Å; F30-F261 HydrophobicContact CE2-CD1 4.22Å; F30-F261 AromaticContact CE2-CD2 3.9Å; F30-F261 HydrophobicContact CE2-CD2 3.9Å; F30-F261 AromaticContact CE2-CG 3.67Å; F30-F261 HydrophobicContact CE2-CG 3.67Å; F30-F261 HydrophobicContact CZ-CB 3.72Å; F30-F261 HydrophobicContact CZ-CD1 4.26Å; F30-F261 AromaticContact CZ-CG 3.95Å; F30-F261 HydrophobicContact CZ-CG 3.95Å |
| 31 | I | 85.1 | Confident | 83.5 | Confident | 125 Ų | 125 | 61.8 Ų | 61.8 | 64% | 0.641 | 30% | 0.3 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -92.4 | -50.3 | -175.8 | -59.8 | 170.6 | 0 | 0 | 0 | 110.1 | L28 | L28-I31 HydrophobicContact CD2-CD1 4Å; L28-I31 PolarHBondContact O-N 3.34Å |
| 32 | F | 73.4 | Confident | 83 | Confident | 74 Ų | 74 | 60.1 Ų | 60.1 | 33% | 0.325 | 29% | 0.293 | S | S | . | . | S | Bend | trans | -90.4 | 124.8 | -176.9 | -61.6 | -61.8 | 0 | 0 | 0 | 111.3 | L28 I39 L248 R251 | L28-F32 HydrophobicContact CB-CD2 3.92Å; L28-F32 HydrophobicContact CB-CE2 4.19Å; L28-F32 HydrophobicContact CD1-CD2 4.4Å; L28-F32 HydrophobicContact CD1-CE2 3.97Å; L28-F32 HydrophobicContact CD2-CE2 4.03Å; L28-F32 HydrophobicContact CG-CE2 4.31Å; L28-F32 PolarHBondContact O-N 2.86Å; F32-I39 HydrophobicContact CD1-CG2 3.73Å; F32-I39 HydrophobicContact CE1-CG2 4.15Å; F32-I39 HydrophobicContact CG-CG2 4.35Å; F32-L248 HydrophobicContact CB-CD2 4.38Å; F32-R251 PolarHBondContact O-NH1 3.03Å |
| 33 | S | 64.6 | Low | 82.3 | Confident | 50 Ų | 50 | 61.3 Ų | 61.3 | 35% | 0.35 | 30% | 0.301 | S | S | . | . | trans | -92.4 | 135.5 | 175 | -174.4 | 0 | 0 | 0 | 0 | 110.7 | R35 Q36 | S33-R35 PolarHBondContact O-N 2.88Å; S33-Q36 PolarHBondContact O-N 3.12Å | ||
| 34 | S | 63.2 | Low | 81.6 | Confident | 41 Ų | 41 | 60.9 Ų | 60.9 | 29% | 0.287 | 30% | 0.297 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -59.9 | -7.7 | 175 | 70.6 | 0 | 0 | 0 | 0 | 113.5 | Q36 | S34-Q36 VanDerWaalsContact C-N 3.29Å; S34-Q36 PolarHBondContact O-N 3.05Å |
| 35 | R | 64.9 | Low | 81.4 | Confident | 228 Ų | 228 | 59.1 Ų | 59.1 | 86% | 0.86 | 28% | 0.283 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -68.9 | -20.9 | -179.1 | -137.2 | 177.8 | -163.6 | -175.1 | 4.6 | 114 | S33 | S33-R35 PolarHBondContact O-N 2.88Š|
| 36 | Q | 75.2 | Confident | 81.2 | Confident | 116 Ų | 116 | 62.2 Ų | 62.2 | 54% | 0.542 | 30% | 0.296 | S | S | . | . | trans | -106.5 | 88.3 | 179.5 | -85.3 | 151.9 | -10.9 | 0 | 0 | 111 | S33 S34 R38 I39 L40 | S33-Q36 PolarHBondContact O-N 3.12Å; S34-Q36 VanDerWaalsContact C-N 3.29Å; S34-Q36 PolarHBondContact O-N 3.05Å; Q36-R38 PolarHBondContact O-N 2.9Å; Q36-I39 HydrophobicContact CB-CB 4.27Å; Q36-I39 HydrophobicContact CB-CD1 3.93Å; Q36-I39 HydrophobicContact CB-CG1 4.07Å; Q36-I39 HydrophobicContact CG-CD1 4.47Å; Q36-I39 PolarHBondContact O-N 3.27Å; Q36-L40 PolarHBondContact O-N 3.28Å; Q36-L40 VanDerWaalsContact O-N 3.13Å | ||
| 37 | K | 79.6 | Confident | 80.8 | Confident | 119 Ų | 119 | 62.3 Ų | 62.3 | 52% | 0.517 | 30% | 0.297 | S | S | . | . | H | α-helix | trans | -49.8 | -35.8 | 179.9 | -60.3 | -166.9 | 180 | -169.4 | 0 | 113.5 | I39 L40 D41 | K37-I39 PolarHBondContact O-N 3.42Å; K37-L40 PolarHBondContact O-N 3.37Å; K37-D41 WeakPolarHBondContact O-CB 3.22Å; K37-D41 PolarHBondContact O-N 2.85Å |
| 38 | R | 82.8 | Confident | 80.5 | Confident | 179 Ų | 179 | 60.7 Ų | 60.7 | 68% | 0.675 | 28% | 0.283 | S | S | * | . | H | α-helix | trans | -60.8 | -41.7 | 174.7 | -75.7 | -175.4 | 176.8 | 178.7 | 2.7 | 114.2 | Q36 G42 N317 L320 | Q36-R38 PolarHBondContact O-N 2.9Å; R38-G42 PolarHBondContact O-N 3.22Å; R38-N317 WeakPolarHBondContact CG-OD1 3.42Å; R38-L320 HydrophobicContact CB-CD2 4.45Å; R38-L320 WeakPolarHBondContact O-CD2 3.4Å |
| 39 | I | 79.9 | Confident | 80.7 | Confident | 69 Ų | 69 | 59.1 Ų | 59.1 | 35% | 0.354 | 28% | 0.275 | S | S | . | . | H | α-helix | trans | -73 | -41.4 | -179.8 | -62.5 | 177.9 | 0 | 0 | 0 | 109.2 | F32 Q36 K37 G42 S43 | F32-I39 HydrophobicContact CD1-CG2 3.73Å; F32-I39 HydrophobicContact CE1-CG2 4.15Å; F32-I39 HydrophobicContact CG-CG2 4.35Å; Q36-I39 HydrophobicContact CB-CB 4.27Å; Q36-I39 HydrophobicContact CB-CD1 3.93Å; Q36-I39 HydrophobicContact CB-CG1 4.07Å; Q36-I39 HydrophobicContact CG-CD1 4.47Å; Q36-I39 PolarHBondContact O-N 3.27Å; K37-I39 PolarHBondContact O-N 3.42Å; I39-G42 PolarHBondContact O-N 3.15Å; I39-S43 VanDerWaalsContact O-CB 3.32Å; I39-S43 WeakPolarHBondContact O-CB 3.49Å; I39-S43 PolarHBondContact O-N 3.02Å; I39-S43 PolarHBondContact O-OG 2.75Å |
| 40 | L | 77.3 | Confident | 80.8 | Confident | 35 Ų | 35 | 59.3 Ų | 59.3 | 18% | 0.183 | 28% | 0.276 | C | S | . | . | H | α-helix | trans | -59.1 | -57.8 | 176 | -179.1 | 62.6 | 0 | 0 | 0 | 111.2 | Q36 K37 G42 S43 L44 L248 | Q36-L40 PolarHBondContact O-N 3.28Å; Q36-L40 VanDerWaalsContact O-N 3.13Å; K37-L40 PolarHBondContact O-N 3.37Å; L40-G42 VanDerWaalsContact C-N 3.28Å; L40-G42 PolarHBondContact O-N 3.49Å; L40-S43 PolarHBondContact O-N 2.79Å; L40-S43 PolarHBondContact O-OG 3.24Å; L40-L44 HydrophobicContact CD1-CD1 4.12Å; L40-L44 HydrophobicContact CD1-CG 4.26Å; L40-L44 HydrophobicContact CG-CD1 4.03Å; L40-L44 WeakPolarHBondContact O-CG 3.4Å; L40-L44 PolarHBondContact O-N 3.42Å; L40-L248 HydrophobicContact CD1-CB 4.02Å; L40-L248 HydrophobicContact CD1-CD1 3.85Å; L40-L248 HydrophobicContact CD1-CG 4.49Å |
| 41 | D | 83.6 | Confident | 80.8 | Confident | 2 Ų | 2 | 55.1 Ų | 55.1 | 1% | 0.011 | 26% | 0.258 | C | S | . | . | H | α-helix | trans | -57.1 | -41.3 | 178.6 | -64 | -2.5 | 0 | 0 | 0 | 111.9 | K37 G45 A312 S315 N317 | K37-D41 WeakPolarHBondContact O-CB 3.22Å; K37-D41 PolarHBondContact O-N 2.85Å; D41-G45 PolarHBondContact O-N 2.81Å; D41-A312 WeakPolarHBondContact CB-O 3.26Å; D41-S315 PolarHBondContact OD1-OG 3.21Å; D41-S315 WeakPolarHBondContact OD2-CB 3.3Å; D41-S315 PolarHBondContact OD2-OG 3.16Å; D41-N317 HydrophobicContact CB-CB 4.16Å; D41-N317 WeakPolarHBondContact OD2-CB 3.27Å; D41-N317 PolarHBondContact OD2-ND2 3.32Å |
| 42 | G | 84.9 | Confident | 81.1 | Confident | 9 Ų | 9 | 51.5 Ų | 51.5 | 9% | 0.093 | 24% | 0.24 | C | C | . | . | H | α-helix | trans | -62.5 | -43.9 | 175.7 | 0 | 0 | 0 | 0 | 0 | 112.5 | R38 I39 L40 F46 T324 | R38-G42 PolarHBondContact O-N 3.22Å; I39-G42 PolarHBondContact O-N 3.15Å; L40-G42 VanDerWaalsContact C-N 3.28Å; L40-G42 PolarHBondContact O-N 3.49Å; G42-F46 WeakPolarHBondContact O-CB 3.19Å; G42-F46 PolarHBondContact O-N 2.94Å; G42-T324 VanDerWaalsContact O-CB 3.22Å; G42-T324 WeakPolarHBondContact O-CB 3.4Å; G42-T324 PolarHBondContact O-OG1 2.85Å |
| 43 | S | 80.4 | Confident | 82 | Confident | 24 Ų | 24 | 48 Ų | 48 | 17% | 0.168 | 22% | 0.224 | C | C | . | . | H | α-helix | trans | -68.1 | -39.9 | 178 | 67.6 | 0 | 0 | 0 | 0 | 112.9 | I39 L40 F46 A47 | I39-S43 VanDerWaalsContact O-CB 3.32Å; I39-S43 WeakPolarHBondContact O-CB 3.49Å; I39-S43 PolarHBondContact O-N 3.02Å; I39-S43 PolarHBondContact O-OG 2.75Å; L40-S43 PolarHBondContact O-N 2.79Å; L40-S43 PolarHBondContact O-OG 3.24Å; S43-F46 PolarHBondContact O-N 3.35Å; S43-A47 WeakPolarHBondContact O-CB 3.48Å; S43-A47 PolarHBondContact O-N 3.41Å |
| 44 | L | 81.4 | Confident | 83.1 | Confident | 9 Ų | 9 | 45.6 Ų | 45.6 | 5% | 0.047 | 21% | 0.208 | C | C | . | . | H | α-helix | trans | -66.4 | -42.8 | 175.1 | -69.7 | 172.7 | 0 | 0 | 0 | 111.4 | L40 F46 A47 A48 I308 E311 A312 | L40-L44 HydrophobicContact CD1-CD1 4.12Å; L40-L44 HydrophobicContact CD1-CG 4.26Å; L40-L44 HydrophobicContact CG-CD1 4.03Å; L40-L44 WeakPolarHBondContact O-CG 3.4Å; L40-L44 PolarHBondContact O-N 3.42Å; L44-F46 PolarHBondContact O-N 3.1Å; L44-A47 PolarHBondContact O-N 2.89Å; L44-A48 WeakPolarHBondContact O-CB 3.49Å; L44-A48 PolarHBondContact O-N 3.31Å; L44-I308 HydrophobicContact CB-CG2 4.3Å; L44-I308 HydrophobicContact CD2-CG2 4.46Å; L44-I308 WeakPolarHBondContact O-CG2 3.13Å; L44-E311 HydrophobicContact CD1-CB 4.44Å; L44-E311 HydrophobicContact CD1-CG 3.87Å; L44-A312 HydrophobicContact CB-CB 3.71Å |
| 45 | G | 88.9 | Confident | 84.4 | Confident | 2 Ų | 2 | 43.7 Ų | 43.7 | 2% | 0.021 | 19% | 0.194 | C | C | . | . | H | α-helix | trans | -57.5 | -49.1 | 172.2 | 0 | 0 | 0 | 0 | 0 | 111.7 | D41 A47 A48 G49 A321 S325 | D41-G45 PolarHBondContact O-N 2.81Å; G45-A47 PolarHBondContact O-N 2.83Å; G45-A48 WeakPolarHBondContact O-CB 3.42Å; G45-A48 PolarHBondContact O-N 3.19Å; G45-G49 PolarHBondContact O-N 3.07Å; G45-A321 WeakPolarHBondContact CA-O 3.33Å; G45-S325 WeakPolarHBondContact O-CA 3.34Å; G45-S325 WeakPolarHBondContact O-CB 3.43Å; G45-S325 PolarHBondContact O-N 3.25Å; G45-S325 PolarHBondContact O-OG 2.97Å |
| 46 | F | 88.1 | Confident | 85.7 | Confident | 65 Ų | 65 | 38.6 Ų | 38.6 | 29% | 0.285 | 18% | 0.176 | S | C | . | . | H | α-helix | trans | -56.9 | -47.3 | 175.7 | -179.2 | -93.6 | 0 | 0 | 0 | 112.3 | G42 S43 L44 G49 V50 T324 L327 G328 V331 | G42-F46 WeakPolarHBondContact O-CB 3.19Å; G42-F46 PolarHBondContact O-N 2.94Å; S43-F46 PolarHBondContact O-N 3.35Å; L44-F46 PolarHBondContact O-N 3.1Å; F46-G49 PolarHBondContact O-N 2.82Å; F46-V50 HydrophobicContact CD1-CG2 4.13Å; F46-V50 HydrophobicContact CE1-CG2 3.69Å; F46-V50 HydrophobicContact CZ-CG2 3.91Å; F46-V50 WeakPolarHBondContact O-CG2 3.24Å; F46-V50 PolarHBondContact O-N 3.1Å; F46-T324 VanDerWaalsContact CA-O 3.3Å; F46-T324 WeakPolarHBondContact CA-O 3.26Å; F46-T324 PolarHBondContact N-OG1 3.03Å; F46-L327 HydrophobicContact CD2-CG 4.41Å; F46-L327 HydrophobicContact CE2-CG 4.32Å; F46-G328 VanDerWaalsContact CD2-CA 3.48Å; F46-G328 VanDerWaalsContact CE2-CA 3.44Å; F46-V331 HydrophobicContact CE2-CG2 4.46Å; F46-V331 HydrophobicContact CZ-CG1 4.5Å |
| 47 | A | 83.6 | Confident | 86.3 | Confident | 1 Ų | 1 | 35.9 Ų | 35.9 | 1% | 0.008 | 16% | 0.161 | C | C | . | . | H | α-helix | trans | -58.6 | -48 | 177.4 | 0 | 0 | 0 | 0 | 0 | 112.2 | S43 L44 G45 G49 V50 M51 P241 | S43-A47 WeakPolarHBondContact O-CB 3.48Å; S43-A47 PolarHBondContact O-N 3.41Å; L44-A47 PolarHBondContact O-N 2.89Å; G45-A47 PolarHBondContact O-N 2.83Å; A47-G49 VanDerWaalsContact C-N 3.26Å; A47-G49 PolarHBondContact O-N 3.07Å; A47-V50 PolarHBondContact O-N 3.44Å; A47-V50 VanDerWaalsContact O-N 3.17Å; A47-M51 WeakPolarHBondContact O-CG 3.38Å; A47-M51 PolarHBondContact O-N 3.45Å; A47-P241 HydrophobicContact CB-CB 3.71Å |
| 48 | A | 88.7 | Confident | 86.5 | Confident | 0 Ų | 0 | 30.4 Ų | 30.4 | 0% | 0 | 14% | 0.138 | C | C | . | . | H | α-helix | trans | -55.7 | -42.3 | 175 | 0 | 0 | 0 | 0 | 0 | 112.2 | L44 G45 L52 V304 I308 I309 | L44-A48 WeakPolarHBondContact O-CB 3.49Å; L44-A48 PolarHBondContact O-N 3.31Å; G45-A48 WeakPolarHBondContact O-CB 3.42Å; G45-A48 PolarHBondContact O-N 3.19Å; A48-L52 WeakPolarHBondContact O-CB 2.92Å; A48-L52 WeakPolarHBondContact O-CG 3.34Å; A48-L52 PolarHBondContact O-N 3.33Å; A48-V304 HydrophobicContact CB-CG1 3.64Å; A48-I308 HydrophobicContact CB-CB 4.32Å; A48-I308 HydrophobicContact CB-CG2 3.74Å; A48-I309 HydrophobicContact CB-CG1 3.83Å |
| 49 | G | 92.3 | Very high | 86.7 | Confident | 0 Ų | 0 | 22 Ų | 22 | 0% | 0 | 11% | 0.106 | C | C | . | . | H | α-helix | trans | -59.9 | -49.5 | 175.7 | 0 | 0 | 0 | 0 | 0 | 113.3 | G45 F46 A47 A53 S325 F329 | G45-G49 PolarHBondContact O-N 3.07Å; F46-G49 PolarHBondContact O-N 2.82Å; A47-G49 VanDerWaalsContact C-N 3.26Å; A47-G49 PolarHBondContact O-N 3.07Å; G49-A53 PolarHBondContact O-N 2.74Å; G49-S325 WeakPolarHBondContact CA-O 3.45Å; G49-S325 WeakPolarHBondContact CA-OG 3Å; G49-S325 PolarHBondContact N-OG 3.17Å; G49-F329 VanDerWaalsContact O-CA 3.3Å; G49-F329 WeakPolarHBondContact O-CA 3.45Å |
| 50 | V | 88.9 | Confident | 87.2 | Confident | 4 Ų | 4 | 20 Ų | 20 | 2% | 0.024 | 10% | 0.096 | C | C | . | . | H | α-helix | trans | -60.6 | -48.5 | 178 | 173.6 | 0 | 0 | 0 | 0 | 110.8 | F46 A47 L52 A53 A54 Q238 P241 G328 M332 | F46-V50 HydrophobicContact CD1-CG2 4.13Å; F46-V50 HydrophobicContact CE1-CG2 3.69Å; F46-V50 HydrophobicContact CZ-CG2 3.91Å; F46-V50 WeakPolarHBondContact O-CG2 3.24Å; F46-V50 PolarHBondContact O-N 3.1Å; A47-V50 PolarHBondContact O-N 3.44Å; A47-V50 VanDerWaalsContact O-N 3.17Å; V50-L52 PolarHBondContact O-N 3.06Å; V50-A53 PolarHBondContact O-N 3.5Å; V50-A54 WeakPolarHBondContact O-CB 3.42Å; V50-A54 PolarHBondContact O-N 3.16Å; V50-Q238 HydrophobicContact CG1-CB 3.99Å; V50-P241 HydrophobicContact CB-CG 3.84Å; V50-P241 HydrophobicContact CG1-CG 3.64Å; V50-P241 HydrophobicContact CG2-CG 4.19Å; V50-G328 WeakPolarHBondContact CG2-O 3.41Å; V50-M332 HydrophobicContact CB-CB 4.35Å; V50-M332 HydrophobicContact CG1-CB 4.03Å; V50-M332 HydrophobicContact CG1-CG 4.06Å; V50-M332 HydrophobicContact CG1-SD 4.04Å; V50-M332 HydrophobicContact CG2-CB 4.41Å |
| 51 | M | 89.6 | Confident | 87.8 | Confident | 6 Ų | 6 | 19.3 Ų | 19.3 | 3% | 0.03 | 10% | 0.095 | C | C | . | . | H | α-helix | trans | -64.2 | -38.4 | -178.1 | -69 | 171.9 | 73.4 | 0 | 0 | 112.6 | A47 A54 S55 E242 M300 V304 I308 | A47-M51 WeakPolarHBondContact O-CG 3.38Å; A47-M51 PolarHBondContact O-N 3.45Å; M51-A54 PolarHBondContact O-N 2.83Å; M51-S55 WeakPolarHBondContact O-CB 3.15Å; M51-S55 PolarHBondContact O-N 3.27Å; M51-S55 PolarHBondContact O-OG 3.3Å; M51-E242 HydrophobicContact CE-CG 4.3Å; M51-E242 HydrophobicContact SD-CG 4.44Å; M51-M300 HydrophobicContact CB-CG 4.06Å; M51-M300 HydrophobicContact CB-SD 4.06Å; M51-M300 HydrophobicContact CE-CG 3.74Å; M51-M300 VanDerWaalsContact O-SD 3.37Å; M51-V304 HydrophobicContact CB-CG2 3.56Å; M51-V304 HydrophobicContact CE-CG2 3.96Å; M51-V304 HydrophobicContact CG-CG2 4.45Å; M51-V304 HydrophobicContact SD-CG2 4.11Å; M51-I308 HydrophobicContact CE-CD1 3.85Å; M51-I308 HydrophobicContact SD-CD1 3.4Å; M51-I308 WeakPolarHBondContact SD-CD1 3.19Å |
| 52 | L | 93.1 | Very high | 87.9 | Confident | 49 Ų | 49 | 20.8 Ų | 20.8 | 26% | 0.257 | 11% | 0.105 | S | C | . | . | H | α-helix | trans | -64.9 | -41.8 | 175.1 | -75.8 | 171.5 | 0 | 0 | 0 | 112.6 | A48 V50 V301 V304 I309 F329 | A48-L52 WeakPolarHBondContact O-CB 2.92Å; A48-L52 WeakPolarHBondContact O-CG 3.34Å; A48-L52 PolarHBondContact O-N 3.33Å; V50-L52 PolarHBondContact O-N 3.06Å; L52-V301 HydrophobicContact CD2-CG2 4.37Å; L52-V304 HydrophobicContact CD1-CG1 3.96Å; L52-V304 HydrophobicContact CD2-CB 4.26Å; L52-V304 HydrophobicContact CD2-CG1 4.01Å; L52-V304 HydrophobicContact CG-CB 4.37Å; L52-V304 HydrophobicContact CG-CG1 3.72Å; L52-I309 HydrophobicContact CD1-CD1 4.25Å; L52-F329 HydrophobicContact CB-CD2 4.15Å; L52-F329 HydrophobicContact CB-CE2 4.33Å |
| 53 | A | 91.8 | Very high | 88.1 | Confident | 0 Ų | 0 | 20.3 Ų | 20.3 | 0% | 0 | 10% | 0.1 | C | C | . | . | H | α-helix | trans | -65.2 | -49 | 175.3 | 0 | 0 | 0 | 0 | 0 | 110.8 | G49 V50 S55 Y56 W57 F329 M332 | G49-A53 PolarHBondContact O-N 2.74Å; V50-A53 PolarHBondContact O-N 3.5Å; A53-S55 VanDerWaalsContact C-N 3.28Å; A53-S55 PolarHBondContact O-N 2.95Å; A53-Y56 PolarHBondContact O-N 3.26Å; A53-W57 HydrophobicContact CB-CE3 3.86Å; A53-W57 HydrophobicContact CB-CZ3 3.8Å; A53-W57 PolarHBondContact O-N 2.89Å; A53-F329 HydrophobicContact CB-CD1 4.42Å; A53-F329 HydrophobicContact CB-CD2 3.68Å; A53-F329 HydrophobicContact CB-CE2 3.9Å; A53-F329 HydrophobicContact CB-CG 3.97Å; A53-F329 HydrophobicContact CB-CZ 4.37Å; A53-M332 HydrophobicContact CB-CB 3.65Å; A53-M332 HydrophobicContact CB-CG 3.66Å |
| 54 | A | 86.8 | Confident | 88.6 | Confident | 0 Ų | 0 | 21.8 Ų | 21.8 | 0% | 0 | 11% | 0.105 | C | C | . | . | H | α-helix | trans | -58 | -40.1 | 178.9 | 0 | 0 | 0 | 0 | 0 | 112.6 | V50 M51 Y56 S58 L59 Q238 M332 | V50-A54 WeakPolarHBondContact O-CB 3.42Å; V50-A54 PolarHBondContact O-N 3.16Å; M51-A54 PolarHBondContact O-N 2.83Å; A54-Y56 PolarHBondContact O-N 2.9Å; A54-S58 WeakPolarHBondContact O-CA 3.31Å; A54-S58 WeakPolarHBondContact O-CB 3.5Å; A54-S58 PolarHBondContact O-N 3.45Å; A54-L59 PolarHBondContact O-N 3.47Å; A54-Q238 HydrophobicContact CB-CB 3.47Å; A54-Q238 VanDerWaalsContact CB-CB 3.47Å; A54-Q238 HydrophobicContact CB-CG 3.68Å; A54-M332 HydrophobicContact CB-CE 3.83Å; A54-M332 HydrophobicContact CB-CG 4.21Å; A54-M332 HydrophobicContact CB-SD 4.45Å |
| 55 | S | 90.2 | Very high | 88.9 | Confident | 1 Ų | 1 | 25.7 Ų | 25.7 | 1% | 0.007 | 13% | 0.127 | C | C | . | . | I | π-helix | trans | -54.2 | -37 | 175 | -65.5 | 0 | 0 | 0 | 0 | 112.5 | M51 A53 L60 A297 M300 | M51-S55 WeakPolarHBondContact O-CB 3.15Å; M51-S55 PolarHBondContact O-N 3.27Å; M51-S55 PolarHBondContact O-OG 3.3Å; A53-S55 VanDerWaalsContact C-N 3.28Å; A53-S55 PolarHBondContact O-N 2.95Å; S55-L60 WeakPolarHBondContact O-CB 3.12Å; S55-L60 WeakPolarHBondContact O-CG 3.5Å; S55-L60 PolarHBondContact O-N 2.9Å; S55-A297 WeakPolarHBondContact O-CB 3.46Å; S55-M300 WeakPolarHBondContact OG-CG 3.44Å; S55-M300 PolarHBondContact OG-SD 2.8Å |
| 56 | Y | 92.1 | Very high | 88.7 | Confident | 120 Ų | 120 | 28.7 Ų | 28.7 | 47% | 0.471 | 14% | 0.141 | S | C | . | . | I | π-helix | trans | -82.4 | -61.7 | 176.3 | -179.1 | -100.2 | 0 | 0 | 0 | 112 | A53 A54 L60 A61 | A53-Y56 PolarHBondContact O-N 3.26Å; A54-Y56 PolarHBondContact O-N 2.9Å; Y56-L60 HydrophobicContact CD2-CB 4.46Å; Y56-L60 PolarHBondContact O-N 3.47Å; Y56-A61 WeakPolarHBondContact O-CB 3.17Å; Y56-A61 PolarHBondContact O-N 3.33Å |
| 57 | W | 87.9 | Confident | 88.7 | Confident | 60 Ų | 60 | 25.6 Ų | 25.6 | 23% | 0.227 | 13% | 0.127 | C | C | . | . | I | π-helix | trans | -76.8 | -37.7 | -167.8 | -80.2 | -79.2 | 0 | 0 | 0 | 114.1 | A53 P62 F329 M333 D336 | A53-W57 HydrophobicContact CB-CE3 3.86Å; A53-W57 HydrophobicContact CB-CZ3 3.8Å; A53-W57 PolarHBondContact O-N 2.89Å; W57-P62 WeakPolarHBondContact O-CD 3.11Å; W57-F329 AromaticContact CH2-CE1 3.61Å; W57-F329 HydrophobicContact CH2-CE1 3.61Å; W57-F329 AromaticContact CH2-CZ 3.57Å; W57-F329 HydrophobicContact CH2-CZ 3.57Å; W57-F329 HydrophobicContact CZ3-CD1 4.5Å; W57-F329 AromaticContact CZ3-CE1 3.6Å; W57-F329 HydrophobicContact CZ3-CE1 3.6Å; W57-F329 HydrophobicContact CZ3-CE2 4.09Å; W57-F329 AromaticContact CZ3-CZ 3.36Å; W57-F329 HydrophobicContact CZ3-CZ 3.36Å; W57-M333 HydrophobicContact CD2-CG 4.37Å; W57-M333 HydrophobicContact CE3-CB 4.23Å; W57-M333 HydrophobicContact CE3-CG 4.32Å; W57-M333 HydrophobicContact CH2-CB 4.1Å; W57-M333 HydrophobicContact CH2-CG 3.66Å; W57-M333 HydrophobicContact CH2-SD 4.02Å; W57-M333 HydrophobicContact CZ2-CB 4.49Å; W57-M333 HydrophobicContact CZ2-CG 3.65Å; W57-M333 HydrophobicContact CZ2-SD 4.11Å; W57-M333 HydrophobicContact CZ3-CB 3.94Å; W57-M333 HydrophobicContact CZ3-CG 3.99Å; W57-D336 HydrophobicContact CB-CB 4.06Å; W57-D336 VanDerWaalsContact CB-CG 3.5Å; W57-D336 WeakPolarHBondContact CB-OD2 3.43Å |
| 58 | S | 83.6 | Confident | 88.8 | Confident | 4 Ų | 4 | 31.3 Ų | 31.3 | 3% | 0.028 | 15% | 0.154 | C | C | . | . | I | π-helix | trans | -94.5 | -15.9 | -174.7 | -45.2 | 0 | 0 | 0 | 0 | 112.8 | A54 M332 D336 | A54-S58 WeakPolarHBondContact O-CA 3.31Å; A54-S58 WeakPolarHBondContact O-CB 3.5Å; A54-S58 PolarHBondContact O-N 3.45Å; S58-M332 WeakPolarHBondContact OG-CE 3.22Å; S58-D336 PolarHBondContact OG-OD1 3.36Å |
| 59 | L | 87.6 | Confident | 88.5 | Confident | 1 Ų | 1 | 36.3 Ų | 36.3 | 1% | 0.005 | 18% | 0.18 | C | C | . | . | I | π-helix | trans | -121.5 | -63.1 | -177.4 | -58.9 | 178.9 | 0 | 0 | 0 | 113.1 | A54 A63 E206 L293 A296 A297 M300 | A54-L59 PolarHBondContact O-N 3.47Å; L59-A63 VanDerWaalsContact O-CB 3.26Å; L59-A63 WeakPolarHBondContact O-CB 3.31Å; L59-A63 PolarHBondContact O-N 3.49Å; L59-E206 HydrophobicContact CD2-CG 4.44Å; L59-L293 HydrophobicContact CD2-CD2 3.7Å; L59-A296 HydrophobicContact CD1-CB 3.98Å; L59-A297 HydrophobicContact CB-CB 3.81Å; L59-A297 HydrophobicContact CD1-CB 4.14Å; L59-M300 HydrophobicContact CD1-CE 3.85Å; L59-M300 HydrophobicContact CD1-SD 4.32Å |
| 60 | L | 91.6 | Very high | 87.8 | Confident | 28 Ų | 28 | 38.6 Ų | 38.6 | 15% | 0.147 | 20% | 0.196 | C | C | . | . | I | π-helix | trans | -66.8 | -47.2 | -175.8 | -82.6 | 165.5 | 0 | 0 | 0 | 113.5 | S55 Y56 A63 I64 V81 F85 A294 A297 | S55-L60 WeakPolarHBondContact O-CB 3.12Å; S55-L60 WeakPolarHBondContact O-CG 3.5Å; S55-L60 PolarHBondContact O-N 2.9Å; Y56-L60 HydrophobicContact CD2-CB 4.46Å; Y56-L60 PolarHBondContact O-N 3.47Å; L60-A63 WeakPolarHBondContact O-CB 3.17Å; L60-A63 PolarHBondContact O-N 3.49Å; L60-A63 VanDerWaalsContact O-N 3.16Å; L60-I64 VanDerWaalsContact O-CG1 3.24Å; L60-I64 WeakPolarHBondContact O-CG1 3.29Å; L60-I64 PolarHBondContact O-N 3.4Å; L60-V81 HydrophobicContact CD2-CG1 3.41Å; L60-V81 VanDerWaalsContact CD2-CG1 3.41Å; L60-F85 HydrophobicContact CD1-CD2 4.08Å; L60-F85 HydrophobicContact CD1-CE2 3.93Å; L60-F85 HydrophobicContact CD2-CD2 3.88Å; L60-F85 HydrophobicContact CG-CD2 4.31Å; L60-A294 HydrophobicContact CD2-CB 4.41Å; L60-A297 HydrophobicContact CD1-CB 4.23Å; L60-A297 HydrophobicContact CD2-CB 4.3Å; L60-A297 HydrophobicContact CG-CB 3.68Å |
| 61 | A | 89.6 | Confident | 87.1 | Confident | 21 Ų | 21 | 41.4 Ų | 41.4 | 17% | 0.174 | 23% | 0.227 | C | C | . | . | H | α-helix | trans | -60.6 | -50 | -178.5 | 0 | 0 | 0 | 0 | 0 | 111.2 | Y56 A63 I64 D65 | Y56-A61 WeakPolarHBondContact O-CB 3.17Å; Y56-A61 PolarHBondContact O-N 3.33Å; A61-A63 VanDerWaalsContact C-N 3.3Å; A61-A63 PolarHBondContact O-N 2.9Å; A61-I64 PolarHBondContact O-N 3.1Å; A61-I64 VanDerWaalsContact O-N 3.13Å; A61-D65 PolarHBondContact O-N 2.86Å |
| 62 | P | 85.6 | Confident | 86.6 | Confident | 32 Ų | 32 | 48.1 Ų | 48.1 | 21% | 0.208 | 26% | 0.255 | C | S | . | . | H | α-helix | trans | -59.1 | -38.3 | 171.8 | -26.7 | 35 | 0 | 0 | 0 | 113.1 | W57 I64 D65 M66 L293 | W57-P62 WeakPolarHBondContact O-CD 3.11Å; P62-I64 VanDerWaalsContact C-N 3.33Å; P62-I64 PolarHBondContact O-N 3.09Å; P62-D65 PolarHBondContact O-N 3.46Å; P62-M66 VanDerWaalsContact O-CB 3.31Å; P62-M66 WeakPolarHBondContact O-CB 3.49Å; P62-M66 WeakPolarHBondContact O-CG 3.38Å; P62-M66 PolarHBondContact O-N 3.13Å; P62-L293 HydrophobicContact CB-CD1 4.32Å |
| 63 | A | 88.9 | Confident | 85.8 | Confident | 0 Ų | 0 | 48.3 Ų | 48.3 | 0% | 0 | 25% | 0.253 | C | S | . | . | H | α-helix | trans | -63.4 | -38.9 | 176.7 | 0 | 0 | 0 | 0 | 0 | 112.7 | L59 L60 A61 A67 V81 L293 A294 | L59-A63 VanDerWaalsContact O-CB 3.26Å; L59-A63 WeakPolarHBondContact O-CB 3.31Å; L59-A63 PolarHBondContact O-N 3.49Å; L60-A63 WeakPolarHBondContact O-CB 3.17Å; L60-A63 PolarHBondContact O-N 3.49Å; L60-A63 VanDerWaalsContact O-N 3.16Å; A61-A63 VanDerWaalsContact C-N 3.3Å; A61-A63 PolarHBondContact O-N 2.9Å; A63-A67 WeakPolarHBondContact O-CB 3.49Å; A63-A67 PolarHBondContact O-N 3.1Å; A63-V81 HydrophobicContact CB-CG2 4.2Å; A63-L293 HydrophobicContact CB-CB 3.82Å; A63-L293 HydrophobicContact CB-CD1 4.45Å; A63-A294 HydrophobicContact CB-CB 4.34Å |
| 64 | I | 90.3 | Very high | 85.2 | Confident | 54 Ų | 54 | 51.1 Ų | 51.1 | 28% | 0.277 | 28% | 0.282 | S | S | . | . | H | α-helix | trans | -66.1 | -51.3 | 175.8 | -67.7 | 162.5 | 0 | 0 | 0 | 109.6 | L60 A61 P62 M66 A67 E68 V81 | L60-I64 VanDerWaalsContact O-CG1 3.24Å; L60-I64 WeakPolarHBondContact O-CG1 3.29Å; L60-I64 PolarHBondContact O-N 3.4Å; A61-I64 PolarHBondContact O-N 3.1Å; A61-I64 VanDerWaalsContact O-N 3.13Å; P62-I64 VanDerWaalsContact C-N 3.33Å; P62-I64 PolarHBondContact O-N 3.09Å; I64-M66 VanDerWaalsContact C-N 3.3Å; I64-M66 PolarHBondContact O-N 3.02Å; I64-A67 WeakPolarHBondContact O-CA 3.25Å; I64-A67 WeakPolarHBondContact O-CB 3.4Å; I64-A67 PolarHBondContact O-N 3.27Å; I64-E68 HydrophobicContact CG2-CG 4.42Å; I64-E68 WeakPolarHBondContact O-CG 3.47Å; I64-E68 PolarHBondContact O-N 2.93Å; I64-V81 HydrophobicContact CG1-CB 4.35Å; I64-V81 HydrophobicContact CG1-CG1 3.93Å; I64-V81 HydrophobicContact CG1-CG2 3.84Å |
| 65 | D | 86.9 | Confident | 85 | Confident | 92 Ų | 92 | 56.7 Ų | 56.7 | 49% | 0.492 | 32% | 0.321 | S | S | . | . | H | α-helix | trans | -58 | -44.8 | 179.9 | -66.8 | -13.4 | 0 | 0 | 0 | 110.8 | A61 P62 A67 E68 D69 | A61-D65 PolarHBondContact O-N 2.86Å; P62-D65 PolarHBondContact O-N 3.46Å; D65-A67 VanDerWaalsContact C-N 3.33Å; D65-A67 PolarHBondContact O-N 3.16Å; D65-E68 PolarHBondContact O-N 2.95Å; D65-D69 VanDerWaalsContact O-CB 3.29Å; D65-D69 WeakPolarHBondContact O-CB 3.43Å; D65-D69 PolarHBondContact O-N 3.21Å |
| 66 | M | 85.1 | Confident | 84.9 | Confident | 64 Ų | 64 | 63.1 Ų | 63.1 | 32% | 0.315 | 35% | 0.349 | S | S | . | . | H | α-helix | trans | -64.7 | -34.6 | 176.1 | -69.2 | 178.1 | 86.3 | 0 | 0 | 112.9 | P62 I64 S70 L289 P290 L293 | P62-M66 VanDerWaalsContact O-CB 3.31Å; P62-M66 WeakPolarHBondContact O-CB 3.49Å; P62-M66 WeakPolarHBondContact O-CG 3.38Å; P62-M66 PolarHBondContact O-N 3.13Å; I64-M66 VanDerWaalsContact C-N 3.3Å; I64-M66 PolarHBondContact O-N 3.02Å; M66-S70 WeakPolarHBondContact O-CB 3.47Å; M66-S70 PolarHBondContact O-N 3.01Å; M66-L289 HydrophobicContact CE-CB 3.77Å; M66-L289 HydrophobicContact CE-CD1 3.55Å; M66-L289 HydrophobicContact CE-CG 4.36Å; M66-L289 HydrophobicContact SD-CB 4.29Å; M66-P290 HydrophobicContact CB-CG 3.89Å; M66-L293 HydrophobicContact SD-CD1 3.96Å |
| 67 | A | 87.8 | Confident | 84.5 | Confident | 0 Ų | 0 | 57.7 Ų | 57.7 | 0% | 0 | 33% | 0.329 | C | S | . | . | H | α-helix | trans | -69.6 | -41.8 | 176.1 | 0 | 0 | 0 | 0 | 0 | 111.6 | A63 I64 D65 S70 Y73 A77 P80 V81 P290 | A63-A67 WeakPolarHBondContact O-CB 3.49Å; A63-A67 PolarHBondContact O-N 3.1Å; I64-A67 WeakPolarHBondContact O-CA 3.25Å; I64-A67 WeakPolarHBondContact O-CB 3.4Å; I64-A67 PolarHBondContact O-N 3.27Å; D65-A67 VanDerWaalsContact C-N 3.33Å; D65-A67 PolarHBondContact O-N 3.16Å; A67-S70 PolarHBondContact O-OG 3.43Å; A67-Y73 HydrophobicContact CB-CD2 4.43Å; A67-A77 HydrophobicContact CB-CB 4.23Å; A67-A77 WeakPolarHBondContact CB-O 3.33Å; A67-P80 HydrophobicContact CB-CG 3.65Å; A67-V81 HydrophobicContact CB-CG2 4.28Å; A67-P290 HydrophobicContact CB-CB 4.31Å |
| 68 | E | 86.4 | Confident | 84.6 | Confident | 121 Ų | 121 | 60.8 Ų | 60.8 | 57% | 0.565 | 34% | 0.344 | S | S | * | . | H | α-helix | trans | -65.7 | -50.3 | 176.6 | -70 | -174.1 | 175 | 0 | 0 | 111.5 | I64 D65 S70 G71 A77 | I64-E68 HydrophobicContact CG2-CG 4.42Å; I64-E68 WeakPolarHBondContact O-CG 3.47Å; I64-E68 PolarHBondContact O-N 2.93Å; D65-E68 PolarHBondContact O-N 2.95Å; E68-S70 PolarHBondContact O-N 3.07Å; E68-G71 PolarHBondContact O-N 3.36Å; E68-A77 HydrophobicContact CB-CB 4.38Å; E68-A77 HydrophobicContact CG-CB 3.52Å |
| 69 | D | 82.2 | Confident | 85 | Confident | 105 Ų | 105 | 64.7 Ų | 64.7 | 56% | 0.561 | 37% | 0.365 | S | S | * | . | H | α-helix | trans | -63.6 | -27 | -179.3 | -83.9 | -1.1 | 0 | 0 | 0 | 112.9 | D65 G71 S222 | D65-D69 VanDerWaalsContact O-CB 3.29Å; D65-D69 WeakPolarHBondContact O-CB 3.43Å; D65-D69 PolarHBondContact O-N 3.21Å; D69-G71 PolarHBondContact O-N 3.23Å; D69-G71 VanDerWaalsContact O-N 3.09Å; D69-S222 PolarHBondContact OD2-OG 2.88Å |
| 70 | S | 78.4 | Confident | 85.2 | Confident | 48 Ų | 48 | 64.6 Ų | 64.6 | 34% | 0.336 | 36% | 0.364 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -62.3 | -19.7 | -179.5 | 75.6 | 0 | 0 | 0 | 0 | 113.7 | M66 A67 E68 K72 Y73 | M66-S70 WeakPolarHBondContact O-CB 3.47Å; M66-S70 PolarHBondContact O-N 3.01Å; A67-S70 PolarHBondContact O-OG 3.43Å; E68-S70 PolarHBondContact O-N 3.07Å; S70-K72 PolarHBondContact O-N 3.39Å; S70-K72 PolarHBondContact OG-N 2.95Å; S70-Y73 WeakPolarHBondContact OG-CD2 3.31Å |
| 71 | G | 74.3 | Confident | 85.3 | Confident | 64 Ų | 64 | 63.8 Ų | 63.8 | 66% | 0.66 | 36% | 0.36 | S | S | * | . | S | Bend | trans | 64 | -1.6 | -178.3 | 0 | 0 | 0 | 0 | 0 | 115.1 | E68 D69 | E68-G71 PolarHBondContact O-N 3.36Å; D69-G71 PolarHBondContact O-N 3.23Å; D69-G71 VanDerWaalsContact O-N 3.09Å |
| 72 | K | 77.6 | Confident | 85.5 | Confident | 146 Ų | 146 | 64.8 Ų | 64.8 | 64% | 0.635 | 37% | 0.368 | S | S | * | . | S | Bend | trans | -80.3 | -30.3 | -176.8 | -71.4 | 178.8 | -176.2 | 171.1 | 0 | 113.1 | S70 | S70-K72 PolarHBondContact O-N 3.39Å; S70-K72 PolarHBondContact OG-N 2.95Å |
| 73 | Y | 76.9 | Confident | 86 | Confident | 53 Ų | 53 | 66 Ų | 66 | 21% | 0.208 | 38% | 0.376 | C | S | . | . | S | Bend | trans | -101.9 | -16 | -169.2 | -56.1 | -73 | 0 | 0 | 0 | 113.5 | A67 S70 S75 F76 P80 Y291 | A67-Y73 HydrophobicContact CB-CD2 4.43Å; S70-Y73 WeakPolarHBondContact OG-CD2 3.31Å; Y73-S75 PolarHBondContact O-N 3.05Å; Y73-F76 WeakPolarHBondContact O-CA 3.17Å; Y73-F76 WeakPolarHBondContact O-CB 3.22Å; Y73-F76 PolarHBondContact O-N 3.44Å; Y73-P80 HydrophobicContact CD1-CG 4.35Å; Y73-P80 HydrophobicContact CD2-CG 4.01Å; Y73-P80 HydrophobicContact CE1-CG 4.3Å; Y73-P80 HydrophobicContact CE2-CB 4.44Å; Y73-P80 HydrophobicContact CE2-CG 3.95Å; Y73-P80 HydrophobicContact CG-CG 4.22Å; Y73-Y291 WeakPolarHBondContact CE1-OH 3.44Å; Y73-Y291 VanDerWaalsContact OH-CE2 3.32Å; Y73-Y291 WeakPolarHBondContact OH-CE2 3.29Å; Y73-Y291 PolarHBondContact OH-OH 3.24Å |
| 74 | G | 80.2 | Confident | 86.3 | Confident | 59 Ų | 59 | 66.2 Ų | 66.2 | 61% | 0.608 | 38% | 0.377 | S | S | * | . | G | 310 helix | trans | 52.1 | -129.6 | -177.6 | 0 | 0 | 0 | 0 | 0 | 111.5 | F76 A77 | G74-F76 PolarHBondContact O-N 3.3Å; G74-F76 VanDerWaalsContact O-N 3.1Å; G74-A77 PolarHBondContact O-N 3.3Å |
| 75 | S | 81.9 | Confident | 86.5 | Confident | 118 Ų | 118 | 66.5 Ų | 66.5 | 83% | 0.825 | 38% | 0.377 | S | S | * | . | G | 310 helix | trans | -65 | -9.1 | 175.9 | -51.8 | 0 | 0 | 0 | 0 | 114.8 | Y73 | Y73-S75 PolarHBondContact O-N 3.05Š|
| 76 | F | 87.1 | Confident | 87 | Confident | 135 Ų | 135 | 66.4 Ų | 66.4 | 59% | 0.592 | 38% | 0.38 | S | S | * | . | G | 310 helix | trans | -100.8 | 22.9 | 179.6 | -60 | -77.7 | 0 | 0 | 0 | 113 | Y73 G74 F78 L79 | Y73-F76 WeakPolarHBondContact O-CA 3.17Å; Y73-F76 WeakPolarHBondContact O-CB 3.22Å; Y73-F76 PolarHBondContact O-N 3.44Å; G74-F76 PolarHBondContact O-N 3.3Å; G74-F76 VanDerWaalsContact O-N 3.1Å; F76-F78 HydrophobicContact CB-CE1 4.49Å; F76-F78 AromaticContact CD1-CE1 3.77Å; F76-F78 HydrophobicContact CD1-CE1 3.77Å; F76-F78 HydrophobicContact CD1-CZ 4.2Å; F76-F78 PolarHBondContact O-N 2.87Å; F76-F78 VanDerWaalsContact O-N 3.1Å; F76-L79 HydrophobicContact CB-CB 4.47Å; F76-L79 WeakPolarHBondContact O-CB 3.3Å; F76-L79 PolarHBondContact O-N 3.46Å |
| 77 | A | 84.9 | Confident | 87.4 | Confident | 6 Ų | 6 | 68.3 Ų | 68.3 | 5% | 0.05 | 39% | 0.39 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -56.9 | -23.3 | 175.8 | 0 | 0 | 0 | 0 | 0 | 113.6 | A67 E68 G74 L79 P80 | A67-A77 HydrophobicContact CB-CB 4.23Å; A67-A77 WeakPolarHBondContact CB-O 3.33Å; E68-A77 HydrophobicContact CB-CB 4.38Å; E68-A77 HydrophobicContact CG-CB 3.52Å; G74-A77 PolarHBondContact O-N 3.3Å; A77-L79 PolarHBondContact O-N 3.36Å; A77-P80 VanDerWaalsContact O-CD 3.26Å; A77-P80 WeakPolarHBondContact O-CD 3.43Å; A77-P80 VanDerWaalsContact O-CG 3.27Å; A77-P80 WeakPolarHBondContact O-CG 3.39Å |
| 78 | F | 89.9 | Confident | 87.5 | Confident | 125 Ų | 125 | 68.3 Ų | 68.3 | 55% | 0.548 | 39% | 0.39 | S | S | . | . | H | α-helix | trans | -66.4 | -23.1 | 172.3 | 78.9 | -90.6 | 0 | 0 | 0 | 113.6 | F76 V81 A82 | F76-F78 HydrophobicContact CB-CE1 4.49Å; F76-F78 AromaticContact CD1-CE1 3.77Å; F76-F78 HydrophobicContact CD1-CE1 3.77Å; F76-F78 HydrophobicContact CD1-CZ 4.2Å; F76-F78 PolarHBondContact O-N 2.87Å; F76-F78 VanDerWaalsContact O-N 3.1Å; F78-V81 PolarHBondContact O-N 2.96Å; F78-A82 HydrophobicContact CD2-CB 4.36Å; F78-A82 WeakPolarHBondContact O-CB 3.36Å; F78-A82 PolarHBondContact O-N 2.89Å |
| 79 | L | 92.2 | Very high | 87.7 | Confident | 86 Ų | 86 | 63.6 Ų | 63.6 | 45% | 0.45 | 37% | 0.372 | S | S | . | . | H | α-helix | trans | -63.4 | -53.6 | -173.9 | -175.1 | 68.3 | 0 | 0 | 0 | 113.3 | F76 A77 V81 A82 V83 | F76-L79 HydrophobicContact CB-CB 4.47Å; F76-L79 WeakPolarHBondContact O-CB 3.3Å; F76-L79 PolarHBondContact O-N 3.46Å; A77-L79 PolarHBondContact O-N 3.36Å; L79-V81 PolarHBondContact O-N 3.44Å; L79-A82 PolarHBondContact O-N 3.25Å; L79-V83 HydrophobicContact CD1-CG2 4.05Å; L79-V83 HydrophobicContact CG-CG2 4.35Å; L79-V83 WeakPolarHBondContact O-CB 3.41Å; L79-V83 VanDerWaalsContact O-CG2 3.24Å; L79-V83 WeakPolarHBondContact O-CG2 3.17Å; L79-V83 PolarHBondContact O-N 3.03Å |
| 80 | P | 91 | Very high | 88.1 | Confident | 0 Ų | 0 | 59.9 Ų | 59.9 | 0% | 0 | 36% | 0.356 | C | S | . | . | H | α-helix | trans | -57.7 | -39.1 | 177.4 | 22.4 | -35.8 | 0 | 0 | 0 | 112.6 | A67 Y73 A77 G84 P290 Y291 | A67-P80 HydrophobicContact CB-CG 3.65Å; Y73-P80 HydrophobicContact CD1-CG 4.35Å; Y73-P80 HydrophobicContact CD2-CG 4.01Å; Y73-P80 HydrophobicContact CE1-CG 4.3Å; Y73-P80 HydrophobicContact CE2-CB 4.44Å; Y73-P80 HydrophobicContact CE2-CG 3.95Å; Y73-P80 HydrophobicContact CG-CG 4.22Å; A77-P80 VanDerWaalsContact O-CD 3.26Å; A77-P80 WeakPolarHBondContact O-CD 3.43Å; A77-P80 VanDerWaalsContact O-CG 3.27Å; A77-P80 WeakPolarHBondContact O-CG 3.39Å; P80-G84 PolarHBondContact O-N 3.24Å; P80-P290 HydrophobicContact CB-CB 4.38Å; P80-Y291 VanDerWaalsContact CA-CE1 3.46Å; P80-Y291 HydrophobicContact CB-CD1 3.99Å; P80-Y291 HydrophobicContact CB-CD2 4.21Å; P80-Y291 HydrophobicContact CB-CE1 3.55Å; P80-Y291 HydrophobicContact CB-CE2 3.78Å; P80-Y291 HydrophobicContact CB-CG 4.3Å; P80-Y291 VanDerWaalsContact CB-CZ 3.42Å; P80-Y291 WeakPolarHBondContact O-CD1 3.17Å |
| 81 | V | 93.6 | Very high | 88.5 | Confident | 10 Ų | 10 | 61 Ų | 61 | 6% | 0.061 | 36% | 0.355 | C | S | . | . | H | α-helix | trans | -68.5 | -49.3 | 179.2 | -177.2 | 0 | 0 | 0 | 0 | 110.8 | L60 A63 I64 A67 F78 L79 V83 G84 F85 A294 | L60-V81 HydrophobicContact CD2-CG1 3.41Å; L60-V81 VanDerWaalsContact CD2-CG1 3.41Å; A63-V81 HydrophobicContact CB-CG2 4.2Å; I64-V81 HydrophobicContact CG1-CB 4.35Å; I64-V81 HydrophobicContact CG1-CG1 3.93Å; I64-V81 HydrophobicContact CG1-CG2 3.84Å; A67-V81 HydrophobicContact CB-CG2 4.28Å; F78-V81 PolarHBondContact O-N 2.96Å; L79-V81 PolarHBondContact O-N 3.44Å; V81-V83 VanDerWaalsContact C-N 3.34Å; V81-V83 PolarHBondContact O-N 3.32Å; V81-G84 PolarHBondContact O-N 2.91Å; V81-F85 WeakPolarHBondContact O-CB 3.35Å; V81-F85 PolarHBondContact O-N 2.92Å; V81-A294 HydrophobicContact CB-CB 4.32Å; V81-A294 HydrophobicContact CG1-CB 3.9Å; V81-A294 VanDerWaalsContact O-CB 3.27Å; V81-A294 WeakPolarHBondContact O-CB 3.36Å |
| 82 | A | 95.2 | Very high | 88.8 | Confident | 42 Ų | 42 | 58.2 Ų | 58.2 | 35% | 0.347 | 33% | 0.325 | S | S | . | . | H | α-helix | trans | -62.6 | -40.9 | 178.9 | 0 | 0 | 0 | 0 | 0 | 112.1 | F78 L79 T86 | F78-A82 HydrophobicContact CD2-CB 4.36Å; F78-A82 WeakPolarHBondContact O-CB 3.36Å; F78-A82 PolarHBondContact O-N 2.89Å; L79-A82 PolarHBondContact O-N 3.25Å; A82-T86 VanDerWaalsContact O-CB 3.31Å; A82-T86 WeakPolarHBondContact O-CB 2.84Å; A82-T86 PolarHBondContact O-N 3.45Å; A82-T86 PolarHBondContact O-OG1 3.15Å |
| 83 | V | 95.4 | Very high | 89.1 | Confident | 59 Ų | 59 | 56.5 Ų | 56.5 | 36% | 0.358 | 32% | 0.315 | S | S | . | . | H | α-helix | trans | -65.1 | -51 | 176 | 170.7 | 0 | 0 | 0 | 0 | 110.4 | L79 V81 F85 T86 L87 | L79-V83 HydrophobicContact CD1-CG2 4.05Å; L79-V83 HydrophobicContact CG-CG2 4.35Å; L79-V83 WeakPolarHBondContact O-CB 3.41Å; L79-V83 VanDerWaalsContact O-CG2 3.24Å; L79-V83 WeakPolarHBondContact O-CG2 3.17Å; L79-V83 PolarHBondContact O-N 3.03Å; V81-V83 VanDerWaalsContact C-N 3.34Å; V81-V83 PolarHBondContact O-N 3.32Å; V83-F85 PolarHBondContact O-N 3.2Å; V83-T86 PolarHBondContact O-N 2.96Å; V83-L87 HydrophobicContact CG1-CD1 3.7Å; V83-L87 HydrophobicContact CG1-CG 4.28Å; V83-L87 VanDerWaalsContact O-CB 3.32Å; V83-L87 WeakPolarHBondContact O-CB 3.47Å; V83-L87 VanDerWaalsContact O-CG 3.22Å; V83-L87 WeakPolarHBondContact O-CG 3.4Å; V83-L87 PolarHBondContact O-N 3.31Å |
| 84 | G | 93.9 | Very high | 89.4 | Confident | 3 Ų | 3 | 59.6 Ų | 59.6 | 3% | 0.031 | 33% | 0.33 | C | S | . | . | H | α-helix | trans | -56.1 | -53.2 | 177.4 | 0 | 0 | 0 | 0 | 0 | 111.4 | P80 V81 T86 L87 G88 Y291 F295 | P80-G84 PolarHBondContact O-N 3.24Å; V81-G84 PolarHBondContact O-N 2.91Å; G84-T86 PolarHBondContact O-N 3.2Å; G84-L87 PolarHBondContact O-N 3.4Å; G84-G88 PolarHBondContact O-N 3.36Å; G84-Y291 WeakPolarHBondContact CA-O 3.24Å; G84-F295 WeakPolarHBondContact O-CA 3.25Å |
| 85 | F | 95.8 | Very high | 89.2 | Confident | 61 Ų | 61 | 58.2 Ų | 58.2 | 27% | 0.268 | 31% | 0.313 | S | S | . | . | H | α-helix | trans | -55.7 | -49.1 | 179 | -172.5 | -88.3 | 0 | 0 | 0 | 112.8 | L60 V81 V83 L87 G88 A89 A294 A297 G298 V301 | L60-F85 HydrophobicContact CD1-CD2 4.08Å; L60-F85 HydrophobicContact CD1-CE2 3.93Å; L60-F85 HydrophobicContact CD2-CD2 3.88Å; L60-F85 HydrophobicContact CG-CD2 4.31Å; V81-F85 WeakPolarHBondContact O-CB 3.35Å; V81-F85 PolarHBondContact O-N 2.92Å; V83-F85 PolarHBondContact O-N 3.2Å; F85-L87 PolarHBondContact O-N 3.16Å; F85-G88 PolarHBondContact O-N 2.79Å; F85-A89 PolarHBondContact O-N 3.14Å; F85-A294 WeakPolarHBondContact CA-O 3.42Å; F85-A294 HydrophobicContact CB-CB 4.4Å; F85-A294 PolarHBondContact N-O 3.48Å; F85-A297 HydrophobicContact CD2-CB 4.13Å; F85-A297 HydrophobicContact CE2-CB 4.34Å; F85-G298 VanDerWaalsContact CE2-CA 3.46Å; F85-G298 WeakPolarHBondContact O-CA 3.26Å; F85-V301 HydrophobicContact CE2-CB 4.35Å; F85-V301 HydrophobicContact CE2-CG2 4.06Å; F85-V301 HydrophobicContact CZ-CB 4.09Å; F85-V301 HydrophobicContact CZ-CG1 4.2Å; F85-V301 HydrophobicContact CZ-CG2 4.15Å |
| 86 | T | 96.2 | Very high | 88.7 | Confident | 90 Ų | 90 | 54.9 Ų | 54.9 | 55% | 0.552 | 29% | 0.286 | S | S | * | . | H | α-helix | trans | -66.5 | -39.6 | -179.9 | -51.1 | 0 | 0 | 0 | 0 | 111.4 | A82 V83 G84 G88 A90 | A82-T86 VanDerWaalsContact O-CB 3.31Å; A82-T86 WeakPolarHBondContact O-CB 2.84Å; A82-T86 PolarHBondContact O-N 3.45Å; A82-T86 PolarHBondContact O-OG1 3.15Å; V83-T86 PolarHBondContact O-N 2.96Å; G84-T86 PolarHBondContact O-N 3.2Å; T86-G88 VanDerWaalsContact C-N 3.33Å; T86-A90 WeakPolarHBondContact O-CB 3.28Å; T86-A90 PolarHBondContact O-N 3.03Å |
| 87 | L | 93.6 | Very high | 88.1 | Confident | 103 Ų | 103 | 52 Ų | 52 | 54% | 0.539 | 28% | 0.276 | S | S | . | . | H | α-helix | trans | -66 | -35.5 | 176.1 | -72.8 | 176.4 | 0 | 0 | 0 | 112.2 | V83 G84 F85 F91 F295 | V83-L87 HydrophobicContact CG1-CD1 3.7Å; V83-L87 HydrophobicContact CG1-CG 4.28Å; V83-L87 VanDerWaalsContact O-CB 3.32Å; V83-L87 WeakPolarHBondContact O-CB 3.47Å; V83-L87 VanDerWaalsContact O-CG 3.22Å; V83-L87 WeakPolarHBondContact O-CG 3.4Å; V83-L87 PolarHBondContact O-N 3.31Å; G84-L87 PolarHBondContact O-N 3.4Å; F85-L87 PolarHBondContact O-N 3.16Å; L87-F91 WeakPolarHBondContact O-CB 3.44Å; L87-F91 PolarHBondContact O-N 2.93Å; L87-F295 HydrophobicContact CB-CD2 4.16Å |
| 88 | G | 89.9 | Confident | 87.4 | Confident | 0 Ų | 0 | 55.4 Ų | 55.4 | 0% | 0 | 30% | 0.296 | C | S | . | . | H | α-helix | trans | -63.3 | -51.8 | 174.2 | 0 | 0 | 0 | 0 | 0 | 112.3 | G84 F85 T86 A90 F91 V92 F295 | G84-G88 PolarHBondContact O-N 3.36Å; F85-G88 PolarHBondContact O-N 2.79Å; T86-G88 VanDerWaalsContact C-N 3.33Å; G88-A90 PolarHBondContact O-N 3.47Å; G88-F91 WeakPolarHBondContact O-CB 3.41Å; G88-F91 PolarHBondContact O-N 3.36Å; G88-V92 PolarHBondContact O-N 3.15Å; G88-F295 WeakPolarHBondContact CA-O 3.47Å; G88-F295 VanDerWaalsContact N-CD2 3.31Å |
| 89 | A | 90.8 | Very high | 86.1 | Confident | 23 Ų | 23 | 50.5 Ų | 50.5 | 19% | 0.19 | 28% | 0.276 | C | S | . | . | H | α-helix | trans | -61.7 | -44.9 | 176.4 | 0 | 0 | 0 | 0 | 0 | 111.6 | F85 F91 V92 Y93 Y302 | F85-A89 PolarHBondContact O-N 3.14Å; A89-F91 VanDerWaalsContact C-N 3.31Å; A89-F91 PolarHBondContact O-N 3.03Å; A89-V92 PolarHBondContact O-N 3.31Å; A89-Y93 WeakPolarHBondContact O-CB 3.26Å; A89-Y93 PolarHBondContact O-N 2.86Å; A89-Y302 HydrophobicContact CB-CD2 4.41Å |
| 90 | A | 91 | Very high | 84.8 | Confident | 27 Ų | 27 | 49 Ų | 49 | 22% | 0.223 | 27% | 0.271 | C | S | . | . | H | α-helix | trans | -63.1 | -37.5 | 176.8 | 0 | 0 | 0 | 0 | 0 | 111.8 | T86 G88 V92 Y93 F94 | T86-A90 WeakPolarHBondContact O-CB 3.28Å; T86-A90 PolarHBondContact O-N 3.03Å; G88-A90 PolarHBondContact O-N 3.47Å; A90-V92 PolarHBondContact O-N 3.41Å; A90-Y93 PolarHBondContact O-N 3.4Å; A90-F94 HydrophobicContact CB-CD2 4.08Å; A90-F94 HydrophobicContact CB-CE2 3.89Å; A90-F94 VanDerWaalsContact O-CB 3.31Å; A90-F94 WeakPolarHBondContact O-CB 3.5Å; A90-F94 WeakPolarHBondContact O-CD2 2.97Å; A90-F94 WeakPolarHBondContact O-CG 2.95Å; A90-F94 PolarHBondContact O-N 3.42Å |
| 91 | F | 87.1 | Confident | 83.4 | Confident | 72 Ų | 72 | 57.1 Ų | 57.1 | 32% | 0.316 | 31% | 0.311 | S | S | . | . | H | α-helix | trans | -59.6 | -46.6 | 177.7 | 170 | -95.6 | 0 | 0 | 0 | 111.6 | L87 G88 A89 F94 A95 I201 F295 | L87-F91 WeakPolarHBondContact O-CB 3.44Å; L87-F91 PolarHBondContact O-N 2.93Å; G88-F91 WeakPolarHBondContact O-CB 3.41Å; G88-F91 PolarHBondContact O-N 3.36Å; A89-F91 VanDerWaalsContact C-N 3.31Å; A89-F91 PolarHBondContact O-N 3.03Å; F91-F94 PolarHBondContact O-N 3.45Å; F91-A95 WeakPolarHBondContact O-CB 3.44Å; F91-A95 PolarHBondContact O-N 3.41Å; F91-I201 HydrophobicContact CE1-CB 4.24Å; F91-I201 HydrophobicContact CE1-CD1 4.16Å; F91-I201 HydrophobicContact CE1-CG2 3.69Å; F91-I201 HydrophobicContact CZ-CB 4.4Å; F91-I201 HydrophobicContact CZ-CD1 3.6Å; F91-I201 HydrophobicContact CZ-CG2 3.79Å; F91-F295 HydrophobicContact CB-CE2 3.73Å; F91-F295 HydrophobicContact CB-CZ 3.75Å; F91-F295 AromaticContact CD1-CZ 3.77Å; F91-F295 HydrophobicContact CD1-CZ 3.77Å; F91-F295 HydrophobicContact CD2-CZ 4.32Å; F91-F295 HydrophobicContact CG-CE2 4.11Å; F91-F295 AromaticContact CG-CZ 3.66Å; F91-F295 HydrophobicContact CG-CZ 3.66Å |
| 92 | V | 80.4 | Confident | 82.1 | Confident | 5 Ų | 5 | 62.4 Ų | 62.4 | 3% | 0.03 | 34% | 0.339 | C | S | . | . | H | α-helix | trans | -66.3 | -47 | 177.1 | -174.7 | 0 | 0 | 0 | 0 | 110.4 | G88 A89 A90 F94 A95 D96 A299 Y302 V303 | G88-V92 PolarHBondContact O-N 3.15Å; A89-V92 PolarHBondContact O-N 3.31Å; A90-V92 PolarHBondContact O-N 3.41Å; V92-F94 VanDerWaalsContact C-N 3.31Å; V92-F94 PolarHBondContact O-N 2.83Å; V92-A95 WeakPolarHBondContact O-CA 3.33Å; V92-A95 VanDerWaalsContact O-CB 3.28Å; V92-A95 WeakPolarHBondContact O-CB 3.24Å; V92-A95 PolarHBondContact O-N 3.05Å; V92-D96 PolarHBondContact O-N 3.37Å; V92-A299 HydrophobicContact CG2-CB 3.6Å; V92-Y302 HydrophobicContact CB-CD1 3.61Å; V92-Y302 HydrophobicContact CB-CE1 4.11Å; V92-Y302 HydrophobicContact CB-CG 4.18Å; V92-Y302 HydrophobicContact CG1-CD1 3.36Å; V92-Y302 HydrophobicContact CG1-CE1 3.64Å; V92-Y302 HydrophobicContact CG1-CG 4.37Å; V92-V303 HydrophobicContact CG1-CG2 3.84Å; V92-V303 HydrophobicContact CG2-CG2 4.3Å |
| 93 | Y | 84.4 | Confident | 80.1 | Confident | 109 Ų | 109 | 63.2 Ų | 63.2 | 43% | 0.427 | 35% | 0.35 | S | S | . | . | H | α-helix | trans | -54.6 | -44.5 | 174.4 | 175.9 | -107.3 | 0 | 0 | 0 | 113 | A89 A90 D96 L97 Y302 | A89-Y93 WeakPolarHBondContact O-CB 3.26Å; A89-Y93 PolarHBondContact O-N 2.86Å; A90-Y93 PolarHBondContact O-N 3.4Å; Y93-D96 WeakPolarHBondContact O-CB 3.5Å; Y93-D96 PolarHBondContact O-N 3.42Å; Y93-L97 HydrophobicContact CD1-CD1 3.93Å; Y93-L97 HydrophobicContact CD1-CG 4.4Å; Y93-L97 HydrophobicContact CE1-CD1 3.29Å; Y93-L97 HydrophobicContact CE1-CG 3.98Å; Y93-L97 HydrophobicContact CE2-CD1 4.39Å; Y93-L97 HydrophobicContact CE2-CD2 4.37Å; Y93-L97 HydrophobicContact CE2-CG 4.26Å; Y93-L97 WeakPolarHBondContact O-CG 3.42Å; Y93-L97 PolarHBondContact O-N 3.03Å; Y93-Y302 HydrophobicContact CD2-CE2 4.13Å; Y93-Y302 WeakPolarHBondContact CD2-OH 3.44Å; Y93-Y302 HydrophobicContact CG-CE2 4.36Å |
| 94 | F | 83.3 | Confident | 78.2 | Confident | 119 Ų | 119 | 62 Ų | 62 | 52% | 0.522 | 34% | 0.342 | S | S | . | . | H | α-helix | trans | -68.3 | -36.8 | 177.6 | -77.3 | -57.6 | 0 | 0 | 0 | 111.9 | A90 F91 V92 D96 L97 V98 | A90-F94 HydrophobicContact CB-CD2 4.08Å; A90-F94 HydrophobicContact CB-CE2 3.89Å; A90-F94 VanDerWaalsContact O-CB 3.31Å; A90-F94 WeakPolarHBondContact O-CB 3.5Å; A90-F94 WeakPolarHBondContact O-CD2 2.97Å; A90-F94 WeakPolarHBondContact O-CG 2.95Å; A90-F94 PolarHBondContact O-N 3.42Å; F91-F94 PolarHBondContact O-N 3.45Å; V92-F94 VanDerWaalsContact C-N 3.31Å; V92-F94 PolarHBondContact O-N 2.83Å; F94-D96 VanDerWaalsContact C-N 3.31Å; F94-L97 HydrophobicContact CD1-CD1 4.22Å; F94-L97 PolarHBondContact O-N 3.43Å; F94-V98 WeakPolarHBondContact O-CB 3.11Å; F94-V98 VanDerWaalsContact O-CG2 3.24Å; F94-V98 WeakPolarHBondContact O-CG2 3.41Å; F94-V98 PolarHBondContact O-N 3.43Å |
| 95 | A | 75 | Confident | 76.1 | Confident | 29 Ų | 29 | 64.2 Ų | 64.2 | 24% | 0.24 | 36% | 0.356 | C | S | . | . | H | α-helix | trans | -55.3 | -54.2 | 169.2 | 0 | 0 | 0 | 0 | 0 | 108.1 | F91 V92 L97 V98 L99 | F91-A95 WeakPolarHBondContact O-CB 3.44Å; F91-A95 PolarHBondContact O-N 3.41Å; V92-A95 WeakPolarHBondContact O-CA 3.33Å; V92-A95 VanDerWaalsContact O-CB 3.28Å; V92-A95 WeakPolarHBondContact O-CB 3.24Å; V92-A95 PolarHBondContact O-N 3.05Å; A95-L97 PolarHBondContact O-N 3.29Å; A95-L97 VanDerWaalsContact O-N 3.07Å; A95-V98 PolarHBondContact O-N 3.38Å; A95-V98 VanDerWaalsContact O-N 3.12Å; A95-L99 HydrophobicContact CB-CD1 4.08Å; A95-L99 WeakPolarHBondContact O-CB 3.19Å; A95-L99 WeakPolarHBondContact O-CD1 3.48Å; A95-L99 WeakPolarHBondContact O-CG 3.36Å; A95-L99 PolarHBondContact O-N 3.31Å; A95-L99 VanDerWaalsContact O-N 3.07Å |
| 96 | D | 73 | Confident | 73.6 | Confident | 48 Ų | 48 | 67.9 Ų | 67.9 | 26% | 0.257 | 38% | 0.377 | S | S | . | . | H | α-helix | trans | -58.6 | -27 | -179.7 | -61.9 | -27.7 | 0 | 0 | 0 | 114.2 | V92 Y93 F94 P100 Y302 | V92-D96 PolarHBondContact O-N 3.37Å; Y93-D96 WeakPolarHBondContact O-CB 3.5Å; Y93-D96 PolarHBondContact O-N 3.42Å; F94-D96 VanDerWaalsContact C-N 3.31Å; D96-P100 WeakPolarHBondContact O-CD 3.19Å; D96-P100 VanDerWaalsContact O-CG 3.26Å; D96-P100 WeakPolarHBondContact O-CG 3.45Å; D96-Y302 WeakPolarHBondContact OD2-CE1 3.33Å; D96-Y302 PolarHBondContact OD2-OH 2.9Å |
| 97 | L | 73.8 | Confident | 71.2 | Confident | 75 Ų | 75 | 70.3 Ų | 70.3 | 39% | 0.393 | 39% | 0.387 | S | S | . | . | H | α-helix | trans | -81.3 | -44.6 | 174 | -72.3 | -177.3 | 0 | 0 | 0 | 114.1 | Y93 F94 A95 L99 P100 M101 | Y93-L97 HydrophobicContact CD1-CD1 3.93Å; Y93-L97 HydrophobicContact CD1-CG 4.4Å; Y93-L97 HydrophobicContact CE1-CD1 3.29Å; Y93-L97 HydrophobicContact CE1-CG 3.98Å; Y93-L97 HydrophobicContact CE2-CD1 4.39Å; Y93-L97 HydrophobicContact CE2-CD2 4.37Å; Y93-L97 HydrophobicContact CE2-CG 4.26Å; Y93-L97 WeakPolarHBondContact O-CG 3.42Å; Y93-L97 PolarHBondContact O-N 3.03Å; F94-L97 HydrophobicContact CD1-CD1 4.22Å; F94-L97 PolarHBondContact O-N 3.43Å; A95-L97 PolarHBondContact O-N 3.29Å; A95-L97 VanDerWaalsContact O-N 3.07Å; L97-L99 PolarHBondContact O-N 2.79Å; L97-P100 WeakPolarHBondContact O-CD 3.32Å; L97-M101 WeakPolarHBondContact O-CG 3.02Å |
| 98 | V | 69.6 | Low | 69 | Low | 78 Ų | 78 | 70.1 Ų | 70.1 | 47% | 0.473 | 39% | 0.391 | S | S | . | . | H | α-helix | trans | -67 | -30.4 | -176.4 | 168.8 | 0 | 0 | 0 | 0 | 110.4 | F94 A95 M101 L102 | F94-V98 WeakPolarHBondContact O-CB 3.11Å; F94-V98 VanDerWaalsContact O-CG2 3.24Å; F94-V98 WeakPolarHBondContact O-CG2 3.41Å; F94-V98 PolarHBondContact O-N 3.43Å; A95-V98 PolarHBondContact O-N 3.38Å; A95-V98 VanDerWaalsContact O-N 3.12Å; V98-M101 WeakPolarHBondContact O-CB 3.47Å; V98-M101 PolarHBondContact O-N 2.93Å; V98-L102 HydrophobicContact CG1-CD1 3.91Å; V98-L102 HydrophobicContact CG1-CG 4.24Å; V98-L102 WeakPolarHBondContact O-CG 3.17Å; V98-L102 PolarHBondContact O-N 2.69Å |
| 99 | L | 63.4 | Low | 66.7 | Low | 21 Ų | 21 | 78.6 Ų | 78.6 | 11% | 0.11 | 43% | 0.431 | C | S | . | . | H | α-helix | trans | -66.4 | -56.6 | -174.7 | -66.6 | 159.3 | 0 | 0 | 0 | 111.6 | A95 L97 M101 L102 I104 L194 | A95-L99 HydrophobicContact CB-CD1 4.08Å; A95-L99 WeakPolarHBondContact O-CB 3.19Å; A95-L99 WeakPolarHBondContact O-CD1 3.48Å; A95-L99 WeakPolarHBondContact O-CG 3.36Å; A95-L99 PolarHBondContact O-N 3.31Å; A95-L99 VanDerWaalsContact O-N 3.07Å; L97-L99 PolarHBondContact O-N 2.79Å; L99-M101 PolarHBondContact O-N 3.14Å; L99-L102 PolarHBondContact O-N 3.26Å; L99-L102 VanDerWaalsContact O-N 3.1Å; L99-I104 HydrophobicContact CD2-CD1 4.29Å; L99-I104 WeakPolarHBondContact O-CB 3.5Å; L99-I104 WeakPolarHBondContact O-CG1 3.49Å; L99-I104 PolarHBondContact O-N 3.45Å; L99-L194 HydrophobicContact CB-CD1 3.76Å; L99-L194 HydrophobicContact CD1-CB 3.94Å; L99-L194 HydrophobicContact CD1-CD1 3.45Å; L99-L194 VanDerWaalsContact CD1-CD1 3.45Å; L99-L194 HydrophobicContact CD1-CD2 3.35Å; L99-L194 HydrophobicContact CD1-CG 3.6Å; L99-L194 HydrophobicContact CD2-CD1 4.05Å; L99-L194 HydrophobicContact CD2-CD2 3.16Å; L99-L194 HydrophobicContact CD2-CG 4.1Å; L99-L194 HydrophobicContact CG-CD1 3.87Å; L99-L194 HydrophobicContact CG-CD2 3.72Å; L99-L194 HydrophobicContact CG-CG 4.23Å |
| 100 | P | 64.4 | Low | 64.4 | Low | 56 Ų | 56 | 81.5 Ų | 81.5 | 36% | 0.364 | 46% | 0.455 | S | S | . | . | H | α-helix | trans | -51.7 | -40.9 | 170.8 | -22.6 | 28.2 | 0 | 0 | 0 | 113.4 | D96 L97 L102 G103 C105 | D96-P100 WeakPolarHBondContact O-CD 3.19Å; D96-P100 VanDerWaalsContact O-CG 3.26Å; D96-P100 WeakPolarHBondContact O-CG 3.45Å; L97-P100 WeakPolarHBondContact O-CD 3.32Å; P100-L102 VanDerWaalsContact C-N 3.3Å; P100-L102 PolarHBondContact O-N 3.33Å; P100-G103 WeakPolarHBondContact O-CA 3.48Å; P100-G103 PolarHBondContact O-N 2.97Å; P100-C105 HydrophobicContact CB-CB 4.11Å; P100-C105 HydrophobicContact CG-CB 3.96Å |
| 101 | M | 62.2 | Low | 61.9 | Low | 170 Ų | 170 | 83.1 Ų | 83.1 | 84% | 0.837 | 47% | 0.468 | S | S | * | . | H | α-helix | trans | -64.1 | -29.3 | -179.3 | -77.4 | -83.8 | -76.6 | 0 | 0 | 113.9 | L97 V98 L99 G103 | L97-M101 WeakPolarHBondContact O-CG 3.02Å; V98-M101 WeakPolarHBondContact O-CB 3.47Å; V98-M101 PolarHBondContact O-N 2.93Å; L99-M101 PolarHBondContact O-N 3.14Å; M101-G103 PolarHBondContact O-N 3.39Å |
| 102 | L | 65.6 | Low | 59.8 | Low | 121 Ų | 121 | 86.5 Ų | 86.5 | 63% | 0.634 | 49% | 0.489 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -76.9 | 7.3 | 172 | -70.7 | 172.1 | 0 | 0 | 0 | 113 | V98 L99 P100 I104 | V98-L102 HydrophobicContact CG1-CD1 3.91Å; V98-L102 HydrophobicContact CG1-CG 4.24Å; V98-L102 WeakPolarHBondContact O-CG 3.17Å; V98-L102 PolarHBondContact O-N 2.69Å; L99-L102 PolarHBondContact O-N 3.26Å; L99-L102 VanDerWaalsContact O-N 3.1Å; P100-L102 VanDerWaalsContact C-N 3.3Å; P100-L102 PolarHBondContact O-N 3.33Å; L102-I104 HydrophobicContact CB-CD1 3.61Å; L102-I104 HydrophobicContact CB-CG1 3.74Å; L102-I104 HydrophobicContact CD1-CD1 4.12Å |
| 103 | G | 53.2 | Low | 57.8 | Low | 58 Ų | 58 | 90.1 Ų | 90.1 | 60% | 0.598 | 52% | 0.52 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 75.7 | 31.3 | -174 | 0 | 0 | 0 | 0 | 0 | 112.4 | P100 M101 R190 | P100-G103 WeakPolarHBondContact O-CA 3.48Å; P100-G103 PolarHBondContact O-N 2.97Å; M101-G103 PolarHBondContact O-N 3.39Å; G103-R190 PolarHBondContact O-NH1 3.19Å |
| 104 | I | 56.1 | Low | 55.5 | Low | 35 Ų | 35 | 91.7 Ų | 91.7 | 18% | 0.179 | 54% | 0.535 | C | S | . | . | trans | -104.3 | -6.7 | -172.4 | -50.7 | -178.3 | 0 | 0 | 0 | 113.3 | L99 L102 R190 L194 | L99-I104 HydrophobicContact CD2-CD1 4.29Å; L99-I104 WeakPolarHBondContact O-CB 3.5Å; L99-I104 WeakPolarHBondContact O-CG1 3.49Å; L99-I104 PolarHBondContact O-N 3.45Å; L102-I104 HydrophobicContact CB-CD1 3.61Å; L102-I104 HydrophobicContact CB-CG1 3.74Å; L102-I104 HydrophobicContact CD1-CD1 4.12Å; I104-R190 HydrophobicContact CG2-CB 3.61Å; I104-R190 HydrophobicContact CG2-CG 3.63Å; I104-R190 WeakPolarHBondContact O-CD 3.37Å; I104-L194 HydrophobicContact CG2-CD1 4.3Å | ||
| 105 | C | 48.6 | Very low | 53.4 | Low | 48 Ų | 48 | 91.6 Ų | 91.6 | 32% | 0.324 | 55% | 0.546 | S | S | . | . | trans | -150.8 | 146.3 | 178.1 | -60.9 | 0 | 0 | 0 | 0 | 116.1 | P100 | P100-C105 HydrophobicContact CB-CB 4.11Å; P100-C105 HydrophobicContact CG-CB 3.96Å | ||
| 106 | I | 44.2 | Very low | 51.5 | Low | 138 Ų | 138 | 101.4 Ų | 101.4 | 71% | 0.708 | 58% | 0.577 | S | S | * | * | trans | -133.1 | 134.7 | 149.4 | -60.7 | 178.6 | 0 | 0 | 0 | 109.4 | ||||
| 107 | D | 45.8 | Very low | 49.9 | Very low | 141 Ų | 141 | 106.6 Ų | 106.6 | 75% | 0.754 | 61% | 0.605 | S | S | * | * | trans | 25.3 | 128.4 | 171 | -107.9 | -49.4 | 0 | 0 | 0 | 123.7 | ||||
| 108 | P | 47.6 | Very low | 47.8 | Very low | 99 Ų | 99 | 107.9 Ų | 107.9 | 64% | 0.643 | 62% | 0.62 | S | S | * | * | S | Bend | trans | -89.2 | -4.5 | -164.6 | -9 | 29.8 | 0 | 0 | 0 | 118.2 | ||
| 109 | Q | 40.6 | Very low | 46.1 | Very low | 179 Ų | 179 | 114.2 Ų | 114.2 | 84% | 0.836 | 64% | 0.641 | S | S | * | * | S | Bend | trans | -118.2 | 0.1 | -163.7 | -76.1 | 174 | -15.8 | 0 | 0 | 116.9 | ||
| 110 | A | 42.2 | Very low | 44.5 | Very low | 83 Ų | 83 | 119.8 Ų | 119.8 | 69% | 0.686 | 68% | 0.676 | S | S | * | * | S | Bend | trans | -107.2 | -16.5 | -173.5 | 0 | 0 | 0 | 0 | 0 | 115.8 | L112 | A110-L112 PolarHBondContact O-N 2.9Š|
| 111 | A | 40.4 | Very low | 42.7 | Very low | 61 Ų | 61 | 120.4 Ų | 120.4 | 50% | 0.504 | 69% | 0.692 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -80.7 | -10.8 | -166.8 | 0 | 0 | 0 | 0 | 0 | 115.7 | ||
| 112 | L | 42.8 | Very low | 41.3 | Very low | 143 Ų | 143 | 121.8 Ų | 121.8 | 75% | 0.749 | 69% | 0.694 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -124.7 | 6.3 | -173 | -87 | 161.3 | 0 | 0 | 0 | 115.4 | A110 | A110-L112 PolarHBondContact O-N 2.9Š|
| 113 | A | 37.3 | Very low | 39.5 | Very low | 82 Ų | 82 | 125.4 Ų | 125.4 | 68% | 0.678 | 71% | 0.707 | S | S | * | * | trans | -91.1 | 12.9 | 178.5 | 0 | 0 | 0 | 0 | 0 | 114.6 | ||||
| 114 | L | 37 | Very low | 38.4 | Very low | 142 Ų | 142 | 132.4 Ų | 132.4 | 74% | 0.743 | 72% | 0.721 | S | S | * | * | trans | -87.7 | 124 | 177.6 | -66.9 | -179.9 | 0 | 0 | 0 | 111.8 | R116 | L114-R116 PolarHBondContact O-N 2.95Š| ||
| 115 | P | 37.9 | Very low | 37 | Very low | 117 Ų | 117 | 138.3 Ų | 138.3 | 76% | 0.76 | 75% | 0.753 | S | S | * | * | trans | -73.9 | 107 | 169 | 28.7 | -27.9 | 0 | 0 | 0 | 108.7 | D117 | P115-D117 VanDerWaalsContact C-N 3.34Å; P115-D117 PolarHBondContact O-N 3.35Å; P115-D117 VanDerWaalsContact O-N 3.12Å | ||
| 116 | R | 35.2 | Very low | 36.2 | Very low | 234 Ų | 234 | 145.5 Ų | 145.5 | 88% | 0.883 | 78% | 0.782 | S | S | * | * | trans | -81.7 | 82.6 | 169.9 | -116.4 | -172.5 | -177.9 | 178.3 | 2.5 | 109.3 | L114 | L114-R116 PolarHBondContact O-N 2.95Š| ||
| 117 | D | 40.1 | Very low | 35.4 | Very low | 157 Ų | 157 | 146.7 Ų | 146.7 | 84% | 0.84 | 79% | 0.79 | S | S | * | * | trans | -96.2 | 102.9 | 159.2 | -99.1 | -27 | 0 | 0 | 0 | 109.1 | P115 | P115-D117 VanDerWaalsContact C-N 3.34Å; P115-D117 PolarHBondContact O-N 3.35Å; P115-D117 VanDerWaalsContact O-N 3.12Å | ||
| 118 | S | 30.3 | Very low | 34.9 | Very low | 103 Ų | 103 | 145.1 Ų | 145.1 | 72% | 0.72 | 79% | 0.787 | S | S | * | * | trans | -169.1 | 113.7 | 149.1 | 43.6 | 0 | 0 | 0 | 0 | 109.6 | V120 | S118-V120 PolarHBondContact O-N 2.94Š| ||
| 119 | K | 33.2 | Very low | 34 | Very low | 211 Ų | 211 | 148.5 Ų | 148.5 | 92% | 0.917 | 80% | 0.799 | S | S | * | * | trans | -44.6 | 125.5 | 170.8 | -69.8 | 172.1 | 175.4 | 176.1 | 0 | 110.8 | G121 | K119-G121 PolarHBondContact O-N 2.86Å; K119-G121 VanDerWaalsContact O-N 3.11Å | ||
| 120 | V | 29.2 | Very low | 33.3 | Very low | 137 Ų | 137 | 149 Ų | 149 | 83% | 0.83 | 80% | 0.799 | S | S | * | * | trans | -72.9 | 98.8 | 163.5 | 175.9 | 0 | 0 | 0 | 0 | 107.6 | S118 | S118-V120 PolarHBondContact O-N 2.94Š| ||
| 121 | G | 27.9 | Very low | 32.7 | Very low | 69 Ų | 69 | 154.5 Ų | 154.5 | 71% | 0.711 | 81% | 0.81 | S | S | * | * | trans | -70.6 | 121.3 | 157 | 0 | 0 | 0 | 0 | 0 | 108.1 | K119 E123 | K119-G121 PolarHBondContact O-N 2.86Å; K119-G121 VanDerWaalsContact O-N 3.11Å; G121-E123 PolarHBondContact O-N 3.16Å | ||
| 122 | K | 32.1 | Very low | 32 | Very low | 200 Ų | 200 | 158.9 Ų | 158.9 | 87% | 0.87 | 82% | 0.824 | S | S | * | * | trans | -65.4 | 122.4 | 168.1 | -78.8 | 175.7 | 170.6 | 175.9 | 0 | 108.7 | ||||
| 123 | E | 27.7 | Very low | 31.4 | Very low | 196 Ų | 196 | 157.8 Ų | 157.8 | 92% | 0.916 | 83% | 0.826 | S | S | * | * | trans | -132.1 | 141.1 | 151 | -76.6 | -168.9 | 147.2 | 0 | 0 | 110.2 | G121 | G121-E123 PolarHBondContact O-N 3.16Š| ||
| 124 | K | 29.6 | Very low | 31.1 | Very low | 206 Ų | 206 | 161.7 Ų | 161.7 | 90% | 0.896 | 84% | 0.835 | S | S | * | * | trans | -85.9 | 145.7 | -169.1 | -73.4 | 170 | 165.4 | -178.3 | 0 | 110.2 | ||||
| 125 | D | 28.4 | Very low | 31.2 | Very low | 159 Ų | 159 | 159.6 Ų | 159.6 | 85% | 0.85 | 83% | 0.83 | S | S | * | * | trans | -51.1 | 134.6 | 152.2 | -84.9 | -42 | 0 | 0 | 0 | 110.1 | ||||
| 126 | E | 29.9 | Very low | 30.9 | Very low | 198 Ų | 198 | 161.1 Ų | 161.1 | 93% | 0.925 | 83% | 0.832 | S | S | * | * | -166.9 | 128.2 | 125.9 | -69.8 | -148.2 | 139.3 | 0 | 0 | 111.1 | |||||
| 127 | D | 29 | Very low | 30.7 | Very low | 164 Ų | 164 | 159 Ų | 159 | 88% | 0.877 | 83% | 0.832 | S | S | * | * | trans | 9.8 | 154.9 | 165.9 | -85.2 | -32.5 | 0 | 0 | 0 | 126.5 | ||||
| 128 | P | 34.9 | Very low | 30.2 | Very low | 107 Ų | 107 | 159.7 Ų | 159.7 | 70% | 0.695 | 83% | 0.833 | S | S | * | * | trans | -95.9 | 125.6 | -178.8 | 36.5 | -27 | 0 | 0 | 0 | 112.6 | ||||
| 129 | L | 28.3 | Very low | 30.2 | Very low | 171 Ų | 171 | 160.9 Ų | 160.9 | 90% | 0.895 | 84% | 0.835 | S | S | * | * | trans | -148.2 | 110.9 | 163.2 | -142.7 | 79.6 | 0 | 0 | 0 | 112.6 | ||||
| 130 | F | 27 | Very low | 30.1 | Very low | 188 Ų | 188 | 157.6 Ų | 157.6 | 83% | 0.825 | 83% | 0.826 | S | S | * | * | trans | 20.8 | 113.2 | 146.3 | -131.7 | -92.3 | 0 | 0 | 0 | 118.8 | ||||
| 131 | Q | 28 | Very low | 30.3 | Very low | 200 Ų | 200 | 162.8 Ų | 162.8 | 94% | 0.935 | 83% | 0.831 | S | S | * | * | trans | -158.4 | 139.3 | 149.9 | -109.2 | 159.7 | 37 | 0 | 0 | 112.5 | ||||
| 132 | L | 27 | Very low | 30.5 | Very low | 152 Ų | 152 | 167 Ų | 167 | 80% | 0.796 | 84% | 0.836 | S | S | * | * | trans | -69.3 | 159 | -172.2 | -69.2 | 145.4 | 0 | 0 | 0 | 113 | ||||
| 133 | P | 30.4 | Very low | 30.3 | Very low | 121 Ų | 121 | 160.9 Ų | 160.9 | 79% | 0.786 | 83% | 0.83 | S | S | * | * | trans | -86.6 | 133.8 | 175.6 | 33.3 | -27.8 | 0 | 0 | 0 | 110.8 | ||||
| 134 | D | 29.6 | Very low | 30.4 | Very low | 163 Ų | 163 | 164 Ų | 164 | 87% | 0.872 | 83% | 0.833 | S | S | * | * | trans | -118.9 | 145.4 | 158.7 | -109.9 | -24 | 0 | 0 | 0 | 110.5 | ||||
| 135 | P | 40.2 | Very low | 30.3 | Very low | 98 Ų | 98 | 158.9 Ų | 158.9 | 64% | 0.636 | 83% | 0.829 | S | S | * | * | trans | -96.8 | 134.2 | -168 | 36.8 | -28.8 | 0 | 0 | 0 | 110.9 | ||||
| 136 | D | 30.7 | Very low | 30.2 | Very low | 150 Ų | 150 | 155 Ų | 155 | 80% | 0.802 | 83% | 0.826 | S | S | * | * | trans | 168 | 106.7 | 144.9 | -92.1 | -23 | 0 | 0 | 0 | 109.2 | ||||
| 137 | E | 32.1 | Very low | 30.5 | Very low | 188 Ų | 188 | 151.5 Ų | 151.5 | 88% | 0.879 | 82% | 0.821 | S | S | * | * | trans | -167.3 | 95.7 | 134.9 | -112.7 | -179.9 | 164.6 | 0 | 0 | 110.7 | ||||
| 138 | M | 28.6 | Very low | 30.4 | Very low | 173 Ų | 173 | 149.9 Ų | 149.9 | 85% | 0.852 | 82% | 0.817 | S | S | * | * | trans | -79.8 | 121.8 | 158.1 | -91.5 | -179.8 | -87.4 | 0 | 0 | 109 | ||||
| 139 | T | 31 | Very low | 30.2 | Very low | 127 Ų | 127 | 151.9 Ų | 151.9 | 78% | 0.779 | 83% | 0.827 | S | S | * | * | trans | -150.2 | 84.5 | 153.2 | 29.7 | 0 | 0 | 0 | 0 | 112.6 | ||||
| 140 | I | 31.6 | Very low | 30.1 | Very low | 142 Ų | 142 | 150.5 Ų | 150.5 | 73% | 0.728 | 82% | 0.821 | S | S | * | * | 34.2 | 113 | 126.2 | -56.7 | 176.2 | 0 | 0 | 0 | 118.4 | I142 | I140-I142 HydrophobicContact CG2-CD1 4.06Å; I140-I142 HydrophobicContact CG2-CG1 3.84Å | |||
| 141 | R | 32.7 | Very low | 30.1 | Very low | 247 Ų | 247 | 150 Ų | 150 | 93% | 0.932 | 82% | 0.818 | S | S | * | * | trans | -81 | 133 | 158.5 | -76.6 | -174.8 | 170.5 | -179 | -1.6 | 111.1 | ||||
| 142 | I | 32.4 | Very low | 30 | Very low | 157 Ų | 157 | 145.5 Ų | 145.5 | 81% | 0.805 | 81% | 0.809 | S | S | * | * | trans | -134.6 | 124.7 | 162.9 | -64.6 | 178.2 | 0 | 0 | 0 | 109.1 | I140 | I140-I142 HydrophobicContact CG2-CD1 4.06Å; I140-I142 HydrophobicContact CG2-CG1 3.84Å | ||
| 143 | G | 28 | Very low | 30.1 | Very low | 72 Ų | 72 | 145.7 Ų | 145.7 | 74% | 0.742 | 81% | 0.806 | S | S | * | * | trans | -87.4 | 174.4 | -178.4 | 0 | 0 | 0 | 0 | 0 | 114.8 | ||||
| 144 | R | 29.2 | Very low | 30 | Very low | 260 Ų | 260 | 147 Ų | 147 | 98% | 0.981 | 81% | 0.806 | S | S | * | * | trans | -155.2 | 135.6 | 157.8 | -137.8 | 175.3 | -176.2 | 173.5 | 0.9 | 111.1 | ||||
| 145 | A | 28.3 | Very low | 30.1 | Very low | 100 Ų | 100 | 143 Ų | 143 | 83% | 0.826 | 80% | 0.803 | S | S | * | * | trans | -103.6 | 139.5 | -173 | 0 | 0 | 0 | 0 | 0 | 112.7 | ||||
| 146 | G | 26.4 | Very low | 29.4 | Very low | 76 Ų | 76 | 147.1 Ų | 147.1 | 78% | 0.784 | 81% | 0.814 | S | S | * | * | trans | 64.3 | 169.9 | 147.2 | 0 | 0 | 0 | 0 | 0 | 120.8 | ||||
| 147 | P | 34.8 | Very low | 29.3 | Very low | 126 Ų | 126 | 145.7 Ų | 145.7 | 82% | 0.818 | 81% | 0.811 | S | S | * | * | cis | -134.4 | 159.4 | 0.4 | 38.5 | -19.7 | 0 | 0 | 0 | 117.4 | ||||
| 148 | V | 27.6 | Very low | 29.3 | Very low | 129 Ų | 129 | 146.5 Ų | 146.5 | 78% | 0.782 | 81% | 0.807 | S | S | * | * | trans | 16.3 | 127.9 | 143 | -171.7 | 0 | 0 | 0 | 0 | 121.1 | ||||
| 149 | T | 30.3 | Very low | 29.2 | Very low | 149 Ų | 149 | 147.4 Ų | 147.4 | 91% | 0.914 | 81% | 0.809 | S | S | * | * | trans | -142.8 | 145 | 133.7 | 47 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 150 | D | 26 | Very low | 29 | Very low | 142 Ų | 142 | 153.2 Ų | 153.2 | 76% | 0.759 | 82% | 0.817 | S | S | * | * | trans | -103.1 | 164.5 | -160.2 | -168 | 13.4 | 0 | 0 | 0 | 113.1 | ||||
| 151 | K | 28.4 | Very low | 29 | Very low | 179 Ų | 179 | 158.4 Ų | 158.4 | 78% | 0.778 | 83% | 0.827 | S | S | * | * | trans | 124.7 | 112.7 | 151.8 | -68 | -174.2 | 176.3 | -176.7 | 0 | 118.9 | ||||
| 152 | S | 25.1 | Very low | 28.7 | Very low | 105 Ų | 105 | 158.6 Ų | 158.6 | 73% | 0.734 | 83% | 0.828 | S | S | * | * | trans | 60.6 | 137.9 | 133.2 | -82.1 | 0 | 0 | 0 | 0 | 119.6 | ||||
| 153 | E | 29 | Very low | 28.4 | Very low | 156 Ų | 156 | 154.5 Ų | 154.5 | 73% | 0.729 | 82% | 0.824 | S | S | * | * | cis | -167.1 | 146.7 | 28 | -125.4 | 175.4 | 134.5 | 0 | 0 | 112 | ||||
| 154 | N | 28.6 | Very low | 28.9 | Very low | 147 Ų | 147 | 157.1 Ų | 157.1 | 79% | 0.786 | 83% | 0.828 | S | S | * | * | trans | 66.8 | 125.6 | 144.3 | -61.7 | -19.9 | 0 | 0 | 0 | 122.9 | ||||
| 155 | G | 30.3 | Very low | 28.8 | Very low | 79 Ų | 79 | 152.5 Ų | 152.5 | 81% | 0.814 | 82% | 0.823 | S | S | * | * | trans | 162.8 | 87.1 | 160.7 | 0 | 0 | 0 | 0 | 0 | 112 | ||||
| 156 | E | 27.1 | Very low | 28.8 | Very low | 186 Ų | 186 | 153.8 Ų | 153.8 | 87% | 0.869 | 83% | 0.825 | S | S | * | * | trans | -52.3 | 159.3 | -175.6 | -60.5 | 175.6 | 138.6 | 0 | 0 | 115.8 | ||||
| 157 | V | 28.7 | Very low | 28.7 | Very low | 120 Ų | 120 | 154 Ų | 154 | 73% | 0.727 | 83% | 0.828 | S | S | * | * | 145 | 106.6 | 127.1 | 168.4 | 0 | 0 | 0 | 0 | 113.1 | |||||
| 158 | Y | 32.2 | Very low | 28.4 | Very low | 205 Ų | 205 | 156.1 Ų | 156.1 | 80% | 0.804 | 83% | 0.827 | S | S | * | * | trans | 72.9 | 95 | 147.8 | -71.1 | -107.6 | 0 | 0 | 0 | 121.9 | ||||
| 159 | Q | 26.2 | Very low | 28.4 | Very low | 191 Ų | 191 | 160.1 Ų | 160.1 | 89% | 0.893 | 83% | 0.834 | S | S | * | * | trans | 25.1 | 103.4 | 133.7 | -70.9 | -177.7 | -10.3 | 0 | 0 | 119.2 | ||||
| 160 | R | 26.6 | Very low | 28.3 | Very low | 249 Ų | 249 | 160.2 Ų | 160.2 | 94% | 0.94 | 83% | 0.829 | S | S | * | * | trans | -94.1 | 111.2 | 155.3 | -138.1 | -178.4 | -158.5 | 179.4 | 5.9 | 109.1 | R162 | R160-R162 PolarHBondContact O-N 3.35Š| ||
| 161 | R | 30.3 | Very low | 28.2 | Very low | 252 Ų | 252 | 156.9 Ų | 156.9 | 95% | 0.951 | 83% | 0.828 | S | S | * | * | trans | -69.5 | 120.2 | 174.1 | -157.1 | 177.8 | -169.6 | -178.4 | 3.1 | 108.9 | ||||
| 162 | R | 27 | Very low | 28.1 | Very low | 251 Ų | 251 | 157.9 Ų | 157.9 | 95% | 0.947 | 84% | 0.835 | S | S | * | * | trans | -113.1 | 137.6 | 172.1 | -137.6 | -178.4 | -170.4 | -176.9 | 2.8 | 108.5 | R160 | R160-R162 PolarHBondContact O-N 3.35Š| ||
| 163 | G | 26.7 | Very low | 28.2 | Very low | 70 Ų | 70 | 162.4 Ų | 162.4 | 72% | 0.722 | 85% | 0.845 | S | S | * | * | trans | -172.3 | 153.2 | 170.4 | 0 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 164 | P | 37.6 | Very low | 28.2 | Very low | 128 Ų | 128 | 159.9 Ų | 159.9 | 83% | 0.831 | 85% | 0.851 | S | S | * | * | -121.1 | 165.6 | -107.5 | 38 | -29.3 | 0 | 0 | 0 | 116.7 | |||||
| 165 | N | 26.9 | Very low | 28.2 | Very low | 163 Ų | 163 | 156.3 Ų | 156.3 | 87% | 0.872 | 85% | 0.848 | S | S | * | * | trans | 27.8 | 127.2 | 153.4 | -89.9 | 6.4 | 0 | 0 | 0 | 121.5 | ||||
| 166 | S | 28.2 | Very low | 28.1 | Very low | 126 Ų | 126 | 157.6 Ų | 157.6 | 88% | 0.881 | 85% | 0.845 | S | S | * | * | 171.5 | 143.4 | 112.5 | 58.4 | 0 | 0 | 0 | 0 | 112.2 | |||||
| 167 | G | 26.1 | Very low | 28.4 | Very low | 81 Ų | 81 | 158.5 Ų | 158.5 | 84% | 0.835 | 85% | 0.846 | S | S | * | * | trans | 121.2 | 103.1 | 149.3 | 0 | 0 | 0 | 0 | 0 | 116.7 | ||||
| 168 | H | 27.6 | Very low | 28.5 | Very low | 171 Ų | 171 | 157.6 Ų | 157.6 | 79% | 0.792 | 84% | 0.841 | S | S | * | * | trans | -75 | 135.8 | 167 | -162.6 | 59.1 | 0 | 0 | 0 | 109.9 | ||||
| 169 | F | 26.9 | Very low | 28.8 | Very low | 213 Ų | 213 | 153.1 Ų | 153.1 | 93% | 0.934 | 84% | 0.837 | S | S | * | * | trans | -162.8 | 127.9 | 152.2 | -101.7 | -73.8 | 0 | 0 | 0 | 111 | ||||
| 170 | D | 27.9 | Very low | 29.4 | Very low | 151 Ų | 151 | 151.6 Ų | 151.6 | 81% | 0.807 | 83% | 0.83 | S | S | * | * | trans | -66.8 | 152.2 | 172.7 | -75.1 | -49.5 | 0 | 0 | 0 | 112.9 | ||||
| 171 | G | 25.3 | Very low | 30.1 | Very low | 71 Ų | 71 | 147.9 Ų | 147.9 | 73% | 0.732 | 82% | 0.823 | S | S | * | * | trans | 142.7 | 99.2 | 152.1 | 0 | 0 | 0 | 0 | 0 | 117 | ||||
| 172 | Q | 26.2 | Very low | 30.4 | Very low | 201 Ų | 201 | 141 Ų | 141 | 94% | 0.939 | 81% | 0.809 | S | S | * | * | trans | 52.5 | 92.5 | 143.7 | -89.9 | 164.3 | -18.8 | 0 | 0 | 118.9 | ||||
| 173 | E | 26.8 | Very low | 30.8 | Very low | 200 Ų | 200 | 131.1 Ų | 131.1 | 94% | 0.935 | 79% | 0.785 | S | S | * | * | trans | -86.9 | 106.6 | 153.2 | -77.2 | -174.3 | 170 | 0 | 0 | 109.9 | G175 | E173-G175 PolarHBondContact O-N 3.34Š| ||
| 174 | A | 29.8 | Very low | 31.6 | Very low | 103 Ų | 103 | 133.7 Ų | 133.7 | 85% | 0.851 | 78% | 0.778 | S | S | * | * | trans | -72.2 | 101.6 | 159.8 | 0 | 0 | 0 | 0 | 0 | 107.9 | S176 | A174-S176 PolarHBondContact O-N 3.4Š| ||
| 175 | G | 27.4 | Very low | 32 | Very low | 72 Ų | 72 | 131.4 Ų | 131.4 | 74% | 0.742 | 76% | 0.762 | S | S | * | * | trans | -63.5 | 105.4 | 176.5 | 0 | 0 | 0 | 0 | 0 | 111.7 | E173 K177 | E173-G175 PolarHBondContact O-N 3.34Å; G175-K177 PolarHBondContact O-N 3.03Å | ||
| 176 | S | 28.3 | Very low | 33.1 | Very low | 105 Ų | 105 | 127.5 Ų | 127.5 | 73% | 0.734 | 74% | 0.741 | S | S | * | * | trans | -67.1 | 114.2 | 161.4 | 57.2 | 0 | 0 | 0 | 0 | 108.6 | A174 T178 | A174-S176 PolarHBondContact O-N 3.4Å; S176-T178 PolarHBondContact O-N 3.17Å; S176-T178 VanDerWaalsContact O-N 3.15Å | ||
| 177 | K | 34.2 | Very low | 34.4 | Very low | 205 Ų | 205 | 124.4 Ų | 124.4 | 89% | 0.891 | 71% | 0.714 | S | S | * | * | trans | -68.9 | 105 | 168.5 | -69.2 | -179.2 | 177.5 | -179.1 | 0 | 108.7 | G175 | G175-K177 PolarHBondContact O-N 3.03Š| ||
| 178 | T | 31 | Very low | 36 | Very low | 102 Ų | 102 | 123.1 Ų | 123.1 | 63% | 0.626 | 69% | 0.693 | S | S | * | * | trans | -76.9 | 129.6 | 168.9 | -27.7 | 0 | 0 | 0 | 0 | 109.2 | S176 E180 | S176-T178 PolarHBondContact O-N 3.17Å; S176-T178 VanDerWaalsContact O-N 3.15Å; T178-E180 HydrophobicContact CG2-CG 4.21Å; T178-E180 PolarHBondContact O-N 3.34Å | ||
| 179 | P | 38.3 | Very low | 37.7 | Very low | 110 Ų | 110 | 119.7 Ų | 119.7 | 71% | 0.714 | 67% | 0.673 | S | S | * | * | trans | -87.1 | 89.4 | 173.2 | 32.4 | -28 | 0 | 0 | 0 | 109.6 | ||||
| 180 | E | 39 | Very low | 39.4 | Very low | 160 Ų | 160 | 113.6 Ų | 113.6 | 75% | 0.748 | 64% | 0.644 | S | S | * | * | trans | -92.4 | -4 | -179.2 | -79.6 | -170.5 | 158.2 | 0 | 0 | 115.2 | T178 | T178-E180 HydrophobicContact CG2-CG 4.21Å; T178-E180 PolarHBondContact O-N 3.34Å | ||
| 181 | E | 39.8 | Very low | 41.1 | Very low | 171 Ų | 171 | 111.3 Ų | 111.3 | 80% | 0.799 | 62% | 0.624 | S | S | * | * | S | Bend | trans | -88.9 | -9.7 | -177.7 | -86.9 | -173.5 | 147.6 | 0 | 0 | 115.6 | ||
| 182 | V | 36.5 | Very low | 43.2 | Very low | 108 Ų | 108 | 108.6 Ų | 108.6 | 66% | 0.655 | 59% | 0.593 | S | S | * | * | S | Bend | trans | -90.4 | -14 | -174.1 | -175.3 | 0 | 0 | 0 | 0 | 113.1 | ||
| 183 | G | 35.4 | Very low | 45.4 | Very low | 43 Ų | 43 | 103.5 Ų | 103.5 | 44% | 0.443 | 57% | 0.571 | S | S | . | * | H | α-helix | trans | -91.5 | -15.8 | -172.5 | 0 | 0 | 0 | 0 | 0 | 117.1 | N187 | G183-N187 PolarHBondContact O-ND2 3.28Å |
| 184 | Q | 43.8 | Very low | 47.3 | Very low | 123 Ų | 123 | 95.4 Ų | 95.4 | 58% | 0.575 | 53% | 0.534 | S | S | * | . | H | α-helix | trans | -92.4 | -32.2 | -171.7 | -72.4 | -178.5 | -4.3 | 0 | 0 | 114.2 | S188 | Q184-S188 PolarHBondContact O-OG 3.34Å |
| 185 | T | 45.9 | Very low | 49.2 | Very low | 81 Ų | 81 | 92 Ų | 92 | 50% | 0.497 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -70.4 | -39.9 | 178.2 | 34.4 | 0 | 0 | 0 | 0 | 112.2 | N187 S188 W189 | T185-N187 VanDerWaalsContact C-N 3.31Å; T185-N187 PolarHBondContact O-N 3.43Å; T185-S188 PolarHBondContact O-N 2.93Å; T185-W189 VanDerWaalsContact O-CD1 3.26Å; T185-W189 PolarHBondContact O-N 2.9Å |
| 186 | D | 49.7 | Very low | 51.7 | Low | 81 Ų | 81 | 89.5 Ų | 89.5 | 43% | 0.433 | 47% | 0.471 | S | S | . | . | H | α-helix | trans | -64.1 | -35.8 | -177.9 | -83 | 9.3 | 0 | 0 | 0 | 112.4 | R190 | D186-R190 WeakPolarHBondContact O-CB 3.34Å; D186-R190 WeakPolarHBondContact O-CD 3.37Å; D186-R190 WeakPolarHBondContact O-CG 3.37Å; D186-R190 PolarHBondContact O-N 2.96Å |
| 187 | N | 57.4 | Low | 54.1 | Low | 60 Ų | 60 | 89 Ų | 89 | 32% | 0.321 | 46% | 0.46 | S | S | . | . | H | α-helix | trans | -72.3 | -33.9 | -179.6 | -66.5 | -15.1 | 0 | 0 | 0 | 112.7 | G183 T185 R191 | G183-N187 PolarHBondContact O-ND2 3.28Å; T185-N187 VanDerWaalsContact C-N 3.31Å; T185-N187 PolarHBondContact O-N 3.43Å; N187-R191 PolarHBondContact O-N 3Å |
| 188 | S | 59.5 | Low | 55.9 | Low | 55 Ų | 55 | 80.2 Ų | 80.2 | 39% | 0.385 | 43% | 0.425 | S | S | . | . | H | α-helix | trans | -74 | -40 | -179.4 | -59.5 | 0 | 0 | 0 | 0 | 112.2 | Q184 T185 R190 R191 I192 | Q184-S188 PolarHBondContact O-OG 3.34Å; T185-S188 PolarHBondContact O-N 2.93Å; S188-R190 VanDerWaalsContact C-N 3.35Å; S188-R191 PolarHBondContact O-N 3.23Å; S188-I192 WeakPolarHBondContact O-CD1 3.34Å; S188-I192 WeakPolarHBondContact O-CG1 3.46Å; S188-I192 PolarHBondContact O-N 3.41Å |
| 189 | W | 63.1 | Low | 58.3 | Low | 98 Ų | 98 | 75.6 Ų | 75.6 | 37% | 0.371 | 40% | 0.397 | S | S | . | . | H | α-helix | trans | -66.4 | -37.3 | 176.4 | -85.3 | 110.2 | 0 | 0 | 0 | 113.2 | T185 I192 L193 L250 V255 | T185-W189 VanDerWaalsContact O-CD1 3.26Å; T185-W189 PolarHBondContact O-N 2.9Å; W189-I192 PolarHBondContact O-N 3.24Å; W189-L193 PolarHBondContact O-N 3.28Å; W189-L250 HydrophobicContact CZ3-CD2 3.95Å; W189-V255 HydrophobicContact CH2-CB 4.12Å; W189-V255 HydrophobicContact CH2-CG1 3.96Å; W189-V255 HydrophobicContact CH2-CG2 3.01Å; W189-V255 HydrophobicContact CZ2-CG2 3.27Å; W189-V255 HydrophobicContact CZ3-CG2 3.72Å |
| 190 | R | 61.6 | Low | 60.6 | Low | 86 Ų | 86 | 71.9 Ų | 71.9 | 33% | 0.325 | 37% | 0.372 | S | S | . | . | H | α-helix | trans | -62.2 | -52.8 | 175 | -73.2 | 167.3 | -170.6 | -117.1 | 12.1 | 110 | G103 I104 D186 S188 I192 L193 L194 | G103-R190 PolarHBondContact O-NH1 3.19Å; I104-R190 HydrophobicContact CG2-CB 3.61Å; I104-R190 HydrophobicContact CG2-CG 3.63Å; I104-R190 WeakPolarHBondContact O-CD 3.37Å; D186-R190 WeakPolarHBondContact O-CB 3.34Å; D186-R190 WeakPolarHBondContact O-CD 3.37Å; D186-R190 WeakPolarHBondContact O-CG 3.37Å; D186-R190 PolarHBondContact O-N 2.96Å; S188-R190 VanDerWaalsContact C-N 3.35Å; R190-I192 VanDerWaalsContact C-N 3.26Å; R190-I192 PolarHBondContact O-N 2.77Å; R190-L193 WeakPolarHBondContact O-CB 3.48Å; R190-L193 PolarHBondContact O-N 3.16Å; R190-L194 WeakPolarHBondContact O-CG 3.46Å; R190-L194 PolarHBondContact O-N 3.45Å |
| 191 | R | 63.9 | Low | 62.6 | Low | 102 Ų | 102 | 66.7 Ų | 66.7 | 39% | 0.385 | 35% | 0.349 | S | S | . | . | H | α-helix | trans | -52.6 | -43.7 | 176.1 | -170.5 | 177.3 | -179.4 | -152.5 | -0.9 | 112.7 | N187 S188 L194 L195 D307 E311 | N187-R191 PolarHBondContact O-N 3Å; S188-R191 PolarHBondContact O-N 3.23Å; R191-L194 PolarHBondContact O-N 3.06Å; R191-L195 PolarHBondContact O-N 3.2Å; R191-D307 IonicContact CZ-OD1 3.83Å; R191-D307 IonicContact NE-OD1 2.76Å; R191-D307 IonicContact NH2-OD1 3.02Å; R191-D307 PolarHBondContact NH2-OD1 3.39Å; R191-E311 IonicContact CZ-OE2 3.72Å; R191-E311 IonicContact NH1-OE2 3.09Å; R191-E311 PolarHBondContact NH1-OE2 3.02Å; R191-E311 IonicContact NH2-OE2 3.22Å |
| 192 | I | 69.6 | Low | 64.6 | Low | 15 Ų | 15 | 59.1 Ų | 59.1 | 8% | 0.077 | 31% | 0.313 | C | S | . | . | H | α-helix | trans | -62.5 | -44.2 | 176.9 | -71.9 | 165.6 | 0 | 0 | 0 | 112.2 | S188 W189 R190 L194 L195 I196 L250 S253 | S188-I192 WeakPolarHBondContact O-CD1 3.34Å; S188-I192 WeakPolarHBondContact O-CG1 3.46Å; S188-I192 PolarHBondContact O-N 3.41Å; W189-I192 PolarHBondContact O-N 3.24Å; R190-I192 VanDerWaalsContact C-N 3.26Å; R190-I192 PolarHBondContact O-N 2.77Å; I192-L194 PolarHBondContact O-N 3.37Å; I192-L195 PolarHBondContact O-N 2.91Å; I192-I196 HydrophobicContact CG2-CD1 3.77Å; I192-I196 HydrophobicContact CG2-CG1 4.49Å; I192-I196 WeakPolarHBondContact O-CD1 3.49Å; I192-I196 WeakPolarHBondContact O-CG1 3.48Å; I192-I196 PolarHBondContact O-N 2.8Å; I192-L250 HydrophobicContact CG2-CD1 4.24Å; I192-L250 HydrophobicContact CG2-CD2 3.47Å; I192-L250 VanDerWaalsContact CG2-CD2 3.47Å; I192-L250 HydrophobicContact CG2-CG 3.46Å; I192-L250 VanDerWaalsContact CG2-CG 3.46Å; I192-S253 VanDerWaalsContact CD1-OG 3.32Å; I192-S253 WeakPolarHBondContact CD1-OG 3.3Å |
| 193 | L | 72.1 | Confident | 67.1 | Low | 94 Ų | 94 | 54 Ų | 54 | 49% | 0.492 | 28% | 0.282 | S | S | . | . | H | α-helix | trans | -60.7 | -34.2 | 176 | -85.4 | 162.3 | 0 | 0 | 0 | 112.3 | W189 R190 I196 L197 | W189-L193 PolarHBondContact O-N 3.28Å; R190-L193 WeakPolarHBondContact O-CB 3.48Å; R190-L193 PolarHBondContact O-N 3.16Å; L193-I196 PolarHBondContact O-N 2.8Å; L193-L197 VanDerWaalsContact O-CB 3.32Å; L193-L197 WeakPolarHBondContact O-CB 3.27Å; L193-L197 PolarHBondContact O-N 3.36Å |
| 194 | L | 66.7 | Low | 69.6 | Low | 30 Ų | 30 | 55.3 Ų | 55.3 | 16% | 0.157 | 28% | 0.278 | C | S | . | . | H | α-helix | trans | -75.6 | -41.3 | -178.8 | -59 | 168.4 | 0 | 0 | 0 | 111.5 | L99 I104 R190 R191 I192 I196 L197 A198 | L99-L194 HydrophobicContact CB-CD1 3.76Å; L99-L194 HydrophobicContact CD1-CB 3.94Å; L99-L194 HydrophobicContact CD1-CD1 3.45Å; L99-L194 VanDerWaalsContact CD1-CD1 3.45Å; L99-L194 HydrophobicContact CD1-CD2 3.35Å; L99-L194 HydrophobicContact CD1-CG 3.6Å; L99-L194 HydrophobicContact CD2-CD1 4.05Å; L99-L194 HydrophobicContact CD2-CD2 3.16Å; L99-L194 HydrophobicContact CD2-CG 4.1Å; L99-L194 HydrophobicContact CG-CD1 3.87Å; L99-L194 HydrophobicContact CG-CD2 3.72Å; L99-L194 HydrophobicContact CG-CG 4.23Å; I104-L194 HydrophobicContact CG2-CD1 4.3Å; R190-L194 WeakPolarHBondContact O-CG 3.46Å; R190-L194 PolarHBondContact O-N 3.45Å; R191-L194 PolarHBondContact O-N 3.06Å; I192-L194 PolarHBondContact O-N 3.37Å; L194-I196 VanDerWaalsContact C-N 3.34Å; L194-I196 PolarHBondContact O-N 3.25Å; L194-L197 PolarHBondContact O-N 3.05Å; L194-A198 VanDerWaalsContact O-CB 3.29Å; L194-A198 WeakPolarHBondContact O-CB 3.27Å; L194-A198 PolarHBondContact O-N 2.92Å |
| 195 | L | 69.6 | Low | 71.6 | Confident | 32 Ų | 32 | 50 Ų | 50 | 17% | 0.168 | 25% | 0.254 | C | S | . | . | H | α-helix | trans | -58.4 | -46.8 | 169.3 | -177.8 | 64.7 | 0 | 0 | 0 | 110.8 | R191 I192 L197 A198 I199 V303 | R191-L195 PolarHBondContact O-N 3.2Å; I192-L195 PolarHBondContact O-N 2.91Å; L195-L197 VanDerWaalsContact C-N 3.35Å; L195-L197 PolarHBondContact O-N 2.87Å; L195-A198 PolarHBondContact O-N 3.41Å; L195-I199 HydrophobicContact CD1-CD1 3.71Å; L195-I199 HydrophobicContact CD1-CG1 4.29Å; L195-I199 HydrophobicContact CG-CD1 3.83Å; L195-I199 VanDerWaalsContact O-CB 3.26Å; L195-I199 WeakPolarHBondContact O-CB 3.33Å; L195-I199 WeakPolarHBondContact O-CG1 3.4Å; L195-I199 PolarHBondContact O-N 3.28Å; L195-V303 HydrophobicContact CD1-CG1 4.44Å |
| 196 | I | 79.9 | Confident | 73.7 | Confident | 19 Ų | 19 | 46.1 Ų | 46.1 | 10% | 0.097 | 23% | 0.231 | C | C | . | . | H | α-helix | trans | -60.6 | -44.1 | 175.9 | -67.3 | 161.2 | 0 | 0 | 0 | 111.1 | I192 L193 L194 I199 T200 V246 L250 Y263 | I192-I196 HydrophobicContact CG2-CD1 3.77Å; I192-I196 HydrophobicContact CG2-CG1 4.49Å; I192-I196 WeakPolarHBondContact O-CD1 3.49Å; I192-I196 WeakPolarHBondContact O-CG1 3.48Å; I192-I196 PolarHBondContact O-N 2.8Å; L193-I196 PolarHBondContact O-N 2.8Å; L194-I196 VanDerWaalsContact C-N 3.34Å; L194-I196 PolarHBondContact O-N 3.25Å; I196-I199 PolarHBondContact O-N 3.48Å; I196-T200 WeakPolarHBondContact O-CB 3.5Å; I196-T200 PolarHBondContact O-N 3.34Å; I196-T200 PolarHBondContact O-OG1 3.22Å; I196-V246 HydrophobicContact CD1-CG1 4.33Å; I196-V246 HydrophobicContact CG1-CG1 3.62Å; I196-L250 HydrophobicContact CD1-CD1 4Å; I196-Y263 HydrophobicContact CD1-CD1 4.03Å; I196-Y263 HydrophobicContact CD1-CG 4.23Å |
| 197 | L | 78.9 | Confident | 75.7 | Confident | 94 Ų | 94 | 42.3 Ų | 42.3 | 49% | 0.492 | 21% | 0.21 | S | C | . | . | H | α-helix | trans | -66.4 | -46.9 | -179.4 | -179.4 | 64.9 | 0 | 0 | 0 | 111.6 | L193 L194 L195 I199 T200 I201 | L193-L197 VanDerWaalsContact O-CB 3.32Å; L193-L197 WeakPolarHBondContact O-CB 3.27Å; L193-L197 PolarHBondContact O-N 3.36Å; L194-L197 PolarHBondContact O-N 3.05Å; L195-L197 VanDerWaalsContact C-N 3.35Å; L195-L197 PolarHBondContact O-N 2.87Å; L197-I199 VanDerWaalsContact C-N 3.3Å; L197-I199 PolarHBondContact O-N 3.49Å; L197-T200 PolarHBondContact O-N 3.01Å; L197-T200 VanDerWaalsContact O-N 3.14Å; L197-I201 HydrophobicContact CD1-CD1 3.96Å; L197-I201 HydrophobicContact CD1-CG1 4.38Å; L197-I201 HydrophobicContact CG-CD1 3.98Å; L197-I201 WeakPolarHBondContact O-CG1 3.46Å; L197-I201 PolarHBondContact O-N 2.96Å |
| 198 | A | 73.3 | Confident | 77.3 | Confident | 20 Ų | 20 | 41.7 Ų | 41.7 | 17% | 0.165 | 21% | 0.207 | C | C | . | . | H | α-helix | trans | -57.3 | -47.1 | 175 | 0 | 0 | 0 | 0 | 0 | 110.2 | L194 L195 T200 I201 H202 | L194-A198 VanDerWaalsContact O-CB 3.29Å; L194-A198 WeakPolarHBondContact O-CB 3.27Å; L194-A198 PolarHBondContact O-N 2.92Å; L195-A198 PolarHBondContact O-N 3.41Å; A198-T200 VanDerWaalsContact C-N 3.3Å; A198-T200 PolarHBondContact O-N 2.96Å; A198-I201 PolarHBondContact O-N 3.24Å; A198-I201 VanDerWaalsContact O-N 3.15Å; A198-H202 PolarHBondContact O-CD2 3.2Å; A198-H202 VanDerWaalsContact O-CD2 3.31Å; A198-H202 PolarHBondContact O-N 2.66Å |
| 199 | I | 79.6 | Confident | 78.7 | Confident | 6 Ų | 6 | 39.2 Ų | 39.2 | 3% | 0.031 | 19% | 0.189 | C | C | . | . | H | α-helix | trans | -64.9 | -32.6 | 177.2 | -68.8 | 173.6 | 0 | 0 | 0 | 111.8 | L195 I196 L197 H202 N203 V246 | L195-I199 HydrophobicContact CD1-CD1 3.71Å; L195-I199 HydrophobicContact CD1-CG1 4.29Å; L195-I199 HydrophobicContact CG-CD1 3.83Å; L195-I199 VanDerWaalsContact O-CB 3.26Å; L195-I199 WeakPolarHBondContact O-CB 3.33Å; L195-I199 WeakPolarHBondContact O-CG1 3.4Å; L195-I199 PolarHBondContact O-N 3.28Å; I196-I199 PolarHBondContact O-N 3.48Å; L197-I199 VanDerWaalsContact C-N 3.3Å; L197-I199 PolarHBondContact O-N 3.49Å; I199-H202 WeakPolarHBondContact CA-CD2 3.39Å; I199-H202 WeakPolarHBondContact CA-NE2 3.44Å; I199-H202 WeakPolarHBondContact CG2-NE2 3.21Å; I199-H202 PolarHBondContact O-CD2 2.78Å; I199-H202 PolarHBondContact O-NE2 2.87Å; I199-N203 WeakPolarHBondContact O-CB 3.45Å; I199-N203 PolarHBondContact O-N 2.79Å; I199-N203 PolarHBondContact O-ND2 3.45Å; I199-V246 HydrophobicContact CB-CG2 4.28Å; I199-V246 HydrophobicContact CD1-CG2 3.4Å; I199-V246 VanDerWaalsContact CD1-CG2 3.4Å; I199-V246 HydrophobicContact CG1-CG2 4.42Å; I199-V246 HydrophobicContact CG2-CG2 4.04Å |
| 200 | T | 86.6 | Confident | 80.2 | Confident | 31 Ų | 31 | 34.5 Ų | 34.5 | 19% | 0.19 | 17% | 0.172 | C | C | . | . | H | α-helix | trans | -70.8 | -37.4 | 175.6 | -56 | 0 | 0 | 0 | 0 | 111 | I196 L197 A198 V270 | I196-T200 WeakPolarHBondContact O-CB 3.5Å; I196-T200 PolarHBondContact O-N 3.34Å; I196-T200 PolarHBondContact O-OG1 3.22Å; L197-T200 PolarHBondContact O-N 3.01Å; L197-T200 VanDerWaalsContact O-N 3.14Å; A198-T200 VanDerWaalsContact C-N 3.3Å; A198-T200 PolarHBondContact O-N 2.96Å; T200-V270 HydrophobicContact CG2-CG1 3.57Å; T200-V270 HydrophobicContact CG2-CG2 4.2Å; T200-V270 WeakPolarHBondContact O-CG2 3.36Å |
| 201 | I | 81.3 | Confident | 81.7 | Confident | 51 Ų | 51 | 30.4 Ų | 30.4 | 26% | 0.262 | 16% | 0.156 | S | C | . | . | H | α-helix | trans | -74.3 | -38.4 | -174 | -69.5 | 172 | 0 | 0 | 0 | 112.3 | F91 L197 A198 I204 P205 | F91-I201 HydrophobicContact CE1-CB 4.24Å; F91-I201 HydrophobicContact CE1-CD1 4.16Å; F91-I201 HydrophobicContact CE1-CG2 3.69Å; F91-I201 HydrophobicContact CZ-CB 4.4Å; F91-I201 HydrophobicContact CZ-CD1 3.6Å; F91-I201 HydrophobicContact CZ-CG2 3.79Å; L197-I201 HydrophobicContact CD1-CD1 3.96Å; L197-I201 HydrophobicContact CD1-CG1 4.38Å; L197-I201 HydrophobicContact CG-CD1 3.98Å; L197-I201 WeakPolarHBondContact O-CG1 3.46Å; L197-I201 PolarHBondContact O-N 2.96Å; A198-I201 PolarHBondContact O-N 3.24Å; A198-I201 VanDerWaalsContact O-N 3.15Å; I201-I204 WeakPolarHBondContact O-CB 3.42Å; I201-I204 PolarHBondContact O-N 3.31Å; I201-P205 WeakPolarHBondContact O-CD 3.42Å |
| 202 | H | 82.9 | Confident | 83 | Confident | 13 Ų | 13 | 25.7 Ų | 25.7 | 6% | 0.06 | 14% | 0.138 | C | C | . | . | H | α-helix | trans | -73.2 | -26 | 176.4 | 80 | 102.6 | 0 | 0 | 0 | 113.4 | A198 I199 I204 P205 E206 E242 | A198-H202 PolarHBondContact O-CD2 3.2Å; A198-H202 VanDerWaalsContact O-CD2 3.31Å; A198-H202 PolarHBondContact O-N 2.66Å; I199-H202 WeakPolarHBondContact CA-CD2 3.39Å; I199-H202 WeakPolarHBondContact CA-NE2 3.44Å; I199-H202 WeakPolarHBondContact CG2-NE2 3.21Å; I199-H202 PolarHBondContact O-CD2 2.78Å; I199-H202 PolarHBondContact O-NE2 2.87Å; H202-I204 PolarHBondContact O-N 3.22Å; H202-I204 VanDerWaalsContact O-N 3.16Å; H202-P205 WeakPolarHBondContact O-CD 3.37Å; H202-E206 IonicContact CE1-OE1 2.6Å; H202-E206 PolarHBondContact CE1-OE1 3.47Å; H202-E206 IonicContact CG-OE1 3.58Å; H202-E206 IonicContact ND1-OE1 3.12Å; H202-E206 PolarHBondContact ND1-OE1 3.07Å; H202-E242 IonicContact CE1-OE1 3.83Å; H202-E242 PolarHBondContact CE1-OE1 3.43Å; H202-E242 IonicContact CE1-OE2 3.36Å; H202-E242 PolarHBondContact CE1-OE2 3.5Å; H202-E242 IonicContact ND1-OE1 2.8Å; H202-E242 IonicContact NE2-OE2 3.91Å |
| 203 | N | 88.6 | Confident | 83.9 | Confident | 0 Ų | 0 | 25.9 Ų | 25.9 | 0% | 0 | 14% | 0.144 | C | C | . | . | H | α-helix | trans | -63.6 | -18.4 | 173.4 | -88.1 | -48.2 | 0 | 0 | 0 | 113 | I199 E206 G207 V270 E271 | I199-N203 WeakPolarHBondContact O-CB 3.45Å; I199-N203 PolarHBondContact O-N 2.79Å; I199-N203 PolarHBondContact O-ND2 3.45Å; N203-E206 PolarHBondContact OD1-OE2 2.8Å; N203-G207 PolarHBondContact O-N 2.8Å; N203-V270 HydrophobicContact CB-CG2 3.55Å; N203-E271 HydrophobicContact CB-CG 3.9Å; N203-E271 PolarHBondContact OD1-OE1 3.18Å |
| 204 | I | 87.7 | Confident | 84.9 | Confident | 70 Ų | 70 | 21.4 Ų | 21.4 | 36% | 0.359 | 12% | 0.121 | S | C | . | . | H | α-helix | trans | -68.7 | -55.8 | 175.8 | -63 | 169.3 | 0 | 0 | 0 | 111.5 | I201 H202 E206 G207 L208 V270 A274 | I201-I204 WeakPolarHBondContact O-CB 3.42Å; I201-I204 PolarHBondContact O-N 3.31Å; H202-I204 PolarHBondContact O-N 3.22Å; H202-I204 VanDerWaalsContact O-N 3.16Å; I204-E206 PolarHBondContact O-N 3.44Å; I204-G207 PolarHBondContact O-N 2.99Å; I204-L208 HydrophobicContact CG2-CD1 4.09Å; I204-L208 WeakPolarHBondContact O-CB 3.46Å; I204-L208 WeakPolarHBondContact O-CG 3.13Å; I204-L208 PolarHBondContact O-N 3.35Å; I204-V270 HydrophobicContact CG1-CB 4.15Å; I204-V270 HydrophobicContact CG1-CG2 4Å; I204-A274 HydrophobicContact CG2-CB 4.32Å; I204-A274 WeakPolarHBondContact O-CB 3.26Å |
| 205 | P | 86.2 | Confident | 86.1 | Confident | 12 Ų | 12 | 20.5 Ų | 20.5 | 8% | 0.078 | 12% | 0.119 | C | C | . | . | H | α-helix | trans | -50.1 | -40.9 | 170.7 | -31.1 | 31.1 | 0 | 0 | 0 | 114.7 | I201 H202 L208 A209 A292 F295 A296 | I201-P205 WeakPolarHBondContact O-CD 3.42Å; H202-P205 WeakPolarHBondContact O-CD 3.37Å; P205-L208 PolarHBondContact O-N 3.4Å; P205-A209 WeakPolarHBondContact O-CB 3.4Å; P205-A209 PolarHBondContact O-N 3.09Å; P205-A292 HydrophobicContact CB-CB 4.27Å; P205-A292 WeakPolarHBondContact CB-O 3.3Å; P205-F295 HydrophobicContact CG-CD1 4.24Å; P205-A296 HydrophobicContact CB-CB 3.93Å; P205-A296 HydrophobicContact CG-CB 4.39Å |
| 206 | E | 89.9 | Confident | 87 | Confident | 0 Ų | 0 | 19.3 Ų | 19.3 | 0% | 0 | 11% | 0.114 | C | C | . | . | H | α-helix | trans | -65.9 | -49.3 | -179.6 | -69 | 173.7 | -151.5 | 0 | 0 | 111.6 | L59 H202 N203 I204 L208 A209 V210 I235 Q238 N239 | L59-E206 HydrophobicContact CD2-CG 4.44Å; H202-E206 IonicContact CE1-OE1 2.6Å; H202-E206 PolarHBondContact CE1-OE1 3.47Å; H202-E206 IonicContact CG-OE1 3.58Å; H202-E206 IonicContact ND1-OE1 3.12Å; H202-E206 PolarHBondContact ND1-OE1 3.07Å; N203-E206 PolarHBondContact OD1-OE2 2.8Å; I204-E206 PolarHBondContact O-N 3.44Å; E206-L208 VanDerWaalsContact C-N 3.33Å; E206-L208 PolarHBondContact O-N 2.95Å; E206-A209 WeakPolarHBondContact O-CB 3.44Å; E206-A209 PolarHBondContact O-N 3.15Å; E206-A209 VanDerWaalsContact O-N 3.15Å; E206-V210 WeakPolarHBondContact O-CG2 3.44Å; E206-V210 PolarHBondContact O-N 2.84Å; E206-I235 HydrophobicContact CB-CD1 4.37Å; E206-I235 HydrophobicContact CB-CG2 3.96Å; E206-I235 HydrophobicContact CG-CG2 4.37Å; E206-Q238 PolarHBondContact OE1-NE2 3.22Å; E206-Q238 PolarHBondContact OE2-NE2 3.16Å; E206-N239 PolarHBondContact OE2-ND2 3.33Å; E206-N239 PolarHBondContact OE2-OD1 3.13Å; E206-N239 VanDerWaalsContact OE2-OD1 3.07Å |
| 207 | G | 92.1 | Very high | 87.4 | Confident | 0 Ų | 0 | 21.4 Ų | 21.4 | 0% | 0 | 12% | 0.124 | C | C | . | . | H | α-helix | trans | -58.2 | -44.7 | 173.6 | 0 | 0 | 0 | 0 | 0 | 112.1 | N203 I204 A209 V210 G211 G275 | N203-G207 PolarHBondContact O-N 2.8Å; I204-G207 PolarHBondContact O-N 2.99Å; G207-A209 VanDerWaalsContact C-N 3.33Å; G207-A209 PolarHBondContact O-N 2.84Å; G207-V210 PolarHBondContact O-N 2.92Å; G207-G211 PolarHBondContact O-N 3.44Å; G207-G275 WeakPolarHBondContact O-CA 3.34Å; G207-G275 PolarHBondContact O-N 2.9Å |
| 208 | L | 90.4 | Very high | 87.6 | Confident | 48 Ų | 48 | 20.2 Ų | 20.2 | 25% | 0.251 | 14% | 0.135 | S | C | . | . | H | α-helix | trans | -58.5 | -43.5 | 174.8 | -80.5 | 169.7 | 0 | 0 | 0 | 112 | I204 P205 E206 G211 V212 A274 | I204-L208 HydrophobicContact CG2-CD1 4.09Å; I204-L208 WeakPolarHBondContact O-CB 3.46Å; I204-L208 WeakPolarHBondContact O-CG 3.13Å; I204-L208 PolarHBondContact O-N 3.35Å; P205-L208 PolarHBondContact O-N 3.4Å; E206-L208 VanDerWaalsContact C-N 3.33Å; E206-L208 PolarHBondContact O-N 2.95Å; L208-G211 PolarHBondContact O-N 3.35Å; L208-V212 VanDerWaalsContact O-CG2 3.31Å; L208-V212 WeakPolarHBondContact O-CG2 3.18Å; L208-V212 PolarHBondContact O-N 3.46Å; L208-A274 WeakPolarHBondContact CD2-O 3.29Å; L208-A274 HydrophobicContact CG-CB 4.21Å |
| 209 | A | 89.3 | Confident | 88.1 | Confident | 2 Ų | 2 | 24.3 Ų | 24.3 | 2% | 0.017 | 15% | 0.149 | C | C | . | . | H | α-helix | trans | -63.6 | -46 | -179.6 | 0 | 0 | 0 | 0 | 0 | 112 | P205 E206 G207 G211 G213 L231 I235 L289 L293 | P205-A209 WeakPolarHBondContact O-CB 3.4Å; P205-A209 PolarHBondContact O-N 3.09Å; E206-A209 WeakPolarHBondContact O-CB 3.44Å; E206-A209 PolarHBondContact O-N 3.15Å; E206-A209 VanDerWaalsContact O-N 3.15Å; G207-A209 VanDerWaalsContact C-N 3.33Å; G207-A209 PolarHBondContact O-N 2.84Å; A209-G211 VanDerWaalsContact C-N 3.32Å; A209-G211 PolarHBondContact O-N 3.41Å; A209-G213 PolarHBondContact O-N 3.23Å; A209-L231 HydrophobicContact CB-CD2 4.28Å; A209-I235 HydrophobicContact CB-CD1 4.4Å; A209-L289 HydrophobicContact CB-CD2 4.29Å; A209-L293 HydrophobicContact CB-CD2 3.49Å; A209-L293 VanDerWaalsContact CB-CD2 3.49Å; A209-L293 HydrophobicContact CB-CG 4.23Å |
| 210 | V | 93.4 | Very high | 87.9 | Confident | 0 Ų | 0 | 27.1 Ų | 27.1 | 0% | 0 | 17% | 0.167 | C | C | . | . | H | α-helix | trans | -59.6 | -45.6 | 173.2 | 176.2 | 0 | 0 | 0 | 0 | 110.7 | T15 T18 E206 G207 G213 F214 A232 I235 | T15-V210 HydrophobicContact CG2-CB 3.81Å; T15-V210 HydrophobicContact CG2-CG1 3.71Å; T18-V210 HydrophobicContact CG2-CG2 4.27Å; E206-V210 WeakPolarHBondContact O-CG2 3.44Å; E206-V210 PolarHBondContact O-N 2.84Å; G207-V210 PolarHBondContact O-N 2.92Å; V210-G213 PolarHBondContact O-N 2.88Å; V210-F214 HydrophobicContact CG1-CD2 3.98Å; V210-F214 HydrophobicContact CG1-CE2 3.98Å; V210-F214 WeakPolarHBondContact O-CD2 3.47Å; V210-F214 PolarHBondContact O-N 3.19Å; V210-F214 VanDerWaalsContact O-N 3.14Å; V210-A232 HydrophobicContact CG1-CB 3.88Å; V210-A232 HydrophobicContact CG2-CB 4.12Å; V210-I235 HydrophobicContact CG2-CD1 3.63Å |
| 211 | G | 93.1 | Very high | 87.4 | Confident | 0 Ų | 0 | 32.1 Ų | 32.1 | 0% | 0 | 20% | 0.198 | C | C | . | . | H | α-helix | trans | -60.4 | -49.5 | -179.7 | 0 | 0 | 0 | 0 | 0 | 113.6 | G207 L208 A209 G215 G275 A279 | G207-G211 PolarHBondContact O-N 3.44Å; L208-G211 PolarHBondContact O-N 3.35Å; A209-G211 VanDerWaalsContact C-N 3.32Å; A209-G211 PolarHBondContact O-N 3.41Å; G211-G215 PolarHBondContact O-N 3.22Å; G211-G275 WeakPolarHBondContact CA-O 3.25Å; G211-A279 WeakPolarHBondContact O-CA 3.43Å; G211-A279 WeakPolarHBondContact O-CB 3.41Å; G211-A279 PolarHBondContact O-N 3.49Å |
| 212 | V | 90.8 | Very high | 87 | Confident | 2 Ų | 2 | 32.4 Ų | 32.4 | 1% | 0.012 | 20% | 0.204 | C | C | . | . | H | α-helix | trans | -70.8 | -37.7 | 178 | 178.2 | 0 | 0 | 0 | 0 | 111.5 | L208 F214 G215 A216 G278 V282 A285 E286 L289 | L208-V212 VanDerWaalsContact O-CG2 3.31Å; L208-V212 WeakPolarHBondContact O-CG2 3.18Å; L208-V212 PolarHBondContact O-N 3.46Å; V212-F214 VanDerWaalsContact C-N 3.28Å; V212-F214 PolarHBondContact O-N 3.32Å; V212-G215 CarbonylContact O-C 3.5Å; V212-G215 PolarHBondContact O-N 3.36Å; V212-A216 HydrophobicContact CG1-CB 4.32Å; V212-A216 WeakPolarHBondContact O-CB 3.32Å; V212-A216 PolarHBondContact O-N 3.47Å; V212-G278 WeakPolarHBondContact CG2-O 3.13Å; V212-V282 HydrophobicContact CG1-CG1 4.05Å; V212-A285 HydrophobicContact CG2-CB 3.38Å; V212-E286 HydrophobicContact CG1-CB 4.34Å; V212-L289 HydrophobicContact CB-CD1 3.52Å; V212-L289 HydrophobicContact CB-CD2 4.47Å; V212-L289 HydrophobicContact CB-CG 4.45Å; V212-L289 HydrophobicContact CG1-CD1 3.3Å; V212-L289 HydrophobicContact CG1-CG 4.46Å; V212-L289 HydrophobicContact CG2-CD1 3.97Å; V212-L289 HydrophobicContact CG2-CD2 4.33Å; V212-L289 HydrophobicContact CG2-CG 4.42Å |
| 213 | G | 90.3 | Very high | 87.1 | Confident | 19 Ų | 19 | 32.7 Ų | 32.7 | 20% | 0.196 | 21% | 0.208 | C | C | . | . | H | α-helix | trans | -51.9 | -50.2 | 175.3 | 0 | 0 | 0 | 0 | 0 | 111 | A209 V210 A228 | A209-G213 PolarHBondContact O-N 3.23Å; V210-G213 PolarHBondContact O-N 2.88Å; G213-A228 VanDerWaalsContact C-CB 3.41Å; G213-A228 WeakPolarHBondContact O-CB 3.17Å |
| 214 | F | 93.3 | Very high | 87.1 | Confident | 0 Ų | 0 | 35.6 Ų | 35.6 | 0% | 0 | 23% | 0.226 | C | C | . | . | H | α-helix | trans | -71.2 | -36.5 | 174.7 | -76 | -63.4 | 0 | 0 | 0 | 113.5 | M1 P7 Q10 A11 V210 V212 A216 I217 F225 A228 R229 A232 | M1-F214 HydrophobicContact CG-CE2 4.45Å; M1-F214 HydrophobicContact CG-CZ 4.22Å; M1-F214 VanDerWaalsContact N-CE1 3.34Å; M1-F214 VanDerWaalsContact N-CZ 3.26Å; M1-F214 HydrophobicContact SD-CE2 4.26Å; M1-F214 HydrophobicContact SD-CZ 3.87Å; P7-F214 WeakPolarHBondContact CB-O 3.12Å; Q10-F214 HydrophobicContact CB-CB 3.83Å; Q10-F214 HydrophobicContact CB-CD1 3.39Å; Q10-F214 HydrophobicContact CB-CD2 4.22Å; Q10-F214 HydrophobicContact CB-CE1 4Å; Q10-F214 HydrophobicContact CB-CG 3.54Å; Q10-F214 HydrophobicContact CG-CD1 4.14Å; A11-F214 HydrophobicContact CB-CB 4.23Å; V210-F214 HydrophobicContact CG1-CD2 3.98Å; V210-F214 HydrophobicContact CG1-CE2 3.98Å; V210-F214 WeakPolarHBondContact O-CD2 3.47Å; V210-F214 PolarHBondContact O-N 3.19Å; V210-F214 VanDerWaalsContact O-N 3.14Å; V212-F214 VanDerWaalsContact C-N 3.28Å; V212-F214 PolarHBondContact O-N 3.32Å; F214-A216 VanDerWaalsContact C-N 3.31Å; F214-A216 PolarHBondContact O-N 3.03Å; F214-I217 HydrophobicContact CB-CD1 4.46Å; F214-I217 HydrophobicContact CD1-CD1 3.68Å; F214-I217 HydrophobicContact CE1-CD1 4.47Å; F214-I217 WeakPolarHBondContact O-CD1 3.41Å; F214-I217 WeakPolarHBondContact O-CG1 3.2Å; F214-I217 PolarHBondContact O-N 3.01Å; F214-F225 HydrophobicContact CE1-CD2 4.08Å; F214-F225 HydrophobicContact CE1-CE2 4.04Å; F214-A228 HydrophobicContact CD1-CB 3.65Å; F214-A228 HydrophobicContact CD2-CB 4.41Å; F214-A228 HydrophobicContact CE1-CB 3.73Å; F214-A228 HydrophobicContact CE2-CB 4.5Å; F214-A228 HydrophobicContact CG-CB 3.99Å; F214-A228 HydrophobicContact CZ-CB 4.17Å; F214-R229 HydrophobicContact CZ-CB 4.32Å; F214-A232 HydrophobicContact CE2-CB 4.1Å |
| 215 | G | 90.2 | Very high | 87.2 | Confident | 12 Ų | 12 | 33.9 Ų | 33.9 | 12% | 0.124 | 22% | 0.216 | C | C | . | . | H | α-helix | trans | -68.8 | -24.2 | 178.6 | 0 | 0 | 0 | 0 | 0 | 115.1 | G211 V212 | G211-G215 PolarHBondContact O-N 3.22Å; V212-G215 CarbonylContact O-C 3.5Å; V212-G215 PolarHBondContact O-N 3.36Å |
| 216 | A | 88.5 | Confident | 87.3 | Confident | 7 Ų | 7 | 37.1 Ų | 37.1 | 6% | 0.058 | 23% | 0.231 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -93.4 | -1.9 | -178.3 | 0 | 0 | 0 | 0 | 0 | 113.2 | V212 F214 G218 K219 A223 V282 | V212-A216 HydrophobicContact CG1-CB 4.32Å; V212-A216 WeakPolarHBondContact O-CB 3.32Å; V212-A216 PolarHBondContact O-N 3.47Å; F214-A216 VanDerWaalsContact C-N 3.31Å; F214-A216 PolarHBondContact O-N 3.03Å; A216-G218 PolarHBondContact O-N 2.5Å; A216-G218 VanDerWaalsContact O-N 3.16Å; A216-K219 HydrophobicContact CB-CD 4.48Å; A216-K219 VanDerWaalsContact O-CB 3.25Å; A216-K219 WeakPolarHBondContact O-CB 3.35Å; A216-K219 WeakPolarHBondContact O-CG 3.22Å; A216-K219 PolarHBondContact O-N 3.16Å; A216-A223 HydrophobicContact CB-CB 4.15Å; A216-A223 VanDerWaalsContact O-CB 3.22Å; A216-A223 WeakPolarHBondContact O-CB 3.44Å; A216-V282 HydrophobicContact CB-CG1 4.03Å |
| 217 | I | 89.2 | Confident | 87.1 | Confident | 62 Ų | 62 | 40.1 Ų | 40.1 | 32% | 0.318 | 25% | 0.252 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -52.3 | 124.2 | -177.9 | -68.3 | 172.5 | 0 | 0 | 0 | 110.7 | F214 K219 A223 F225 A228 | F214-I217 HydrophobicContact CB-CD1 4.46Å; F214-I217 HydrophobicContact CD1-CD1 3.68Å; F214-I217 HydrophobicContact CE1-CD1 4.47Å; F214-I217 WeakPolarHBondContact O-CD1 3.41Å; F214-I217 WeakPolarHBondContact O-CG1 3.2Å; F214-I217 PolarHBondContact O-N 3.01Å; I217-K219 VanDerWaalsContact C-N 3.31Å; I217-K219 PolarHBondContact O-N 3.43Å; I217-A223 WeakPolarHBondContact CA-O 3.41Å; I217-F225 HydrophobicContact CD1-CB 4.09Å; I217-F225 HydrophobicContact CD1-CD2 4.12Å; I217-A228 HydrophobicContact CD1-CB 4.28Å; I217-A228 HydrophobicContact CG1-CB 4.42Å |
| 218 | G | 83.8 | Confident | 86.9 | Confident | 70 Ų | 70 | 40.3 Ų | 40.3 | 72% | 0.722 | 25% | 0.253 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 79.6 | 2.5 | 179.5 | 0 | 0 | 0 | 0 | 0 | 115.4 | A216 A223 | A216-G218 PolarHBondContact O-N 2.5Å; A216-G218 VanDerWaalsContact O-N 3.16Å; G218-A223 PolarHBondContact N-O 3.5Å |
| 219 | K | 82.4 | Confident | 87 | Confident | 105 Ų | 105 | 41 Ų | 41 | 46% | 0.457 | 25% | 0.252 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -79.2 | -30.8 | 172.4 | -65.7 | -169 | -179.3 | -174.2 | 0 | 113.1 | A216 I217 V282 | A216-K219 HydrophobicContact CB-CD 4.48Å; A216-K219 VanDerWaalsContact O-CB 3.25Å; A216-K219 WeakPolarHBondContact O-CB 3.35Å; A216-K219 WeakPolarHBondContact O-CG 3.22Å; A216-K219 PolarHBondContact O-N 3.16Å; I217-K219 VanDerWaalsContact C-N 3.31Å; I217-K219 PolarHBondContact O-N 3.43Å; K219-V282 HydrophobicContact CD-CG1 4.12Å |
| 220 | T | 76.5 | Confident | 86.9 | Confident | 65 Ų | 65 | 42.1 Ų | 42.1 | 40% | 0.399 | 26% | 0.258 | S | S | . | . | S | Bend | trans | -133.6 | 165.7 | 175.3 | 67.1 | 0 | 0 | 0 | 0 | 109.6 | S222 A223 | T220-S222 PolarHBondContact O-N 2.89Å; T220-A223 PolarHBondContact O-N 3.17Å; T220-A223 VanDerWaalsContact OG1-CB 3.25Å; T220-A223 WeakPolarHBondContact OG1-CB 3.26Å; T220-A223 PolarHBondContact OG1-N 2.99Å; T220-A223 VanDerWaalsContact OG1-N 3.1Å |
| 221 | T | 75.7 | Confident | 86.5 | Confident | 137 Ų | 137 | 43.7 Ų | 43.7 | 84% | 0.84 | 27% | 0.266 | S | S | * | . | S | Bend | trans | -65.8 | -29.1 | 175.2 | 43.8 | 0 | 0 | 0 | 0 | 112.7 | ||
| 222 | S | 73.4 | Confident | 86.5 | Confident | 57 Ų | 57 | 43.7 Ų | 43.7 | 40% | 0.399 | 27% | 0.266 | S | S | . | . | S | Bend | trans | -81.6 | -29.2 | 179.6 | -44.3 | 0 | 0 | 0 | 0 | 112.1 | D69 T220 T224 | D69-S222 PolarHBondContact OD2-OG 2.88Å; T220-S222 PolarHBondContact O-N 2.89Å; S222-T224 VanDerWaalsContact C-N 3.34Å; S222-T224 PolarHBondContact O-N 3.16Å |
| 223 | A | 83.6 | Confident | 86.4 | Confident | 18 Ų | 18 | 45.4 Ų | 45.4 | 15% | 0.149 | 28% | 0.275 | C | S | . | . | trans | -78.5 | 77.8 | -179.9 | 0 | 0 | 0 | 0 | 0 | 112.1 | A216 I217 G218 T220 | A216-A223 HydrophobicContact CB-CB 4.15Å; A216-A223 VanDerWaalsContact O-CB 3.22Å; A216-A223 WeakPolarHBondContact O-CB 3.44Å; I217-A223 WeakPolarHBondContact CA-O 3.41Å; G218-A223 PolarHBondContact N-O 3.5Å; T220-A223 PolarHBondContact O-N 3.17Å; T220-A223 VanDerWaalsContact OG1-CB 3.25Å; T220-A223 WeakPolarHBondContact OG1-CB 3.26Å; T220-A223 PolarHBondContact OG1-N 2.99Å; T220-A223 VanDerWaalsContact OG1-N 3.1Å | ||
| 224 | T | 88.9 | Confident | 86.2 | Confident | 61 Ų | 61 | 44.6 Ų | 44.6 | 37% | 0.374 | 27% | 0.266 | S | S | . | . | trans | -100.9 | 161 | 177.6 | 65.8 | 0 | 0 | 0 | 0 | 111.9 | S222 E226 S227 A228 | S222-T224 VanDerWaalsContact C-N 3.34Å; S222-T224 PolarHBondContact O-N 3.16Å; T224-E226 VanDerWaalsContact C-N 3.26Å; T224-E226 PolarHBondContact O-N 2.91Å; T224-S227 PolarHBondContact O-N 3.46Å; T224-S227 WeakPolarHBondContact OG1-CB 3.21Å; T224-S227 PolarHBondContact OG1-N 2.84Å; T224-A228 PolarHBondContact O-N 3.09Å | ||
| 225 | F | 90.4 | Very high | 86 | Confident | 35 Ų | 35 | 44.6 Ų | 44.6 | 15% | 0.154 | 27% | 0.266 | C | S | . | . | H | α-helix | trans | -58.8 | -40.4 | 171.9 | 173.7 | -97.3 | 0 | 0 | 0 | 112 | E3 F214 I217 A228 R229 | E3-F225 HydrophobicContact CG-CD1 4.16Å; E3-F225 HydrophobicContact CG-CE1 3.67Å; E3-F225 HydrophobicContact CG-CZ 3.94Å; F214-F225 HydrophobicContact CE1-CD2 4.08Å; F214-F225 HydrophobicContact CE1-CE2 4.04Å; I217-F225 HydrophobicContact CD1-CB 4.09Å; I217-F225 HydrophobicContact CD1-CD2 4.12Å; F225-A228 PolarHBondContact O-N 2.82Å; F225-R229 VanDerWaalsContact O-CB 3.28Å; F225-R229 WeakPolarHBondContact O-CB 3.46Å; F225-R229 PolarHBondContact O-N 3.34Å |
| 226 | E | 88.7 | Confident | 86 | Confident | 80 Ų | 80 | 44 Ų | 44 | 37% | 0.374 | 26% | 0.261 | S | S | . | . | H | α-helix | trans | -62.3 | -48.5 | 177.8 | -60.3 | -64.9 | 119 | 0 | 0 | 110.8 | T224 A228 R229 N230 | T224-E226 VanDerWaalsContact C-N 3.26Å; T224-E226 PolarHBondContact O-N 2.91Å; E226-A228 PolarHBondContact O-N 3.02Å; E226-R229 PolarHBondContact O-N 3.16Å; E226-R229 IonicContact OE1-CZ 2.87Å; E226-R229 IonicContact OE1-NH1 3.06Å; E226-R229 PolarHBondContact OE1-NH1 3.47Å; E226-R229 IonicContact OE1-NH2 3.79Å; E226-R229 IonicContact OE2-CZ 3.79Å; E226-R229 IonicContact OE2-NH1 3.66Å; E226-R229 PolarHBondContact OE2-NH1 2.86Å; E226-R229 IonicContact OE2-NH2 3.83Å; E226-R229 PolarHBondContact OE2-NH2 2.87Å; E226-N230 WeakPolarHBondContact O-CB 3.4Å; E226-N230 PolarHBondContact O-N 3.16Å; E226-N230 PolarHBondContact O-OD1 3.47Å |
| 227 | S | 84.4 | Confident | 85.8 | Confident | 63 Ų | 63 | 45.3 Ų | 45.3 | 44% | 0.441 | 27% | 0.266 | S | S | . | . | H | α-helix | trans | -58.3 | -47.7 | 176.6 | 172.4 | 0 | 0 | 0 | 0 | 112.1 | T224 R229 N230 L231 | T224-S227 PolarHBondContact O-N 3.46Å; T224-S227 WeakPolarHBondContact OG1-CB 3.21Å; T224-S227 PolarHBondContact OG1-N 2.84Å; S227-R229 VanDerWaalsContact C-N 3.33Å; S227-R229 PolarHBondContact O-N 2.64Å; S227-N230 PolarHBondContact O-N 3.44Å; S227-L231 WeakPolarHBondContact O-CB 3.4Å; S227-L231 PolarHBondContact O-N 2.94Å |
| 228 | A | 89.2 | Confident | 85.6 | Confident | 3 Ų | 3 | 42.5 Ų | 42.5 | 3% | 0.025 | 25% | 0.251 | C | S | . | . | H | α-helix | trans | -63.9 | -37.5 | 178.4 | 0 | 0 | 0 | 0 | 0 | 112.9 | G213 F214 I217 T224 F225 E226 A232 | G213-A228 VanDerWaalsContact C-CB 3.41Å; G213-A228 WeakPolarHBondContact O-CB 3.17Å; F214-A228 HydrophobicContact CD1-CB 3.65Å; F214-A228 HydrophobicContact CD2-CB 4.41Å; F214-A228 HydrophobicContact CE1-CB 3.73Å; F214-A228 HydrophobicContact CE2-CB 4.5Å; F214-A228 HydrophobicContact CG-CB 3.99Å; F214-A228 HydrophobicContact CZ-CB 4.17Å; I217-A228 HydrophobicContact CD1-CB 4.28Å; I217-A228 HydrophobicContact CG1-CB 4.42Å; T224-A228 PolarHBondContact O-N 3.09Å; F225-A228 PolarHBondContact O-N 2.82Å; E226-A228 PolarHBondContact O-N 3.02Å; A228-A232 PolarHBondContact O-N 3.44Å; A228-A232 VanDerWaalsContact O-N 3.13Å |
| 229 | R | 91.4 | Very high | 85.9 | Confident | 64 Ų | 64 | 39.1 Ų | 39.1 | 24% | 0.242 | 22% | 0.217 | C | C | . | . | H | α-helix | trans | -68.6 | -44.6 | 176.5 | -174 | -170.2 | 72.9 | -145.7 | -2.7 | 111.4 | M1 F214 F225 E226 S227 L231 A232 I233 | M1-R229 HydrophobicContact SD-CG 4.06Å; F214-R229 HydrophobicContact CZ-CB 4.32Å; F225-R229 VanDerWaalsContact O-CB 3.28Å; F225-R229 WeakPolarHBondContact O-CB 3.46Å; F225-R229 PolarHBondContact O-N 3.34Å; E226-R229 PolarHBondContact O-N 3.16Å; E226-R229 IonicContact OE1-CZ 2.87Å; E226-R229 IonicContact OE1-NH1 3.06Å; E226-R229 PolarHBondContact OE1-NH1 3.47Å; E226-R229 IonicContact OE1-NH2 3.79Å; E226-R229 IonicContact OE2-CZ 3.79Å; E226-R229 IonicContact OE2-NH1 3.66Å; E226-R229 PolarHBondContact OE2-NH1 2.86Å; E226-R229 IonicContact OE2-NH2 3.83Å; E226-R229 PolarHBondContact OE2-NH2 2.87Å; S227-R229 VanDerWaalsContact C-N 3.33Å; S227-R229 PolarHBondContact O-N 2.64Å; R229-L231 VanDerWaalsContact C-N 3.34Å; R229-A232 PolarHBondContact O-N 2.89Å; R229-I233 HydrophobicContact CG-CD1 4.02Å; R229-I233 WeakPolarHBondContact O-CG1 3.3Å; R229-I233 PolarHBondContact O-N 3.31Å |
| 230 | N | 87.4 | Confident | 86.2 | Confident | 25 Ų | 25 | 37.5 Ų | 37.5 | 13% | 0.134 | 21% | 0.21 | C | C | . | . | H | α-helix | trans | -66.6 | -39.5 | -178.8 | -67.5 | -0.4 | 0 | 0 | 0 | 110.5 | E226 S227 A232 I233 G234 L339 G340 | E226-N230 WeakPolarHBondContact O-CB 3.4Å; E226-N230 PolarHBondContact O-N 3.16Å; E226-N230 PolarHBondContact O-OD1 3.47Å; S227-N230 PolarHBondContact O-N 3.44Å; N230-A232 PolarHBondContact O-N 3.46Å; N230-I233 PolarHBondContact O-N 2.88Å; N230-G234 PolarHBondContact O-N 2.97Å; N230-L339 VanDerWaalsContact CG-O 3.28Å; N230-L339 PolarHBondContact ND2-O 2.65Å; N230-L339 VanDerWaalsContact ND2-O 3.16Å; N230-L339 PolarHBondContact OD1-O 3.11Å; N230-G340 WeakPolarHBondContact ND2-CA 3.5Å; N230-G340 PolarHBondContact ND2-OXT 3.44Å |
| 231 | L | 86.1 | Confident | 86.4 | Confident | 33 Ų | 33 | 34.8 Ų | 34.8 | 17% | 0.173 | 19% | 0.193 | C | C | . | . | H | α-helix | trans | -56.9 | -48 | 169.9 | 179 | 64.1 | 0 | 0 | 0 | 112.1 | A209 S227 R229 I233 G234 I235 | A209-L231 HydrophobicContact CB-CD2 4.28Å; S227-L231 WeakPolarHBondContact O-CB 3.4Å; S227-L231 PolarHBondContact O-N 2.94Å; R229-L231 VanDerWaalsContact C-N 3.34Å; L231-I233 VanDerWaalsContact C-N 3.3Å; L231-I233 PolarHBondContact O-N 3.48Å; L231-G234 PolarHBondContact O-N 2.92Å; L231-I235 HydrophobicContact CD1-CD1 3.95Å; L231-I235 HydrophobicContact CD1-CG1 4.41Å; L231-I235 HydrophobicContact CG-CD1 4.03Å; L231-I235 WeakPolarHBondContact O-CG1 3.49Å; L231-I235 PolarHBondContact O-N 3.01Å |
| 232 | A | 92.3 | Very high | 86.9 | Confident | 0 Ų | 0 | 28.3 Ų | 28.3 | 0% | 0 | 15% | 0.153 | C | C | . | . | H | α-helix | trans | -64.1 | -34 | 177.8 | 0 | 0 | 0 | 0 | 0 | 112.9 | M1 T18 V210 F214 A228 R229 N230 G236 | M1-A232 HydrophobicContact SD-CB 4.07Å; T18-A232 VanDerWaalsContact CG2-O 3.23Å; T18-A232 WeakPolarHBondContact CG2-O 3.28Å; V210-A232 HydrophobicContact CG1-CB 3.88Å; V210-A232 HydrophobicContact CG2-CB 4.12Å; F214-A232 HydrophobicContact CE2-CB 4.1Å; A228-A232 PolarHBondContact O-N 3.44Å; A228-A232 VanDerWaalsContact O-N 3.13Å; R229-A232 PolarHBondContact O-N 2.89Å; N230-A232 PolarHBondContact O-N 3.46Å; A232-G236 PolarHBondContact O-N 3.3Å |
| 233 | I | 89.3 | Confident | 87.6 | Confident | 37 Ų | 37 | 25.6 Ų | 25.6 | 19% | 0.19 | 13% | 0.134 | C | C | . | . | H | α-helix | trans | -69 | -47.3 | 175.4 | -70.6 | 167.9 | 0 | 0 | 0 | 110.7 | F17 R229 N230 L231 I235 G236 I237 L339 | F17-I233 HydrophobicContact CE1-CG1 4.44Å; R229-I233 HydrophobicContact CG-CD1 4.02Å; R229-I233 WeakPolarHBondContact O-CG1 3.3Å; R229-I233 PolarHBondContact O-N 3.31Å; N230-I233 PolarHBondContact O-N 2.88Å; L231-I233 VanDerWaalsContact C-N 3.3Å; L231-I233 PolarHBondContact O-N 3.48Å; I233-I235 PolarHBondContact O-N 3.06Å; I233-G236 PolarHBondContact O-N 3.24Å; I233-G236 VanDerWaalsContact O-N 3.17Å; I233-I237 HydrophobicContact CG2-CD1 3.7Å; I233-I237 HydrophobicContact CG2-CG1 4.43Å; I233-I237 VanDerWaalsContact O-CG1 3.31Å; I233-I237 WeakPolarHBondContact O-CG1 3.45Å; I233-I237 PolarHBondContact O-N 2.72Å; I233-L339 HydrophobicContact CG2-CD1 4.15Å |
| 234 | G | 84.6 | Confident | 87.6 | Confident | 2 Ų | 2 | 25.3 Ų | 25.3 | 2% | 0.021 | 13% | 0.13 | C | C | . | . | H | α-helix | trans | -57.6 | -48.3 | 177.8 | 0 | 0 | 0 | 0 | 0 | 111.9 | N230 L231 I237 Q238 M332 | N230-G234 PolarHBondContact O-N 2.97Å; L231-G234 PolarHBondContact O-N 2.92Å; G234-I237 PolarHBondContact O-N 3.27Å; G234-Q238 PolarHBondContact O-N 3.19Å; G234-M332 WeakPolarHBondContact O-CE 3.43Å |
| 235 | I | 89 | Confident | 87.1 | Confident | 1 Ų | 1 | 22.7 Ų | 22.7 | 1% | 0.005 | 12% | 0.115 | C | C | . | . | H | α-helix | trans | -60.7 | -47.7 | 173.2 | -67.3 | 170 | 0 | 0 | 0 | 110.4 | T18 E206 A209 V210 L231 I233 I237 Q238 N239 | T18-I235 HydrophobicContact CG2-CB 4.11Å; T18-I235 HydrophobicContact CG2-CG2 3.79Å; E206-I235 HydrophobicContact CB-CD1 4.37Å; E206-I235 HydrophobicContact CB-CG2 3.96Å; E206-I235 HydrophobicContact CG-CG2 4.37Å; A209-I235 HydrophobicContact CB-CD1 4.4Å; V210-I235 HydrophobicContact CG2-CD1 3.63Å; L231-I235 HydrophobicContact CD1-CD1 3.95Å; L231-I235 HydrophobicContact CD1-CG1 4.41Å; L231-I235 HydrophobicContact CG-CD1 4.03Å; L231-I235 WeakPolarHBondContact O-CG1 3.49Å; L231-I235 PolarHBondContact O-N 3.01Å; I233-I235 PolarHBondContact O-N 3.06Å; I235-I237 VanDerWaalsContact C-N 3.29Å; I235-I237 PolarHBondContact O-N 3.46Å; I235-Q238 WeakPolarHBondContact O-CG 3.44Å; I235-Q238 PolarHBondContact O-N 3.43Å; I235-N239 VanDerWaalsContact O-CG 3.24Å; I235-N239 PolarHBondContact O-N 3.33Å; I235-N239 VanDerWaalsContact O-N 3.11Å; I235-N239 PolarHBondContact O-OD1 3.18Å |
| 236 | G | 90.8 | Very high | 86.9 | Confident | 0 Ų | 0 | 21 Ų | 21 | 0% | 0 | 11% | 0.108 | C | C | . | . | H | α-helix | trans | -59.2 | -40.1 | -178.3 | 0 | 0 | 0 | 0 | 0 | 113.5 | L21 A232 I233 Q238 N239 F240 | L21-G236 WeakPolarHBondContact CB-O 2.98Å; L21-G236 WeakPolarHBondContact CD1-O 3.3Å; A232-G236 PolarHBondContact O-N 3.3Å; I233-G236 PolarHBondContact O-N 3.24Å; I233-G236 VanDerWaalsContact O-N 3.17Å; G236-Q238 VanDerWaalsContact C-N 3.32Å; G236-Q238 PolarHBondContact O-N 2.87Å; G236-N239 PolarHBondContact O-N 3.15Å; G236-F240 PolarHBondContact O-N 2.83Å |
| 237 | I | 84.9 | Confident | 86.8 | Confident | 34 Ų | 34 | 17.2 Ų | 17.2 | 17% | 0.174 | 9% | 0.09 | C | C | . | . | H | α-helix | trans | -62.3 | -40.9 | -177.7 | -71.6 | 162.4 | 0 | 0 | 0 | 111.5 | I233 G234 I235 P241 M332 L335 L339 | I233-I237 HydrophobicContact CG2-CD1 3.7Å; I233-I237 HydrophobicContact CG2-CG1 4.43Å; I233-I237 VanDerWaalsContact O-CG1 3.31Å; I233-I237 WeakPolarHBondContact O-CG1 3.45Å; I233-I237 PolarHBondContact O-N 2.72Å; G234-I237 PolarHBondContact O-N 3.27Å; I235-I237 VanDerWaalsContact C-N 3.29Å; I235-I237 PolarHBondContact O-N 3.46Å; I237-P241 WeakPolarHBondContact O-CD 3.29Å; I237-M332 HydrophobicContact CB-SD 4.17Å; I237-M332 HydrophobicContact CG2-SD 3.53Å; I237-M332 VanDerWaalsContact CG2-SD 3.53Å; I237-L335 HydrophobicContact CD1-CB 3.92Å; I237-L335 HydrophobicContact CD1-CD1 4.02Å; I237-L335 HydrophobicContact CD1-CG 4.39Å; I237-L335 HydrophobicContact CG2-CD1 3.78Å; I237-L339 HydrophobicContact CD1-CD1 4.39Å |
| 238 | Q | 85.6 | Confident | 86.7 | Confident | 2 Ų | 2 | 14.4 Ų | 14.4 | 1% | 0.009 | 7% | 0.07 | C | C | . | . | H | α-helix | trans | -81.1 | -23.7 | -176.9 | 76.2 | 96.8 | 39.5 | 0 | 0 | 112.8 | V50 A54 E206 G234 I235 G236 F240 P241 E242 M300 M332 | V50-Q238 HydrophobicContact CG1-CB 3.99Å; A54-Q238 HydrophobicContact CB-CB 3.47Å; A54-Q238 VanDerWaalsContact CB-CB 3.47Å; A54-Q238 HydrophobicContact CB-CG 3.68Å; E206-Q238 PolarHBondContact OE1-NE2 3.22Å; E206-Q238 PolarHBondContact OE2-NE2 3.16Å; G234-Q238 PolarHBondContact O-N 3.19Å; I235-Q238 WeakPolarHBondContact O-CG 3.44Å; I235-Q238 PolarHBondContact O-N 3.43Å; G236-Q238 VanDerWaalsContact C-N 3.32Å; G236-Q238 PolarHBondContact O-N 2.87Å; Q238-F240 PolarHBondContact O-N 2.74Å; Q238-P241 WeakPolarHBondContact O-CD 3.46Å; Q238-E242 PolarHBondContact NE2-OE1 3.36Å; Q238-E242 PolarHBondContact OE1-OE1 3.07Å; Q238-M300 PolarHBondContact OE1-SD 3.47Å; Q238-M332 HydrophobicContact CB-CE 4.46Å; Q238-M332 HydrophobicContact CB-SD 4.49Å |
| 239 | N | 90.1 | Very high | 86 | Confident | 0 Ų | 0 | 16.3 Ų | 16.3 | 0% | 0 | 8% | 0.082 | C | C | . | . | H | α-helix | trans | -66.5 | -24.5 | 172.4 | -69.4 | 29.8 | 0 | 0 | 0 | 112.5 | T22 E206 I235 G236 E242 G243 E271 | T22-N239 WeakPolarHBondContact CA-O 3.13Å; T22-N239 WeakPolarHBondContact OG1-CB 3.33Å; E206-N239 PolarHBondContact OE2-ND2 3.33Å; E206-N239 PolarHBondContact OE2-OD1 3.13Å; E206-N239 VanDerWaalsContact OE2-OD1 3.07Å; I235-N239 VanDerWaalsContact O-CG 3.24Å; I235-N239 PolarHBondContact O-N 3.33Å; I235-N239 VanDerWaalsContact O-N 3.11Å; I235-N239 PolarHBondContact O-OD1 3.18Å; G236-N239 PolarHBondContact O-N 3.15Å; N239-E242 WeakPolarHBondContact O-CB 3.21Å; N239-E242 PolarHBondContact O-N 3.33Å; N239-G243 PolarHBondContact O-N 3.45Å; N239-G243 VanDerWaalsContact O-N 3.1Å; N239-E271 PolarHBondContact ND2-OE1 3.33Å; N239-E271 PolarHBondContact ND2-OE2 3.28Å; N239-E271 VanDerWaalsContact ND2-OE2 3.15Å |
| 240 | F | 87.2 | Confident | 85.4 | Confident | 71 Ų | 71 | 13.3 Ų | 13.3 | 31% | 0.311 | 7% | 0.071 | S | C | . | . | H | α-helix | trans | -60.4 | -54.3 | 174.5 | -177.3 | -79.1 | 0 | 0 | 0 | 112.4 | L21 A24 G25 L28 G236 Q238 E242 G243 L244 | L21-F240 HydrophobicContact CB-CB 4.36Å; L21-F240 WeakPolarHBondContact O-CA 3.44Å; A24-F240 HydrophobicContact CB-CD2 3.94Å; A24-F240 HydrophobicContact CB-CE2 3.85Å; G25-F240 VanDerWaalsContact CA-O 3.23Å; G25-F240 WeakPolarHBondContact CA-O 3.16Å; L28-F240 HydrophobicContact CD1-CE1 3.45Å; L28-F240 VanDerWaalsContact CD1-CE1 3.45Å; L28-F240 HydrophobicContact CD1-CZ 3.38Å; L28-F240 HydrophobicContact CD2-CZ 4.37Å; L28-F240 HydrophobicContact CG-CE1 4.36Å; L28-F240 HydrophobicContact CG-CZ 3.84Å; G236-F240 PolarHBondContact O-N 2.83Å; Q238-F240 PolarHBondContact O-N 2.74Å; F240-E242 PolarHBondContact O-N 3.44Å; F240-G243 PolarHBondContact O-N 3.1Å; F240-L244 PolarHBondContact O-N 3.04Å |
| 241 | P | 81.6 | Confident | 85.2 | Confident | 7 Ų | 7 | 14.7 Ų | 14.7 | 5% | 0.045 | 7% | 0.074 | C | C | . | . | H | α-helix | trans | -51.2 | -37.5 | 168.8 | -27.6 | 27.4 | 0 | 0 | 0 | 115.4 | A47 V50 I237 Q238 L244 A245 | A47-P241 HydrophobicContact CB-CB 3.71Å; V50-P241 HydrophobicContact CB-CG 3.84Å; V50-P241 HydrophobicContact CG1-CG 3.64Å; V50-P241 HydrophobicContact CG2-CG 4.19Å; I237-P241 WeakPolarHBondContact O-CD 3.29Å; Q238-P241 WeakPolarHBondContact O-CD 3.46Å; P241-L244 WeakPolarHBondContact O-CB 3.44Å; P241-L244 PolarHBondContact O-N 3.26Å; P241-A245 WeakPolarHBondContact O-CB 3.32Å; P241-A245 PolarHBondContact O-N 2.75Å |
| 242 | E | 85.4 | Confident | 84.6 | Confident | 1 Ų | 1 | 15.2 Ų | 15.2 | 1% | 0.005 | 9% | 0.088 | C | C | . | . | H | α-helix | trans | -67.5 | -44 | -177.2 | -65.1 | 176.3 | 177.9 | 0 | 0 | 113 | M51 H202 Q238 N239 F240 L244 A245 V246 | M51-E242 HydrophobicContact CE-CG 4.3Å; M51-E242 HydrophobicContact SD-CG 4.44Å; H202-E242 IonicContact CE1-OE1 3.83Å; H202-E242 PolarHBondContact CE1-OE1 3.43Å; H202-E242 IonicContact CE1-OE2 3.36Å; H202-E242 PolarHBondContact CE1-OE2 3.5Å; H202-E242 IonicContact ND1-OE1 2.8Å; H202-E242 IonicContact NE2-OE2 3.91Å; Q238-E242 PolarHBondContact NE2-OE1 3.36Å; Q238-E242 PolarHBondContact OE1-OE1 3.07Å; N239-E242 WeakPolarHBondContact O-CB 3.21Å; N239-E242 PolarHBondContact O-N 3.33Å; F240-E242 PolarHBondContact O-N 3.44Å; E242-L244 PolarHBondContact O-N 3.32Å; E242-A245 WeakPolarHBondContact O-CB 3.27Å; E242-A245 PolarHBondContact O-N 2.98Å; E242-V246 PolarHBondContact O-N 3.37Å |
| 243 | G | 88.9 | Confident | 83.7 | Confident | 0 Ų | 0 | 17.4 Ų | 17.4 | 0% | 0 | 10% | 0.103 | C | C | . | . | H | α-helix | trans | -59.6 | -35.3 | 175.4 | 0 | 0 | 0 | 0 | 0 | 112.1 | T22 A26 N239 F240 S247 | T22-G243 WeakPolarHBondContact O-CA 3.49Å; A26-G243 WeakPolarHBondContact CA-O 3.36Å; N239-G243 PolarHBondContact O-N 3.45Å; N239-G243 VanDerWaalsContact O-N 3.1Å; F240-G243 PolarHBondContact O-N 3.1Å; G243-S247 WeakPolarHBondContact O-CB 3.47Å; G243-S247 PolarHBondContact O-N 3.24Å; G243-S247 VanDerWaalsContact O-N 3.11Å; G243-S247 PolarHBondContact O-OG 2.98Å |
| 244 | L | 84.2 | Confident | 83.2 | Confident | 12 Ų | 12 | 19 Ų | 19 | 6% | 0.063 | 13% | 0.128 | C | C | . | . | H | α-helix | trans | -69.8 | -42.9 | 172.9 | 177.5 | 143.9 | 0 | 0 | 0 | 111.7 | L28 F240 P241 E242 V246 S247 L248 | L28-L244 HydrophobicContact CB-CD1 4.05Å; L28-L244 HydrophobicContact CD1-CD1 3.58Å; L28-L244 HydrophobicContact CG-CD1 4.47Å; F240-L244 PolarHBondContact O-N 3.04Å; P241-L244 WeakPolarHBondContact O-CB 3.44Å; P241-L244 PolarHBondContact O-N 3.26Å; E242-L244 PolarHBondContact O-N 3.32Å; L244-V246 PolarHBondContact O-N 3.11Å; L244-S247 PolarHBondContact O-N 3.22Å; L244-S247 PolarHBondContact O-OG 3.29Å; L244-L248 HydrophobicContact CD1-CD1 3.9Å; L244-L248 HydrophobicContact CD2-CD1 3.51Å; L244-L248 HydrophobicContact CD2-CG 4.37Å; L244-L248 HydrophobicContact CG-CD1 3.49Å; L244-L248 VanDerWaalsContact CG-CD1 3.49Å; L244-L248 HydrophobicContact CG-CG 3.99Å; L244-L248 WeakPolarHBondContact O-CB 3.18Å; L244-L248 PolarHBondContact O-N 3.3Å |
| 245 | A | 78.1 | Confident | 83.2 | Confident | 6 Ų | 6 | 19.6 Ų | 19.6 | 5% | 0.05 | 13% | 0.132 | C | C | . | . | H | α-helix | trans | -62.8 | -29.1 | 179.6 | 0 | 0 | 0 | 0 | 0 | 112.8 | P241 E242 P249 | P241-A245 WeakPolarHBondContact O-CB 3.32Å; P241-A245 PolarHBondContact O-N 2.75Å; E242-A245 WeakPolarHBondContact O-CB 3.27Å; E242-A245 PolarHBondContact O-N 2.98Å; A245-P249 WeakPolarHBondContact O-CD 3.33Å; A245-P249 WeakPolarHBondContact O-CG 3.4Å |
| 246 | V | 84.8 | Confident | 83.2 | Confident | 1 Ų | 1 | 22.6 Ų | 22.6 | 1% | 0.006 | 15% | 0.153 | C | C | . | . | H | α-helix | trans | -78.8 | -53.6 | 171.1 | 174.5 | 0 | 0 | 0 | 0 | 111.5 | I196 I199 E242 L244 P249 L250 | I196-V246 HydrophobicContact CD1-CG1 4.33Å; I196-V246 HydrophobicContact CG1-CG1 3.62Å; I199-V246 HydrophobicContact CB-CG2 4.28Å; I199-V246 HydrophobicContact CD1-CG2 3.4Å; I199-V246 VanDerWaalsContact CD1-CG2 3.4Å; I199-V246 HydrophobicContact CG1-CG2 4.42Å; I199-V246 HydrophobicContact CG2-CG2 4.04Å; E242-V246 PolarHBondContact O-N 3.37Å; L244-V246 PolarHBondContact O-N 3.11Å; V246-P249 WeakPolarHBondContact O-CD 3.33Å; V246-L250 HydrophobicContact CG1-CD1 3.69Å; V246-L250 WeakPolarHBondContact O-CD1 3.47Å; V246-L250 PolarHBondContact O-N 3.4Å |
| 247 | S | 88.4 | Confident | 83.2 | Confident | 0 Ų | 0 | 24.4 Ų | 24.4 | 0% | 0 | 16% | 0.164 | C | C | . | . | H | α-helix | trans | -72.2 | -33.3 | -167.9 | 60.4 | 0 | 0 | 0 | 0 | 114.3 | A26 G243 L244 L250 R251 A260 | A26-S247 WeakPolarHBondContact CA-OG 3.46Å; A26-S247 PolarHBondContact O-OG 3.21Å; G243-S247 WeakPolarHBondContact O-CB 3.47Å; G243-S247 PolarHBondContact O-N 3.24Å; G243-S247 VanDerWaalsContact O-N 3.11Å; G243-S247 PolarHBondContact O-OG 2.98Å; L244-S247 PolarHBondContact O-N 3.22Å; L244-S247 PolarHBondContact O-OG 3.29Å; S247-L250 WeakPolarHBondContact O-CB 3.48Å; S247-R251 PolarHBondContact O-N 2.6Å; S247-A260 WeakPolarHBondContact CB-O 3.34Å; S247-A260 WeakPolarHBondContact O-CB 3.46Å |
| 248 | L | 81.8 | Confident | 83.7 | Confident | 4 Ų | 4 | 29.6 Ų | 29.6 | 2% | 0.021 | 18% | 0.181 | C | C | . | . | H | α-helix | trans | -69.4 | -48.5 | -179.2 | -78.5 | -179.4 | 0 | 0 | 0 | 113.3 | V29 F32 L40 L244 L250 R251 G252 | V29-L248 HydrophobicContact CG2-CD2 4.33Å; F32-L248 HydrophobicContact CB-CD2 4.38Å; L40-L248 HydrophobicContact CD1-CB 4.02Å; L40-L248 HydrophobicContact CD1-CD1 3.85Å; L40-L248 HydrophobicContact CD1-CG 4.49Å; L244-L248 HydrophobicContact CD1-CD1 3.9Å; L244-L248 HydrophobicContact CD2-CD1 3.51Å; L244-L248 HydrophobicContact CD2-CG 4.37Å; L244-L248 HydrophobicContact CG-CD1 3.49Å; L244-L248 VanDerWaalsContact CG-CD1 3.49Å; L244-L248 HydrophobicContact CG-CG 3.99Å; L244-L248 WeakPolarHBondContact O-CB 3.18Å; L244-L248 PolarHBondContact O-N 3.3Å; L248-L250 VanDerWaalsContact C-N 3.32Å; L248-L250 PolarHBondContact O-N 2.88Å; L248-R251 PolarHBondContact O-N 3.02Å; L248-G252 PolarHBondContact O-N 3.46Å |
| 249 | P | 73.4 | Confident | 83.9 | Confident | 43 Ų | 43 | 32 Ų | 32 | 28% | 0.279 | 20% | 0.196 | S | C | . | . | H | α-helix | trans | -60.2 | -40 | 174.3 | -27 | 37.4 | 0 | 0 | 0 | 112.9 | A245 V246 R251 G252 S253 | A245-P249 WeakPolarHBondContact O-CD 3.33Å; A245-P249 WeakPolarHBondContact O-CG 3.4Å; V246-P249 WeakPolarHBondContact O-CD 3.33Å; P249-R251 PolarHBondContact O-N 3.17Å; P249-G252 CarbonylContact O-C 3.54Å; P249-G252 WeakPolarHBondContact O-CA 3.36Å; P249-G252 PolarHBondContact O-N 2.92Å; P249-G252 VanDerWaalsContact O-N 3.07Å; P249-S253 PolarHBondContact O-N 3.48Å |
| 250 | L | 80.4 | Confident | 83.9 | Confident | 0 Ų | 0 | 32 Ų | 32 | 0% | 0 | 20% | 0.196 | C | C | . | . | H | α-helix | trans | -55 | -50.8 | 172.1 | -91.5 | 157.4 | 0 | 0 | 0 | 111.8 | W189 I192 I196 V246 S247 L248 G252 S253 V255 A260 Y263 | W189-L250 HydrophobicContact CZ3-CD2 3.95Å; I192-L250 HydrophobicContact CG2-CD1 4.24Å; I192-L250 HydrophobicContact CG2-CD2 3.47Å; I192-L250 VanDerWaalsContact CG2-CD2 3.47Å; I192-L250 HydrophobicContact CG2-CG 3.46Å; I192-L250 VanDerWaalsContact CG2-CG 3.46Å; I196-L250 HydrophobicContact CD1-CD1 4Å; V246-L250 HydrophobicContact CG1-CD1 3.69Å; V246-L250 WeakPolarHBondContact O-CD1 3.47Å; V246-L250 PolarHBondContact O-N 3.4Å; S247-L250 WeakPolarHBondContact O-CB 3.48Å; L248-L250 VanDerWaalsContact C-N 3.32Å; L248-L250 PolarHBondContact O-N 2.88Å; L250-G252 VanDerWaalsContact C-N 3.25Å; L250-G252 PolarHBondContact O-N 3.2Å; L250-S253 PolarHBondContact O-N 3.43Å; L250-S253 PolarHBondContact O-OG 3.46Å; L250-V255 HydrophobicContact CD2-CG2 4.17Å; L250-V255 WeakPolarHBondContact O-CB 3.17Å; L250-V255 WeakPolarHBondContact O-CG2 3.18Å; L250-V255 PolarHBondContact O-N 2.92Å; L250-A260 HydrophobicContact CB-CB 3.79Å; L250-Y263 VanDerWaalsContact CD1-CB 3.47Å; L250-Y263 HydrophobicContact CD1-CG 4.27Å; L250-Y263 HydrophobicContact CD2-CD2 4.33Å |
| 251 | R | 81.7 | Confident | 84.3 | Confident | 55 Ų | 55 | 30 Ų | 30 | 21% | 0.208 | 19% | 0.187 | C | C | . | . | H | α-helix | trans | -64.9 | -34.3 | 176.2 | -177.2 | 168.2 | -177.8 | -150.5 | 9.8 | 111.8 | V29 F32 S247 L248 P249 S253 G254 T257 A260 | V29-R251 HydrophobicContact CG2-CB 3.67Å; V29-R251 HydrophobicContact CG2-CG 4.17Å; V29-R251 PolarHBondContact O-NH1 2.76Å; F32-R251 PolarHBondContact O-NH1 3.03Å; S247-R251 PolarHBondContact O-N 2.6Å; L248-R251 PolarHBondContact O-N 3.02Å; P249-R251 PolarHBondContact O-N 3.17Å; R251-S253 VanDerWaalsContact C-N 3.31Å; R251-S253 PolarHBondContact O-N 3.2Å; R251-G254 PolarHBondContact O-N 3.45Å; R251-T257 PolarHBondContact NE-OG1 3.11Å; R251-A260 HydrophobicContact CB-CB 4.09Å |
| 252 | G | 74.6 | Confident | 84.9 | Confident | 44 Ų | 44 | 34.9 Ų | 34.9 | 45% | 0.454 | 21% | 0.205 | S | C | . | . | H | α-helix | trans | -60 | -35.1 | 175.1 | 0 | 0 | 0 | 0 | 0 | 113.9 | L248 P249 L250 G254 | L248-G252 PolarHBondContact O-N 3.46Å; P249-G252 CarbonylContact O-C 3.54Å; P249-G252 WeakPolarHBondContact O-CA 3.36Å; P249-G252 PolarHBondContact O-N 2.92Å; P249-G252 VanDerWaalsContact O-N 3.07Å; L250-G252 VanDerWaalsContact C-N 3.25Å; L250-G252 PolarHBondContact O-N 3.2Å; G252-G254 PolarHBondContact O-N 3.45Å |
| 253 | S | 73.4 | Confident | 85.2 | Confident | 45 Ų | 45 | 39.5 Ų | 39.5 | 32% | 0.315 | 22% | 0.223 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -79.8 | 5.7 | 177.9 | 69.8 | 0 | 0 | 0 | 0 | 114.4 | I192 P249 L250 R251 V255 | I192-S253 VanDerWaalsContact CD1-OG 3.32Å; I192-S253 WeakPolarHBondContact CD1-OG 3.3Å; P249-S253 PolarHBondContact O-N 3.48Å; L250-S253 PolarHBondContact O-N 3.43Å; L250-S253 PolarHBondContact O-OG 3.46Å; R251-S253 VanDerWaalsContact C-N 3.31Å; R251-S253 PolarHBondContact O-N 3.2Å; S253-V255 WeakPolarHBondContact OG-CG2 3.36Å |
| 254 | G | 77.8 | Confident | 85.3 | Confident | 70 Ų | 70 | 39.5 Ų | 39.5 | 72% | 0.722 | 22% | 0.223 | S | C | * | . | T | Hydrogen-bonded Turn | trans | 96.4 | 6.2 | 176.3 | 0 | 0 | 0 | 0 | 0 | 114.5 | R251 G252 | R251-G254 PolarHBondContact O-N 3.45Å; G252-G254 PolarHBondContact O-N 3.45Å |
| 255 | V | 84.2 | Confident | 85.8 | Confident | 16 Ų | 16 | 39.7 Ų | 39.7 | 10% | 0.097 | 22% | 0.223 | C | C | . | . | trans | -71.5 | 146.8 | 177.4 | -170.1 | 0 | 0 | 0 | 0 | 110.8 | W189 L250 S253 T259 | W189-V255 HydrophobicContact CH2-CB 4.12Å; W189-V255 HydrophobicContact CH2-CG1 3.96Å; W189-V255 HydrophobicContact CH2-CG2 3.01Å; W189-V255 HydrophobicContact CZ2-CG2 3.27Å; W189-V255 HydrophobicContact CZ3-CG2 3.72Å; L250-V255 HydrophobicContact CD2-CG2 4.17Å; L250-V255 WeakPolarHBondContact O-CB 3.17Å; L250-V255 WeakPolarHBondContact O-CG2 3.18Å; L250-V255 PolarHBondContact O-N 2.92Å; S253-V255 WeakPolarHBondContact OG-CG2 3.36Å; V255-T259 HydrophobicContact CG1-CG2 3.44Å; V255-T259 VanDerWaalsContact CG1-CG2 3.44Å | ||
| 256 | S | 90.8 | Very high | 86.6 | Confident | 64 Ų | 64 | 42.8 Ų | 42.8 | 45% | 0.448 | 24% | 0.239 | S | C | . | . | trans | -58.7 | 143.6 | 176.7 | 90.3 | 0 | 0 | 0 | 0 | 111 | W258 T259 A260 | S256-W258 PolarHBondContact O-N 2.85Å; S256-W258 VanDerWaalsContact O-N 3.15Å; S256-T259 PolarHBondContact O-N 3.49Å; S256-T259 VanDerWaalsContact O-N 3.09Å; S256-T259 WeakPolarHBondContact OG-CB 3.32Å; S256-T259 PolarHBondContact OG-N 3.16Å; S256-T259 VanDerWaalsContact OG-N 3.15Å; S256-T259 PolarHBondContact OG-OG1 3.04Å; S256-A260 PolarHBondContact O-N 3.23Å | ||
| 257 | T | 90.3 | Very high | 86.9 | Confident | 38 Ų | 38 | 42.8 Ų | 42.8 | 23% | 0.233 | 24% | 0.239 | C | C | . | . | H | α-helix | trans | -54 | -37.1 | 179.4 | -46.6 | 0 | 0 | 0 | 0 | 112.1 | V29 F30 R251 F261 | V29-T257 HydrophobicContact CG1-CG2 3.87Å; V29-T257 HydrophobicContact CG2-CG2 4.36Å; V29-T257 WeakPolarHBondContact O-CG2 3.34Å; F30-T257 HydrophobicContact CD1-CG2 3.37Å; F30-T257 HydrophobicContact CE1-CG2 3.47Å; F30-T257 VanDerWaalsContact CE1-CG2 3.47Å; F30-T257 HydrophobicContact CG-CG2 4.04Å; F30-T257 HydrophobicContact CZ-CG2 4.19Å; R251-T257 PolarHBondContact NE-OG1 3.11Å; T257-F261 WeakPolarHBondContact O-CB 3.47Å; T257-F261 PolarHBondContact O-N 3.36Å |
| 258 | W | 94 | Very high | 87.1 | Confident | 143 Ų | 143 | 42.8 Ų | 42.8 | 54% | 0.542 | 24% | 0.239 | S | C | . | . | H | α-helix | trans | -69.1 | -44.1 | 179.5 | -163.4 | -121 | 0 | 0 | 0 | 111.9 | F30 S256 F261 W262 | F30-W258 AromaticContact CE1-CE3 3.8Å; F30-W258 HydrophobicContact CE1-CE3 3.8Å; F30-W258 HydrophobicContact CE1-CZ3 4.23Å; F30-W258 HydrophobicContact CE2-CE3 4.44Å; F30-W258 HydrophobicContact CE2-CZ3 4.29Å; F30-W258 AromaticContact CZ-CE3 3.37Å; F30-W258 HydrophobicContact CZ-CE3 3.37Å; F30-W258 AromaticContact CZ-CZ3 3.59Å; F30-W258 HydrophobicContact CZ-CZ3 3.59Å; S256-W258 PolarHBondContact O-N 2.85Å; S256-W258 VanDerWaalsContact O-N 3.15Å; W258-F261 HydrophobicContact CE3-CD1 4.23Å; W258-F261 HydrophobicContact CH2-CD1 4.18Å; W258-F261 HydrophobicContact CH2-CE1 4.11Å; W258-F261 AromaticContact CZ3-CD1 3.95Å; W258-F261 HydrophobicContact CZ3-CD1 3.95Å; W258-F261 HydrophobicContact CZ3-CE1 4.24Å; W258-F261 PolarHBondContact O-N 3.03Å; W258-W262 AromaticContact CD1-CD1 3.62Å; W258-W262 AromaticContact CD1-NE1 3.46Å; W258-W262 AromaticContact CE2-CD1 3.96Å; W258-W262 AromaticContact CE2-NE1 3.25Å; W258-W262 VanDerWaalsContact CE2-NE1 3.25Å; W258-W262 HydrophobicContact CZ2-CZ2 4.25Å; W258-W262 AromaticContact CZ2-NE1 3.69Å; W258-W262 AromaticContact NE1-CD1 3.61Å; W258-W262 AromaticContact NE1-NE1 2.93Å; W258-W262 PolarHBondContact O-N 3.28Å |
| 259 | T | 91.3 | Very high | 87.7 | Confident | 51 Ų | 51 | 46.8 Ų | 46.8 | 31% | 0.313 | 26% | 0.258 | S | S | . | . | H | α-helix | trans | -64.8 | -41.9 | 176.3 | -55.9 | 0 | 0 | 0 | 0 | 111 | V255 S256 F261 W262 Y263 | V255-T259 HydrophobicContact CG1-CG2 3.44Å; V255-T259 VanDerWaalsContact CG1-CG2 3.44Å; S256-T259 PolarHBondContact O-N 3.49Å; S256-T259 VanDerWaalsContact O-N 3.09Å; S256-T259 WeakPolarHBondContact OG-CB 3.32Å; S256-T259 PolarHBondContact OG-N 3.16Å; S256-T259 VanDerWaalsContact OG-N 3.15Å; S256-T259 PolarHBondContact OG-OG1 3.04Å; T259-F261 PolarHBondContact O-N 3.01Å; T259-W262 PolarHBondContact O-N 3.2Å; T259-Y263 HydrophobicContact CG2-CD2 3.72Å; T259-Y263 HydrophobicContact CG2-CE2 3.53Å; T259-Y263 VanDerWaalsContact O-CD2 3.25Å; T259-Y263 WeakPolarHBondContact O-CD2 3.47Å; T259-Y263 PolarHBondContact O-N 3.04Å |
| 260 | A | 90.4 | Very high | 88.7 | Confident | 0 Ų | 0 | 46.3 Ų | 46.3 | 0% | 0 | 26% | 0.255 | C | S | . | . | H | α-helix | trans | -61 | -43 | 176.1 | 0 | 0 | 0 | 0 | 0 | 112.4 | V29 S247 L250 R251 S256 G264 | V29-A260 HydrophobicContact CG2-CB 4.24Å; S247-A260 WeakPolarHBondContact CB-O 3.34Å; S247-A260 WeakPolarHBondContact O-CB 3.46Å; L250-A260 HydrophobicContact CB-CB 3.79Å; R251-A260 HydrophobicContact CB-CB 4.09Å; S256-A260 PolarHBondContact O-N 3.23Å; A260-G264 PolarHBondContact O-N 2.96Å |
| 261 | F | 94.6 | Very high | 89.4 | Confident | 31 Ų | 31 | 46.3 Ų | 46.3 | 14% | 0.136 | 26% | 0.255 | C | S | . | . | H | α-helix | trans | -60.3 | -46.3 | 172.6 | 167.7 | -108.7 | 0 | 0 | 0 | 112.2 | A26 A27 V29 F30 T257 W258 T259 Y263 G264 Q265 | A26-F261 HydrophobicContact CB-CD2 3.99Å; A26-F261 HydrophobicContact CB-CE2 4.41Å; A27-F261 HydrophobicContact CB-CD2 4.2Å; A27-F261 HydrophobicContact CB-CE2 3.97Å; V29-F261 HydrophobicContact CG1-CB 4.02Å; F30-F261 HydrophobicContact CE2-CB 3.73Å; F30-F261 HydrophobicContact CE2-CD1 4.22Å; F30-F261 AromaticContact CE2-CD2 3.9Å; F30-F261 HydrophobicContact CE2-CD2 3.9Å; F30-F261 AromaticContact CE2-CG 3.67Å; F30-F261 HydrophobicContact CE2-CG 3.67Å; F30-F261 HydrophobicContact CZ-CB 3.72Å; F30-F261 HydrophobicContact CZ-CD1 4.26Å; F30-F261 AromaticContact CZ-CG 3.95Å; F30-F261 HydrophobicContact CZ-CG 3.95Å; T257-F261 WeakPolarHBondContact O-CB 3.47Å; T257-F261 PolarHBondContact O-N 3.36Å; W258-F261 HydrophobicContact CE3-CD1 4.23Å; W258-F261 HydrophobicContact CH2-CD1 4.18Å; W258-F261 HydrophobicContact CH2-CE1 4.11Å; W258-F261 AromaticContact CZ3-CD1 3.95Å; W258-F261 HydrophobicContact CZ3-CD1 3.95Å; W258-F261 HydrophobicContact CZ3-CE1 4.24Å; W258-F261 PolarHBondContact O-N 3.03Å; T259-F261 PolarHBondContact O-N 3.01Å; F261-Y263 PolarHBondContact O-N 3.49Å; F261-G264 PolarHBondContact O-N 3.48Å; F261-Q265 HydrophobicContact CE1-CG 4.39Å; F261-Q265 HydrophobicContact CE2-CB 4.4Å; F261-Q265 HydrophobicContact CE2-CG 4.44Å; F261-Q265 HydrophobicContact CZ-CG 4.19Å; F261-Q265 WeakPolarHBondContact O-CG 3.48Å; F261-Q265 PolarHBondContact O-N 2.93Å |
| 262 | W | 94.8 | Very high | 90.1 | Very high | 109 Ų | 109 | 44.5 Ų | 44.5 | 41% | 0.413 | 25% | 0.25 | S | C | . | . | H | α-helix | trans | -58.9 | -49.6 | 179.3 | -87.5 | 113.6 | 0 | 0 | 0 | 112.5 | W258 T259 G264 Q265 L266 | W258-W262 AromaticContact CD1-CD1 3.62Å; W258-W262 AromaticContact CD1-NE1 3.46Å; W258-W262 AromaticContact CE2-CD1 3.96Å; W258-W262 AromaticContact CE2-NE1 3.25Å; W258-W262 VanDerWaalsContact CE2-NE1 3.25Å; W258-W262 HydrophobicContact CZ2-CZ2 4.25Å; W258-W262 AromaticContact CZ2-NE1 3.69Å; W258-W262 AromaticContact NE1-CD1 3.61Å; W258-W262 AromaticContact NE1-NE1 2.93Å; W258-W262 PolarHBondContact O-N 3.28Å; T259-W262 PolarHBondContact O-N 3.2Å; W262-G264 VanDerWaalsContact C-N 3.3Å; W262-G264 PolarHBondContact O-N 3.45Å; W262-Q265 HydrophobicContact CE3-CG 4.27Å; W262-Q265 PolarHBondContact O-N 2.89Å; W262-L266 HydrophobicContact CE3-CD1 4.43Å; W262-L266 HydrophobicContact CE3-CG 4.3Å; W262-L266 WeakPolarHBondContact O-CB 3.38Å; W262-L266 WeakPolarHBondContact O-CG 3.37Å; W262-L266 PolarHBondContact O-N 3.43Å |
| 263 | Y | 90.9 | Very high | 91.1 | Very high | 98 Ų | 98 | 47.3 Ų | 47.3 | 38% | 0.384 | 25% | 0.254 | S | S | . | . | H | α-helix | trans | -63 | -38.3 | 177.1 | -79.4 | -72.3 | 0 | 0 | 0 | 111.9 | I196 L250 T259 F261 L266 S267 | I196-Y263 HydrophobicContact CD1-CD1 4.03Å; I196-Y263 HydrophobicContact CD1-CG 4.23Å; L250-Y263 VanDerWaalsContact CD1-CB 3.47Å; L250-Y263 HydrophobicContact CD1-CG 4.27Å; L250-Y263 HydrophobicContact CD2-CD2 4.33Å; T259-Y263 HydrophobicContact CG2-CD2 3.72Å; T259-Y263 HydrophobicContact CG2-CE2 3.53Å; T259-Y263 VanDerWaalsContact O-CD2 3.25Å; T259-Y263 WeakPolarHBondContact O-CD2 3.47Å; T259-Y263 PolarHBondContact O-N 3.04Å; F261-Y263 PolarHBondContact O-N 3.49Å; Y263-L266 PolarHBondContact O-N 3.23Å; Y263-S267 PolarHBondContact O-N 3.48Å |
| 264 | G | 91.3 | Very high | 92 | Very high | 0 Ų | 0 | 45.5 Ų | 45.5 | 0% | 0 | 24% | 0.241 | C | C | . | . | H | α-helix | trans | -65.3 | -39.9 | 177.9 | 0 | 0 | 0 | 0 | 0 | 114.6 | A260 F261 W262 S267 | A260-G264 PolarHBondContact O-N 2.96Å; F261-G264 PolarHBondContact O-N 3.48Å; W262-G264 VanDerWaalsContact C-N 3.3Å; W262-G264 PolarHBondContact O-N 3.45Å; G264-S267 PolarHBondContact O-OG 2.93Å |
| 265 | Q | 95.3 | Very high | 92.8 | Very high | 15 Ų | 15 | 42.1 Ų | 42.1 | 7% | 0.07 | 21% | 0.207 | C | C | . | . | H | α-helix | trans | -82.7 | -26.8 | 176.7 | 72.9 | 89.5 | 77.6 | 0 | 0 | 112.6 | W19 A23 F261 W262 S267 G268 M269 | W19-Q265 VanDerWaalsContact CZ2-OE1 3.31Å; W19-Q265 PolarHBondContact NE1-O 2.83Å; W19-Q265 VanDerWaalsContact NE1-O 3.09Å; A23-Q265 HydrophobicContact CB-CB 3.8Å; F261-Q265 HydrophobicContact CE1-CG 4.39Å; F261-Q265 HydrophobicContact CE2-CB 4.4Å; F261-Q265 HydrophobicContact CE2-CG 4.44Å; F261-Q265 HydrophobicContact CZ-CG 4.19Å; F261-Q265 WeakPolarHBondContact O-CG 3.48Å; F261-Q265 PolarHBondContact O-N 2.93Å; W262-Q265 HydrophobicContact CE3-CG 4.27Å; W262-Q265 PolarHBondContact O-N 2.89Å; Q265-S267 VanDerWaalsContact C-N 3.31Å; Q265-G268 PolarHBondContact O-N 3.37Å; Q265-M269 PolarHBondContact O-N 3.32Å |
| 266 | L | 93.9 | Very high | 93.3 | Very high | 71 Ų | 71 | 44.5 Ų | 44.5 | 37% | 0.372 | 22% | 0.218 | S | C | . | . | H | α-helix | trans | -71.1 | -28.7 | 179.7 | -78.9 | 174 | 0 | 0 | 0 | 111.5 | W262 Y263 G268 M269 | W262-L266 HydrophobicContact CE3-CD1 4.43Å; W262-L266 HydrophobicContact CE3-CG 4.3Å; W262-L266 WeakPolarHBondContact O-CB 3.38Å; W262-L266 WeakPolarHBondContact O-CG 3.37Å; W262-L266 PolarHBondContact O-N 3.43Å; Y263-L266 PolarHBondContact O-N 3.23Å; L266-G268 VanDerWaalsContact C-N 3.26Å; L266-G268 PolarHBondContact O-N 3.03Å; L266-M269 HydrophobicContact CD2-CE 3.48Å; L266-M269 VanDerWaalsContact CD2-CE 3.48Å; L266-M269 HydrophobicContact CD2-SD 3.73Å; L266-M269 WeakPolarHBondContact O-CB 3.13Å; L266-M269 PolarHBondContact O-N 3.38Å; L266-M269 VanDerWaalsContact O-N 3.16Å |
| 267 | S | 91.2 | Very high | 93.4 | Very high | 1 Ų | 1 | 46.7 Ų | 46.7 | 1% | 0.007 | 22% | 0.224 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -61.8 | -33.3 | 176.8 | 60.9 | 0 | 0 | 0 | 0 | 112.7 | Y263 G264 Q265 | Y263-S267 PolarHBondContact O-N 3.48Å; G264-S267 PolarHBondContact O-OG 2.93Å; Q265-S267 VanDerWaalsContact C-N 3.31Å |
| 268 | G | 92.6 | Very high | 93.4 | Very high | 0 Ų | 0 | 44.9 Ų | 44.9 | 0% | 0 | 21% | 0.213 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -89 | -6.9 | 175.5 | 0 | 0 | 0 | 0 | 0 | 114.8 | Q265 L266 V270 E271 | Q265-G268 PolarHBondContact O-N 3.37Å; L266-G268 VanDerWaalsContact C-N 3.26Å; L266-G268 PolarHBondContact O-N 3.03Å; G268-V270 PolarHBondContact O-N 3.4Å; G268-E271 WeakPolarHBondContact CA-OE1 3.34Å; G268-E271 WeakPolarHBondContact O-CB 3.12Å; G268-E271 VanDerWaalsContact O-CG 3.3Å; G268-E271 WeakPolarHBondContact O-CG 3.08Å; G268-E271 PolarHBondContact O-N 3Å |
| 269 | M | 94.4 | Very high | 93.2 | Very high | 88 Ų | 88 | 38.6 Ų | 38.6 | 43% | 0.433 | 19% | 0.192 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -68.1 | -9.7 | -176.1 | -166.4 | 175.9 | 68.9 | 0 | 0 | 113.1 | Q265 L266 E271 P272 | Q265-M269 PolarHBondContact O-N 3.32Å; L266-M269 HydrophobicContact CD2-CE 3.48Å; L266-M269 VanDerWaalsContact CD2-CE 3.48Å; L266-M269 HydrophobicContact CD2-SD 3.73Å; L266-M269 WeakPolarHBondContact O-CB 3.13Å; L266-M269 PolarHBondContact O-N 3.38Å; L266-M269 VanDerWaalsContact O-N 3.16Å; M269-E271 VanDerWaalsContact C-N 3.31Å; M269-P272 WeakPolarHBondContact O-CD 3.31Å |
| 270 | V | 94.5 | Very high | 93.1 | Very high | 34 Ų | 34 | 40.1 Ų | 40.1 | 21% | 0.206 | 21% | 0.21 | C | C | . | . | H | α-helix | trans | -72.7 | -23.3 | 172.2 | -63.1 | 0 | 0 | 0 | 0 | 112.7 | T200 N203 I204 G268 I273 A274 | T200-V270 HydrophobicContact CG2-CG1 3.57Å; T200-V270 HydrophobicContact CG2-CG2 4.2Å; T200-V270 WeakPolarHBondContact O-CG2 3.36Å; N203-V270 HydrophobicContact CB-CG2 3.55Å; I204-V270 HydrophobicContact CG1-CB 4.15Å; I204-V270 HydrophobicContact CG1-CG2 4Å; G268-V270 PolarHBondContact O-N 3.4Å; V270-I273 PolarHBondContact O-N 3.42Å; V270-A274 VanDerWaalsContact O-CB 3.3Å; V270-A274 WeakPolarHBondContact O-CB 3.34Å; V270-A274 PolarHBondContact O-N 3.18Å |
| 271 | E | 94.8 | Very high | 93 | Very high | 0 Ų | 0 | 42 Ų | 42 | 0% | 0 | 23% | 0.226 | C | C | . | . | H | α-helix | trans | -63 | -46.5 | -175.9 | -55.9 | 162.2 | -135.2 | 0 | 0 | 112.4 | T15 T18 W19 T22 N203 N239 G268 M269 I273 A274 G275 | T15-E271 WeakPolarHBondContact CG2-O 3.23Å; T18-E271 WeakPolarHBondContact CB-OE2 3.36Å; T18-E271 PolarHBondContact OG1-OE2 2.89Å; W19-E271 PolarHBondContact N-OE2 2.91Å; W19-E271 VanDerWaalsContact N-OE2 3.16Å; T22-E271 PolarHBondContact OG1-OE1 3.3Å; N203-E271 HydrophobicContact CB-CG 3.9Å; N203-E271 PolarHBondContact OD1-OE1 3.18Å; N239-E271 PolarHBondContact ND2-OE1 3.33Å; N239-E271 PolarHBondContact ND2-OE2 3.28Å; N239-E271 VanDerWaalsContact ND2-OE2 3.15Å; G268-E271 WeakPolarHBondContact CA-OE1 3.34Å; G268-E271 WeakPolarHBondContact O-CB 3.12Å; G268-E271 VanDerWaalsContact O-CG 3.3Å; G268-E271 WeakPolarHBondContact O-CG 3.08Å; G268-E271 PolarHBondContact O-N 3Å; M269-E271 VanDerWaalsContact C-N 3.31Å; E271-I273 VanDerWaalsContact C-N 3.28Å; E271-I273 PolarHBondContact O-N 3.45Å; E271-A274 PolarHBondContact O-N 3.3Å; E271-G275 PolarHBondContact O-N 3.5Å |
| 272 | P | 96.6 | Very high | 92.6 | Very high | 16 Ų | 16 | 40.9 Ų | 40.9 | 10% | 0.104 | 22% | 0.221 | C | C | . | . | H | α-helix | trans | -60.9 | -36.2 | 177.2 | -23.9 | 35.9 | 0 | 0 | 0 | 114.1 | T15 L16 W19 M269 L276 | T15-P272 WeakPolarHBondContact OG1-CA 3.47Å; L16-P272 HydrophobicContact CD2-CB 4.48Å; L16-P272 HydrophobicContact CD2-CG 4.23Å; W19-P272 HydrophobicContact CB-CG 4.04Å; W19-P272 HydrophobicContact CG-CG 4.4Å; M269-P272 WeakPolarHBondContact O-CD 3.31Å; P272-L276 WeakPolarHBondContact O-CG 3.49Å; P272-L276 PolarHBondContact O-N 2.88Å; P272-L276 VanDerWaalsContact O-N 3.1Å |
| 273 | I | 95.7 | Very high | 92 | Very high | 104 Ų | 104 | 40.7 Ų | 40.7 | 53% | 0.533 | 23% | 0.232 | S | C | . | . | H | α-helix | trans | -68.7 | -49.4 | 177.9 | -57.4 | 172.1 | 0 | 0 | 0 | 109.2 | V270 E271 G275 L276 L277 | V270-I273 PolarHBondContact O-N 3.42Å; E271-I273 VanDerWaalsContact C-N 3.28Å; E271-I273 PolarHBondContact O-N 3.45Å; I273-G275 VanDerWaalsContact C-N 3.33Å; I273-G275 PolarHBondContact O-N 2.86Å; I273-L276 PolarHBondContact O-N 3.01Å; I273-L277 HydrophobicContact CG2-CD1 4.36Å; I273-L277 WeakPolarHBondContact O-CG 3.44Å; I273-L277 PolarHBondContact O-N 3.17Å; I273-L277 VanDerWaalsContact O-N 3.1Å |
| 274 | A | 93.2 | Very high | 91.6 | Very high | 6 Ų | 6 | 44 Ų | 44 | 5% | 0.05 | 25% | 0.249 | C | C | . | . | H | α-helix | trans | -60.2 | -40.8 | 177.7 | 0 | 0 | 0 | 0 | 0 | 112 | I204 L208 V270 E271 L277 G278 | I204-A274 HydrophobicContact CG2-CB 4.32Å; I204-A274 WeakPolarHBondContact O-CB 3.26Å; L208-A274 WeakPolarHBondContact CD2-O 3.29Å; L208-A274 HydrophobicContact CG-CB 4.21Å; V270-A274 VanDerWaalsContact O-CB 3.3Å; V270-A274 WeakPolarHBondContact O-CB 3.34Å; V270-A274 PolarHBondContact O-N 3.18Å; E271-A274 PolarHBondContact O-N 3.3Å; A274-L277 PolarHBondContact O-N 3.03Å; A274-G278 PolarHBondContact O-N 3.38Å |
| 275 | G | 94.4 | Very high | 91.2 | Very high | 0 Ų | 0 | 44.7 Ų | 44.7 | 0% | 0 | 25% | 0.254 | C | S | . | . | H | α-helix | trans | -69.4 | -38.2 | 178.9 | 0 | 0 | 0 | 0 | 0 | 114.2 | G207 G211 E271 I273 L277 G278 A279 | G207-G275 WeakPolarHBondContact O-CA 3.34Å; G207-G275 PolarHBondContact O-N 2.9Å; G211-G275 WeakPolarHBondContact CA-O 3.25Å; E271-G275 PolarHBondContact O-N 3.5Å; I273-G275 VanDerWaalsContact C-N 3.33Å; I273-G275 PolarHBondContact O-N 2.86Å; G275-L277 VanDerWaalsContact C-N 3.32Å; G275-L277 PolarHBondContact O-N 3.36Å; G275-G278 PolarHBondContact O-N 3.48Å; G275-A279 WeakPolarHBondContact O-CB 3.38Å; G275-A279 PolarHBondContact O-N 2.91Å |
| 276 | L | 94.8 | Very high | 90.7 | Very high | 65 Ų | 65 | 47.1 Ų | 47.1 | 34% | 0.34 | 27% | 0.265 | S | S | . | . | H | α-helix | trans | -61.9 | -42.8 | 171.4 | -75.7 | 176.2 | 0 | 0 | 0 | 111.4 | V8 L12 P272 I273 A279 A280 | V8-L276 HydrophobicContact CG1-CD2 3.7Å; L12-L276 HydrophobicContact CB-CD2 4.01Å; L12-L276 HydrophobicContact CD1-CD1 4.21Å; L12-L276 HydrophobicContact CD1-CD2 4.38Å; L12-L276 HydrophobicContact CD1-CG 4.32Å; P272-L276 WeakPolarHBondContact O-CG 3.49Å; P272-L276 PolarHBondContact O-N 2.88Å; P272-L276 VanDerWaalsContact O-N 3.1Å; I273-L276 PolarHBondContact O-N 3.01Å; L276-A279 PolarHBondContact O-N 2.86Å; L276-A280 WeakPolarHBondContact O-CB 3.38Å; L276-A280 PolarHBondContact O-N 3.18Å |
| 277 | L | 92.2 | Very high | 90.3 | Very high | 110 Ų | 110 | 46.2 Ų | 46.2 | 58% | 0.576 | 26% | 0.264 | S | S | * | . | H | α-helix | trans | -63.7 | -43.4 | 175.3 | -68.5 | 174.2 | 0 | 0 | 0 | 111.6 | I273 A274 G275 A279 A280 A281 | I273-L277 HydrophobicContact CG2-CD1 4.36Å; I273-L277 WeakPolarHBondContact O-CG 3.44Å; I273-L277 PolarHBondContact O-N 3.17Å; I273-L277 VanDerWaalsContact O-N 3.1Å; A274-L277 PolarHBondContact O-N 3.03Å; G275-L277 VanDerWaalsContact C-N 3.32Å; G275-L277 PolarHBondContact O-N 3.36Å; L277-A279 PolarHBondContact O-N 3.29Å; L277-A280 PolarHBondContact O-N 2.9Å; L277-A281 VanDerWaalsContact O-CB 3.27Å; L277-A281 WeakPolarHBondContact O-CB 3.37Å; L277-A281 PolarHBondContact O-N 3.29Å |
| 278 | G | 90.3 | Very high | 90.1 | Very high | 0 Ų | 0 | 51.5 Ų | 51.5 | 0% | 0 | 29% | 0.292 | C | S | . | . | H | α-helix | trans | -59.9 | -45.6 | 176.7 | 0 | 0 | 0 | 0 | 0 | 112.3 | V212 A274 G275 A280 A281 V282 | V212-G278 WeakPolarHBondContact CG2-O 3.13Å; A274-G278 PolarHBondContact O-N 3.38Å; G275-G278 PolarHBondContact O-N 3.48Å; G278-A280 VanDerWaalsContact C-N 3.34Å; G278-A280 PolarHBondContact O-N 3.44Å; G278-A281 PolarHBondContact O-N 2.93Å; G278-V282 VanDerWaalsContact O-CG2 3.29Å; G278-V282 WeakPolarHBondContact O-CG2 3.39Å; G278-V282 PolarHBondContact O-N 3.23Å |
| 279 | A | 90.9 | Very high | 89.7 | Confident | 12 Ų | 12 | 51.9 Ų | 51.9 | 10% | 0.099 | 29% | 0.293 | C | S | . | . | H | α-helix | trans | -66.7 | -33.2 | 177.3 | 0 | 0 | 0 | 0 | 0 | 113.2 | A11 G211 G275 L276 L277 V282 | A11-A279 HydrophobicContact CB-CB 3.51Å; G211-A279 WeakPolarHBondContact O-CA 3.43Å; G211-A279 WeakPolarHBondContact O-CB 3.41Å; G211-A279 PolarHBondContact O-N 3.49Å; G275-A279 WeakPolarHBondContact O-CB 3.38Å; G275-A279 PolarHBondContact O-N 2.91Å; L276-A279 PolarHBondContact O-N 2.86Å; L277-A279 PolarHBondContact O-N 3.29Å; A279-V282 WeakPolarHBondContact O-CG2 3.44Å |
| 280 | A | 89.1 | Confident | 89.5 | Confident | 82 Ų | 82 | 48 Ų | 48 | 68% | 0.678 | 28% | 0.275 | S | S | * | . | H | α-helix | trans | -78.4 | -33.9 | 177.4 | 0 | 0 | 0 | 0 | 0 | 112.9 | L276 L277 G278 | L276-A280 WeakPolarHBondContact O-CB 3.38Å; L276-A280 PolarHBondContact O-N 3.18Å; L277-A280 PolarHBondContact O-N 2.9Å; G278-A280 VanDerWaalsContact C-N 3.34Å; G278-A280 PolarHBondContact O-N 3.44Å |
| 281 | A | 88.1 | Confident | 89.4 | Confident | 41 Ų | 41 | 50 Ų | 50 | 34% | 0.339 | 28% | 0.279 | S | S | . | . | S | Bend | trans | -110.8 | 29.3 | -172.1 | 0 | 0 | 0 | 0 | 0 | 113.4 | L277 G278 V283 F284 A285 | L277-A281 VanDerWaalsContact O-CB 3.27Å; L277-A281 WeakPolarHBondContact O-CB 3.37Å; L277-A281 PolarHBondContact O-N 3.29Å; G278-A281 PolarHBondContact O-N 2.93Å; A281-V283 PolarHBondContact O-N 2.9Å; A281-F284 WeakPolarHBondContact O-CA 3.18Å; A281-F284 PolarHBondContact O-N 3.07Å; A281-A285 PolarHBondContact O-N 2.95Å |
| 282 | V | 86.3 | Confident | 89 | Confident | 7 Ų | 7 | 51 Ų | 51 | 4% | 0.042 | 29% | 0.287 | C | S | . | . | H | α-helix | trans | -47.8 | -43.6 | -174.7 | 175 | 0 | 0 | 0 | 0 | 113 | V212 A216 K219 G278 A279 F284 A285 E286 | V212-V282 HydrophobicContact CG1-CG1 4.05Å; A216-V282 HydrophobicContact CB-CG1 4.03Å; K219-V282 HydrophobicContact CD-CG1 4.12Å; G278-V282 VanDerWaalsContact O-CG2 3.29Å; G278-V282 WeakPolarHBondContact O-CG2 3.39Å; G278-V282 PolarHBondContact O-N 3.23Å; A279-V282 WeakPolarHBondContact O-CG2 3.44Å; V282-F284 PolarHBondContact O-N 3.48Å; V282-A285 PolarHBondContact O-N 2.85Å; V282-E286 WeakPolarHBondContact O-CB 3.49Å; V282-E286 PolarHBondContact O-N 2.97Å |
| 283 | V | 81.3 | Confident | 88.7 | Confident | 105 Ų | 105 | 50.3 Ų | 50.3 | 64% | 0.636 | 28% | 0.283 | S | S | * | . | H | α-helix | trans | -61.2 | -32.8 | -178.3 | 179 | 0 | 0 | 0 | 0 | 112.4 | A281 | A281-V283 PolarHBondContact O-N 2.9Å |
| 284 | F | 83.9 | Confident | 88.6 | Confident | 168 Ų | 168 | 45.4 Ų | 45.4 | 74% | 0.737 | 26% | 0.257 | S | S | * | . | H | α-helix | trans | -88.4 | -33.9 | 177.8 | -63.7 | -76.4 | 0 | 0 | 0 | 112.4 | A281 V282 | A281-F284 WeakPolarHBondContact O-CA 3.18Å; A281-F284 PolarHBondContact O-N 3.07Å; V282-F284 PolarHBondContact O-N 3.48Å |
| 285 | A | 82.8 | Confident | 88.5 | Confident | 14 Ų | 14 | 47.1 Ų | 47.1 | 12% | 0.116 | 26% | 0.264 | C | S | . | . | H | α-helix | trans | -80.4 | -38.9 | -175 | 0 | 0 | 0 | 0 | 0 | 112.6 | V212 A281 V282 L288 L289 | V212-A285 HydrophobicContact CG2-CB 3.38Å; A281-A285 PolarHBondContact O-N 2.95Å; V282-A285 PolarHBondContact O-N 2.85Å; A285-L288 WeakPolarHBondContact O-CA 3.5Å; A285-L288 WeakPolarHBondContact O-CB 3.3Å; A285-L288 PolarHBondContact O-N 3.3Å; A285-L289 WeakPolarHBondContact O-CG 3.34Å; A285-L289 PolarHBondContact O-N 3.45Å; A285-L289 VanDerWaalsContact O-N 3.09Å |
| 286 | E | 83.8 | Confident | 88.3 | Confident | 65 Ų | 65 | 47.1 Ų | 47.1 | 30% | 0.304 | 26% | 0.264 | S | S | . | . | G | 310 helix | trans | -53.8 | -44.9 | -175.3 | -177.1 | -179.5 | -179.9 | 0 | 0 | 113.7 | V212 V282 L288 L289 | V212-E286 HydrophobicContact CG1-CB 4.34Å; V282-E286 WeakPolarHBondContact O-CB 3.49Å; V282-E286 PolarHBondContact O-N 2.97Å; E286-L288 PolarHBondContact O-N 3.44Å; E286-L289 PolarHBondContact O-N 3.33Å |
| 287 | P | 86.2 | Confident | 88.1 | Confident | 52 Ų | 52 | 44 Ų | 44 | 34% | 0.338 | 25% | 0.248 | S | C | . | . | G | 310 helix | trans | -67.3 | -22.1 | 176.1 | -20.5 | 34.2 | 0 | 0 | 0 | 114.7 | ||
| 288 | L | 86.8 | Confident | 88.1 | Confident | 113 Ų | 113 | 38.8 Ų | 38.8 | 59% | 0.592 | 22% | 0.22 | S | C | * | . | G | 310 helix | trans | -89.9 | -17.6 | -179.7 | -95.8 | 67.8 | 0 | 0 | 0 | 112.5 | A285 E286 Y291 A292 | A285-L288 WeakPolarHBondContact O-CA 3.5Å; A285-L288 WeakPolarHBondContact O-CB 3.3Å; A285-L288 PolarHBondContact O-N 3.3Å; E286-L288 PolarHBondContact O-N 3.44Å; L288-Y291 WeakPolarHBondContact O-CB 3.37Å; L288-Y291 PolarHBondContact O-N 2.94Å; L288-Y291 VanDerWaalsContact O-N 3.16Å; L288-A292 PolarHBondContact O-N 3.29Å |
| 289 | L | 83.7 | Confident | 88 | Confident | 7 Ų | 7 | 39 Ų | 39 | 4% | 0.037 | 22% | 0.222 | C | C | . | . | H | α-helix | trans | -60 | -44 | -173 | -78.4 | 174.9 | 0 | 0 | 0 | 115.2 | M66 A209 V212 A285 E286 Y291 A292 L293 | M66-L289 HydrophobicContact CE-CB 3.77Å; M66-L289 HydrophobicContact CE-CD1 3.55Å; M66-L289 HydrophobicContact CE-CG 4.36Å; M66-L289 HydrophobicContact SD-CB 4.29Å; A209-L289 HydrophobicContact CB-CD2 4.29Å; V212-L289 HydrophobicContact CB-CD1 3.52Å; V212-L289 HydrophobicContact CB-CD2 4.47Å; V212-L289 HydrophobicContact CB-CG 4.45Å; V212-L289 HydrophobicContact CG1-CD1 3.3Å; V212-L289 HydrophobicContact CG1-CG 4.46Å; V212-L289 HydrophobicContact CG2-CD1 3.97Å; V212-L289 HydrophobicContact CG2-CD2 4.33Å; V212-L289 HydrophobicContact CG2-CG 4.42Å; A285-L289 WeakPolarHBondContact O-CG 3.34Å; A285-L289 PolarHBondContact O-N 3.45Å; A285-L289 VanDerWaalsContact O-N 3.09Å; E286-L289 PolarHBondContact O-N 3.33Å; L289-Y291 PolarHBondContact O-N 3.45Å; L289-A292 PolarHBondContact O-N 3.02Å; L289-A292 VanDerWaalsContact O-N 3.07Å; L289-L293 WeakPolarHBondContact O-CB 3.18Å; L289-L293 WeakPolarHBondContact O-CG 3.41Å; L289-L293 PolarHBondContact O-N 3.39Å |
| 290 | P | 89.9 | Confident | 87.9 | Confident | 6 Ų | 6 | 38.7 Ų | 38.7 | 4% | 0.039 | 22% | 0.219 | C | C | . | . | H | α-helix | trans | -57.1 | -38.2 | 177.5 | -26.3 | 35.3 | 0 | 0 | 0 | 112 | M66 A67 P80 A294 | M66-P290 HydrophobicContact CB-CG 3.89Å; A67-P290 HydrophobicContact CB-CB 4.31Å; P80-P290 HydrophobicContact CB-CB 4.38Å; P290-A294 WeakPolarHBondContact O-CB 3.29Å; P290-A294 PolarHBondContact O-N 3.23Å; P290-A294 VanDerWaalsContact O-N 3.15Å |
| 291 | Y | 91.9 | Very high | 88 | Confident | 77 Ų | 77 | 36.5 Ų | 36.5 | 30% | 0.302 | 20% | 0.197 | S | C | . | . | H | α-helix | trans | -70.3 | -43.5 | 175.9 | -58.6 | -94.3 | 0 | 0 | 0 | 111.6 | Y73 P80 G84 L288 L289 F295 | Y73-Y291 WeakPolarHBondContact CE1-OH 3.44Å; Y73-Y291 VanDerWaalsContact OH-CE2 3.32Å; Y73-Y291 WeakPolarHBondContact OH-CE2 3.29Å; Y73-Y291 PolarHBondContact OH-OH 3.24Å; P80-Y291 VanDerWaalsContact CA-CE1 3.46Å; P80-Y291 HydrophobicContact CB-CD1 3.99Å; P80-Y291 HydrophobicContact CB-CD2 4.21Å; P80-Y291 HydrophobicContact CB-CE1 3.55Å; P80-Y291 HydrophobicContact CB-CE2 3.78Å; P80-Y291 HydrophobicContact CB-CG 4.3Å; P80-Y291 VanDerWaalsContact CB-CZ 3.42Å; P80-Y291 WeakPolarHBondContact O-CD1 3.17Å; G84-Y291 WeakPolarHBondContact CA-O 3.24Å; L288-Y291 WeakPolarHBondContact O-CB 3.37Å; L288-Y291 PolarHBondContact O-N 2.94Å; L288-Y291 VanDerWaalsContact O-N 3.16Å; L289-Y291 PolarHBondContact O-N 3.45Å; Y291-F295 WeakPolarHBondContact O-CB 3.32Å; Y291-F295 PolarHBondContact O-N 3.28Å |
| 292 | A | 88.3 | Confident | 88 | Confident | 21 Ų | 21 | 36.7 Ų | 36.7 | 17% | 0.174 | 19% | 0.189 | C | C | . | . | H | α-helix | trans | -68.2 | -43.3 | -177.3 | 0 | 0 | 0 | 0 | 0 | 112.5 | P205 L288 L289 F295 A296 | P205-A292 HydrophobicContact CB-CB 4.27Å; P205-A292 WeakPolarHBondContact CB-O 3.3Å; L288-A292 PolarHBondContact O-N 3.29Å; L289-A292 PolarHBondContact O-N 3.02Å; L289-A292 VanDerWaalsContact O-N 3.07Å; A292-F295 WeakPolarHBondContact O-CB 3.38Å; A292-F295 PolarHBondContact O-N 3.44Å; A292-A296 PolarHBondContact O-N 3.11Å |
| 293 | L | 89.7 | Confident | 87.8 | Confident | 2 Ų | 2 | 36.9 Ų | 36.9 | 1% | 0.01 | 19% | 0.191 | C | C | . | . | H | α-helix | trans | -64.9 | -46.1 | 175.4 | -75.8 | 176.2 | 0 | 0 | 0 | 111.3 | L59 P62 A63 M66 A209 L289 F295 A296 A297 | L59-L293 HydrophobicContact CD2-CD2 3.7Å; P62-L293 HydrophobicContact CB-CD1 4.32Å; A63-L293 HydrophobicContact CB-CB 3.82Å; A63-L293 HydrophobicContact CB-CD1 4.45Å; M66-L293 HydrophobicContact SD-CD1 3.96Å; A209-L293 HydrophobicContact CB-CD2 3.49Å; A209-L293 VanDerWaalsContact CB-CD2 3.49Å; A209-L293 HydrophobicContact CB-CG 4.23Å; L289-L293 WeakPolarHBondContact O-CB 3.18Å; L289-L293 WeakPolarHBondContact O-CG 3.41Å; L289-L293 PolarHBondContact O-N 3.39Å; L293-F295 VanDerWaalsContact C-N 3.3Å; L293-F295 PolarHBondContact O-N 2.85Å; L293-A296 PolarHBondContact O-N 3.39Å; L293-A297 PolarHBondContact O-N 3.37Å |
| 294 | A | 93.6 | Very high | 88.1 | Confident | 0 Ų | 0 | 31.9 Ų | 31.9 | 0% | 0 | 16% | 0.16 | C | C | . | . | H | α-helix | trans | -64.4 | -37.8 | 175.6 | 0 | 0 | 0 | 0 | 0 | 111.6 | L60 A63 V81 F85 P290 A297 G298 | L60-A294 HydrophobicContact CD2-CB 4.41Å; A63-A294 HydrophobicContact CB-CB 4.34Å; V81-A294 HydrophobicContact CB-CB 4.32Å; V81-A294 HydrophobicContact CG1-CB 3.9Å; V81-A294 VanDerWaalsContact O-CB 3.27Å; V81-A294 WeakPolarHBondContact O-CB 3.36Å; F85-A294 WeakPolarHBondContact CA-O 3.42Å; F85-A294 HydrophobicContact CB-CB 4.4Å; F85-A294 PolarHBondContact N-O 3.48Å; P290-A294 WeakPolarHBondContact O-CB 3.29Å; P290-A294 PolarHBondContact O-N 3.23Å; P290-A294 VanDerWaalsContact O-N 3.15Å; A294-A297 PolarHBondContact O-N 3.19Å; A294-G298 PolarHBondContact O-N 3.35Å |
| 295 | F | 91.8 | Very high | 88.4 | Confident | 43 Ų | 43 | 28 Ų | 28 | 19% | 0.189 | 15% | 0.15 | C | C | . | . | H | α-helix | trans | -58.4 | -47.7 | 172.1 | 174.7 | -80.2 | 0 | 0 | 0 | 112 | G84 L87 G88 F91 P205 Y291 A292 L293 A297 G298 A299 | G84-F295 WeakPolarHBondContact O-CA 3.25Å; L87-F295 HydrophobicContact CB-CD2 4.16Å; G88-F295 WeakPolarHBondContact CA-O 3.47Å; G88-F295 VanDerWaalsContact N-CD2 3.31Å; F91-F295 HydrophobicContact CB-CE2 3.73Å; F91-F295 HydrophobicContact CB-CZ 3.75Å; F91-F295 AromaticContact CD1-CZ 3.77Å; F91-F295 HydrophobicContact CD1-CZ 3.77Å; F91-F295 HydrophobicContact CD2-CZ 4.32Å; F91-F295 HydrophobicContact CG-CE2 4.11Å; F91-F295 AromaticContact CG-CZ 3.66Å; F91-F295 HydrophobicContact CG-CZ 3.66Å; P205-F295 HydrophobicContact CG-CD1 4.24Å; Y291-F295 WeakPolarHBondContact O-CB 3.32Å; Y291-F295 PolarHBondContact O-N 3.28Å; A292-F295 WeakPolarHBondContact O-CB 3.38Å; A292-F295 PolarHBondContact O-N 3.44Å; L293-F295 VanDerWaalsContact C-N 3.3Å; L293-F295 PolarHBondContact O-N 2.85Å; F295-A297 VanDerWaalsContact C-N 3.34Å; F295-A297 PolarHBondContact O-N 3.26Å; F295-G298 PolarHBondContact O-N 2.89Å; F295-A299 WeakPolarHBondContact O-CB 3.14Å; F295-A299 PolarHBondContact O-N 3.32Å |
| 296 | A | 88.2 | Confident | 88.5 | Confident | 0 Ų | 0 | 31.2 Ų | 31.2 | 0% | 0 | 17% | 0.165 | C | C | . | . | H | α-helix | trans | -59.9 | -44.9 | 175.8 | 0 | 0 | 0 | 0 | 0 | 111.4 | L59 P205 A292 L293 G298 A299 M300 | L59-A296 HydrophobicContact CD1-CB 3.98Å; P205-A296 HydrophobicContact CB-CB 3.93Å; P205-A296 HydrophobicContact CG-CB 4.39Å; A292-A296 PolarHBondContact O-N 3.11Å; L293-A296 PolarHBondContact O-N 3.39Å; A296-G298 PolarHBondContact O-N 3.13Å; A296-A299 PolarHBondContact O-N 2.87Å; A296-M300 VanDerWaalsContact O-CB 3.24Å; A296-M300 WeakPolarHBondContact O-CB 3.49Å; A296-M300 PolarHBondContact O-N 2.79Å |
| 297 | A | 91.9 | Very high | 88.2 | Confident | 0 Ų | 0 | 29.7 Ų | 29.7 | 0% | 0 | 16% | 0.159 | C | C | . | . | H | α-helix | trans | -61.1 | -43.7 | 176.9 | 0 | 0 | 0 | 0 | 0 | 112.6 | S55 L59 L60 F85 L293 A294 F295 M300 V301 | S55-A297 WeakPolarHBondContact O-CB 3.46Å; L59-A297 HydrophobicContact CB-CB 3.81Å; L59-A297 HydrophobicContact CD1-CB 4.14Å; L60-A297 HydrophobicContact CD1-CB 4.23Å; L60-A297 HydrophobicContact CD2-CB 4.3Å; L60-A297 HydrophobicContact CG-CB 3.68Å; F85-A297 HydrophobicContact CD2-CB 4.13Å; F85-A297 HydrophobicContact CE2-CB 4.34Å; L293-A297 PolarHBondContact O-N 3.37Å; A294-A297 PolarHBondContact O-N 3.19Å; F295-A297 VanDerWaalsContact C-N 3.34Å; F295-A297 PolarHBondContact O-N 3.26Å; A297-M300 PolarHBondContact O-N 3.45Å; A297-V301 WeakPolarHBondContact O-CB 3.48Å; A297-V301 VanDerWaalsContact O-CG2 3.27Å; A297-V301 WeakPolarHBondContact O-CG2 3.42Å; A297-V301 PolarHBondContact O-N 3.25Å |
| 298 | G | 92 | Very high | 87.9 | Confident | 0 Ų | 0 | 27.8 Ų | 27.8 | 0% | 0 | 15% | 0.146 | C | C | . | . | H | α-helix | trans | -64.7 | -43.9 | 178.4 | 0 | 0 | 0 | 0 | 0 | 112.9 | F85 A294 F295 A296 Y302 | F85-G298 VanDerWaalsContact CE2-CA 3.46Å; F85-G298 WeakPolarHBondContact O-CA 3.26Å; A294-G298 PolarHBondContact O-N 3.35Å; F295-G298 PolarHBondContact O-N 2.89Å; A296-G298 PolarHBondContact O-N 3.13Å; G298-Y302 WeakPolarHBondContact O-CB 3.29Å; G298-Y302 PolarHBondContact O-N 3.33Å |
| 299 | A | 87.4 | Confident | 87.9 | Confident | 5 Ų | 5 | 24.9 Ų | 24.9 | 4% | 0.041 | 13% | 0.13 | C | C | . | . | H | α-helix | trans | -61.2 | -46.3 | 174.5 | 0 | 0 | 0 | 0 | 0 | 111.3 | V92 F295 A296 Y302 V303 | V92-A299 HydrophobicContact CG2-CB 3.6Å; F295-A299 WeakPolarHBondContact O-CB 3.14Å; F295-A299 PolarHBondContact O-N 3.32Å; A296-A299 PolarHBondContact O-N 2.87Å; A299-Y302 PolarHBondContact O-N 2.91Å; A299-V303 WeakPolarHBondContact O-CG2 3.37Å; A299-V303 PolarHBondContact O-N 3.41Å |
| 300 | M | 88.6 | Confident | 87.9 | Confident | 4 Ų | 4 | 27.4 Ų | 27.4 | 2% | 0.02 | 15% | 0.147 | C | C | . | . | H | α-helix | trans | -64 | -45.3 | -179.8 | -172 | -178.5 | -67.6 | 0 | 0 | 112.4 | M51 S55 L59 Q238 A296 A297 Y302 V303 V304 | M51-M300 HydrophobicContact CB-CG 4.06Å; M51-M300 HydrophobicContact CB-SD 4.06Å; M51-M300 HydrophobicContact CE-CG 3.74Å; M51-M300 VanDerWaalsContact O-SD 3.37Å; S55-M300 WeakPolarHBondContact OG-CG 3.44Å; S55-M300 PolarHBondContact OG-SD 2.8Å; L59-M300 HydrophobicContact CD1-CE 3.85Å; L59-M300 HydrophobicContact CD1-SD 4.32Å; Q238-M300 PolarHBondContact OE1-SD 3.47Å; A296-M300 VanDerWaalsContact O-CB 3.24Å; A296-M300 WeakPolarHBondContact O-CB 3.49Å; A296-M300 PolarHBondContact O-N 2.79Å; A297-M300 PolarHBondContact O-N 3.45Å; M300-Y302 VanDerWaalsContact C-N 3.31Å; M300-Y302 PolarHBondContact O-N 3Å; M300-V303 PolarHBondContact O-N 3.33Å; M300-V304 VanDerWaalsContact O-CG2 3.26Å; M300-V304 WeakPolarHBondContact O-CG2 3.03Å; M300-V304 PolarHBondContact O-N 3.29Å |
| 301 | V | 92.1 | Very high | 87.4 | Confident | 37 Ų | 37 | 29.9 Ų | 29.9 | 22% | 0.224 | 16% | 0.158 | C | C | . | . | H | α-helix | trans | -60.2 | -42.9 | 174.9 | 170.5 | 0 | 0 | 0 | 0 | 110.9 | L52 F85 A297 V304 V305 | L52-V301 HydrophobicContact CD2-CG2 4.37Å; F85-V301 HydrophobicContact CE2-CB 4.35Å; F85-V301 HydrophobicContact CE2-CG2 4.06Å; F85-V301 HydrophobicContact CZ-CB 4.09Å; F85-V301 HydrophobicContact CZ-CG1 4.2Å; F85-V301 HydrophobicContact CZ-CG2 4.15Å; A297-V301 WeakPolarHBondContact O-CB 3.48Å; A297-V301 VanDerWaalsContact O-CG2 3.27Å; A297-V301 WeakPolarHBondContact O-CG2 3.42Å; A297-V301 PolarHBondContact O-N 3.25Å; V301-V304 PolarHBondContact O-N 3.09Å; V301-V305 HydrophobicContact CG1-CG2 4.35Å; V301-V305 WeakPolarHBondContact O-CB 3.17Å; V301-V305 VanDerWaalsContact O-CG2 3.27Å; V301-V305 WeakPolarHBondContact O-CG2 3.4Å; V301-V305 PolarHBondContact O-N 3.15Å |
| 302 | Y | 88.9 | Confident | 86.9 | Confident | 45 Ų | 45 | 26.3 Ų | 26.3 | 18% | 0.176 | 14% | 0.144 | C | C | . | . | H | α-helix | trans | -59.8 | -51.8 | 176.6 | -177.6 | -77.8 | 0 | 0 | 0 | 111.3 | A89 V92 Y93 D96 G298 A299 M300 V304 V305 D306 | A89-Y302 HydrophobicContact CB-CD2 4.41Å; V92-Y302 HydrophobicContact CB-CD1 3.61Å; V92-Y302 HydrophobicContact CB-CE1 4.11Å; V92-Y302 HydrophobicContact CB-CG 4.18Å; V92-Y302 HydrophobicContact CG1-CD1 3.36Å; V92-Y302 HydrophobicContact CG1-CE1 3.64Å; V92-Y302 HydrophobicContact CG1-CG 4.37Å; Y93-Y302 HydrophobicContact CD2-CE2 4.13Å; Y93-Y302 WeakPolarHBondContact CD2-OH 3.44Å; Y93-Y302 HydrophobicContact CG-CE2 4.36Å; D96-Y302 WeakPolarHBondContact OD2-CE1 3.33Å; D96-Y302 PolarHBondContact OD2-OH 2.9Å; G298-Y302 WeakPolarHBondContact O-CB 3.29Å; G298-Y302 PolarHBondContact O-N 3.33Å; A299-Y302 PolarHBondContact O-N 2.91Å; M300-Y302 VanDerWaalsContact C-N 3.31Å; M300-Y302 PolarHBondContact O-N 3Å; Y302-V304 VanDerWaalsContact C-N 3.31Å; Y302-V304 PolarHBondContact O-N 3.39Å; Y302-V305 PolarHBondContact O-N 2.89Å; Y302-V305 VanDerWaalsContact O-N 3.17Å; Y302-D306 HydrophobicContact CD1-CB 4.27Å; Y302-D306 HydrophobicContact CE1-CB 3.8Å; Y302-D306 WeakPolarHBondContact O-CB 3.17Å; Y302-D306 PolarHBondContact O-N 2.9Å; Y302-D306 PolarHBondContact OH-OD2 3.15Å |
| 303 | V | 82.2 | Confident | 86.8 | Confident | 11 Ų | 11 | 29.9 Ų | 29.9 | 7% | 0.067 | 16% | 0.158 | C | C | . | . | H | α-helix | trans | -58.4 | -41.7 | 178.6 | 171 | 0 | 0 | 0 | 0 | 111.6 | V92 L195 A299 M300 V305 D307 I308 | V92-V303 HydrophobicContact CG1-CG2 3.84Å; V92-V303 HydrophobicContact CG2-CG2 4.3Å; L195-V303 HydrophobicContact CD1-CG1 4.44Å; A299-V303 WeakPolarHBondContact O-CG2 3.37Å; A299-V303 PolarHBondContact O-N 3.41Å; M300-V303 PolarHBondContact O-N 3.33Å; V303-V305 PolarHBondContact O-N 3.04Å; V303-D307 WeakPolarHBondContact O-CA 3.23Å; V303-D307 WeakPolarHBondContact O-CB 3.41Å; V303-D307 PolarHBondContact O-N 2.98Å; V303-I308 HydrophobicContact CG1-CD1 4.3Å; V303-I308 HydrophobicContact CG1-CG1 4.27Å; V303-I308 PolarHBondContact O-N 3.26Å; V303-I308 VanDerWaalsContact O-N 3.16Å |
| 304 | V | 87 | Confident | 86.4 | Confident | 0 Ų | 0 | 34.3 Ų | 34.3 | 0% | 0 | 18% | 0.184 | C | C | . | . | I | π-helix | trans | -64.4 | -43 | 179 | 174.5 | 0 | 0 | 0 | 0 | 111.4 | A48 M51 L52 M300 V301 Y302 I308 I309 | A48-V304 HydrophobicContact CB-CG1 3.64Å; M51-V304 HydrophobicContact CB-CG2 3.56Å; M51-V304 HydrophobicContact CE-CG2 3.96Å; M51-V304 HydrophobicContact CG-CG2 4.45Å; M51-V304 HydrophobicContact SD-CG2 4.11Å; L52-V304 HydrophobicContact CD1-CG1 3.96Å; L52-V304 HydrophobicContact CD2-CB 4.26Å; L52-V304 HydrophobicContact CD2-CG1 4.01Å; L52-V304 HydrophobicContact CG-CB 4.37Å; L52-V304 HydrophobicContact CG-CG1 3.72Å; M300-V304 VanDerWaalsContact O-CG2 3.26Å; M300-V304 WeakPolarHBondContact O-CG2 3.03Å; M300-V304 PolarHBondContact O-N 3.29Å; V301-V304 PolarHBondContact O-N 3.09Å; Y302-V304 VanDerWaalsContact C-N 3.31Å; Y302-V304 PolarHBondContact O-N 3.39Å; V304-I308 HydrophobicContact CG2-CD1 4.26Å; V304-I308 PolarHBondContact O-N 2.94Å; V304-I309 HydrophobicContact CG1-CD1 3.72Å; V304-I309 HydrophobicContact CG1-CG1 3.85Å; V304-I309 WeakPolarHBondContact O-CB 3.5Å; V304-I309 WeakPolarHBondContact O-CG1 3.49Å; V304-I309 PolarHBondContact O-N 3.38Å |
| 305 | V | 90.4 | Very high | 85.6 | Confident | 86 Ų | 86 | 36.3 Ų | 36.3 | 52% | 0.521 | 20% | 0.198 | S | C | . | . | I | π-helix | trans | -73.1 | -42.7 | -177.1 | 172.2 | 0 | 0 | 0 | 0 | 112 | V301 Y302 V303 P310 | V301-V305 HydrophobicContact CG1-CG2 4.35Å; V301-V305 WeakPolarHBondContact O-CB 3.17Å; V301-V305 VanDerWaalsContact O-CG2 3.27Å; V301-V305 WeakPolarHBondContact O-CG2 3.4Å; V301-V305 PolarHBondContact O-N 3.15Å; Y302-V305 PolarHBondContact O-N 2.89Å; Y302-V305 VanDerWaalsContact O-N 3.17Å; V303-V305 PolarHBondContact O-N 3.04Å; V305-P310 WeakPolarHBondContact O-CD 3.45Å; V305-P310 WeakPolarHBondContact O-CG 3.44Å |
| 306 | D | 83.3 | Confident | 85.2 | Confident | 82 Ų | 82 | 37.5 Ų | 37.5 | 44% | 0.439 | 22% | 0.223 | S | C | . | . | I | π-helix | trans | -87.9 | -31.6 | -172.7 | -153.9 | 57.2 | 0 | 0 | 0 | 113 | Y302 P310 | Y302-D306 HydrophobicContact CD1-CB 4.27Å; Y302-D306 HydrophobicContact CE1-CB 3.8Å; Y302-D306 WeakPolarHBondContact O-CB 3.17Å; Y302-D306 PolarHBondContact O-N 2.9Å; Y302-D306 PolarHBondContact OH-OD2 3.15Å; D306-P310 WeakPolarHBondContact O-CG 3.35Å |
| 307 | D | 77.4 | Confident | 85.1 | Confident | 32 Ų | 32 | 39 Ų | 39 | 17% | 0.171 | 23% | 0.231 | C | C | . | . | I | π-helix | trans | -111.5 | -63.1 | -178.1 | -80.2 | -48.5 | 0 | 0 | 0 | 113.5 | R191 V303 P310 E311 | R191-D307 IonicContact CZ-OD1 3.83Å; R191-D307 IonicContact NE-OD1 2.76Å; R191-D307 IonicContact NH2-OD1 3.02Å; R191-D307 PolarHBondContact NH2-OD1 3.39Å; V303-D307 WeakPolarHBondContact O-CA 3.23Å; V303-D307 WeakPolarHBondContact O-CB 3.41Å; V303-D307 PolarHBondContact O-N 2.98Å; D307-P310 WeakPolarHBondContact O-CD 3.46Å; D307-E311 WeakPolarHBondContact O-CB 3.35Å; D307-E311 PolarHBondContact O-N 2.92Å |
| 308 | I | 80.5 | Confident | 85 | Confident | 12 Ų | 12 | 39.9 Ų | 39.9 | 6% | 0.062 | 24% | 0.24 | C | C | . | . | I | π-helix | trans | -68.9 | -45.8 | -163.3 | -55 | -175.8 | 0 | 0 | 0 | 112 | L44 A48 M51 V303 V304 A312 | L44-I308 HydrophobicContact CB-CG2 4.3Å; L44-I308 HydrophobicContact CD2-CG2 4.46Å; L44-I308 WeakPolarHBondContact O-CG2 3.13Å; A48-I308 HydrophobicContact CB-CB 4.32Å; A48-I308 HydrophobicContact CB-CG2 3.74Å; M51-I308 HydrophobicContact CE-CD1 3.85Å; M51-I308 HydrophobicContact SD-CD1 3.4Å; M51-I308 WeakPolarHBondContact SD-CD1 3.19Å; V303-I308 HydrophobicContact CG1-CD1 4.3Å; V303-I308 HydrophobicContact CG1-CG1 4.27Å; V303-I308 PolarHBondContact O-N 3.26Å; V303-I308 VanDerWaalsContact O-N 3.16Å; V304-I308 HydrophobicContact CG2-CD1 4.26Å; V304-I308 PolarHBondContact O-N 2.94Å; I308-A312 WeakPolarHBondContact O-CB 3.43Å; I308-A312 PolarHBondContact O-N 3.37Å |
| 309 | I | 86.6 | Confident | 85 | Confident | 52 Ų | 52 | 50.2 Ų | 50.2 | 27% | 0.267 | 28% | 0.279 | S | S | . | . | H | α-helix | trans | -64.5 | -50 | 179.2 | -71.1 | 171.6 | 0 | 0 | 0 | 111 | A48 L52 V304 E311 A312 Q313 | A48-I309 HydrophobicContact CB-CG1 3.83Å; L52-I309 HydrophobicContact CD1-CD1 4.25Å; V304-I309 HydrophobicContact CG1-CD1 3.72Å; V304-I309 HydrophobicContact CG1-CG1 3.85Å; V304-I309 WeakPolarHBondContact O-CB 3.5Å; V304-I309 WeakPolarHBondContact O-CG1 3.49Å; V304-I309 PolarHBondContact O-N 3.38Å; I309-E311 PolarHBondContact O-N 3.09Å; I309-A312 PolarHBondContact O-N 3.37Å; I309-Q313 WeakPolarHBondContact O-CG 3Å; I309-Q313 PolarHBondContact O-N 3.38Å |
| 310 | P | 84.7 | Confident | 85.2 | Confident | 60 Ų | 60 | 53.6 Ų | 53.6 | 39% | 0.39 | 30% | 0.296 | S | S | . | . | H | α-helix | trans | -57.1 | -47.1 | 175.1 | -30.2 | 39.1 | 0 | 0 | 0 | 112.8 | V305 D306 D307 A312 Q313 V314 | V305-P310 WeakPolarHBondContact O-CD 3.45Å; V305-P310 WeakPolarHBondContact O-CG 3.44Å; D306-P310 WeakPolarHBondContact O-CG 3.35Å; D307-P310 WeakPolarHBondContact O-CD 3.46Å; P310-A312 PolarHBondContact O-N 3.2Å; P310-Q313 PolarHBondContact O-N 3.18Å; P310-V314 WeakPolarHBondContact O-CG2 3.48Å; P310-V314 PolarHBondContact O-N 3.08Å |
| 311 | E | 78.8 | Confident | 85.3 | Confident | 59 Ų | 59 | 53.5 Ų | 53.5 | 28% | 0.276 | 30% | 0.296 | S | S | . | . | H | α-helix | trans | -60.1 | -43.2 | -179.2 | -171.8 | 68.4 | -144 | 0 | 0 | 111.7 | L44 R191 D307 I309 Q313 V314 | L44-E311 HydrophobicContact CD1-CB 4.44Å; L44-E311 HydrophobicContact CD1-CG 3.87Å; R191-E311 IonicContact CZ-OE2 3.72Å; R191-E311 IonicContact NH1-OE2 3.09Å; R191-E311 PolarHBondContact NH1-OE2 3.02Å; R191-E311 IonicContact NH2-OE2 3.22Å; D307-E311 WeakPolarHBondContact O-CB 3.35Å; D307-E311 PolarHBondContact O-N 2.92Å; I309-E311 PolarHBondContact O-N 3.09Å; E311-Q313 PolarHBondContact O-N 2.88Å; E311-Q313 VanDerWaalsContact O-N 3.08Å; E311-V314 PolarHBondContact O-N 3.43Å |
| 312 | A | 81.8 | Confident | 85.4 | Confident | 1 Ų | 1 | 54.5 Ų | 54.5 | 1% | 0.008 | 31% | 0.305 | C | S | . | . | H | α-helix | trans | -62.7 | -17.7 | 177.6 | 0 | 0 | 0 | 0 | 0 | 113.7 | D41 L44 I308 I309 P310 A321 | D41-A312 WeakPolarHBondContact CB-O 3.26Å; L44-A312 HydrophobicContact CB-CB 3.71Å; I308-A312 WeakPolarHBondContact O-CB 3.43Å; I308-A312 PolarHBondContact O-N 3.37Å; I309-A312 PolarHBondContact O-N 3.37Å; P310-A312 PolarHBondContact O-N 3.2Å; A312-A321 HydrophobicContact CB-CB 3.74Å; A312-A321 WeakPolarHBondContact O-CB 3.41Å |
| 313 | Q | 86.8 | Confident | 85.7 | Confident | 96 Ų | 96 | 61.6 Ų | 61.6 | 45% | 0.449 | 33% | 0.331 | S | S | . | . | H | α-helix | trans | -99.3 | -10.3 | -179 | -63.5 | -176 | 21.6 | 0 | 0 | 113.7 | I309 P310 E311 S315 G316 | I309-Q313 WeakPolarHBondContact O-CG 3Å; I309-Q313 PolarHBondContact O-N 3.38Å; P310-Q313 PolarHBondContact O-N 3.18Å; E311-Q313 PolarHBondContact O-N 2.88Å; E311-Q313 VanDerWaalsContact O-N 3.08Å; Q313-S315 PolarHBondContact O-N 2.98Å; Q313-G316 PolarHBondContact O-N 3.49Å |
| 314 | V | 80.1 | Confident | 86.2 | Confident | 95 Ų | 95 | 62.3 Ų | 62.3 | 58% | 0.576 | 34% | 0.336 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -60.8 | -39.3 | -174.1 | 173.7 | 0 | 0 | 0 | 0 | 112.7 | P310 E311 G316 | P310-V314 WeakPolarHBondContact O-CG2 3.48Å; P310-V314 PolarHBondContact O-N 3.08Å; E311-V314 PolarHBondContact O-N 3.43Å; V314-G316 PolarHBondContact O-N 3.41Å |
| 315 | S | 77.1 | Confident | 86.6 | Confident | 42 Ų | 42 | 63.2 Ų | 63.2 | 29% | 0.294 | 34% | 0.342 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -85.3 | 15 | -172.5 | -34.7 | 0 | 0 | 0 | 0 | 115 | D41 Q313 N317 | D41-S315 PolarHBondContact OD1-OG 3.21Å; D41-S315 WeakPolarHBondContact OD2-CB 3.3Å; D41-S315 PolarHBondContact OD2-OG 3.16Å; Q313-S315 PolarHBondContact O-N 2.98Å; S315-N317 VanDerWaalsContact C-N 3.29Å; S315-N317 PolarHBondContact O-N 2.81Å; S315-N317 PolarHBondContact O-ND2 2.96Å |
| 316 | G | 82.9 | Confident | 86.9 | Confident | 69 Ų | 69 | 63.8 Ų | 63.8 | 71% | 0.711 | 34% | 0.341 | S | S | * | . | S | Bend | trans | 77.8 | 6.5 | 179 | 0 | 0 | 0 | 0 | 0 | 114.9 | Q313 V314 | Q313-G316 PolarHBondContact O-N 3.49Å; V314-G316 PolarHBondContact O-N 3.41Å |
| 317 | N | 86.9 | Confident | 87.4 | Confident | 31 Ų | 31 | 64.5 Ų | 64.5 | 17% | 0.166 | 35% | 0.345 | C | S | . | . | trans | -97.9 | 27.5 | 175.9 | -51.9 | -68.3 | 0 | 0 | 0 | 112.9 | R38 D41 S315 R319 L320 A321 | R38-N317 WeakPolarHBondContact CG-OD1 3.42Å; D41-N317 HydrophobicContact CB-CB 4.16Å; D41-N317 WeakPolarHBondContact OD2-CB 3.27Å; D41-N317 PolarHBondContact OD2-ND2 3.32Å; S315-N317 VanDerWaalsContact C-N 3.29Å; S315-N317 PolarHBondContact O-N 2.81Å; S315-N317 PolarHBondContact O-ND2 2.96Å; N317-R319 VanDerWaalsContact C-N 3.26Å; N317-R319 PolarHBondContact O-N 2.88Å; N317-R319 VanDerWaalsContact O-N 3.09Å; N317-L320 HydrophobicContact CB-CB 4.29Å; N317-L320 WeakPolarHBondContact O-CA 3.36Å; N317-L320 WeakPolarHBondContact O-CB 3.43Å; N317-L320 PolarHBondContact O-N 3.33Å; N317-A321 PolarHBondContact O-N 3.37Å; N317-A321 VanDerWaalsContact O-N 3.13Å | ||
| 318 | G | 88.9 | Confident | 88 | Confident | 18 Ų | 18 | 63 Ų | 63 | 19% | 0.186 | 34% | 0.336 | C | S | . | . | H | α-helix | trans | -54.1 | -36.4 | -172.1 | 0 | 0 | 0 | 0 | 0 | 114.9 | L320 A321 S322 | G318-L320 VanDerWaalsContact C-N 3.34Å; G318-L320 PolarHBondContact O-N 2.86Å; G318-A321 PolarHBondContact O-N 3.39Å; G318-S322 PolarHBondContact O-N 2.87Å; G318-S322 PolarHBondContact O-OG 2.87Å |
| 319 | R | 92.9 | Very high | 88.6 | Confident | 217 Ų | 217 | 65.8 Ų | 65.8 | 82% | 0.819 | 35% | 0.348 | S | S | * | . | H | α-helix | trans | -62.4 | -39 | 174.6 | -71.1 | -174.4 | -179.2 | -178.6 | 0.6 | 113.1 | N317 W323 | N317-R319 VanDerWaalsContact C-N 3.26Å; N317-R319 PolarHBondContact O-N 2.88Å; N317-R319 VanDerWaalsContact O-N 3.09Å; R319-W323 VanDerWaalsContact O-CD1 3.24Å; R319-W323 PolarHBondContact O-N 3.07Å; R319-W323 VanDerWaalsContact O-N 3.14Å |
| 320 | L | 90.8 | Very high | 88.9 | Confident | 76 Ų | 76 | 66.4 Ų | 66.4 | 40% | 0.398 | 36% | 0.355 | S | S | . | . | H | α-helix | trans | -65.2 | -48.8 | 176.2 | 178.9 | 67.4 | 0 | 0 | 0 | 109.4 | R38 N317 G318 S322 W323 T324 | R38-L320 HydrophobicContact CB-CD2 4.45Å; R38-L320 WeakPolarHBondContact O-CD2 3.4Å; N317-L320 HydrophobicContact CB-CB 4.29Å; N317-L320 WeakPolarHBondContact O-CA 3.36Å; N317-L320 WeakPolarHBondContact O-CB 3.43Å; N317-L320 PolarHBondContact O-N 3.33Å; G318-L320 VanDerWaalsContact C-N 3.34Å; G318-L320 PolarHBondContact O-N 2.86Å; L320-S322 VanDerWaalsContact C-N 3.32Å; L320-S322 PolarHBondContact O-N 3.29Å; L320-W323 PolarHBondContact O-N 2.88Å; L320-T324 HydrophobicContact CD1-CG2 4.15Å; L320-T324 HydrophobicContact CG-CG2 4.36Å; L320-T324 WeakPolarHBondContact O-CG2 3.12Å; L320-T324 PolarHBondContact O-N 3.47Å; L320-T324 PolarHBondContact O-OG1 3.06Å; L320-T324 VanDerWaalsContact O-OG1 3.09Å |
| 321 | A | 90.4 | Very high | 89.1 | Confident | 3 Ų | 3 | 66 Ų | 66 | 3% | 0.025 | 35% | 0.351 | C | S | . | . | H | α-helix | trans | -57.2 | -41.8 | 177.7 | 0 | 0 | 0 | 0 | 0 | 112.6 | G45 A312 N317 G318 T324 S325 | G45-A321 WeakPolarHBondContact CA-O 3.33Å; A312-A321 HydrophobicContact CB-CB 3.74Å; A312-A321 WeakPolarHBondContact O-CB 3.41Å; N317-A321 PolarHBondContact O-N 3.37Å; N317-A321 VanDerWaalsContact O-N 3.13Å; G318-A321 PolarHBondContact O-N 3.39Å; A321-T324 WeakPolarHBondContact CA-OG1 3.45Å; A321-T324 PolarHBondContact O-OG1 2.67Å; A321-T324 VanDerWaalsContact O-OG1 3.09Å; A321-S325 VanDerWaalsContact O-CB 3.26Å; A321-S325 WeakPolarHBondContact O-CB 3.48Å; A321-S325 PolarHBondContact O-N 3.03Å |
| 322 | S | 94.6 | Very high | 89.5 | Confident | 58 Ų | 58 | 63.2 Ų | 63.2 | 41% | 0.406 | 34% | 0.338 | S | S | . | . | H | α-helix | trans | -63.9 | -46.2 | 175.6 | -55.6 | 0 | 0 | 0 | 0 | 112.2 | G318 L320 S325 I326 | G318-S322 PolarHBondContact O-N 2.87Å; G318-S322 PolarHBondContact O-OG 2.87Å; L320-S322 VanDerWaalsContact C-N 3.32Å; L320-S322 PolarHBondContact O-N 3.29Å; S322-S325 WeakPolarHBondContact O-CB 3.33Å; S322-S325 PolarHBondContact O-N 2.7Å; S322-I326 WeakPolarHBondContact O-CG1 3.47Å; S322-I326 PolarHBondContact O-N 3.35Å |
| 323 | W | 96.3 | Very high | 89.9 | Confident | 193 Ų | 193 | 66.2 Ų | 66.2 | 73% | 0.731 | 35% | 0.352 | S | S | * | . | H | α-helix | trans | -66.8 | -39.2 | 179.2 | -84.6 | 113.6 | 0 | 0 | 0 | 112.7 | R319 L320 S325 I326 L327 | R319-W323 VanDerWaalsContact O-CD1 3.24Å; R319-W323 PolarHBondContact O-N 3.07Å; R319-W323 VanDerWaalsContact O-N 3.14Å; L320-W323 PolarHBondContact O-N 2.88Å; W323-S325 VanDerWaalsContact C-N 3.3Å; W323-I326 PolarHBondContact O-N 2.98Å; W323-L327 WeakPolarHBondContact O-CB 3.3Å; W323-L327 PolarHBondContact O-N 3.28Å |
| 324 | T | 92.3 | Very high | 89.9 | Confident | 26 Ų | 26 | 64.7 Ų | 64.7 | 16% | 0.16 | 35% | 0.352 | C | S | . | . | H | α-helix | trans | -68.8 | -31.9 | 174.9 | 57.6 | 0 | 0 | 0 | 0 | 111.5 | G42 F46 L320 A321 L327 G328 | G42-T324 VanDerWaalsContact O-CB 3.22Å; G42-T324 WeakPolarHBondContact O-CB 3.4Å; G42-T324 PolarHBondContact O-OG1 2.85Å; F46-T324 VanDerWaalsContact CA-O 3.3Å; F46-T324 WeakPolarHBondContact CA-O 3.26Å; F46-T324 PolarHBondContact N-OG1 3.03Å; L320-T324 HydrophobicContact CD1-CG2 4.15Å; L320-T324 HydrophobicContact CG-CG2 4.36Å; L320-T324 WeakPolarHBondContact O-CG2 3.12Å; L320-T324 PolarHBondContact O-N 3.47Å; L320-T324 PolarHBondContact O-OG1 3.06Å; L320-T324 VanDerWaalsContact O-OG1 3.09Å; A321-T324 WeakPolarHBondContact CA-OG1 3.45Å; A321-T324 PolarHBondContact O-OG1 2.67Å; A321-T324 VanDerWaalsContact O-OG1 3.09Å; T324-L327 WeakPolarHBondContact O-CB 3.44Å; T324-L327 PolarHBondContact O-N 3.42Å; T324-G328 PolarHBondContact O-N 3.19Å |
| 325 | S | 94.3 | Very high | 89.9 | Confident | 19 Ų | 19 | 63 Ų | 63 | 13% | 0.133 | 34% | 0.339 | C | S | . | . | H | α-helix | trans | -63.2 | -46.7 | 170.4 | -173.3 | 0 | 0 | 0 | 0 | 112.7 | G45 G49 A321 S322 W323 L327 G328 F329 | G45-S325 WeakPolarHBondContact O-CA 3.34Å; G45-S325 WeakPolarHBondContact O-CB 3.43Å; G45-S325 PolarHBondContact O-N 3.25Å; G45-S325 PolarHBondContact O-OG 2.97Å; G49-S325 WeakPolarHBondContact CA-O 3.45Å; G49-S325 WeakPolarHBondContact CA-OG 3Å; G49-S325 PolarHBondContact N-OG 3.17Å; A321-S325 VanDerWaalsContact O-CB 3.26Å; A321-S325 WeakPolarHBondContact O-CB 3.48Å; A321-S325 PolarHBondContact O-N 3.03Å; S322-S325 WeakPolarHBondContact O-CB 3.33Å; S322-S325 PolarHBondContact O-N 2.7Å; W323-S325 VanDerWaalsContact C-N 3.3Å; S325-L327 VanDerWaalsContact C-N 3.28Å; S325-L327 PolarHBondContact O-N 3.14Å; S325-G328 PolarHBondContact O-N 2.87Å; S325-F329 WeakPolarHBondContact O-CB 3.25Å; S325-F329 PolarHBondContact O-N 2.88Å |
| 326 | I | 97.1 | Very high | 90 | Very high | 99 Ų | 99 | 62.5 Ų | 62.5 | 51% | 0.508 | 33% | 0.334 | S | S | . | . | H | α-helix | trans | -59.7 | -42.6 | 173.3 | -63.3 | -60.3 | 0 | 0 | 0 | 111 | S322 W323 F329 V330 | S322-I326 WeakPolarHBondContact O-CG1 3.47Å; S322-I326 PolarHBondContact O-N 3.35Å; W323-I326 PolarHBondContact O-N 2.98Å; I326-F329 PolarHBondContact O-N 3.41Å; I326-V330 HydrophobicContact CG2-CG2 4.42Å; I326-V330 WeakPolarHBondContact O-CG2 3.32Å; I326-V330 PolarHBondContact O-N 3.09Å |
| 327 | L | 93.8 | Very high | 89.8 | Confident | 96 Ų | 96 | 63.6 Ų | 63.6 | 50% | 0.503 | 33% | 0.326 | S | S | . | . | H | α-helix | trans | -60.6 | -47.1 | 175.9 | 178.1 | 64.2 | 0 | 0 | 0 | 111.7 | F46 W323 T324 S325 F329 V330 V331 | F46-L327 HydrophobicContact CD2-CG 4.41Å; F46-L327 HydrophobicContact CE2-CG 4.32Å; W323-L327 WeakPolarHBondContact O-CB 3.3Å; W323-L327 PolarHBondContact O-N 3.28Å; T324-L327 WeakPolarHBondContact O-CB 3.44Å; T324-L327 PolarHBondContact O-N 3.42Å; S325-L327 VanDerWaalsContact C-N 3.28Å; S325-L327 PolarHBondContact O-N 3.14Å; L327-F329 VanDerWaalsContact C-N 3.33Å; L327-F329 PolarHBondContact O-N 3.47Å; L327-V330 PolarHBondContact O-N 3.4Å; L327-V331 HydrophobicContact CD1-CG2 4.15Å; L327-V331 HydrophobicContact CG-CG2 4.42Å; L327-V331 WeakPolarHBondContact O-CB 3.43Å; L327-V331 VanDerWaalsContact O-CG2 3.25Å; L327-V331 WeakPolarHBondContact O-CG2 3.25Å; L327-V331 PolarHBondContact O-N 3.13Å |
| 328 | G | 90.3 | Very high | 89.3 | Confident | 0 Ų | 0 | 65 Ų | 65 | 0% | 0 | 35% | 0.349 | C | S | . | . | H | α-helix | trans | -60.3 | -43.3 | 177.5 | 0 | 0 | 0 | 0 | 0 | 112.3 | F46 V50 T324 S325 V331 M332 | F46-G328 VanDerWaalsContact CD2-CA 3.48Å; F46-G328 VanDerWaalsContact CE2-CA 3.44Å; V50-G328 WeakPolarHBondContact CG2-O 3.41Å; T324-G328 PolarHBondContact O-N 3.19Å; S325-G328 PolarHBondContact O-N 2.87Å; G328-V331 PolarHBondContact O-N 3.09Å; G328-M332 WeakPolarHBondContact O-CB 3.47Å; G328-M332 PolarHBondContact O-N 2.76Å |
| 329 | F | 93.9 | Very high | 88.2 | Confident | 72 Ų | 72 | 68.5 Ų | 68.5 | 32% | 0.316 | 36% | 0.362 | S | S | . | . | H | α-helix | trans | -60.7 | -48.7 | 175.9 | -170.8 | -79.8 | 0 | 0 | 0 | 111.7 | G49 L52 A53 W57 S325 I326 L327 V331 M332 M333 | G49-F329 VanDerWaalsContact O-CA 3.3Å; G49-F329 WeakPolarHBondContact O-CA 3.45Å; L52-F329 HydrophobicContact CB-CD2 4.15Å; L52-F329 HydrophobicContact CB-CE2 4.33Å; A53-F329 HydrophobicContact CB-CD1 4.42Å; A53-F329 HydrophobicContact CB-CD2 3.68Å; A53-F329 HydrophobicContact CB-CE2 3.9Å; A53-F329 HydrophobicContact CB-CG 3.97Å; A53-F329 HydrophobicContact CB-CZ 4.37Å; W57-F329 AromaticContact CH2-CE1 3.61Å; W57-F329 HydrophobicContact CH2-CE1 3.61Å; W57-F329 AromaticContact CH2-CZ 3.57Å; W57-F329 HydrophobicContact CH2-CZ 3.57Å; W57-F329 HydrophobicContact CZ3-CD1 4.5Å; W57-F329 AromaticContact CZ3-CE1 3.6Å; W57-F329 HydrophobicContact CZ3-CE1 3.6Å; W57-F329 HydrophobicContact CZ3-CE2 4.09Å; W57-F329 AromaticContact CZ3-CZ 3.36Å; W57-F329 HydrophobicContact CZ3-CZ 3.36Å; S325-F329 WeakPolarHBondContact O-CB 3.25Å; S325-F329 PolarHBondContact O-N 2.88Å; I326-F329 PolarHBondContact O-N 3.41Å; L327-F329 VanDerWaalsContact C-N 3.33Å; L327-F329 PolarHBondContact O-N 3.47Å; F329-V331 PolarHBondContact O-N 2.76Å; F329-M332 PolarHBondContact O-N 2.87Å; F329-M333 VanDerWaalsContact O-CB 3.29Å; F329-M333 WeakPolarHBondContact O-CB 3.43Å; F329-M333 PolarHBondContact O-N 3.41Å |
| 330 | V | 93.4 | Very high | 86.4 | Confident | 65 Ų | 65 | 62.3 Ų | 62.3 | 39% | 0.394 | 37% | 0.366 | S | S | . | . | H | α-helix | trans | -64.1 | -41.7 | 178.8 | 170.1 | 0 | 0 | 0 | 0 | 111.4 | I326 L327 S334 | I326-V330 HydrophobicContact CG2-CG2 4.42Å; I326-V330 WeakPolarHBondContact O-CG2 3.32Å; I326-V330 PolarHBondContact O-N 3.09Å; L327-V330 PolarHBondContact O-N 3.4Å; V330-S334 VanDerWaalsContact O-CB 3.25Å; V330-S334 WeakPolarHBondContact O-CB 3.32Å; V330-S334 PolarHBondContact O-N 3.13Å; V330-S334 PolarHBondContact O-OG 2.9Å |
| 331 | V | 88.4 | Confident | 86.2 | Confident | 52 Ų | 52 | 61.6 Ų | 61.6 | 32% | 0.315 | 36% | 0.364 | S | S | . | . | H | α-helix | trans | -60.5 | -50.6 | 176.7 | 166.6 | 0 | 0 | 0 | 0 | 109.8 | F46 L327 G328 F329 S334 L335 | F46-V331 HydrophobicContact CE2-CG2 4.46Å; F46-V331 HydrophobicContact CZ-CG1 4.5Å; L327-V331 HydrophobicContact CD1-CG2 4.15Å; L327-V331 HydrophobicContact CG-CG2 4.42Å; L327-V331 WeakPolarHBondContact O-CB 3.43Å; L327-V331 VanDerWaalsContact O-CG2 3.25Å; L327-V331 WeakPolarHBondContact O-CG2 3.25Å; L327-V331 PolarHBondContact O-N 3.13Å; G328-V331 PolarHBondContact O-N 3.09Å; F329-V331 PolarHBondContact O-N 2.76Å; V331-S334 PolarHBondContact O-N 3.16Å; V331-L335 HydrophobicContact CG1-CD1 3.7Å; V331-L335 HydrophobicContact CG1-CG 4.42Å; V331-L335 WeakPolarHBondContact O-CB 3.32Å; V331-L335 WeakPolarHBondContact O-CG 3.46Å; V331-L335 PolarHBondContact O-N 3.07Å |
| 332 | M | 87.4 | Confident | 86 | Confident | 0 Ų | 0 | 64.7 Ų | 64.7 | 0% | 0 | 38% | 0.382 | C | S | . | . | H | α-helix | trans | -63.4 | -47 | -180 | -176.8 | 59.9 | -161.6 | 0 | 0 | 112.1 | V50 A53 A54 S58 G234 I237 Q238 G328 F329 S334 L335 D336 | V50-M332 HydrophobicContact CB-CB 4.35Å; V50-M332 HydrophobicContact CG1-CB 4.03Å; V50-M332 HydrophobicContact CG1-CG 4.06Å; V50-M332 HydrophobicContact CG1-SD 4.04Å; V50-M332 HydrophobicContact CG2-CB 4.41Å; A53-M332 HydrophobicContact CB-CB 3.65Å; A53-M332 HydrophobicContact CB-CG 3.66Å; A54-M332 HydrophobicContact CB-CE 3.83Å; A54-M332 HydrophobicContact CB-CG 4.21Å; A54-M332 HydrophobicContact CB-SD 4.45Å; S58-M332 WeakPolarHBondContact OG-CE 3.22Å; G234-M332 WeakPolarHBondContact O-CE 3.43Å; I237-M332 HydrophobicContact CB-SD 4.17Å; I237-M332 HydrophobicContact CG2-SD 3.53Å; I237-M332 VanDerWaalsContact CG2-SD 3.53Å; Q238-M332 HydrophobicContact CB-CE 4.46Å; Q238-M332 HydrophobicContact CB-SD 4.49Å; G328-M332 WeakPolarHBondContact O-CB 3.47Å; G328-M332 PolarHBondContact O-N 2.76Å; F329-M332 PolarHBondContact O-N 2.87Å; M332-S334 VanDerWaalsContact C-N 3.3Å; M332-S334 PolarHBondContact O-N 3.46Å; M332-L335 PolarHBondContact O-N 3.19Å; M332-D336 HydrophobicContact CE-CB 4.35Å; M332-D336 WeakPolarHBondContact O-CB 3.34Å; M332-D336 PolarHBondContact O-N 3.12Å |
| 333 | M | 89.5 | Confident | 85.5 | Confident | 64 Ų | 64 | 65.1 Ų | 65.1 | 32% | 0.315 | 38% | 0.381 | S | S | . | . | H | α-helix | trans | -56.9 | -44.2 | 175.2 | -179 | -162 | 78.7 | 0 | 0 | 111.7 | W57 F329 L335 D336 V337 | W57-M333 HydrophobicContact CD2-CG 4.37Å; W57-M333 HydrophobicContact CE3-CB 4.23Å; W57-M333 HydrophobicContact CE3-CG 4.32Å; W57-M333 HydrophobicContact CH2-CB 4.1Å; W57-M333 HydrophobicContact CH2-CG 3.66Å; W57-M333 HydrophobicContact CH2-SD 4.02Å; W57-M333 HydrophobicContact CZ2-CB 4.49Å; W57-M333 HydrophobicContact CZ2-CG 3.65Å; W57-M333 HydrophobicContact CZ2-SD 4.11Å; W57-M333 HydrophobicContact CZ3-CB 3.94Å; W57-M333 HydrophobicContact CZ3-CG 3.99Å; F329-M333 VanDerWaalsContact O-CB 3.29Å; F329-M333 WeakPolarHBondContact O-CB 3.43Å; F329-M333 PolarHBondContact O-N 3.41Å; M333-L335 VanDerWaalsContact C-N 3.32Å; M333-L335 PolarHBondContact O-N 3.44Å; M333-D336 PolarHBondContact O-N 3.05Å; M333-V337 HydrophobicContact CG-CG2 4.31Å; M333-V337 VanDerWaalsContact O-CB 3.3Å; M333-V337 WeakPolarHBondContact O-CB 3.18Å; M333-V337 VanDerWaalsContact O-CG2 3.29Å; M333-V337 WeakPolarHBondContact O-CG2 3.11Å; M333-V337 PolarHBondContact O-N 3.38Å |
| 334 | S | 87.5 | Confident | 84.9 | Confident | 63 Ų | 63 | 57.5 Ų | 57.5 | 44% | 0.441 | 36% | 0.36 | S | S | . | . | H | α-helix | trans | -67.9 | -34.6 | -179.8 | -56.4 | 0 | 0 | 0 | 0 | 112 | V330 V331 M332 G338 | V330-S334 VanDerWaalsContact O-CB 3.25Å; V330-S334 WeakPolarHBondContact O-CB 3.32Å; V330-S334 PolarHBondContact O-N 3.13Å; V330-S334 PolarHBondContact O-OG 2.9Å; V331-S334 PolarHBondContact O-N 3.16Å; M332-S334 VanDerWaalsContact C-N 3.3Å; M332-S334 PolarHBondContact O-N 3.46Å; S334-G338 VanDerWaalsContact O-CA 3.25Å; S334-G338 WeakPolarHBondContact O-CA 3.32Å; S334-G338 PolarHBondContact O-N 3.39Å |
| 335 | L | 80.3 | Confident | 84.4 | Confident | 59 Ų | 59 | 59.5 Ų | 59.5 | 31% | 0.309 | 37% | 0.373 | S | S | . | . | H | α-helix | trans | -71.4 | -45 | 176.3 | -70.8 | 168.4 | 0 | 0 | 0 | 111.1 | I237 V331 M332 M333 L339 | I237-L335 HydrophobicContact CD1-CB 3.92Å; I237-L335 HydrophobicContact CD1-CD1 4.02Å; I237-L335 HydrophobicContact CD1-CG 4.39Å; I237-L335 HydrophobicContact CG2-CD1 3.78Å; V331-L335 HydrophobicContact CG1-CD1 3.7Å; V331-L335 HydrophobicContact CG1-CG 4.42Å; V331-L335 WeakPolarHBondContact O-CB 3.32Å; V331-L335 WeakPolarHBondContact O-CG 3.46Å; V331-L335 PolarHBondContact O-N 3.07Å; M332-L335 PolarHBondContact O-N 3.19Å; M333-L335 VanDerWaalsContact C-N 3.32Å; M333-L335 PolarHBondContact O-N 3.44Å; L335-L339 HydrophobicContact CB-CD1 4.38Å; L335-L339 HydrophobicContact CD2-CD1 3.9Å; L335-L339 WeakPolarHBondContact O-CB 3.42Å; L335-L339 VanDerWaalsContact O-CG 3.29Å; L335-L339 WeakPolarHBondContact O-CG 3.22Å; L335-L339 PolarHBondContact O-N 2.71Å |
| 336 | D | 77.4 | Confident | 83.8 | Confident | 32 Ų | 32 | 62.2 Ų | 62.2 | 17% | 0.171 | 39% | 0.389 | C | S | . | . | H | α-helix | trans | -66.6 | -49.9 | 179.8 | -165.5 | 102.8 | 0 | 0 | 0 | 111.2 | W57 S58 M332 M333 G338 G340 | W57-D336 HydrophobicContact CB-CB 4.06Å; W57-D336 VanDerWaalsContact CB-CG 3.5Å; W57-D336 WeakPolarHBondContact CB-OD2 3.43Å; S58-D336 PolarHBondContact OG-OD1 3.36Å; M332-D336 HydrophobicContact CE-CB 4.35Å; M332-D336 WeakPolarHBondContact O-CB 3.34Å; M332-D336 PolarHBondContact O-N 3.12Å; M333-D336 PolarHBondContact O-N 3.05Å; D336-G338 PolarHBondContact O-N 2.9Å; D336-G340 WeakPolarHBondContact O-CA 3.42Å; D336-G340 PolarHBondContact O-N 3.37Å |
| 337 | V | 80.4 | Confident | 82.8 | Confident | 92 Ų | 92 | 59.6 Ų | 59.6 | 56% | 0.558 | 38% | 0.381 | S | S | * | . | H | α-helix | trans | -70.9 | -30.4 | 178.3 | 177.3 | 0 | 0 | 0 | 0 | 112.6 | M333 | M333-V337 HydrophobicContact CG-CG2 4.31Å; M333-V337 VanDerWaalsContact O-CB 3.3Å; M333-V337 WeakPolarHBondContact O-CB 3.18Å; M333-V337 VanDerWaalsContact O-CG2 3.29Å; M333-V337 WeakPolarHBondContact O-CG2 3.11Å; M333-V337 PolarHBondContact O-N 3.38Å |
| 338 | G | 75.4 | Confident | 82 | Confident | 62 Ų | 62 | 56.8 Ų | 56.8 | 64% | 0.639 | 37% | 0.371 | S | S | * | . | H | α-helix | trans | -87.1 | -26.4 | -175.8 | 0 | 0 | 0 | 0 | 0 | 114.6 | S334 D336 | S334-G338 VanDerWaalsContact O-CA 3.25Å; S334-G338 WeakPolarHBondContact O-CA 3.32Å; S334-G338 PolarHBondContact O-N 3.39Å; D336-G338 PolarHBondContact O-N 2.9Å |
| 339 | L | 66.6 | Low | 81.3 | Confident | 90 Ų | 90 | 61.5 Ų | 61.5 | 47% | 0.471 | 40% | 0.402 | S | S | . | . | H | α-helix | trans | -105.6 | -14.9 | 177.8 | -56.9 | 172.2 | 0 | 0 | 0 | 112.7 | N230 I233 I237 L335 | N230-L339 VanDerWaalsContact CG-O 3.28Å; N230-L339 PolarHBondContact ND2-O 2.65Å; N230-L339 VanDerWaalsContact ND2-O 3.16Å; N230-L339 PolarHBondContact OD1-O 3.11Å; I233-L339 HydrophobicContact CG2-CD1 4.15Å; I237-L339 HydrophobicContact CD1-CD1 4.39Å; L335-L339 HydrophobicContact CB-CD1 4.38Å; L335-L339 HydrophobicContact CD2-CD1 3.9Å; L335-L339 WeakPolarHBondContact O-CB 3.42Å; L335-L339 VanDerWaalsContact O-CG 3.29Å; L335-L339 WeakPolarHBondContact O-CG 3.22Å; L335-L339 PolarHBondContact O-N 2.71Å |
| 340 | G | 55.1 | Low | 80.1 | Confident | 87 Ų | 87 | 60.5 Ų | 60.5 | 90% | 0.897 | 41% | 0.41 | S | S | * | . | trans | -83.1 | 0 | -178.7 | 0 | 0 | 0 | 0 | 0 | 114.8 | N230 D336 | N230-G340 WeakPolarHBondContact ND2-CA 3.5Å; N230-G340 PolarHBondContact ND2-OXT 3.44Å; D336-G340 WeakPolarHBondContact O-CA 3.42Å; D336-G340 PolarHBondContact O-N 3.37Å |
Retrieved 340 of 340 residues in 496 ms
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