| 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 | 71.4 | Confident | 90.8 | Very high | 150 Ų | 150 | 67.3 Ų | 67.3 | 74% | 0.739 | 40% | 0.399 | S | S | * | . | 0 | 123.4 | 0 | -166.9 | 158.9 | 65.6 | 0 | 0 | 107.3 | D5 A6 V68 | M1-D5 HydrophobicContact CG-CB 3.55Å; M1-D5 HydrophobicContact SD-CB 4.4Å; M1-A6 HydrophobicContact CE-CB 4.25Å; M1-V68 HydrophobicContact SD-CG2 4.17Å | |||
| 2 | N | 86.5 | Confident | 91.3 | Very high | 72 Ų | 72 | 61.7 Ų | 61.7 | 39% | 0.385 | 37% | 0.366 | S | S | . | . | trans | -77.5 | 169.9 | -179.9 | 64.1 | 38.5 | 0 | 0 | 0 | 110.6 | W4 D5 A6 | N2-W4 VanDerWaalsContact C-N 3.26Å; N2-W4 PolarHBondContact O-N 3.02Å; N2-W4 PolarHBondContact OD1-N 3.45Å; N2-D5 PolarHBondContact ND2-OD2 3.48Å; N2-D5 PolarHBondContact O-N 3.47Å; N2-D5 WeakPolarHBondContact OD1-CB 3.35Å; N2-D5 PolarHBondContact OD1-N 3.13Å; N2-D5 PolarHBondContact OD1-OD1 3.45Å; N2-D5 PolarHBondContact OD1-OD2 3.25Å; N2-A6 PolarHBondContact O-N 3.07Å; N2-A6 VanDerWaalsContact O-N 3.1Å | ||
| 3 | S | 89.3 | Confident | 91.8 | Very high | 99 Ų | 99 | 63.2 Ų | 63.2 | 69% | 0.692 | 38% | 0.376 | S | S | * | . | H | α-helix | trans | -60.7 | -33.6 | -178.6 | 51.7 | 0 | 0 | 0 | 0 | 113.2 | G7 | S3-G7 PolarHBondContact O-N 3.13Å |
| 4 | W | 90.8 | Very high | 92.2 | Very high | 176 Ų | 176 | 61.6 Ų | 61.6 | 67% | 0.667 | 38% | 0.378 | S | S | * | . | H | α-helix | trans | -67.7 | -46.5 | 177.2 | -73 | 106 | 0 | 0 | 0 | 112.6 | N2 A6 G7 L8 | N2-W4 VanDerWaalsContact C-N 3.26Å; N2-W4 PolarHBondContact O-N 3.02Å; N2-W4 PolarHBondContact OD1-N 3.45Å; W4-A6 VanDerWaalsContact C-N 3.3Å; W4-A6 PolarHBondContact O-N 2.95Å; W4-G7 PolarHBondContact O-N 3.29Å; W4-G7 VanDerWaalsContact O-N 3.15Å; W4-L8 WeakPolarHBondContact O-CG 3.46Å; W4-L8 PolarHBondContact O-N 3.14Å |
| 5 | D | 90.2 | Very high | 92.6 | Very high | 14 Ų | 14 | 58.1 Ų | 58.1 | 8% | 0.075 | 36% | 0.357 | C | S | . | . | H | α-helix | trans | -63.4 | -39.2 | 177.8 | -62.6 | -28.4 | 0 | 0 | 0 | 110.7 | M1 N2 L8 A9 V67 H274 | M1-D5 HydrophobicContact CG-CB 3.55Å; M1-D5 HydrophobicContact SD-CB 4.4Å; N2-D5 PolarHBondContact ND2-OD2 3.48Å; N2-D5 PolarHBondContact O-N 3.47Å; N2-D5 WeakPolarHBondContact OD1-CB 3.35Å; N2-D5 PolarHBondContact OD1-N 3.13Å; N2-D5 PolarHBondContact OD1-OD1 3.45Å; N2-D5 PolarHBondContact OD1-OD2 3.25Å; D5-L8 PolarHBondContact O-N 3.39Å; D5-A9 VanDerWaalsContact O-CB 3.25Å; D5-A9 WeakPolarHBondContact O-CB 3.29Å; D5-A9 PolarHBondContact O-N 3.5Å; D5-V67 HydrophobicContact CB-CG1 4.37Å; D5-H274 IonicContact OD1-CE1 2.71Å; D5-H274 IonicContact OD1-ND1 2.86Å |
| 6 | A | 92.9 | Very high | 92.9 | Very high | 46 Ų | 46 | 56.1 Ų | 56.1 | 38% | 0.38 | 34% | 0.343 | S | S | . | . | H | α-helix | trans | -63.1 | -42.1 | 173.1 | 0 | 0 | 0 | 0 | 0 | 111.8 | M1 N2 W4 A9 G10 | M1-A6 HydrophobicContact CE-CB 4.25Å; N2-A6 PolarHBondContact O-N 3.07Å; N2-A6 VanDerWaalsContact O-N 3.1Å; W4-A6 VanDerWaalsContact C-N 3.3Å; W4-A6 PolarHBondContact O-N 2.95Å; A6-A9 PolarHBondContact O-N 3.2Å; A6-G10 PolarHBondContact O-N 3.38Å |
| 7 | G | 94.8 | Very high | 93.2 | Very high | 47 Ų | 47 | 55.2 Ų | 55.2 | 49% | 0.485 | 35% | 0.348 | S | S | . | . | H | α-helix | trans | -62.9 | -44.2 | 174.7 | 0 | 0 | 0 | 0 | 0 | 113 | S3 W4 G10 L11 | S3-G7 PolarHBondContact O-N 3.13Å; W4-G7 PolarHBondContact O-N 3.29Å; W4-G7 VanDerWaalsContact O-N 3.15Å; G7-G10 PolarHBondContact O-N 3.06Å; G7-L11 PolarHBondContact O-N 3.45Å |
| 8 | L | 94.8 | Very high | 93.5 | Very high | 13 Ų | 13 | 55.8 Ų | 55.8 | 7% | 0.068 | 35% | 0.351 | C | S | . | . | H | α-helix | trans | -66 | -42 | 176.9 | -70 | 167.7 | 0 | 0 | 0 | 111.9 | W4 D5 L11 L12 H274 V277 L278 | W4-L8 WeakPolarHBondContact O-CG 3.46Å; W4-L8 PolarHBondContact O-N 3.14Å; D5-L8 PolarHBondContact O-N 3.39Å; L8-L11 PolarHBondContact O-N 2.97Å; L8-L12 PolarHBondContact O-N 3.47Å; L8-H274 HydrophobicContact CD1-CB 4.47Å; L8-V277 HydrophobicContact CB-CG1 4.26Å; L8-V277 HydrophobicContact CD1-CB 4.02Å; L8-V277 HydrophobicContact CD1-CG1 3.9Å; L8-V277 HydrophobicContact CD2-CG1 4.26Å; L8-V277 HydrophobicContact CG-CG1 4.37Å; L8-L278 HydrophobicContact CD2-CB 4.05Å; L8-L278 HydrophobicContact CD2-CD1 4.22Å |
| 9 | A | 95.4 | Very high | 93.7 | Very high | 10 Ų | 10 | 52.9 Ų | 52.9 | 8% | 0.083 | 33% | 0.332 | C | S | . | . | H | α-helix | trans | -61.3 | -44.7 | 173.4 | 0 | 0 | 0 | 0 | 0 | 111.4 | D5 A6 L11 L12 V13 L64 | D5-A9 VanDerWaalsContact O-CB 3.25Å; D5-A9 WeakPolarHBondContact O-CB 3.29Å; D5-A9 PolarHBondContact O-N 3.5Å; A6-A9 PolarHBondContact O-N 3.2Å; A9-L11 PolarHBondContact O-N 2.94Å; A9-L12 PolarHBondContact O-N 3.35Å; A9-V13 WeakPolarHBondContact O-CG2 3.38Å; A9-V13 PolarHBondContact O-N 2.92Å; A9-L64 HydrophobicContact CB-CD1 3.66Å |
| 10 | G | 96.3 | Very high | 93.9 | Very high | 44 Ų | 44 | 53.8 Ų | 53.8 | 45% | 0.454 | 33% | 0.334 | S | S | . | . | H | α-helix | trans | -59.9 | -42.8 | 174.7 | 0 | 0 | 0 | 0 | 0 | 112.8 | A6 G7 V13 G14 | A6-G10 PolarHBondContact O-N 3.38Å; G7-G10 PolarHBondContact O-N 3.06Å; G10-V13 PolarHBondContact O-N 2.99Å; G10-G14 PolarHBondContact O-N 3.04Å |
| 11 | L | 96.1 | Very high | 94 | Very high | 69 Ų | 69 | 56.9 Ų | 56.9 | 36% | 0.361 | 35% | 0.348 | S | S | . | . | H | α-helix | trans | -60.9 | -44.2 | 174.6 | 177.7 | 63.1 | 0 | 0 | 0 | 111.9 | G7 L8 A9 G14 T15 L278 C281 | G7-L11 PolarHBondContact O-N 3.45Å; L8-L11 PolarHBondContact O-N 2.97Å; A9-L11 PolarHBondContact O-N 2.94Å; L11-G14 PolarHBondContact O-N 2.87Å; L11-T15 WeakPolarHBondContact O-CB 3.35Å; L11-T15 PolarHBondContact O-N 3.43Å; L11-T15 PolarHBondContact O-OG1 3.08Å; L11-L278 HydrophobicContact CD2-CD1 4.02Å; L11-C281 HydrophobicContact CD2-CB 3.83Å; L11-C281 HydrophobicContact CG-CB 4.44Å |
| 12 | L | 96.7 | Very high | 95.1 | Very high | 0 Ų | 0 | 49.9 Ų | 49.9 | 0% | 0 | 31% | 0.314 | C | S | . | . | H | α-helix | trans | -62.8 | -46.5 | 176.3 | -77.9 | 170.1 | 0 | 0 | 0 | 111.6 | L8 A9 G14 T15 I16 T63 L64 V67 C281 Y284 | L8-L12 PolarHBondContact O-N 3.47Å; A9-L12 PolarHBondContact O-N 3.35Å; L12-G14 PolarHBondContact O-N 2.84Å; L12-T15 WeakPolarHBondContact O-CB 3.21Å; L12-T15 PolarHBondContact O-N 2.97Å; L12-I16 VanDerWaalsContact O-CG1 3.26Å; L12-I16 WeakPolarHBondContact O-CG1 3.3Å; L12-I16 PolarHBondContact O-N 3.27Å; L12-T63 HydrophobicContact CD1-CG2 4.15Å; L12-L64 HydrophobicContact CB-CD1 4.29Å; L12-L64 HydrophobicContact CD1-CB 4.31Å; L12-L64 HydrophobicContact CD1-CD1 4.39Å; L12-V67 HydrophobicContact CD1-CG2 4.23Å; L12-C281 HydrophobicContact CD2-CB 4.42Å; L12-C281 VanDerWaalsContact CD2-SG 3.58Å; L12-Y284 HydrophobicContact CD2-CD2 3.9Å |
| 13 | V | 98 | Very high | 95.6 | Very high | 82 Ų | 82 | 46.4 Ų | 46.4 | 50% | 0.497 | 30% | 0.295 | S | S | . | . | H | α-helix | trans | -60.3 | -45.8 | 177.7 | 171.2 | 0 | 0 | 0 | 0 | 111 | A9 G10 T15 I16 G17 L64 | A9-V13 WeakPolarHBondContact O-CG2 3.38Å; A9-V13 PolarHBondContact O-N 2.92Å; G10-V13 PolarHBondContact O-N 2.99Å; V13-T15 VanDerWaalsContact C-N 3.34Å; V13-T15 PolarHBondContact O-N 2.96Å; V13-I16 PolarHBondContact O-N 3.3Å; V13-G17 PolarHBondContact O-N 3.23Å; V13-L64 HydrophobicContact CG2-CD1 4.25Å; V13-L64 HydrophobicContact CG2-CD2 3.75Å |
| 14 | G | 97.8 | Very high | 95.9 | Very high | 40 Ų | 40 | 42.8 Ų | 42.8 | 41% | 0.412 | 27% | 0.273 | S | S | . | . | H | α-helix | trans | -59.8 | -43.6 | 174.7 | 0 | 0 | 0 | 0 | 0 | 112.3 | G10 L11 L12 G17 V18 | G10-G14 PolarHBondContact O-N 3.04Å; L11-G14 PolarHBondContact O-N 2.87Å; L12-G14 PolarHBondContact O-N 2.84Å; G14-G17 PolarHBondContact O-N 3.02Å; G14-V18 WeakPolarHBondContact O-CG2 3.48Å; G14-V18 PolarHBondContact O-N 2.87Å |
| 15 | T | 97.3 | Very high | 96.1 | Very high | 9 Ų | 9 | 37.4 Ų | 37.4 | 6% | 0.055 | 26% | 0.257 | C | S | . | . | H | α-helix | trans | -62.9 | -43.2 | 177.3 | -56.9 | 0 | 0 | 0 | 0 | 111.8 | L11 L12 V13 S19 M60 A288 | L11-T15 WeakPolarHBondContact O-CB 3.35Å; L11-T15 PolarHBondContact O-N 3.43Å; L11-T15 PolarHBondContact O-OG1 3.08Å; L12-T15 WeakPolarHBondContact O-CB 3.21Å; L12-T15 PolarHBondContact O-N 2.97Å; V13-T15 VanDerWaalsContact C-N 3.34Å; V13-T15 PolarHBondContact O-N 2.96Å; T15-S19 WeakPolarHBondContact O-CB 3.34Å; T15-S19 PolarHBondContact O-N 2.94Å; T15-M60 HydrophobicContact CG2-SD 4.29Å; T15-A288 HydrophobicContact CG2-CB 4.17Å |
| 16 | I | 98.4 | Very high | 96.3 | Very high | 27 Ų | 27 | 36.7 Ų | 36.7 | 14% | 0.138 | 25% | 0.253 | C | S | . | . | H | α-helix | trans | -59.1 | -51.7 | 175.5 | -70.8 | 163.6 | 0 | 0 | 0 | 110 | L12 V13 V18 S19 L20 T56 M60 L64 | L12-I16 VanDerWaalsContact O-CG1 3.26Å; L12-I16 WeakPolarHBondContact O-CG1 3.3Å; L12-I16 PolarHBondContact O-N 3.27Å; V13-I16 PolarHBondContact O-N 3.3Å; I16-V18 PolarHBondContact O-N 2.89Å; I16-S19 PolarHBondContact O-N 3.31Å; I16-L20 HydrophobicContact CG2-CD1 3.83Å; I16-L20 HydrophobicContact CG2-CG 4.32Å; I16-L20 WeakPolarHBondContact O-CB 3.3Å; I16-L20 WeakPolarHBondContact O-CG 3.33Å; I16-L20 PolarHBondContact O-N 3.47Å; I16-T56 HydrophobicContact CB-CG2 4.32Å; I16-T56 HydrophobicContact CG1-CG2 4.4Å; I16-T56 HydrophobicContact CG2-CG2 4.02Å; I16-M60 HydrophobicContact CD1-CB 3.8Å; I16-M60 HydrophobicContact CG1-CB 3.58Å; I16-M60 HydrophobicContact CG1-CG 4.31Å; I16-M60 HydrophobicContact CG1-SD 3.75Å; I16-L64 HydrophobicContact CD1-CD2 4.48Å |
| 17 | G | 98.1 | Very high | 96.4 | Very high | 41 Ų | 41 | 36.6 Ų | 36.6 | 42% | 0.423 | 25% | 0.246 | S | C | . | . | H | α-helix | trans | -59 | -48.7 | -178.9 | 0 | 0 | 0 | 0 | 0 | 112.6 | V13 G14 L21 | V13-G17 PolarHBondContact O-N 3.23Å; G14-G17 PolarHBondContact O-N 3.02Å; G17-L21 WeakPolarHBondContact O-CB 3.41Å; G17-L21 PolarHBondContact O-N 2.98Å; G17-L21 VanDerWaalsContact O-N 3.08Å |
| 18 | V | 97.5 | Very high | 96.3 | Very high | 66 Ų | 66 | 37.8 Ų | 37.8 | 40% | 0.4 | 24% | 0.241 | S | C | . | . | H | α-helix | trans | -64.6 | -42.3 | 178 | 176 | 0 | 0 | 0 | 0 | 111 | G14 I16 S22 A288 F292 | G14-V18 WeakPolarHBondContact O-CG2 3.48Å; G14-V18 PolarHBondContact O-N 2.87Å; I16-V18 PolarHBondContact O-N 2.89Å; V18-S22 VanDerWaalsContact O-CB 3.23Å; V18-S22 WeakPolarHBondContact O-CB 3.47Å; V18-S22 PolarHBondContact O-N 3.31Å; V18-S22 PolarHBondContact O-OG 3.32Å; V18-A288 HydrophobicContact CB-CB 4.28Å; V18-A288 HydrophobicContact CG1-CB 3.97Å; V18-F292 HydrophobicContact CG1-CE2 3.95Å; V18-F292 HydrophobicContact CG1-CZ 4.29Å |
| 19 | S | 97.6 | Very high | 96.2 | Very high | 0 Ų | 0 | 37.2 Ų | 37.2 | 0% | 0 | 24% | 0.238 | C | C | . | . | H | α-helix | trans | -64.3 | -47.3 | -179.5 | -176.7 | 0 | 0 | 0 | 0 | 111.9 | T15 I16 S22 N23 T56 | T15-S19 WeakPolarHBondContact O-CB 3.34Å; T15-S19 PolarHBondContact O-N 2.94Å; I16-S19 PolarHBondContact O-N 3.31Å; S19-S22 PolarHBondContact O-OG 2.86Å; S19-N23 VanDerWaalsContact O-CB 3.26Å; S19-N23 WeakPolarHBondContact O-CB 3.3Å; S19-N23 PolarHBondContact O-N 3.3Å; S19-N23 PolarHBondContact O-ND2 2.78Å; S19-N23 PolarHBondContact OG-ND2 3Å; S19-T56 WeakPolarHBondContact CB-OG1 3.39Å; S19-T56 PolarHBondContact OG-OG1 2.81Å |
| 20 | L | 98 | Very high | 96 | Very high | 70 Ų | 70 | 37 Ų | 37 | 37% | 0.366 | 24% | 0.236 | S | C | . | . | H | α-helix | trans | -60.3 | -48.3 | 177 | -71.8 | 176.2 | 0 | 0 | 0 | 111.5 | I16 G24 L53 T56 V57 | I16-L20 HydrophobicContact CG2-CD1 3.83Å; I16-L20 HydrophobicContact CG2-CG 4.32Å; I16-L20 WeakPolarHBondContact O-CB 3.3Å; I16-L20 WeakPolarHBondContact O-CG 3.33Å; I16-L20 PolarHBondContact O-N 3.47Å; L20-G24 WeakPolarHBondContact O-CA 3.33Å; L20-G24 PolarHBondContact O-N 3.45Å; L20-L53 HydrophobicContact CD2-CD2 4.12Å; L20-T56 HydrophobicContact CD2-CG2 3.73Å; L20-T56 HydrophobicContact CG-CG2 3.66Å; L20-V57 HydrophobicContact CD2-CG1 3.85Å |
| 21 | L | 96.2 | Very high | 95.8 | Very high | 119 Ų | 119 | 40.1 Ų | 40.1 | 62% | 0.623 | 24% | 0.241 | S | C | * | . | H | α-helix | trans | -62.4 | -52.3 | -179.6 | 178.3 | 62.4 | 0 | 0 | 0 | 111.3 | G17 L25 | G17-L21 WeakPolarHBondContact O-CB 3.41Å; G17-L21 PolarHBondContact O-N 2.98Å; G17-L21 VanDerWaalsContact O-N 3.08Å; L21-L25 HydrophobicContact CD1-CD1 4.09Å; L21-L25 HydrophobicContact CD1-CG 4.37Å; L21-L25 HydrophobicContact CG-CD1 4.21Å; L21-L25 WeakPolarHBondContact O-CB 3.3Å; L21-L25 WeakPolarHBondContact O-CG 3.08Å; L21-L25 PolarHBondContact O-N 3.36Å |
| 22 | S | 95.3 | Very high | 95.5 | Very high | 3 Ų | 3 | 41.8 Ų | 41.8 | 2% | 0.021 | 25% | 0.247 | C | C | . | . | H | α-helix | trans | -70.5 | -44.1 | -173.1 | 62 | 0 | 0 | 0 | 0 | 112.7 | V18 S19 L25 V26 | V18-S22 VanDerWaalsContact O-CB 3.23Å; V18-S22 WeakPolarHBondContact O-CB 3.47Å; V18-S22 PolarHBondContact O-N 3.31Å; V18-S22 PolarHBondContact O-OG 3.32Å; S19-S22 PolarHBondContact O-OG 2.86Å; S22-L25 PolarHBondContact O-N 3.21Å; S22-V26 WeakPolarHBondContact O-CG2 3.47Å; S22-V26 PolarHBondContact O-N 2.99Å; S22-V26 VanDerWaalsContact O-N 3.13Å |
| 23 | N | 96.7 | Very high | 95.2 | Very high | 0 Ų | 0 | 42.6 Ų | 42.6 | 0% | 0 | 25% | 0.253 | C | S | . | . | H | α-helix | trans | -70.3 | -36.8 | 175.8 | -70.4 | -82.4 | 0 | 0 | 0 | 111.4 | S19 L25 V26 L27 T49 N52 L53 A287 P291 | S19-N23 VanDerWaalsContact O-CB 3.26Å; S19-N23 WeakPolarHBondContact O-CB 3.3Å; S19-N23 PolarHBondContact O-N 3.3Å; S19-N23 PolarHBondContact O-ND2 2.78Å; S19-N23 PolarHBondContact OG-ND2 3Å; N23-L25 PolarHBondContact O-N 3.15Å; N23-V26 PolarHBondContact O-N 3.23Å; N23-L27 WeakPolarHBondContact O-CB 3.36Å; N23-L27 PolarHBondContact O-N 2.87Å; N23-T49 HydrophobicContact CB-CG2 3.93Å; N23-T49 WeakPolarHBondContact O-CG2 3.08Å; N23-N52 WeakPolarHBondContact OD1-CB 3.49Å; N23-N52 PolarHBondContact OD1-ND2 3.44Å; N23-L53 HydrophobicContact CB-CD1 4.43Å; N23-L53 HydrophobicContact CB-CD2 3.75Å; N23-L53 HydrophobicContact CB-CG 3.79Å; N23-A287 PolarHBondContact ND2-O 2.83Å; N23-P291 HydrophobicContact CB-CG 4.3Å; N23-P291 VanDerWaalsContact CG-CG 3.45Å; N23-P291 VanDerWaalsContact OD1-CG 3.28Å; N23-P291 WeakPolarHBondContact OD1-CG 3.25Å |
| 24 | G | 95.9 | Very high | 94.7 | Very high | 22 Ų | 22 | 40.7 Ų | 40.7 | 23% | 0.227 | 25% | 0.246 | C | C | . | . | H | α-helix | trans | -59.6 | -44.6 | 173.4 | 0 | 0 | 0 | 0 | 0 | 112.3 | L20 V26 L27 L28 | L20-G24 WeakPolarHBondContact O-CA 3.33Å; L20-G24 PolarHBondContact O-N 3.45Å; G24-V26 PolarHBondContact O-N 3.41Å; G24-L27 PolarHBondContact O-N 3.49Å; G24-L28 WeakPolarHBondContact O-CB 3.43Å; G24-L28 VanDerWaalsContact O-CG 3.29Å; G24-L28 WeakPolarHBondContact O-CG 3.5Å; G24-L28 PolarHBondContact O-N 3.42Å |
| 25 | L | 94 | Very high | 94.3 | Very high | 63 Ų | 63 | 43.9 Ų | 43.9 | 33% | 0.33 | 25% | 0.253 | S | S | . | . | H | α-helix | trans | -62.4 | -40.6 | 174.9 | -73.4 | 171.6 | 0 | 0 | 0 | 112.7 | L21 S22 N23 L28 C29 L296 | L21-L25 HydrophobicContact CD1-CD1 4.09Å; L21-L25 HydrophobicContact CD1-CG 4.37Å; L21-L25 HydrophobicContact CG-CD1 4.21Å; L21-L25 WeakPolarHBondContact O-CB 3.3Å; L21-L25 WeakPolarHBondContact O-CG 3.08Å; L21-L25 PolarHBondContact O-N 3.36Å; S22-L25 PolarHBondContact O-N 3.21Å; N23-L25 PolarHBondContact O-N 3.15Å; L25-L28 PolarHBondContact O-N 2.82Å; L25-C29 PolarHBondContact O-N 3.16Å; L25-C29 PolarHBondContact O-SG 3.06Å; L25-L296 HydrophobicContact CB-CD2 4.47Å |
| 26 | V | 94.8 | Very high | 93.8 | Very high | 0 Ų | 0 | 43.7 Ų | 43.7 | 0% | 0 | 25% | 0.252 | C | S | . | . | H | α-helix | trans | -64.2 | -44.7 | 175.8 | 171.2 | 0 | 0 | 0 | 0 | 110.9 | S22 N23 G24 C29 L30 T45 T49 P291 L296 Y301 | S22-V26 WeakPolarHBondContact O-CG2 3.47Å; S22-V26 PolarHBondContact O-N 2.99Å; S22-V26 VanDerWaalsContact O-N 3.13Å; N23-V26 PolarHBondContact O-N 3.23Å; G24-V26 PolarHBondContact O-N 3.41Å; V26-C29 WeakPolarHBondContact O-CB 3.45Å; V26-C29 PolarHBondContact O-N 3Å; V26-L30 HydrophobicContact CG1-CD1 4.06Å; V26-L30 WeakPolarHBondContact O-CG 3.29Å; V26-L30 PolarHBondContact O-N 3.35Å; V26-T45 HydrophobicContact CG1-CG2 3.72Å; V26-T49 HydrophobicContact CB-CG2 4.39Å; V26-T49 HydrophobicContact CG1-CG2 4.32Å; V26-T49 WeakPolarHBondContact CG1-OG1 3.4Å; V26-P291 HydrophobicContact CG2-CB 3.75Å; V26-P291 HydrophobicContact CG2-CG 4.39Å; V26-L296 HydrophobicContact CG2-CD1 4.43Å; V26-L296 HydrophobicContact CG2-CD2 3.76Å; V26-L296 HydrophobicContact CG2-CG 3.86Å; V26-Y301 HydrophobicContact CG1-CE1 4.07Å |
| 27 | L | 95.6 | Very high | 93.5 | Very high | 43 Ų | 43 | 49.1 Ų | 49.1 | 23% | 0.225 | 27% | 0.271 | C | S | . | . | H | α-helix | trans | -60.8 | -46.2 | 177 | -176 | 59.7 | 0 | 0 | 0 | 111.1 | N23 G24 C29 L30 L31 L46 T49 L53 | N23-L27 WeakPolarHBondContact O-CB 3.36Å; N23-L27 PolarHBondContact O-N 2.87Å; G24-L27 PolarHBondContact O-N 3.49Å; L27-C29 VanDerWaalsContact C-N 3.34Å; L27-C29 PolarHBondContact O-N 3.2Å; L27-L30 WeakPolarHBondContact O-CB 3.29Å; L27-L30 PolarHBondContact O-N 3.44Å; L27-L30 VanDerWaalsContact O-N 3.15Å; L27-L31 HydrophobicContact CD1-CD1 4.46Å; L27-L31 HydrophobicContact CD1-CG 4.38Å; L27-L31 HydrophobicContact CG-CD1 4.12Å; L27-L31 HydrophobicContact CG-CG 4.46Å; L27-L31 VanDerWaalsContact O-CG 3.3Å; L27-L31 WeakPolarHBondContact O-CG 3.39Å; L27-L31 PolarHBondContact O-N 3.34Å; L27-L46 HydrophobicContact CD1-CD1 3.75Å; L27-T49 HydrophobicContact CB-CG2 3.92Å; L27-L53 HydrophobicContact CD2-CD1 3.9Å |
| 28 | L | 92.8 | Very high | 93 | Very high | 72 Ų | 72 | 56.2 Ų | 56.2 | 38% | 0.377 | 29% | 0.285 | S | S | . | . | H | α-helix | trans | -59 | -43.8 | 175.5 | -71.3 | 172.5 | 0 | 0 | 0 | 111.9 | G24 L25 L30 L31 H32 | G24-L28 WeakPolarHBondContact O-CB 3.43Å; G24-L28 VanDerWaalsContact O-CG 3.29Å; G24-L28 WeakPolarHBondContact O-CG 3.5Å; G24-L28 PolarHBondContact O-N 3.42Å; L25-L28 PolarHBondContact O-N 2.82Å; L28-L30 VanDerWaalsContact C-N 3.31Å; L28-L30 PolarHBondContact O-N 2.9Å; L28-L31 PolarHBondContact O-N 3.46Å; L28-H32 WeakPolarHBondContact O-CB 3.3Å; L28-H32 PolarHBondContact O-N 3.27Å; L28-H32 PolarHBondContact O-ND1 3.15Å |
| 29 | C | 91.9 | Very high | 92.6 | Very high | 2 Ų | 2 | 56.2 Ų | 56.2 | 1% | 0.014 | 28% | 0.28 | C | S | . | . | H | α-helix | trans | -58.9 | -42.4 | 175.3 | -70.9 | 0 | 0 | 0 | 0 | 112.4 | L25 V26 L27 S33 I36 Y301 C305 | L25-C29 PolarHBondContact O-N 3.16Å; L25-C29 PolarHBondContact O-SG 3.06Å; V26-C29 WeakPolarHBondContact O-CB 3.45Å; V26-C29 PolarHBondContact O-N 3Å; L27-C29 VanDerWaalsContact C-N 3.34Å; L27-C29 PolarHBondContact O-N 3.2Å; C29-S33 VanDerWaalsContact O-CB 3.3Å; C29-S33 WeakPolarHBondContact O-CB 3.42Å; C29-S33 PolarHBondContact O-N 2.98Å; C29-I36 HydrophobicContact CB-CD1 4.48Å; C29-Y301 HydrophobicContact CB-CD1 3.75Å; C29-Y301 HydrophobicContact CB-CE1 4.04Å; C29-C305 PolarHBondContact SG-SG 3.08Å |
| 30 | L | 92.1 | Very high | 92.3 | Very high | 6 Ų | 6 | 56.5 Ų | 56.5 | 3% | 0.031 | 28% | 0.283 | C | S | . | . | H | α-helix | trans | -65.2 | -43.8 | 177.6 | -76.4 | 165.4 | 0 | 0 | 0 | 111.4 | V26 L27 L28 H32 I36 R37 A42 T45 L46 Y301 | V26-L30 HydrophobicContact CG1-CD1 4.06Å; V26-L30 WeakPolarHBondContact O-CG 3.29Å; V26-L30 PolarHBondContact O-N 3.35Å; L27-L30 WeakPolarHBondContact O-CB 3.29Å; L27-L30 PolarHBondContact O-N 3.44Å; L27-L30 VanDerWaalsContact O-N 3.15Å; L28-L30 VanDerWaalsContact C-N 3.31Å; L28-L30 PolarHBondContact O-N 2.9Å; L30-H32 VanDerWaalsContact C-N 3.35Å; L30-H32 PolarHBondContact O-N 3.42Å; L30-I36 HydrophobicContact CD2-CG2 3.63Å; L30-R37 WeakPolarHBondContact O-CD 3.47Å; L30-R37 WeakPolarHBondContact O-CG 3.36Å; L30-R37 PolarHBondContact O-NE 2.94Å; L30-A42 HydrophobicContact CD2-CB 3.97Å; L30-T45 HydrophobicContact CD1-CG2 4.08Å; L30-L46 HydrophobicContact CD1-CB 4.23Å; L30-L46 HydrophobicContact CD1-CD1 4.2Å; L30-Y301 HydrophobicContact CG-CE1 4.43Å |
| 31 | L | 91.4 | Very high | 92 | Very high | 108 Ų | 108 | 53.7 Ų | 53.7 | 57% | 0.565 | 27% | 0.268 | S | S | * | . | H | α-helix | trans | -65.2 | -38.9 | 179.5 | -66.9 | 173.9 | 0 | 0 | 0 | 112 | L27 L28 | L27-L31 HydrophobicContact CD1-CD1 4.46Å; L27-L31 HydrophobicContact CD1-CG 4.38Å; L27-L31 HydrophobicContact CG-CD1 4.12Å; L27-L31 HydrophobicContact CG-CG 4.46Å; L27-L31 VanDerWaalsContact O-CG 3.3Å; L27-L31 WeakPolarHBondContact O-CG 3.39Å; L27-L31 PolarHBondContact O-N 3.34Å; L28-L31 PolarHBondContact O-N 3.46Å |
| 32 | H | 89.3 | Confident | 91.9 | Very high | 104 Ų | 104 | 48.4 Ų | 48.4 | 48% | 0.481 | 24% | 0.242 | S | C | . | . | H | α-helix | trans | -86.1 | -29.9 | -174.8 | -70.3 | 80.1 | 0 | 0 | 0 | 114.3 | L28 L30 L308 | L28-H32 WeakPolarHBondContact O-CB 3.3Å; L28-H32 PolarHBondContact O-N 3.27Å; L28-H32 PolarHBondContact O-ND1 3.15Å; L30-H32 VanDerWaalsContact C-N 3.35Å; L30-H32 PolarHBondContact O-N 3.42Å; H32-L308 HydrophobicContact CB-CD1 4.38Å |
| 33 | S | 89.7 | Confident | 91.9 | Very high | 18 Ų | 18 | 51 Ų | 51 | 13% | 0.126 | 26% | 0.256 | C | S | . | . | trans | -102.9 | 104.5 | -175.3 | -173.3 | 0 | 0 | 0 | 0 | 112.2 | C29 D35 I36 R37 | C29-S33 VanDerWaalsContact O-CB 3.3Å; C29-S33 WeakPolarHBondContact O-CB 3.42Å; C29-S33 PolarHBondContact O-N 2.98Å; S33-D35 PolarHBondContact O-N 2.98Å; S33-I36 PolarHBondContact O-N 2.9Å; S33-I36 WeakPolarHBondContact OG-CG1 3.49Å; S33-I36 PolarHBondContact OG-N 3.25Å; S33-R37 PolarHBondContact O-N 3.4Å | ||
| 34 | A | 88.9 | Confident | 91.8 | Very high | 42 Ų | 42 | 51 Ų | 51 | 35% | 0.347 | 26% | 0.256 | S | S | . | . | H | α-helix | trans | -61.5 | -32.2 | 172.4 | 0 | 0 | 0 | 0 | 0 | 112.3 | I36 R37 R38 | A34-I36 VanDerWaalsContact C-N 3.32Å; A34-I36 PolarHBondContact O-N 3.15Å; A34-R37 PolarHBondContact O-N 3.5Å; A34-R38 VanDerWaalsContact O-CG 3.3Å; A34-R38 WeakPolarHBondContact O-CG 3.49Å; A34-R38 PolarHBondContact O-N 3.26Å |
| 35 | D | 88 | Confident | 91.7 | Very high | 107 Ų | 107 | 50.3 Ų | 50.3 | 57% | 0.572 | 25% | 0.247 | S | C | * | . | H | α-helix | trans | -66 | -34 | 178.8 | -67.7 | -23.6 | 0 | 0 | 0 | 112.9 | S33 Q39 | S33-D35 PolarHBondContact O-N 2.98Å; D35-Q39 WeakPolarHBondContact O-CG 3.08Å; D35-Q39 PolarHBondContact O-NE2 3.3Å; D35-Q39 VanDerWaalsContact O-NE2 3.15Å |
| 36 | I | 87.6 | Confident | 91.8 | Very high | 5 Ų | 5 | 50.5 Ų | 50.5 | 3% | 0.026 | 25% | 0.248 | C | C | . | . | H | α-helix | trans | -71.2 | -49.6 | 172.6 | -62.2 | 176.3 | 0 | 0 | 0 | 108.9 | C29 L30 S33 A34 R38 Q39 A42 Y301 | C29-I36 HydrophobicContact CB-CD1 4.48Å; L30-I36 HydrophobicContact CD2-CG2 3.63Å; S33-I36 PolarHBondContact O-N 2.9Å; S33-I36 WeakPolarHBondContact OG-CG1 3.49Å; S33-I36 PolarHBondContact OG-N 3.25Å; A34-I36 VanDerWaalsContact C-N 3.32Å; A34-I36 PolarHBondContact O-N 3.15Å; I36-R38 VanDerWaalsContact C-N 3.27Å; I36-R38 PolarHBondContact O-N 3.06Å; I36-Q39 WeakPolarHBondContact O-CB 3.32Å; I36-Q39 PolarHBondContact O-N 3.26Å; I36-A42 WeakPolarHBondContact O-CB 3.39Å; I36-Y301 HydrophobicContact CD1-CD1 4.16Å; I36-Y301 HydrophobicContact CD1-CD2 4.39Å; I36-Y301 HydrophobicContact CD1-CE1 4.18Å; I36-Y301 HydrophobicContact CD1-CE2 4.42Å; I36-Y301 HydrophobicContact CD1-CG 4.27Å; I36-Y301 HydrophobicContact CG2-CE1 4.25Å; I36-Y301 HydrophobicContact CG2-CE2 4.02Å; I36-Y301 WeakPolarHBondContact CG2-OH 3.16Å |
| 37 | R | 91.2 | Very high | 91.9 | Very high | 140 Ų | 140 | 51.2 Ų | 51.2 | 53% | 0.528 | 25% | 0.252 | S | S | . | . | H | α-helix | trans | -59.7 | -31.6 | -176.9 | -72.2 | -169.2 | -72.7 | 141.3 | -3.5 | 114.6 | L30 S33 A34 Q39 | L30-R37 WeakPolarHBondContact O-CD 3.47Å; L30-R37 WeakPolarHBondContact O-CG 3.36Å; L30-R37 PolarHBondContact O-NE 2.94Å; S33-R37 PolarHBondContact O-N 3.4Å; A34-R37 PolarHBondContact O-N 3.5Å; R37-Q39 PolarHBondContact O-N 3.26Å |
| 38 | R | 88.9 | Confident | 91.9 | Very high | 191 Ų | 191 | 49.3 Ų | 49.3 | 72% | 0.721 | 24% | 0.242 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -67.9 | -14.6 | 178.2 | -77.1 | 172.6 | 173.3 | 175.7 | -3.7 | 113.6 | A34 I36 | A34-R38 VanDerWaalsContact O-CG 3.3Å; A34-R38 WeakPolarHBondContact O-CG 3.49Å; A34-R38 PolarHBondContact O-N 3.26Å; I36-R38 VanDerWaalsContact C-N 3.27Å; I36-R38 PolarHBondContact O-N 3.06Å |
| 39 | Q | 89.6 | Confident | 92.1 | Very high | 66 Ų | 66 | 45.9 Ų | 45.9 | 31% | 0.308 | 22% | 0.224 | S | C | . | . | S | Bend | trans | -88.6 | 136.3 | -179.5 | -54.9 | 173.4 | 27.6 | 0 | 0 | 110.4 | D35 I36 R37 P41 A42 | D35-Q39 WeakPolarHBondContact O-CG 3.08Å; D35-Q39 PolarHBondContact O-NE2 3.3Å; D35-Q39 VanDerWaalsContact O-NE2 3.15Å; I36-Q39 WeakPolarHBondContact O-CB 3.32Å; I36-Q39 PolarHBondContact O-N 3.26Å; R37-Q39 PolarHBondContact O-N 3.26Å; Q39-P41 VanDerWaalsContact C-N 3.28Å; Q39-P41 VanDerWaalsContact O-N 3.14Å; Q39-A42 WeakPolarHBondContact O-CB 3.21Å; Q39-A42 PolarHBondContact O-N 3.3Å |
| 40 | A | 90.9 | Very high | 92.4 | Very high | 6 Ų | 6 | 48.7 Ų | 48.7 | 5% | 0.05 | 24% | 0.243 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -48.6 | -39.2 | 176.6 | 0 | 0 | 0 | 0 | 0 | 114.8 | A42 L43 M118 A123 | A40-A42 PolarHBondContact O-N 3.24Å; A40-A42 VanDerWaalsContact O-N 3.11Å; A40-L43 PolarHBondContact O-N 3.43Å; A40-M118 HydrophobicContact CB-CG 3.72Å; A40-M118 HydrophobicContact CB-SD 4.44Å; A40-A123 HydrophobicContact CB-CB 4.08Å |
| 41 | P | 91.6 | Very high | 92.7 | Very high | 10 Ų | 10 | 49 Ų | 49 | 7% | 0.065 | 25% | 0.247 | C | C | . | . | H | α-helix | trans | -65.6 | -15.5 | 179 | -19.6 | 33.4 | 0 | 0 | 0 | 114.7 | Q39 L43 F44 T45 D103 Y114 | Q39-P41 VanDerWaalsContact C-N 3.28Å; Q39-P41 VanDerWaalsContact O-N 3.14Å; P41-L43 VanDerWaalsContact C-N 3.27Å; P41-L43 PolarHBondContact O-N 3.06Å; P41-F44 PolarHBondContact O-N 2.95Å; P41-T45 WeakPolarHBondContact O-CB 3.44Å; P41-T45 PolarHBondContact O-N 3.08Å; P41-T45 PolarHBondContact O-OG1 3.09Å; P41-D103 WeakPolarHBondContact CG-OD2 3.45Å; P41-Y114 WeakPolarHBondContact CD-OH 3.29Å; P41-Y114 WeakPolarHBondContact CG-OH 3.34Å |
| 42 | A | 93.1 | Very high | 93 | Very high | 9 Ų | 9 | 44.3 Ų | 44.3 | 7% | 0.074 | 22% | 0.223 | C | C | . | . | H | α-helix | trans | -63.3 | -33.9 | 177.2 | 0 | 0 | 0 | 0 | 0 | 111.9 | L30 I36 Q39 A40 T45 L46 | L30-A42 HydrophobicContact CD2-CB 3.97Å; I36-A42 WeakPolarHBondContact O-CB 3.39Å; Q39-A42 WeakPolarHBondContact O-CB 3.21Å; Q39-A42 PolarHBondContact O-N 3.3Å; A40-A42 PolarHBondContact O-N 3.24Å; A40-A42 VanDerWaalsContact O-N 3.11Å; A42-T45 PolarHBondContact O-N 2.83Å; A42-L46 VanDerWaalsContact O-CB 3.24Å; A42-L46 WeakPolarHBondContact O-CB 3.46Å; A42-L46 PolarHBondContact O-N 3.35Å |
| 43 | L | 95.3 | Very high | 93.4 | Very high | 58 Ų | 58 | 41 Ų | 41 | 30% | 0.304 | 21% | 0.208 | S | C | . | . | H | α-helix | trans | -65.5 | -46 | 176.7 | -70.1 | 178.4 | 0 | 0 | 0 | 111.9 | A40 P41 T45 L46 N47 L120 A123 A124 | A40-L43 PolarHBondContact O-N 3.43Å; P41-L43 VanDerWaalsContact C-N 3.27Å; P41-L43 PolarHBondContact O-N 3.06Å; L43-T45 VanDerWaalsContact C-N 3.32Å; L43-T45 PolarHBondContact O-N 2.99Å; L43-L46 PolarHBondContact O-N 2.8Å; L43-N47 WeakPolarHBondContact O-CB 3.44Å; L43-N47 PolarHBondContact O-N 3.12Å; L43-L120 HydrophobicContact CD1-CD2 3.88Å; L43-L120 WeakPolarHBondContact CD1-O 3.23Å; L43-L120 HydrophobicContact CG-CD2 4.07Å; L43-A123 HydrophobicContact CD1-CB 4.12Å; L43-A124 HydrophobicContact CD1-CB 4.14Å |
| 44 | F | 94.6 | Very high | 93.8 | Very high | 0 Ų | 0 | 43.3 Ų | 43.3 | 0% | 0 | 22% | 0.219 | C | C | . | . | H | α-helix | trans | -62.4 | -42 | 175.6 | -56 | -55 | 0 | 0 | 0 | 111.9 | P41 N47 L48 A99 L100 D103 A123 M126 V127 | P41-F44 PolarHBondContact O-N 2.95Å; F44-N47 PolarHBondContact O-N 2.85Å; F44-L48 PolarHBondContact O-N 2.97Å; F44-A99 HydrophobicContact CD1-CB 3.99Å; F44-A99 HydrophobicContact CE1-CB 3.79Å; F44-A99 HydrophobicContact CZ-CB 4.4Å; F44-L100 HydrophobicContact CB-CD2 3.56Å; F44-L100 HydrophobicContact CB-CG 3.81Å; F44-L100 HydrophobicContact CD2-CD2 4.01Å; F44-L100 HydrophobicContact CG-CD2 4.12Å; F44-L100 HydrophobicContact CG-CG 4.37Å; F44-D103 HydrophobicContact CD2-CB 4.48Å; F44-D103 HydrophobicContact CE2-CB 4.05Å; F44-A123 HydrophobicContact CE1-CB 4.28Å; F44-A123 HydrophobicContact CE2-CB 3.9Å; F44-A123 HydrophobicContact CZ-CB 3.61Å; F44-M126 HydrophobicContact CE1-CB 3.71Å; F44-M126 HydrophobicContact CE1-CE 4.47Å; F44-M126 HydrophobicContact CE1-SD 4.4Å; F44-M126 HydrophobicContact CZ-CB 4Å; F44-M126 HydrophobicContact CZ-CE 4.1Å; F44-M126 HydrophobicContact CZ-SD 3.78Å; F44-V127 HydrophobicContact CD1-CG2 3.59Å; F44-V127 HydrophobicContact CE1-CG2 3.82Å |
| 45 | T | 94.1 | Very high | 94.2 | Very high | 6 Ų | 6 | 42 Ų | 42 | 4% | 0.037 | 21% | 0.207 | C | C | . | . | H | α-helix | trans | -62.9 | -45.1 | 178.3 | -53 | 0 | 0 | 0 | 0 | 110.6 | V26 L30 P41 A42 L43 L48 T49 Y294 S295 Y301 | V26-T45 HydrophobicContact CG1-CG2 3.72Å; L30-T45 HydrophobicContact CD1-CG2 4.08Å; P41-T45 WeakPolarHBondContact O-CB 3.44Å; P41-T45 PolarHBondContact O-N 3.08Å; P41-T45 PolarHBondContact O-OG1 3.09Å; A42-T45 PolarHBondContact O-N 2.83Å; L43-T45 VanDerWaalsContact C-N 3.32Å; L43-T45 PolarHBondContact O-N 2.99Å; T45-L48 PolarHBondContact O-N 3.24Å; T45-T49 VanDerWaalsContact O-CB 3.29Å; T45-T49 WeakPolarHBondContact O-CB 3.31Å; T45-T49 PolarHBondContact O-N 3.35Å; T45-T49 PolarHBondContact O-OG1 3.47Å; T45-Y294 HydrophobicContact CG2-CD2 4.01Å; T45-Y294 HydrophobicContact CG2-CE2 3.61Å; T45-S295 VanDerWaalsContact CG2-OG 3.25Å; T45-S295 WeakPolarHBondContact CG2-OG 3.46Å; T45-Y301 WeakPolarHBondContact CG2-OH 3.34Å |
| 46 | L | 95.6 | Very high | 94.7 | Very high | 68 Ų | 68 | 37 Ų | 37 | 36% | 0.356 | 18% | 0.18 | S | C | . | . | H | α-helix | trans | -63 | -46.3 | 178 | -177.4 | 64 | 0 | 0 | 0 | 111.1 | L27 L30 A42 L43 L48 T49 C50 | L27-L46 HydrophobicContact CD1-CD1 3.75Å; L30-L46 HydrophobicContact CD1-CB 4.23Å; L30-L46 HydrophobicContact CD1-CD1 4.2Å; A42-L46 VanDerWaalsContact O-CB 3.24Å; A42-L46 WeakPolarHBondContact O-CB 3.46Å; A42-L46 PolarHBondContact O-N 3.35Å; L43-L46 PolarHBondContact O-N 2.8Å; L46-L48 PolarHBondContact O-N 3.48Å; L46-T49 PolarHBondContact O-N 3.23Å; L46-C50 WeakPolarHBondContact O-CB 3.25Å; L46-C50 PolarHBondContact O-N 2.9Å; L46-C50 PolarHBondContact O-SG 3.32Å; L46-C50 VanDerWaalsContact O-SG 3.35Å |
| 47 | N | 97.1 | Very high | 95.2 | Very high | 15 Ų | 15 | 40.8 Ų | 40.8 | 8% | 0.08 | 20% | 0.203 | C | C | . | . | H | α-helix | trans | -55.1 | -50.7 | 176.3 | -176.6 | 47.6 | 0 | 0 | 0 | 111.8 | L43 F44 G51 N92 S96 V127 W131 | L43-N47 WeakPolarHBondContact O-CB 3.44Å; L43-N47 PolarHBondContact O-N 3.12Å; F44-N47 PolarHBondContact O-N 2.85Å; N47-G51 PolarHBondContact O-N 2.88Å; N47-N92 PolarHBondContact ND2-ND2 3.26Å; N47-N92 VanDerWaalsContact ND2-ND2 3.16Å; N47-N92 PolarHBondContact ND2-OD1 3.35Å; N47-N92 PolarHBondContact OD1-ND2 3.19Å; N47-S96 PolarHBondContact ND2-OG 2.96Å; N47-V127 HydrophobicContact CB-CG1 4.3Å; N47-W131 PolarHBondContact OD1-NE1 2.89Å |
| 48 | L | 96.3 | Very high | 95.4 | Very high | 3 Ų | 3 | 35.8 Ų | 35.8 | 2% | 0.016 | 19% | 0.189 | C | C | . | . | H | α-helix | trans | -63.2 | -44.5 | 177.4 | -78.6 | 167.3 | 0 | 0 | 0 | 112.2 | F44 T45 L46 G51 N52 L100 Y294 | F44-L48 PolarHBondContact O-N 2.97Å; T45-L48 PolarHBondContact O-N 3.24Å; L46-L48 PolarHBondContact O-N 3.48Å; L48-G51 PolarHBondContact O-N 3.47Å; L48-N52 WeakPolarHBondContact O-CB 3.49Å; L48-N52 PolarHBondContact O-N 3.4Å; L48-N52 PolarHBondContact O-ND2 3Å; L48-L100 HydrophobicContact CD1-CD1 3.39Å; L48-L100 HydrophobicContact CD1-CG 4.47Å; L48-Y294 HydrophobicContact CB-CE1 4.49Å; L48-Y294 WeakPolarHBondContact CB-OH 3.35Å; L48-Y294 HydrophobicContact CD1-CD1 4.41Å; L48-Y294 HydrophobicContact CD1-CE1 3.78Å |
| 49 | T | 96.9 | Very high | 95.8 | Very high | 0 Ų | 0 | 26.8 Ų | 26.8 | 0% | 0 | 16% | 0.155 | C | C | . | . | H | α-helix | trans | -62.7 | -46.7 | -178.3 | -57.8 | 0 | 0 | 0 | 0 | 111 | N23 V26 L27 T45 L46 N52 L53 | N23-T49 HydrophobicContact CB-CG2 3.93Å; N23-T49 WeakPolarHBondContact O-CG2 3.08Å; V26-T49 HydrophobicContact CB-CG2 4.39Å; V26-T49 HydrophobicContact CG1-CG2 4.32Å; V26-T49 WeakPolarHBondContact CG1-OG1 3.4Å; L27-T49 HydrophobicContact CB-CG2 3.92Å; T45-T49 VanDerWaalsContact O-CB 3.29Å; T45-T49 WeakPolarHBondContact O-CB 3.31Å; T45-T49 PolarHBondContact O-N 3.35Å; T45-T49 PolarHBondContact O-OG1 3.47Å; L46-T49 PolarHBondContact O-N 3.23Å; T49-N52 PolarHBondContact O-N 3.45Å; T49-L53 HydrophobicContact CG2-CD1 4.21Å; T49-L53 WeakPolarHBondContact O-CB 3.4Å; T49-L53 VanDerWaalsContact O-CG 3.31Å; T49-L53 WeakPolarHBondContact O-CG 3.46Å; T49-L53 PolarHBondContact O-N 3.47Å |
| 50 | C | 97.5 | Very high | 96.2 | Very high | 60 Ų | 60 | 23.7 Ų | 23.7 | 41% | 0.405 | 14% | 0.14 | S | C | . | . | H | α-helix | trans | -63.9 | -44.4 | 176.8 | -68.2 | 0 | 0 | 0 | 0 | 111.7 | L46 L53 L54 | L46-C50 WeakPolarHBondContact O-CB 3.25Å; L46-C50 PolarHBondContact O-N 2.9Å; L46-C50 PolarHBondContact O-SG 3.32Å; L46-C50 VanDerWaalsContact O-SG 3.35Å; C50-L53 PolarHBondContact O-N 3.24Å; C50-L54 WeakPolarHBondContact O-CB 3.37Å; C50-L54 PolarHBondContact O-N 3.13Å |
| 51 | G | 98.1 | Very high | 96.5 | Very high | 12 Ų | 12 | 25.8 Ų | 25.8 | 12% | 0.124 | 15% | 0.154 | C | C | . | . | H | α-helix | trans | -63.6 | -41.3 | 177.2 | 0 | 0 | 0 | 0 | 0 | 113.1 | N47 L48 L54 C55 | N47-G51 PolarHBondContact O-N 2.88Å; L48-G51 PolarHBondContact O-N 3.47Å; G51-L54 PolarHBondContact O-N 3.23Å; G51-C55 WeakPolarHBondContact O-CB 3.25Å; G51-C55 PolarHBondContact O-N 2.84Å |
| 52 | N | 97.9 | Very high | 96.8 | Very high | 10 Ų | 10 | 26.5 Ų | 26.5 | 5% | 0.053 | 16% | 0.157 | C | C | . | . | H | α-helix | trans | -64 | -45.6 | 176.4 | -74.1 | -13.7 | 0 | 0 | 0 | 111.2 | N23 L48 T49 C55 T56 A287 D290 | N23-N52 WeakPolarHBondContact OD1-CB 3.49Å; N23-N52 PolarHBondContact OD1-ND2 3.44Å; L48-N52 WeakPolarHBondContact O-CB 3.49Å; L48-N52 PolarHBondContact O-N 3.4Å; L48-N52 PolarHBondContact O-ND2 3Å; T49-N52 PolarHBondContact O-N 3.45Å; N52-C55 PolarHBondContact O-N 3.1Å; N52-T56 VanDerWaalsContact O-CB 3.28Å; N52-T56 WeakPolarHBondContact O-CB 3.32Å; N52-T56 PolarHBondContact O-N 2.88Å; N52-T56 PolarHBondContact O-OG1 3.46Å; N52-A287 HydrophobicContact CB-CB 3.83Å; N52-D290 PolarHBondContact ND2-OD2 3.5Å |
| 53 | L | 98.4 | Very high | 96.9 | Very high | 34 Ų | 34 | 26.1 Ų | 26.1 | 18% | 0.178 | 15% | 0.153 | C | C | . | . | H | α-helix | trans | -60.7 | -46.9 | 175.3 | -73.2 | 170.3 | 0 | 0 | 0 | 111.1 | L20 N23 L27 T49 C50 C55 T56 V57 | L20-L53 HydrophobicContact CD2-CD2 4.12Å; N23-L53 HydrophobicContact CB-CD1 4.43Å; N23-L53 HydrophobicContact CB-CD2 3.75Å; N23-L53 HydrophobicContact CB-CG 3.79Å; L27-L53 HydrophobicContact CD2-CD1 3.9Å; T49-L53 HydrophobicContact CG2-CD1 4.21Å; T49-L53 WeakPolarHBondContact O-CB 3.4Å; T49-L53 VanDerWaalsContact O-CG 3.31Å; T49-L53 WeakPolarHBondContact O-CG 3.46Å; T49-L53 PolarHBondContact O-N 3.47Å; C50-L53 PolarHBondContact O-N 3.24Å; L53-C55 PolarHBondContact O-N 2.86Å; L53-T56 WeakPolarHBondContact O-CB 3.31Å; L53-T56 PolarHBondContact O-N 3.32Å; L53-T56 VanDerWaalsContact O-N 3.1Å; L53-V57 VanDerWaalsContact O-CG2 3.26Å; L53-V57 WeakPolarHBondContact O-CG2 3.46Å; L53-V57 PolarHBondContact O-N 2.77Å |
| 54 | L | 98 | Very high | 97 | Very high | 68 Ų | 68 | 25.2 Ų | 25.2 | 36% | 0.356 | 15% | 0.148 | S | C | . | . | H | α-helix | trans | -60.8 | -45.3 | 179.1 | -174.1 | 60 | 0 | 0 | 0 | 112.2 | C50 G51 T56 V57 V58 L85 L89 | C50-L54 WeakPolarHBondContact O-CB 3.37Å; C50-L54 PolarHBondContact O-N 3.13Å; G51-L54 PolarHBondContact O-N 3.23Å; L54-T56 VanDerWaalsContact C-N 3.29Å; L54-T56 PolarHBondContact O-N 3Å; L54-V57 HydrophobicContact CD1-CG2 4.47Å; L54-V57 WeakPolarHBondContact O-CG2 3.46Å; L54-V57 PolarHBondContact O-N 3.33Å; L54-V58 HydrophobicContact CD1-CG2 3.93Å; L54-V58 WeakPolarHBondContact O-CB 3.35Å; L54-V58 PolarHBondContact O-N 2.96Å; L54-L85 HydrophobicContact CD2-CD2 4.13Å; L54-L89 HydrophobicContact CB-CD1 4.14Å; L54-L89 HydrophobicContact CD2-CD1 4.13Å; L54-L89 HydrophobicContact CD2-CD2 4.38Å; L54-L89 HydrophobicContact CG-CD1 4.05Å |
| 55 | C | 97.9 | Very high | 97.1 | Very high | 14 Ų | 14 | 27 Ų | 27 | 10% | 0.095 | 16% | 0.164 | C | C | . | . | I | π-helix | trans | -60.3 | -41.3 | 173.6 | -179.8 | 0 | 0 | 0 | 0 | 111.5 | G51 N52 L53 N59 M60 L89 | G51-C55 WeakPolarHBondContact O-CB 3.25Å; G51-C55 PolarHBondContact O-N 2.84Å; N52-C55 PolarHBondContact O-N 3.1Å; L53-C55 PolarHBondContact O-N 2.86Å; C55-N59 WeakPolarHBondContact O-CA 3.38Å; C55-N59 WeakPolarHBondContact O-CB 3.36Å; C55-N59 PolarHBondContact O-N 3.47Å; C55-M60 PolarHBondContact O-N 3.35Å; C55-M60 VanDerWaalsContact O-N 3.11Å; C55-L89 HydrophobicContact CB-CD1 3.87Å |
| 56 | T | 98.3 | Very high | 97.1 | Very high | 1 Ų | 1 | 26.8 Ų | 26.8 | 1% | 0.006 | 16% | 0.163 | C | C | . | . | I | π-helix | trans | -68.1 | -35.2 | -179.1 | -55.2 | 0 | 0 | 0 | 0 | 112.7 | I16 S19 L20 N52 L53 L54 M60 P61 | I16-T56 HydrophobicContact CB-CG2 4.32Å; I16-T56 HydrophobicContact CG1-CG2 4.4Å; I16-T56 HydrophobicContact CG2-CG2 4.02Å; S19-T56 WeakPolarHBondContact CB-OG1 3.39Å; S19-T56 PolarHBondContact OG-OG1 2.81Å; L20-T56 HydrophobicContact CD2-CG2 3.73Å; L20-T56 HydrophobicContact CG-CG2 3.66Å; N52-T56 VanDerWaalsContact O-CB 3.28Å; N52-T56 WeakPolarHBondContact O-CB 3.32Å; N52-T56 PolarHBondContact O-N 2.88Å; N52-T56 PolarHBondContact O-OG1 3.46Å; L53-T56 WeakPolarHBondContact O-CB 3.31Å; L53-T56 PolarHBondContact O-N 3.32Å; L53-T56 VanDerWaalsContact O-N 3.1Å; L54-T56 VanDerWaalsContact C-N 3.29Å; L54-T56 PolarHBondContact O-N 3Å; T56-M60 HydrophobicContact CG2-CE 4.46Å; T56-M60 HydrophobicContact CG2-SD 3.97Å; T56-M60 WeakPolarHBondContact OG1-CE 3.24Å; T56-P61 VanDerWaalsContact O-CD 3.24Å; T56-P61 WeakPolarHBondContact O-CD 3.43Å |
| 57 | V | 97.8 | Very high | 97.1 | Very high | 85 Ų | 85 | 23.7 Ų | 23.7 | 52% | 0.515 | 15% | 0.146 | S | C | . | . | I | π-helix | trans | -88.6 | -22.9 | -178.6 | -63.5 | 0 | 0 | 0 | 0 | 113.9 | L20 L53 L54 | L20-V57 HydrophobicContact CD2-CG1 3.85Å; L53-V57 VanDerWaalsContact O-CG2 3.26Å; L53-V57 WeakPolarHBondContact O-CG2 3.46Å; L53-V57 PolarHBondContact O-N 2.77Å; L54-V57 HydrophobicContact CD1-CG2 4.47Å; L54-V57 WeakPolarHBondContact O-CG2 3.46Å; L54-V57 PolarHBondContact O-N 3.33Å |
| 58 | V | 96.3 | Very high | 97 | Very high | 36 Ų | 36 | 26.8 Ų | 26.8 | 22% | 0.218 | 17% | 0.166 | C | C | . | . | I | π-helix | trans | -107.2 | -57.5 | -178.6 | -178.9 | 0 | 0 | 0 | 0 | 111.9 | L54 L62 A82 L85 | L54-V58 HydrophobicContact CD1-CG2 3.93Å; L54-V58 WeakPolarHBondContact O-CB 3.35Å; L54-V58 PolarHBondContact O-N 2.96Å; V58-L62 HydrophobicContact CG1-CD1 4.34Å; V58-L62 WeakPolarHBondContact O-CD1 3.42Å; V58-L62 WeakPolarHBondContact O-CG 3.42Å; V58-A82 HydrophobicContact CG1-CB 4.44Å; V58-L85 HydrophobicContact CG1-CD1 4.11Å |
| 59 | N | 97.3 | Very high | 96.8 | Very high | 2 Ų | 2 | 28.6 Ų | 28.6 | 1% | 0.011 | 18% | 0.181 | C | C | . | . | I | π-helix | trans | -78.9 | -44 | -168.1 | -65.1 | 98.6 | 0 | 0 | 0 | 113.2 | C55 L62 T63 A82 D86 Y284 | C55-N59 WeakPolarHBondContact O-CA 3.38Å; C55-N59 WeakPolarHBondContact O-CB 3.36Å; C55-N59 PolarHBondContact O-N 3.47Å; N59-L62 PolarHBondContact O-N 3.46Å; N59-T63 WeakPolarHBondContact O-CB 3.33Å; N59-T63 PolarHBondContact O-N 2.82Å; N59-T63 PolarHBondContact O-OG1 3.34Å; N59-A82 PolarHBondContact ND2-O 2.92Å; N59-D86 WeakPolarHBondContact ND2-CB 3.42Å; N59-Y284 HydrophobicContact CB-CE1 4.18Å |
| 60 | M | 97.7 | Very high | 96.5 | Very high | 0 Ų | 0 | 33.1 Ų | 33.1 | 0% | 0 | 20% | 0.202 | C | C | . | . | H | α-helix | trans | -64.3 | -42.6 | -179 | -57 | -174.5 | -166.7 | 0 | 0 | 112.8 | T15 I16 C55 T56 T63 L64 Y284 A287 | T15-M60 HydrophobicContact CG2-SD 4.29Å; I16-M60 HydrophobicContact CD1-CB 3.8Å; I16-M60 HydrophobicContact CG1-CB 3.58Å; I16-M60 HydrophobicContact CG1-CG 4.31Å; I16-M60 HydrophobicContact CG1-SD 3.75Å; C55-M60 PolarHBondContact O-N 3.35Å; C55-M60 VanDerWaalsContact O-N 3.11Å; T56-M60 HydrophobicContact CG2-CE 4.46Å; T56-M60 HydrophobicContact CG2-SD 3.97Å; T56-M60 WeakPolarHBondContact OG1-CE 3.24Å; M60-T63 PolarHBondContact O-N 3.34Å; M60-L64 WeakPolarHBondContact O-CB 3.4Å; M60-L64 PolarHBondContact O-N 2.84Å; M60-Y284 HydrophobicContact CE-CD1 4.11Å; M60-Y284 HydrophobicContact CE-CG 4.08Å; M60-Y284 HydrophobicContact CG-CD1 4.05Å; M60-Y284 HydrophobicContact CG-CD2 3.92Å; M60-Y284 HydrophobicContact CG-CE1 4.4Å; M60-Y284 HydrophobicContact CG-CE2 4.25Å; M60-Y284 HydrophobicContact CG-CG 3.81Å; M60-Y284 HydrophobicContact SD-CG 4.38Å; M60-A287 HydrophobicContact CE-CB 3.74Å |
| 61 | P | 97.1 | Very high | 96.1 | Very high | 51 Ų | 51 | 38.5 Ų | 38.5 | 33% | 0.331 | 21% | 0.214 | S | C | . | . | H | α-helix | trans | -67.8 | -37.6 | 178.1 | -23.7 | 37.6 | 0 | 0 | 0 | 112.9 | T56 T63 L64 A65 | T56-P61 VanDerWaalsContact O-CD 3.24Å; T56-P61 WeakPolarHBondContact O-CD 3.43Å; P61-T63 VanDerWaalsContact C-N 3.32Å; P61-L64 PolarHBondContact O-N 2.93Å; P61-A65 WeakPolarHBondContact O-CB 3.46Å; P61-A65 PolarHBondContact O-N 3.11Å |
| 62 | L | 96.8 | Very high | 95.9 | Very high | 25 Ų | 25 | 40.5 Ų | 40.5 | 13% | 0.131 | 22% | 0.22 | C | C | . | . | H | α-helix | trans | -65.1 | -37.8 | 173.5 | -72.2 | 174.3 | 0 | 0 | 0 | 111.7 | V58 N59 G66 P73 A74 L78 A82 | V58-L62 HydrophobicContact CG1-CD1 4.34Å; V58-L62 WeakPolarHBondContact O-CD1 3.42Å; V58-L62 WeakPolarHBondContact O-CG 3.42Å; N59-L62 PolarHBondContact O-N 3.46Å; L62-G66 PolarHBondContact O-N 3.43Å; L62-P73 HydrophobicContact CD2-CG 4.49Å; L62-P73 WeakPolarHBondContact O-CG 3.45Å; L62-A74 HydrophobicContact CD2-CB 3.74Å; L62-L78 HydrophobicContact CD1-CG 4.2Å; L62-L78 HydrophobicContact CD2-CD2 4.19Å; L62-A82 HydrophobicContact CD1-CB 3.41Å; L62-A82 VanDerWaalsContact CD1-CB 3.41Å |
| 63 | T | 96.8 | Very high | 95.4 | Very high | 1 Ų | 1 | 42.2 Ų | 42.2 | 1% | 0.006 | 23% | 0.232 | C | C | . | . | H | α-helix | trans | -66.7 | -44.6 | 174.3 | -56.2 | 0 | 0 | 0 | 0 | 111.2 | L12 N59 M60 P61 A65 G66 V67 A154 S155 Y284 | L12-T63 HydrophobicContact CD1-CG2 4.15Å; N59-T63 WeakPolarHBondContact O-CB 3.33Å; N59-T63 PolarHBondContact O-N 2.82Å; N59-T63 PolarHBondContact O-OG1 3.34Å; M60-T63 PolarHBondContact O-N 3.34Å; P61-T63 VanDerWaalsContact C-N 3.32Å; T63-A65 VanDerWaalsContact C-N 3.33Å; T63-A65 PolarHBondContact O-N 3.02Å; T63-G66 WeakPolarHBondContact O-CA 3.4Å; T63-G66 PolarHBondContact O-N 2.93Å; T63-G66 VanDerWaalsContact O-N 3.08Å; T63-V67 WeakPolarHBondContact O-CG2 3.36Å; T63-V67 PolarHBondContact O-N 2.74Å; T63-A154 WeakPolarHBondContact CA-O 3.43Å; T63-S155 VanDerWaalsContact OG1-CB 3.26Å; T63-S155 WeakPolarHBondContact OG1-CB 3.1Å; T63-Y284 HydrophobicContact CG2-CE2 4.1Å; T63-Y284 WeakPolarHBondContact OG1-CE2 3.48Å; T63-Y284 PolarHBondContact OG1-OH 3.41Å |
| 64 | L | 97.3 | Very high | 94.7 | Very high | 38 Ų | 38 | 41.8 Ų | 41.8 | 20% | 0.199 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -57.4 | -46.4 | 175.6 | 176.5 | 63 | 0 | 0 | 0 | 111.4 | A9 L12 V13 I16 M60 P61 G66 V67 V68 | A9-L64 HydrophobicContact CB-CD1 3.66Å; L12-L64 HydrophobicContact CB-CD1 4.29Å; L12-L64 HydrophobicContact CD1-CB 4.31Å; L12-L64 HydrophobicContact CD1-CD1 4.39Å; V13-L64 HydrophobicContact CG2-CD1 4.25Å; V13-L64 HydrophobicContact CG2-CD2 3.75Å; I16-L64 HydrophobicContact CD1-CD2 4.48Å; M60-L64 WeakPolarHBondContact O-CB 3.4Å; M60-L64 PolarHBondContact O-N 2.84Å; P61-L64 PolarHBondContact O-N 2.93Å; L64-G66 VanDerWaalsContact C-N 3.29Å; L64-G66 PolarHBondContact O-N 3.43Å; L64-V67 PolarHBondContact O-N 3.26Å; L64-V68 HydrophobicContact CD1-CG2 4.37Å; L64-V68 WeakPolarHBondContact O-CG2 3.35Å; L64-V68 PolarHBondContact O-N 3.41Å |
| 65 | A | 96 | Very high | 94.4 | Very high | 39 Ų | 39 | 41 Ų | 41 | 32% | 0.322 | 24% | 0.241 | S | C | . | . | H | α-helix | trans | -63.8 | -35.9 | 176.1 | 0 | 0 | 0 | 0 | 0 | 111.9 | P61 T63 V68 A69 P73 | P61-A65 WeakPolarHBondContact O-CB 3.46Å; P61-A65 PolarHBondContact O-N 3.11Å; T63-A65 VanDerWaalsContact C-N 3.33Å; T63-A65 PolarHBondContact O-N 3.02Å; A65-V68 PolarHBondContact O-N 3.21Å; A65-A69 WeakPolarHBondContact O-CB 3.23Å; A65-A69 PolarHBondContact O-N 2.68Å; A65-P73 HydrophobicContact CB-CB 3.39Å; A65-P73 HydrophobicContact CB-CG 3.79Å |
| 66 | G | 95.2 | Very high | 94.2 | Very high | 1 Ų | 1 | 42.8 Ų | 42.8 | 1% | 0.01 | 25% | 0.25 | C | C | . | . | H | α-helix | trans | -63.1 | -40.8 | 173.3 | 0 | 0 | 0 | 0 | 0 | 112.9 | L62 T63 L64 Q70 | L62-G66 PolarHBondContact O-N 3.43Å; T63-G66 WeakPolarHBondContact O-CA 3.4Å; T63-G66 PolarHBondContact O-N 2.93Å; T63-G66 VanDerWaalsContact O-N 3.08Å; L64-G66 VanDerWaalsContact C-N 3.29Å; L64-G66 PolarHBondContact O-N 3.43Å; G66-Q70 WeakPolarHBondContact O-CA 3.38Å; G66-Q70 PolarHBondContact O-N 2.83Å |
| 67 | V | 95.1 | Very high | 94 | Very high | 2 Ų | 2 | 53.6 Ų | 53.6 | 1% | 0.012 | 29% | 0.291 | C | S | . | . | H | α-helix | trans | -66 | -44.6 | 175 | 173.6 | 0 | 0 | 0 | 0 | 111.3 | D5 L12 T63 L64 Q70 A154 V277 | D5-V67 HydrophobicContact CB-CG1 4.37Å; L12-V67 HydrophobicContact CD1-CG2 4.23Å; T63-V67 WeakPolarHBondContact O-CG2 3.36Å; T63-V67 PolarHBondContact O-N 2.74Å; L64-V67 PolarHBondContact O-N 3.26Å; V67-Q70 PolarHBondContact O-NE2 3.4Å; V67-A154 HydrophobicContact CG2-CB 3.64Å; V67-V277 HydrophobicContact CG2-CG1 3.73Å |
| 68 | V | 94.4 | Very high | 93.9 | Very high | 81 Ų | 81 | 53.3 Ų | 53.3 | 49% | 0.491 | 29% | 0.286 | S | S | . | . | H | α-helix | trans | -70.4 | -43.5 | -178.9 | 173.7 | 0 | 0 | 0 | 0 | 111.5 | M1 L64 A65 | M1-V68 HydrophobicContact SD-CG2 4.17Å; L64-V68 HydrophobicContact CD1-CG2 4.37Å; L64-V68 WeakPolarHBondContact O-CG2 3.35Å; L64-V68 PolarHBondContact O-N 3.41Å; A65-V68 PolarHBondContact O-N 3.21Å |
| 69 | A | 91.8 | Very high | 93.9 | Very high | 41 Ų | 41 | 51.6 Ų | 51.6 | 34% | 0.339 | 28% | 0.275 | S | S | . | . | H | α-helix | trans | -83.5 | -14.9 | -176.1 | 0 | 0 | 0 | 0 | 0 | 113.5 | A65 R71 | A65-A69 WeakPolarHBondContact O-CB 3.23Å; A65-A69 PolarHBondContact O-N 2.68Å; A69-R71 HydrophobicContact CB-CG 3.95Å; A69-R71 WeakPolarHBondContact O-CG 3.46Å; A69-R71 PolarHBondContact O-N 2.94Å |
| 70 | Q | 90.2 | Very high | 93.9 | Very high | 95 Ų | 95 | 56 Ų | 56 | 44% | 0.444 | 29% | 0.292 | S | S | . | . | S | Bend | trans | 54.9 | 21 | -174.4 | -64.5 | -71.1 | -46.4 | 0 | 0 | 113.9 | G66 V67 Q151 | G66-Q70 WeakPolarHBondContact O-CA 3.38Å; G66-Q70 PolarHBondContact O-N 2.83Å; V67-Q70 PolarHBondContact O-NE2 3.4Å; Q70-Q151 PolarHBondContact O-NE2 3.13Å |
| 71 | R | 90.9 | Very high | 93.8 | Very high | 173 Ų | 173 | 60.5 Ų | 60.5 | 65% | 0.653 | 32% | 0.316 | S | S | * | . | S | Bend | trans | -152.1 | 170.5 | -178.9 | 68.2 | -170.5 | 173.4 | 102.8 | -4.5 | 109.3 | A69 P73 | A69-R71 HydrophobicContact CB-CG 3.95Å; A69-R71 WeakPolarHBondContact O-CG 3.46Å; A69-R71 PolarHBondContact O-N 2.94Å; R71-P73 VanDerWaalsContact O-CD 3.26Å; R71-P73 WeakPolarHBondContact O-CD 3.31Å; R71-P73 VanDerWaalsContact O-N 3.12Å |
| 72 | Q | 92.9 | Very high | 93.9 | Very high | 53 Ų | 53 | 58.1 Ų | 58.1 | 25% | 0.248 | 30% | 0.3 | C | S | . | . | trans | -57.7 | 117.9 | 173.5 | -172.3 | -179.9 | -61.2 | 0 | 0 | 110 | A74 F149 | Q72-A74 WeakPolarHBondContact CG-O 3.28Å; Q72-A74 PolarHBondContact NE2-O 3.3Å; Q72-F149 HydrophobicContact CB-CB 4.11Å; Q72-F149 HydrophobicContact CB-CD1 4.01Å; Q72-F149 HydrophobicContact CB-CD2 4.25Å; Q72-F149 HydrophobicContact CB-CG 3.86Å; Q72-F149 HydrophobicContact CG-CB 3.89Å; Q72-F149 HydrophobicContact CG-CD2 4.17Å; Q72-F149 HydrophobicContact CG-CG 3.99Å | ||
| 73 | P | 86.5 | Confident | 93.9 | Very high | 47 Ų | 47 | 56.9 Ų | 56.9 | 31% | 0.305 | 29% | 0.294 | S | S | . | . | trans | -84.5 | -19.2 | -170.7 | 31.3 | -35 | 0 | 0 | 0 | 113.6 | L62 A65 R71 | L62-P73 HydrophobicContact CD2-CG 4.49Å; L62-P73 WeakPolarHBondContact O-CG 3.45Å; A65-P73 HydrophobicContact CB-CB 3.39Å; A65-P73 HydrophobicContact CB-CG 3.79Å; R71-P73 VanDerWaalsContact O-CD 3.26Å; R71-P73 WeakPolarHBondContact O-CD 3.31Å; R71-P73 VanDerWaalsContact O-N 3.12Å | ||
| 74 | A | 85.1 | Confident | 94 | Very high | 24 Ų | 24 | 59 Ų | 59 | 20% | 0.198 | 30% | 0.302 | C | S | . | . | S | Bend | trans | -124.9 | 169.6 | -175.8 | 0 | 0 | 0 | 0 | 0 | 112 | L62 Q72 L78 | L62-A74 HydrophobicContact CD2-CB 3.74Å; Q72-A74 WeakPolarHBondContact CG-O 3.28Å; Q72-A74 PolarHBondContact NE2-O 3.3Å; A74-L78 HydrophobicContact CB-CB 4.17Å; A74-L78 HydrophobicContact CB-CD2 3.79Å; A74-L78 HydrophobicContact CB-CG 4.16Å |
| 75 | G | 91.3 | Very high | 94 | Very high | 52 Ų | 52 | 58.5 Ų | 58.5 | 54% | 0.536 | 30% | 0.3 | S | S | . | . | trans | -61.9 | 154.3 | 172.8 | 0 | 0 | 0 | 0 | 0 | 112.9 | R77 L78 C79 | G75-R77 VanDerWaalsContact C-N 3.27Å; G75-R77 PolarHBondContact O-N 3.48Å; G75-L78 PolarHBondContact O-N 3.28Å; G75-L78 VanDerWaalsContact O-N 3.08Å; G75-C79 PolarHBondContact O-N 3.28Å | ||
| 76 | D | 93.2 | Very high | 94.1 | Very high | 51 Ų | 51 | 57.1 Ų | 57.1 | 27% | 0.273 | 29% | 0.287 | S | S | . | . | H | α-helix | trans | -55.8 | -38.8 | -175.9 | -171.9 | 69 | 0 | 0 | 0 | 112.6 | L78 C79 R80 R161 | D76-L78 PolarHBondContact O-N 2.9Å; D76-C79 PolarHBondContact O-N 2.9Å; D76-R80 WeakPolarHBondContact O-CG 3.38Å; D76-R80 PolarHBondContact O-N 2.95Å; D76-R80 IonicContact OD1-NE 3.11Å; D76-R80 IonicContact OD2-CZ 2.89Å; D76-R80 IonicContact OD2-NE 3.59Å; D76-R80 PolarHBondContact OD2-NE 3.07Å; D76-R80 IonicContact OD2-NH2 3.71Å; D76-R80 PolarHBondContact OD2-NH2 3.12Å; D76-R161 IonicContact OD1-NH2 3.94Å |
| 77 | R | 94.9 | Very high | 94.3 | Very high | 228 Ų | 228 | 57.2 Ų | 57.2 | 86% | 0.86 | 29% | 0.288 | S | S | * | . | H | α-helix | trans | -59.8 | -47.1 | 176.2 | -63.5 | -174.1 | -171.2 | -174.3 | 3.1 | 112.6 | G75 C79 R80 L81 | G75-R77 VanDerWaalsContact C-N 3.27Å; G75-R77 PolarHBondContact O-N 3.48Å; R77-C79 VanDerWaalsContact C-N 3.31Å; R77-C79 PolarHBondContact O-N 2.9Å; R77-R80 PolarHBondContact O-N 2.9Å; R77-L81 PolarHBondContact O-N 3.4Å |
| 78 | L | 95.3 | Very high | 94.4 | Very high | 79 Ų | 79 | 57.9 Ų | 57.9 | 41% | 0.414 | 29% | 0.29 | S | S | . | . | H | α-helix | trans | -67 | -36.5 | 179 | -177.6 | 56.1 | 0 | 0 | 0 | 110.7 | L62 A74 G75 D76 L81 A82 | L62-L78 HydrophobicContact CD1-CG 4.2Å; L62-L78 HydrophobicContact CD2-CD2 4.19Å; A74-L78 HydrophobicContact CB-CB 4.17Å; A74-L78 HydrophobicContact CB-CD2 3.79Å; A74-L78 HydrophobicContact CB-CG 4.16Å; G75-L78 PolarHBondContact O-N 3.28Å; G75-L78 VanDerWaalsContact O-N 3.08Å; D76-L78 PolarHBondContact O-N 2.9Å; L78-L81 HydrophobicContact CD1-CD2 4.49Å; L78-L81 PolarHBondContact O-N 3.29Å; L78-A82 VanDerWaalsContact O-CB 3.31Å; L78-A82 WeakPolarHBondContact O-CB 3.41Å; L78-A82 PolarHBondContact O-N 3.08Å |
| 79 | C | 96.1 | Very high | 94.6 | Very high | 0 Ų | 0 | 54.7 Ų | 54.7 | 0% | 0 | 27% | 0.271 | C | S | . | . | H | α-helix | trans | -66.9 | -42.4 | 176.2 | -168.4 | 0 | 0 | 0 | 0 | 112.5 | G75 D76 R77 L81 A82 A83 F149 C156 | G75-C79 PolarHBondContact O-N 3.28Å; D76-C79 PolarHBondContact O-N 2.9Å; R77-C79 VanDerWaalsContact C-N 3.31Å; R77-C79 PolarHBondContact O-N 2.9Å; C79-L81 PolarHBondContact O-N 3.02Å; C79-A82 PolarHBondContact O-N 3.39Å; C79-A83 WeakPolarHBondContact O-CB 3.2Å; C79-A83 PolarHBondContact O-N 3.25Å; C79-F149 PolarHBondContact SG-N 3.24Å; C79-F149 VanDerWaalsContact SG-N 3.36Å; C79-C156 WeakPolarHBondContact CA-SG 3.48Å; C79-C156 HydrophobicContact CB-CB 4.16Å; C79-C156 WeakPolarHBondContact CB-SG 3.48Å; C79-C156 VanDerWaalsContact O-CB 3.27Å; C79-C156 WeakPolarHBondContact O-CB 3.29Å; C79-C156 WeakPolarHBondContact SG-CB 3.07Å; C79-C156 CovalentContact SG-SG 2.04Å; C79-C156 PolarHBondContact SG-SG 2.94Å |
| 80 | R | 96.6 | Very high | 94.9 | Very high | 96 Ų | 96 | 54 Ų | 54 | 36% | 0.362 | 27% | 0.265 | S | S | . | . | H | α-helix | trans | -62.1 | -42.2 | 174.4 | -69 | -175.1 | -161 | -163.8 | 5.6 | 112 | D76 R77 A83 F84 L147 | D76-R80 WeakPolarHBondContact O-CG 3.38Å; D76-R80 PolarHBondContact O-N 2.95Å; D76-R80 IonicContact OD1-NE 3.11Å; D76-R80 IonicContact OD2-CZ 2.89Å; D76-R80 IonicContact OD2-NE 3.59Å; D76-R80 PolarHBondContact OD2-NE 3.07Å; D76-R80 IonicContact OD2-NH2 3.71Å; D76-R80 PolarHBondContact OD2-NH2 3.12Å; R77-R80 PolarHBondContact O-N 2.9Å; R80-A83 PolarHBondContact O-N 2.85Å; R80-F84 WeakPolarHBondContact O-CB 3.06Å; R80-F84 PolarHBondContact O-N 3.28Å; R80-L147 HydrophobicContact CB-CB 4.47Å; R80-L147 HydrophobicContact CG-CB 4.41Å |
| 81 | L | 96.9 | Very high | 95.3 | Very high | 94 Ų | 94 | 49.5 Ų | 49.5 | 49% | 0.492 | 24% | 0.244 | S | C | . | . | H | α-helix | trans | -61.8 | -44.7 | 174.1 | 177.5 | 62 | 0 | 0 | 0 | 111.5 | R77 L78 C79 F84 L85 | R77-L81 PolarHBondContact O-N 3.4Å; L78-L81 HydrophobicContact CD1-CD2 4.49Å; L78-L81 PolarHBondContact O-N 3.29Å; C79-L81 PolarHBondContact O-N 3.02Å; L81-F84 WeakPolarHBondContact O-CB 3.26Å; L81-F84 PolarHBondContact O-N 2.94Å; L81-L85 HydrophobicContact CD1-CD1 4.33Å; L81-L85 HydrophobicContact CD1-CG 4.35Å; L81-L85 HydrophobicContact CG-CD1 4.22Å; L81-L85 WeakPolarHBondContact O-CG 3.41Å; L81-L85 PolarHBondContact O-N 2.95Å |
| 82 | A | 97.6 | Very high | 95.6 | Very high | 0 Ų | 0 | 41.5 Ų | 41.5 | 0% | 0 | 21% | 0.214 | C | C | . | . | H | α-helix | trans | -63.3 | -43.2 | 176.9 | 0 | 0 | 0 | 0 | 0 | 111.7 | V58 N59 L62 L78 C79 F84 L85 D86 C156 | V58-A82 HydrophobicContact CG1-CB 4.44Å; N59-A82 PolarHBondContact ND2-O 2.92Å; L62-A82 HydrophobicContact CD1-CB 3.41Å; L62-A82 VanDerWaalsContact CD1-CB 3.41Å; L78-A82 VanDerWaalsContact O-CB 3.31Å; L78-A82 WeakPolarHBondContact O-CB 3.41Å; L78-A82 PolarHBondContact O-N 3.08Å; C79-A82 PolarHBondContact O-N 3.39Å; A82-F84 VanDerWaalsContact C-N 3.34Å; A82-F84 PolarHBondContact O-N 3.36Å; A82-L85 PolarHBondContact O-N 2.93Å; A82-D86 VanDerWaalsContact O-CB 3.28Å; A82-D86 WeakPolarHBondContact O-CB 3.39Å; A82-D86 PolarHBondContact O-N 3.34Å; A82-C156 HydrophobicContact CB-CB 3.88Å |
| 83 | A | 97.9 | Very high | 95.8 | Very high | 0 Ų | 0 | 39.4 Ų | 39.4 | 0% | 0 | 21% | 0.205 | C | C | . | . | H | α-helix | trans | -63.1 | -38.9 | 176 | 0 | 0 | 0 | 0 | 0 | 112.4 | C79 R80 T87 L147 C156 | C79-A83 WeakPolarHBondContact O-CB 3.2Å; C79-A83 PolarHBondContact O-N 3.25Å; R80-A83 PolarHBondContact O-N 2.85Å; A83-T87 WeakPolarHBondContact O-CB 3.36Å; A83-T87 PolarHBondContact O-N 3.35Å; A83-T87 PolarHBondContact O-OG1 3.16Å; A83-L147 HydrophobicContact CB-CB 3.99Å; A83-L147 HydrophobicContact CB-CD2 3.9Å; A83-L147 HydrophobicContact CB-CG 4.47Å; A83-C156 WeakPolarHBondContact CA-O 3.4Å; A83-C156 HydrophobicContact CB-CB 4.15Å |
| 84 | F | 98.5 | Very high | 96.3 | Very high | 44 Ų | 44 | 37.3 Ų | 37.3 | 19% | 0.193 | 19% | 0.192 | C | C | . | . | H | α-helix | trans | -60.1 | -52.2 | 172.7 | -178 | -80.2 | 0 | 0 | 0 | 110.7 | R80 L81 A82 D86 T87 F88 L135 P138 L142 L147 | R80-F84 WeakPolarHBondContact O-CB 3.06Å; R80-F84 PolarHBondContact O-N 3.28Å; L81-F84 WeakPolarHBondContact O-CB 3.26Å; L81-F84 PolarHBondContact O-N 2.94Å; A82-F84 VanDerWaalsContact C-N 3.34Å; A82-F84 PolarHBondContact O-N 3.36Å; F84-D86 PolarHBondContact O-N 3.28Å; F84-T87 PolarHBondContact O-N 2.87Å; F84-F88 VanDerWaalsContact O-CB 3.31Å; F84-F88 WeakPolarHBondContact O-CB 3.5Å; F84-F88 PolarHBondContact O-N 3.1Å; F84-L135 HydrophobicContact CE1-CD1 4.25Å; F84-L135 HydrophobicContact CZ-CD1 3.63Å; F84-P138 HydrophobicContact CD1-CB 4.36Å; F84-P138 HydrophobicContact CD2-CB 3.63Å; F84-P138 HydrophobicContact CE1-CB 4.44Å; F84-P138 HydrophobicContact CE2-CB 3.73Å; F84-P138 HydrophobicContact CE2-CG 4.23Å; F84-P138 HydrophobicContact CG-CB 3.95Å; F84-P138 HydrophobicContact CZ-CB 4.14Å; F84-P138 HydrophobicContact CZ-CG 4.22Å; F84-L142 HydrophobicContact CD2-CB 4.43Å; F84-L142 HydrophobicContact CD2-CD2 4.42Å; F84-L147 HydrophobicContact CB-CD1 4.02Å; F84-L147 HydrophobicContact CD2-CD1 4.31Å |
| 85 | L | 98.3 | Very high | 96.9 | Very high | 29 Ų | 29 | 36.6 Ų | 36.6 | 15% | 0.152 | 18% | 0.184 | C | C | . | . | H | α-helix | trans | -62.6 | -41.3 | 178.6 | -71.3 | 174.7 | 0 | 0 | 0 | 111.8 | L54 V58 L81 A82 T87 F88 L89 | L54-L85 HydrophobicContact CD2-CD2 4.13Å; V58-L85 HydrophobicContact CG1-CD1 4.11Å; L81-L85 HydrophobicContact CD1-CD1 4.33Å; L81-L85 HydrophobicContact CD1-CG 4.35Å; L81-L85 HydrophobicContact CG-CD1 4.22Å; L81-L85 WeakPolarHBondContact O-CG 3.41Å; L81-L85 PolarHBondContact O-N 2.95Å; A82-L85 PolarHBondContact O-N 2.93Å; L85-T87 PolarHBondContact O-N 3.33Å; L85-F88 PolarHBondContact O-N 2.77Å; L85-L89 HydrophobicContact CB-CD1 4.33Å; L85-L89 WeakPolarHBondContact O-CB 3.22Å; L85-L89 WeakPolarHBondContact O-CG 3.45Å; L85-L89 PolarHBondContact O-N 3.47Å |
| 86 | D | 97.9 | Very high | 97.1 | Very high | 10 Ų | 10 | 34.1 Ų | 34.1 | 5% | 0.053 | 16% | 0.159 | C | C | . | . | H | α-helix | trans | -58.2 | -49.5 | 178.2 | -171.6 | 82.7 | 0 | 0 | 0 | 110.7 | N59 A82 F84 A90 K280 Y284 | N59-D86 WeakPolarHBondContact ND2-CB 3.42Å; A82-D86 VanDerWaalsContact O-CB 3.28Å; A82-D86 WeakPolarHBondContact O-CB 3.39Å; A82-D86 PolarHBondContact O-N 3.34Å; F84-D86 PolarHBondContact O-N 3.28Å; D86-A90 WeakPolarHBondContact O-CB 3.43Å; D86-A90 PolarHBondContact O-N 2.97Å; D86-K280 WeakPolarHBondContact OD1-CE 3.26Å; D86-K280 IonicContact OD1-NZ 3.19Å; D86-K280 PolarHBondContact OD1-NZ 3.36Å; D86-K280 IonicContact OD2-NZ 2.96Å; D86-K280 PolarHBondContact OD2-NZ 3.29Å; D86-Y284 PolarHBondContact OD1-OH 3.29Å |
| 87 | T | 98.1 | Very high | 97.1 | Very high | 3 Ų | 3 | 31.7 Ų | 31.7 | 2% | 0.018 | 15% | 0.146 | C | C | . | . | H | α-helix | trans | -66.3 | -46.4 | -179.7 | -53.6 | 0 | 0 | 0 | 0 | 111.3 | A83 F84 L85 A91 F137 P138 L158 F176 | A83-T87 WeakPolarHBondContact O-CB 3.36Å; A83-T87 PolarHBondContact O-N 3.35Å; A83-T87 PolarHBondContact O-OG1 3.16Å; F84-T87 PolarHBondContact O-N 2.87Å; L85-T87 PolarHBondContact O-N 3.33Å; T87-A91 PolarHBondContact O-N 3.41Å; T87-A91 VanDerWaalsContact O-N 3.16Å; T87-F137 HydrophobicContact CG2-CB 4.35Å; T87-P138 HydrophobicContact CG2-CB 4.2Å; T87-L158 HydrophobicContact CG2-CD1 4.18Å; T87-L158 HydrophobicContact CG2-CD2 4.41Å; T87-L158 HydrophobicContact CG2-CG 4.3Å; T87-F176 HydrophobicContact CG2-CD2 4.46Å; T87-F176 HydrophobicContact CG2-CE2 3.76Å; T87-F176 HydrophobicContact CG2-CZ 3.88Å |
| 88 | F | 98.6 | Very high | 97.1 | Very high | 15 Ų | 15 | 21.2 Ų | 21.2 | 7% | 0.066 | 11% | 0.108 | C | C | . | . | H | α-helix | trans | -59.4 | -53.2 | 177.2 | 173.6 | -111 | 0 | 0 | 0 | 111.9 | F84 L85 A90 A91 N92 W131 A134 L135 P138 | F84-F88 VanDerWaalsContact O-CB 3.31Å; F84-F88 WeakPolarHBondContact O-CB 3.5Å; F84-F88 PolarHBondContact O-N 3.1Å; L85-F88 PolarHBondContact O-N 2.77Å; F88-A90 PolarHBondContact O-N 2.94Å; F88-A91 PolarHBondContact O-N 2.95Å; F88-N92 VanDerWaalsContact O-CB 3.29Å; F88-N92 WeakPolarHBondContact O-CB 3.41Å; F88-N92 PolarHBondContact O-N 2.9Å; F88-W131 HydrophobicContact CE1-CE3 4.46Å; F88-W131 HydrophobicContact CE1-CH2 4.33Å; F88-W131 HydrophobicContact CE1-CZ3 4.24Å; F88-W131 HydrophobicContact CE2-CE3 4.29Å; F88-W131 AromaticContact CZ-CD2 3.78Å; F88-W131 HydrophobicContact CZ-CD2 3.78Å; F88-W131 AromaticContact CZ-CE3 3.56Å; F88-W131 HydrophobicContact CZ-CE3 3.56Å; F88-W131 HydrophobicContact CZ-CG 4.38Å; F88-W131 HydrophobicContact CZ-CH2 4.17Å; F88-W131 HydrophobicContact CZ-CZ2 4.36Å; F88-W131 AromaticContact CZ-CZ3 3.76Å; F88-W131 HydrophobicContact CZ-CZ3 3.76Å; F88-A134 HydrophobicContact CD2-CB 3.87Å; F88-A134 HydrophobicContact CE2-CB 3.91Å; F88-L135 HydrophobicContact CD2-CB 4.44Å; F88-L135 HydrophobicContact CD2-CD1 4.43Å; F88-L135 HydrophobicContact CE2-CB 4.37Å; F88-P138 HydrophobicContact CB-CG 3.91Å |
| 89 | L | 98.2 | Very high | 97.1 | Very high | 15 Ų | 15 | 17.8 Ų | 17.8 | 8% | 0.079 | 9% | 0.091 | C | C | . | . | H | α-helix | trans | -68.1 | -36.8 | -174.9 | -67.1 | 173.3 | 0 | 0 | 0 | 111.6 | L54 C55 L85 S93 | L54-L89 HydrophobicContact CB-CD1 4.14Å; L54-L89 HydrophobicContact CD2-CD1 4.13Å; L54-L89 HydrophobicContact CD2-CD2 4.38Å; L54-L89 HydrophobicContact CG-CD1 4.05Å; C55-L89 HydrophobicContact CB-CD1 3.87Å; L85-L89 HydrophobicContact CB-CD1 4.33Å; L85-L89 WeakPolarHBondContact O-CB 3.22Å; L85-L89 WeakPolarHBondContact O-CG 3.45Å; L85-L89 PolarHBondContact O-N 3.47Å; L89-S93 WeakPolarHBondContact O-CB 3.43Å; L89-S93 PolarHBondContact O-N 3.4Å |
| 90 | A | 97.4 | Very high | 97 | Very high | 27 Ų | 27 | 17.9 Ų | 17.9 | 22% | 0.223 | 9% | 0.091 | C | C | . | . | H | α-helix | trans | -62 | -50.3 | 174.6 | 0 | 0 | 0 | 0 | 0 | 111.5 | D86 F88 S93 M94 | D86-A90 WeakPolarHBondContact O-CB 3.43Å; D86-A90 PolarHBondContact O-N 2.97Å; F88-A90 PolarHBondContact O-N 2.94Å; A90-S93 PolarHBondContact O-N 3.45Å; A90-M94 HydrophobicContact CB-CE 4.04Å; A90-M94 VanDerWaalsContact O-CE 3.26Å; A90-M94 WeakPolarHBondContact O-CE 3.24Å; A90-M94 WeakPolarHBondContact O-CG 3.2Å; A90-M94 PolarHBondContact O-N 3.35Å |
| 91 | A | 98.1 | Very high | 96.8 | Very high | 0 Ų | 0 | 13.3 Ų | 13.3 | 0% | 0 | 7% | 0.074 | C | C | . | . | H | α-helix | trans | -63 | -46.8 | 177.1 | 0 | 0 | 0 | 0 | 0 | 112.3 | T87 F88 S93 M94 L95 A134 F176 | T87-A91 PolarHBondContact O-N 3.41Å; T87-A91 VanDerWaalsContact O-N 3.16Å; F88-A91 PolarHBondContact O-N 2.95Å; A91-S93 VanDerWaalsContact C-N 3.29Å; A91-S93 PolarHBondContact O-N 2.69Å; A91-M94 PolarHBondContact O-N 2.8Å; A91-L95 WeakPolarHBondContact O-CG 3.47Å; A91-L95 PolarHBondContact O-N 3.35Å; A91-A134 HydrophobicContact CB-CB 3.74Å; A91-F176 HydrophobicContact CB-CE2 3.83Å; A91-F176 HydrophobicContact CB-CZ 4.46Å |
| 92 | N | 98.1 | Very high | 96.7 | Very high | 4 Ų | 4 | 11.3 Ų | 11.3 | 2% | 0.021 | 6% | 0.064 | C | C | . | . | H | α-helix | trans | -61 | -38.7 | 178.8 | -178 | 53.8 | 0 | 0 | 0 | 111.4 | N47 F88 S96 T130 A134 | N47-N92 PolarHBondContact ND2-ND2 3.26Å; N47-N92 VanDerWaalsContact ND2-ND2 3.16Å; N47-N92 PolarHBondContact ND2-OD1 3.35Å; N47-N92 PolarHBondContact OD1-ND2 3.19Å; F88-N92 VanDerWaalsContact O-CB 3.29Å; F88-N92 WeakPolarHBondContact O-CB 3.41Å; F88-N92 PolarHBondContact O-N 2.9Å; N92-S96 WeakPolarHBondContact O-CB 3.1Å; N92-S96 PolarHBondContact O-N 3.47Å; N92-S96 PolarHBondContact O-OG 2.69Å; N92-T130 WeakPolarHBondContact OD1-CB 3.49Å; N92-T130 PolarHBondContact OD1-OG1 2.92Å; N92-A134 HydrophobicContact CB-CB 3.8Å |
| 93 | S | 97.1 | Very high | 96.4 | Very high | 9 Ų | 9 | 11.3 Ų | 11.3 | 6% | 0.063 | 6% | 0.064 | C | C | . | . | H | α-helix | trans | -64.6 | -47.2 | 175.8 | 179.9 | 0 | 0 | 0 | 0 | 112 | L89 A90 A91 S96 M97 | L89-S93 WeakPolarHBondContact O-CB 3.43Å; L89-S93 PolarHBondContact O-N 3.4Å; A90-S93 PolarHBondContact O-N 3.45Å; A91-S93 VanDerWaalsContact C-N 3.29Å; A91-S93 PolarHBondContact O-N 2.69Å; S93-S96 PolarHBondContact O-N 2.88Å; S93-M97 WeakPolarHBondContact O-CG 3.29Å; S93-M97 PolarHBondContact O-N 3.25Å |
| 94 | M | 96.9 | Very high | 96 | Very high | 4 Ų | 4 | 13.6 Ų | 13.6 | 2% | 0.02 | 7% | 0.072 | C | C | . | . | H | α-helix | trans | -60.2 | -49.2 | 178 | -71.4 | -177.7 | -97.8 | 0 | 0 | 111.7 | A90 A91 S96 M97 A98 F181 S184 F250 F254 | A90-M94 HydrophobicContact CB-CE 4.04Å; A90-M94 VanDerWaalsContact O-CE 3.26Å; A90-M94 WeakPolarHBondContact O-CE 3.24Å; A90-M94 WeakPolarHBondContact O-CG 3.2Å; A90-M94 PolarHBondContact O-N 3.35Å; A91-M94 PolarHBondContact O-N 2.8Å; M94-S96 VanDerWaalsContact C-N 3.34Å; M94-S96 PolarHBondContact O-N 2.67Å; M94-M97 WeakPolarHBondContact O-CB 3.19Å; M94-M97 PolarHBondContact O-N 3.13Å; M94-A98 PolarHBondContact O-N 3.43Å; M94-F181 HydrophobicContact SD-CB 3.65Å; M94-F181 HydrophobicContact SD-CD2 4.15Å; M94-F181 HydrophobicContact SD-CG 4.42Å; M94-S184 WeakPolarHBondContact O-CB 3.4Å; M94-S184 PolarHBondContact O-OG 3.35Å; M94-S184 VanDerWaalsContact O-OG 3.05Å; M94-F250 HydrophobicContact CB-CE2 4.15Å; M94-F250 HydrophobicContact CG-CE2 3.92Å; M94-F250 HydrophobicContact CG-CZ 4.26Å; M94-F254 HydrophobicContact CG-CD1 4.45Å; M94-F254 HydrophobicContact CG-CD2 3.89Å; M94-F254 HydrophobicContact CG-CE1 4.23Å; M94-F254 HydrophobicContact CG-CE2 3.59Å; M94-F254 HydrophobicContact CG-CG 4.3Å; M94-F254 HydrophobicContact CG-CZ 3.78Å; M94-F254 HydrophobicContact SD-CD1 4.43Å; M94-F254 HydrophobicContact SD-CD2 4.42Å; M94-F254 HydrophobicContact SD-CG 4.31Å |
| 95 | L | 97.2 | Very high | 95.6 | Very high | 8 Ų | 8 | 14.9 Ų | 14.9 | 4% | 0.042 | 8% | 0.076 | C | C | . | . | H | α-helix | trans | -65.8 | -35.5 | 178.6 | -65.8 | 172.1 | 0 | 0 | 0 | 112.2 | A91 M97 A98 A99 T130 H133 L183 | A91-L95 WeakPolarHBondContact O-CG 3.47Å; A91-L95 PolarHBondContact O-N 3.35Å; L95-M97 VanDerWaalsContact C-N 3.3Å; L95-M97 PolarHBondContact O-N 2.85Å; L95-A98 WeakPolarHBondContact O-CB 3.48Å; L95-A98 PolarHBondContact O-N 3.42Å; L95-A99 PolarHBondContact O-N 3Å; L95-T130 HydrophobicContact CB-CG2 3.71Å; L95-H133 HydrophobicContact CD1-CB 3.88Å; L95-L183 HydrophobicContact CD2-CD2 4.26Å |
| 96 | S | 96.3 | Very high | 95.3 | Very high | 0 Ų | 0 | 14.2 Ų | 14.2 | 0% | 0 | 7% | 0.073 | C | C | . | . | H | α-helix | trans | -65.8 | -32.8 | 175.1 | -66.6 | 0 | 0 | 0 | 0 | 112.6 | N47 N92 S93 M94 A99 L100 | N47-S96 PolarHBondContact ND2-OG 2.96Å; N92-S96 WeakPolarHBondContact O-CB 3.1Å; N92-S96 PolarHBondContact O-N 3.47Å; N92-S96 PolarHBondContact O-OG 2.69Å; S93-S96 PolarHBondContact O-N 2.88Å; M94-S96 VanDerWaalsContact C-N 3.34Å; M94-S96 PolarHBondContact O-N 2.67Å; S96-A99 PolarHBondContact O-N 2.81Å; S96-L100 WeakPolarHBondContact O-CB 3.37Å; S96-L100 WeakPolarHBondContact O-CG 3.21Å; S96-L100 PolarHBondContact O-N 3.43Å |
| 97 | M | 93.6 | Very high | 94.8 | Very high | 0 Ų | 0 | 15 Ų | 15 | 0% | 0 | 8% | 0.081 | C | C | . | . | H | α-helix | trans | -66.3 | -38.7 | 173.4 | -72.8 | -72.4 | -66.6 | 0 | 0 | 111.7 | S93 M94 L95 L100 S101 F246 F250 K286 | S93-M97 WeakPolarHBondContact O-CG 3.29Å; S93-M97 PolarHBondContact O-N 3.25Å; M94-M97 WeakPolarHBondContact O-CB 3.19Å; M94-M97 PolarHBondContact O-N 3.13Å; L95-M97 VanDerWaalsContact C-N 3.3Å; L95-M97 PolarHBondContact O-N 2.85Å; M97-L100 PolarHBondContact O-N 3.44Å; M97-L100 HydrophobicContact SD-CD1 4.47Å; M97-S101 PolarHBondContact O-N 3.49Å; M97-F246 HydrophobicContact CE-CD1 3.45Å; M97-F246 VanDerWaalsContact CE-CD1 3.45Å; M97-F246 HydrophobicContact CE-CE1 3.54Å; M97-F246 HydrophobicContact SD-CE1 4.12Å; M97-F250 HydrophobicContact CB-CD2 4.41Å; M97-K286 PolarHBondContact SD-NZ 3.01Å |
| 98 | A | 95.2 | Very high | 94.2 | Very high | 9 Ų | 9 | 17.3 Ų | 17.3 | 7% | 0.074 | 10% | 0.095 | C | C | . | . | H | α-helix | trans | -65.4 | -42.9 | 172.3 | 0 | 0 | 0 | 0 | 0 | 111.5 | M94 L95 L100 S101 I102 V187 | M94-A98 PolarHBondContact O-N 3.43Å; L95-A98 WeakPolarHBondContact O-CB 3.48Å; L95-A98 PolarHBondContact O-N 3.42Å; A98-L100 VanDerWaalsContact C-N 3.35Å; A98-L100 PolarHBondContact O-N 3.04Å; A98-S101 PolarHBondContact O-N 2.92Å; A98-S101 VanDerWaalsContact O-N 3.13Å; A98-S101 PolarHBondContact O-OG 3.46Å; A98-I102 WeakPolarHBondContact O-CG1 3.37Å; A98-I102 PolarHBondContact O-N 3.39Å; A98-V187 HydrophobicContact CB-CB 4.06Å; A98-V187 HydrophobicContact CB-CG1 3.87Å |
| 99 | A | 95.5 | Very high | 93.6 | Very high | 6 Ų | 6 | 18.3 Ų | 18.3 | 5% | 0.05 | 10% | 0.102 | C | C | . | . | H | α-helix | trans | -59.1 | -44.4 | 174.3 | 0 | 0 | 0 | 0 | 0 | 112.2 | F44 L95 S96 S101 I102 D103 M126 | F44-A99 HydrophobicContact CD1-CB 3.99Å; F44-A99 HydrophobicContact CE1-CB 3.79Å; F44-A99 HydrophobicContact CZ-CB 4.4Å; L95-A99 PolarHBondContact O-N 3Å; S96-A99 PolarHBondContact O-N 2.81Å; A99-S101 VanDerWaalsContact C-N 3.31Å; A99-S101 PolarHBondContact O-N 2.87Å; A99-I102 PolarHBondContact O-N 2.99Å; A99-D103 PolarHBondContact O-N 2.76Å; A99-M126 HydrophobicContact CB-CE 3.71Å |
| 100 | L | 92.9 | Very high | 93 | Very high | 2 Ų | 2 | 21.2 Ų | 21.2 | 1% | 0.01 | 11% | 0.114 | C | C | . | . | H | α-helix | trans | -61.4 | -36.9 | 174.2 | -83.5 | 174.2 | 0 | 0 | 0 | 112.7 | F44 L48 S96 M97 A98 D103 R104 Y294 | F44-L100 HydrophobicContact CB-CD2 3.56Å; F44-L100 HydrophobicContact CB-CG 3.81Å; F44-L100 HydrophobicContact CD2-CD2 4.01Å; F44-L100 HydrophobicContact CG-CD2 4.12Å; F44-L100 HydrophobicContact CG-CG 4.37Å; L48-L100 HydrophobicContact CD1-CD1 3.39Å; L48-L100 HydrophobicContact CD1-CG 4.47Å; S96-L100 WeakPolarHBondContact O-CB 3.37Å; S96-L100 WeakPolarHBondContact O-CG 3.21Å; S96-L100 PolarHBondContact O-N 3.43Å; M97-L100 PolarHBondContact O-N 3.44Å; M97-L100 HydrophobicContact SD-CD1 4.47Å; A98-L100 VanDerWaalsContact C-N 3.35Å; A98-L100 PolarHBondContact O-N 3.04Å; L100-D103 PolarHBondContact O-N 3.33Å; L100-R104 WeakPolarHBondContact O-CG 3.22Å; L100-R104 PolarHBondContact O-N 3.43Å; L100-Y294 HydrophobicContact CD1-CD1 4.3Å; L100-Y294 HydrophobicContact CD1-CG 4.42Å |
| 101 | S | 92.8 | Very high | 92.3 | Very high | 0 Ų | 0 | 23.9 Ų | 23.9 | 0% | 0 | 13% | 0.129 | C | C | . | . | H | α-helix | trans | -71.9 | -34.1 | 179.5 | 83.2 | 0 | 0 | 0 | 0 | 112.1 | M97 A98 A99 R104 W105 T191 | M97-S101 PolarHBondContact O-N 3.49Å; A98-S101 PolarHBondContact O-N 2.92Å; A98-S101 VanDerWaalsContact O-N 3.13Å; A98-S101 PolarHBondContact O-OG 3.46Å; A99-S101 VanDerWaalsContact C-N 3.31Å; A99-S101 PolarHBondContact O-N 2.87Å; S101-R104 PolarHBondContact O-N 3.26Å; S101-W105 WeakPolarHBondContact O-CB 3.34Å; S101-W105 PolarHBondContact O-N 3.04Å; S101-T191 VanDerWaalsContact CB-OG1 3.27Å; S101-T191 WeakPolarHBondContact CB-OG1 3.39Å; S101-T191 PolarHBondContact OG-OG1 2.95Å |
| 102 | I | 94 | Very high | 91.8 | Very high | 53 Ų | 53 | 32.2 Ų | 32.2 | 27% | 0.272 | 17% | 0.173 | S | C | . | . | H | α-helix | trans | -63 | -48.5 | 169.9 | -66 | 166.9 | 0 | 0 | 0 | 110.4 | A98 A99 R104 W105 V106 M126 V187 T191 | A98-I102 WeakPolarHBondContact O-CG1 3.37Å; A98-I102 PolarHBondContact O-N 3.39Å; A99-I102 PolarHBondContact O-N 2.99Å; I102-R104 VanDerWaalsContact C-N 3.3Å; I102-R104 PolarHBondContact O-N 3.43Å; I102-W105 HydrophobicContact CG2-CE3 4.36Å; I102-W105 WeakPolarHBondContact O-CB 3.44Å; I102-W105 PolarHBondContact O-N 3.42Å; I102-W105 VanDerWaalsContact O-N 3.1Å; I102-V106 HydrophobicContact CG2-CG2 4.49Å; I102-V106 WeakPolarHBondContact O-CG2 3.48Å; I102-V106 PolarHBondContact O-N 2.95Å; I102-M126 HydrophobicContact CB-CE 4Å; I102-M126 HydrophobicContact CD1-CE 4.14Å; I102-M126 HydrophobicContact CG2-CE 3.98Å; I102-V187 HydrophobicContact CD1-CG1 3.94Å; I102-V187 HydrophobicContact CG1-CG1 3.88Å; I102-T191 HydrophobicContact CG1-CG2 3.87Å |
| 103 | D | 92.6 | Very high | 91.3 | Very high | 0 Ų | 0 | 34.8 Ų | 34.8 | 0% | 0 | 19% | 0.191 | C | C | . | . | H | α-helix | trans | -54.7 | -46.4 | 174.6 | 166.4 | 75 | 0 | 0 | 0 | 111.7 | P41 F44 A99 L100 W105 V106 A107 Y114 M118 | P41-D103 WeakPolarHBondContact CG-OD2 3.45Å; F44-D103 HydrophobicContact CD2-CB 4.48Å; F44-D103 HydrophobicContact CE2-CB 4.05Å; A99-D103 PolarHBondContact O-N 2.76Å; L100-D103 PolarHBondContact O-N 3.33Å; D103-W105 VanDerWaalsContact C-N 3.3Å; D103-W105 PolarHBondContact O-N 3.22Å; D103-V106 PolarHBondContact O-N 2.84Å; D103-A107 WeakPolarHBondContact O-CB 3.47Å; D103-A107 PolarHBondContact O-N 3.2Å; D103-Y114 WeakPolarHBondContact OD1-CE2 3.47Å; D103-Y114 PolarHBondContact OD1-OH 3.32Å; D103-M118 HydrophobicContact CB-CE 4.44Å |
| 104 | R | 89.3 | Confident | 91 | Very high | 47 Ų | 47 | 36.4 Ų | 36.4 | 18% | 0.177 | 20% | 0.196 | C | C | . | . | H | α-helix | trans | -59.8 | -43.1 | 176.9 | -70.2 | -71.2 | 148.3 | -127.6 | -21.1 | 111.9 | L100 S101 I102 A107 V108 | L100-R104 WeakPolarHBondContact O-CG 3.22Å; L100-R104 PolarHBondContact O-N 3.43Å; S101-R104 PolarHBondContact O-N 3.26Å; I102-R104 VanDerWaalsContact C-N 3.3Å; I102-R104 PolarHBondContact O-N 3.43Å; R104-A107 PolarHBondContact O-N 2.91Å; R104-V108 WeakPolarHBondContact O-CG2 3.43Å; R104-V108 PolarHBondContact O-N 3.09Å |
| 105 | W | 90.4 | Very high | 90.5 | Very high | 71 Ų | 71 | 46.9 Ų | 46.9 | 27% | 0.269 | 24% | 0.235 | S | C | . | . | H | α-helix | trans | -61.4 | -49.1 | 177.4 | 167.9 | 59.3 | 0 | 0 | 0 | 111.4 | S101 I102 D103 A107 V108 V109 T191 V195 | S101-W105 WeakPolarHBondContact O-CB 3.34Å; S101-W105 PolarHBondContact O-N 3.04Å; I102-W105 HydrophobicContact CG2-CE3 4.36Å; I102-W105 WeakPolarHBondContact O-CB 3.44Å; I102-W105 PolarHBondContact O-N 3.42Å; I102-W105 VanDerWaalsContact O-N 3.1Å; D103-W105 VanDerWaalsContact C-N 3.3Å; D103-W105 PolarHBondContact O-N 3.22Å; W105-A107 VanDerWaalsContact C-N 3.33Å; W105-A107 PolarHBondContact O-N 2.83Å; W105-V108 PolarHBondContact O-N 2.8Å; W105-V109 HydrophobicContact CG-CG2 4.39Å; W105-V109 VanDerWaalsContact NE1-CG2 3.34Å; W105-V109 WeakPolarHBondContact O-CB 3.47Å; W105-V109 WeakPolarHBondContact O-CG2 3.22Å; W105-V109 PolarHBondContact O-N 3.24Å; W105-T191 HydrophobicContact CB-CG2 4.27Å; W105-V195 HydrophobicContact CB-CG2 3.99Å |
| 106 | V | 91.2 | Very high | 90.1 | Very high | 16 Ų | 16 | 50 Ų | 50 | 10% | 0.097 | 26% | 0.263 | C | S | . | . | H | α-helix | trans | -59.7 | -43.5 | 177.5 | 179.1 | 0 | 0 | 0 | 0 | 111.2 | I102 D103 V108 F110 Y114 K117 M118 | I102-V106 HydrophobicContact CG2-CG2 4.49Å; I102-V106 WeakPolarHBondContact O-CG2 3.48Å; I102-V106 PolarHBondContact O-N 2.95Å; D103-V106 PolarHBondContact O-N 2.84Å; V106-V108 PolarHBondContact O-N 2.92Å; V106-F110 HydrophobicContact CG1-CD2 4.37Å; V106-F110 PolarHBondContact O-N 2.81Å; V106-Y114 HydrophobicContact CG1-CD2 4.13Å; V106-K117 HydrophobicContact CG1-CB 3.97Å; V106-M118 HydrophobicContact CG1-CB 4.4Å; V106-M118 HydrophobicContact CG2-CE 4.37Å |
| 107 | A | 88.6 | Confident | 89.7 | Confident | 27 Ų | 27 | 55.2 Ų | 55.2 | 22% | 0.223 | 29% | 0.285 | C | S | . | . | H | α-helix | trans | -64.4 | -34.9 | 179.6 | 0 | 0 | 0 | 0 | 0 | 113.9 | D103 R104 W105 Y114 | D103-A107 WeakPolarHBondContact O-CB 3.47Å; D103-A107 PolarHBondContact O-N 3.2Å; R104-A107 PolarHBondContact O-N 2.91Å; W105-A107 VanDerWaalsContact C-N 3.33Å; W105-A107 PolarHBondContact O-N 2.83Å; A107-Y114 VanDerWaalsContact CA-CD2 3.48Å; A107-Y114 HydrophobicContact CB-CD2 3.67Å; A107-Y114 HydrophobicContact CB-CE2 3.72Å; A107-Y114 HydrophobicContact CB-CG 4.38Å |
| 108 | V | 84.4 | Confident | 89.6 | Confident | 51 Ų | 51 | 55.9 Ų | 55.9 | 31% | 0.309 | 29% | 0.288 | S | S | . | . | H | α-helix | trans | -83.4 | -38.4 | -179.9 | 173.3 | 0 | 0 | 0 | 0 | 111.7 | R104 W105 V106 V195 V198 | R104-V108 WeakPolarHBondContact O-CG2 3.43Å; R104-V108 PolarHBondContact O-N 3.09Å; W105-V108 PolarHBondContact O-N 2.8Å; V106-V108 PolarHBondContact O-N 2.92Å; V108-V195 HydrophobicContact CB-CG1 4.34Å; V108-V195 HydrophobicContact CB-CG2 4.34Å; V108-V195 HydrophobicContact CG1-CG1 4.12Å; V108-V195 HydrophobicContact CG2-CG1 4.14Å; V108-V198 HydrophobicContact CG1-CG1 4.38Å |
| 109 | V | 85.4 | Confident | 89.4 | Confident | 35 Ų | 35 | 60.1 Ų | 60.1 | 21% | 0.212 | 30% | 0.302 | C | S | . | . | H | α-helix | trans | -80.1 | -32.3 | -176.8 | 178.8 | 0 | 0 | 0 | 0 | 112.3 | W105 P111 V198 | W105-V109 HydrophobicContact CG-CG2 4.39Å; W105-V109 VanDerWaalsContact NE1-CG2 3.34Å; W105-V109 WeakPolarHBondContact O-CB 3.47Å; W105-V109 WeakPolarHBondContact O-CG2 3.22Å; W105-V109 PolarHBondContact O-N 3.24Å; V109-P111 VanDerWaalsContact C-CD 3.44Å; V109-P111 WeakPolarHBondContact O-CD 3.43Å; V109-V198 HydrophobicContact CG1-CG2 4.47Å; V109-V198 HydrophobicContact CG2-CB 4.13Å; V109-V198 HydrophobicContact CG2-CG1 4.25Å; V109-V198 HydrophobicContact CG2-CG2 3.79Å |
| 110 | F | 85.9 | Confident | 89.2 | Confident | 77 Ų | 77 | 63.6 Ų | 63.6 | 34% | 0.338 | 32% | 0.32 | S | S | . | . | trans | -126 | 62.1 | -177.8 | -53.3 | -74.7 | 0 | 0 | 0 | 111.5 | V106 L112 S113 Y114 K117 | V106-F110 HydrophobicContact CG1-CD2 4.37Å; V106-F110 PolarHBondContact O-N 2.81Å; F110-L112 VanDerWaalsContact C-N 3.35Å; F110-L112 PolarHBondContact O-N 3.16Å; F110-S113 CarbonylContact O-C 3.27Å; F110-S113 PolarHBondContact O-N 3.43Å; F110-Y114 WeakPolarHBondContact O-CA 3.43Å; F110-Y114 WeakPolarHBondContact O-CB 3.33Å; F110-Y114 PolarHBondContact O-N 2.99Å; F110-K117 HydrophobicContact CB-CD 3.9Å; F110-K117 HydrophobicContact CD1-CD 4.32Å; F110-K117 HydrophobicContact CD2-CD 3.84Å; F110-K117 HydrophobicContact CE2-CD 4.44Å; F110-K117 HydrophobicContact CG-CD 3.76Å | ||
| 111 | P | 84.1 | Confident | 89.3 | Confident | 82 Ų | 82 | 70.5 Ų | 70.5 | 53% | 0.532 | 35% | 0.346 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -60.6 | -39.7 | -172.2 | 23.4 | -33.7 | 0 | 0 | 0 | 113.5 | V109 | V109-P111 VanDerWaalsContact C-CD 3.44Å; V109-P111 WeakPolarHBondContact O-CD 3.43Å |
| 112 | L | 86.6 | Confident | 89.4 | Confident | 175 Ų | 175 | 72.2 Ų | 72.2 | 92% | 0.916 | 36% | 0.355 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -78.4 | -28 | -178.7 | -60.2 | 178.7 | 0 | 0 | 0 | 113.1 | F110 | F110-L112 VanDerWaalsContact C-N 3.35Å; F110-L112 PolarHBondContact O-N 3.16Å |
| 113 | S | 87.8 | Confident | 89.4 | Confident | 58 Ų | 58 | 69.7 Ų | 69.7 | 41% | 0.406 | 34% | 0.342 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -104.2 | 7.6 | -179.1 | -47 | 0 | 0 | 0 | 0 | 112.9 | F110 R115 A116 K117 | F110-S113 CarbonylContact O-C 3.27Å; F110-S113 PolarHBondContact O-N 3.43Å; S113-R115 VanDerWaalsContact C-N 3.34Å; S113-R115 PolarHBondContact O-N 3.41Å; S113-A116 PolarHBondContact O-N 3.43Å; S113-A116 VanDerWaalsContact O-N 3.09Å; S113-K117 PolarHBondContact O-N 3.37Å |
| 114 | Y | 89.9 | Confident | 89.6 | Confident | 43 Ų | 43 | 71.9 Ų | 71.9 | 17% | 0.169 | 36% | 0.36 | C | S | . | . | H | α-helix | trans | -55.5 | -48.6 | -176.5 | 170.7 | -103.1 | 0 | 0 | 0 | 111.4 | P41 D103 V106 A107 F110 A116 K117 M118 | P41-Y114 WeakPolarHBondContact CD-OH 3.29Å; P41-Y114 WeakPolarHBondContact CG-OH 3.34Å; D103-Y114 WeakPolarHBondContact OD1-CE2 3.47Å; D103-Y114 PolarHBondContact OD1-OH 3.32Å; V106-Y114 HydrophobicContact CG1-CD2 4.13Å; A107-Y114 VanDerWaalsContact CA-CD2 3.48Å; A107-Y114 HydrophobicContact CB-CD2 3.67Å; A107-Y114 HydrophobicContact CB-CE2 3.72Å; A107-Y114 HydrophobicContact CB-CG 4.38Å; F110-Y114 WeakPolarHBondContact O-CA 3.43Å; F110-Y114 WeakPolarHBondContact O-CB 3.33Å; F110-Y114 PolarHBondContact O-N 2.99Å; Y114-A116 PolarHBondContact O-N 2.94Å; Y114-K117 PolarHBondContact O-N 3.3Å; Y114-K117 VanDerWaalsContact O-N 3.12Å; Y114-M118 HydrophobicContact CD2-CB 4Å; Y114-M118 HydrophobicContact CE2-CB 3.59Å; Y114-M118 HydrophobicContact CE2-CG 3.81Å; Y114-M118 PolarHBondContact O-N 2.98Å |
| 115 | R | 86.6 | Confident | 90 | Very high | 225 Ų | 225 | 76.6 Ų | 76.6 | 85% | 0.849 | 38% | 0.382 | S | S | * | . | H | α-helix | trans | -62.8 | -28.1 | -179.4 | -69.3 | -175.9 | -179.6 | -118.9 | 4.1 | 113.4 | S113 | S113-R115 VanDerWaalsContact C-N 3.34Å; S113-R115 PolarHBondContact O-N 3.41Å |
| 116 | A | 88.4 | Confident | 90.3 | Very high | 74 Ų | 74 | 75.2 Ų | 75.2 | 61% | 0.612 | 38% | 0.379 | S | S | * | . | H | α-helix | trans | -81.2 | -34.9 | 175.8 | 0 | 0 | 0 | 0 | 0 | 112.1 | S113 Y114 | S113-A116 PolarHBondContact O-N 3.43Å; S113-A116 VanDerWaalsContact O-N 3.09Å; Y114-A116 PolarHBondContact O-N 2.94Å |
| 117 | K | 88.4 | Confident | 90.6 | Very high | 109 Ų | 109 | 75.6 Ų | 75.6 | 47% | 0.474 | 38% | 0.381 | S | S | . | . | H | α-helix | trans | -86.1 | -28.4 | -177.3 | -71.6 | -175.5 | -180 | -70.2 | 0 | 114.5 | V106 F110 S113 Y114 | V106-K117 HydrophobicContact CG1-CB 3.97Å; F110-K117 HydrophobicContact CB-CD 3.9Å; F110-K117 HydrophobicContact CD1-CD 4.32Å; F110-K117 HydrophobicContact CD2-CD 3.84Å; F110-K117 HydrophobicContact CE2-CD 4.44Å; F110-K117 HydrophobicContact CG-CD 3.76Å; S113-K117 PolarHBondContact O-N 3.37Å; Y114-K117 PolarHBondContact O-N 3.3Å; Y114-K117 VanDerWaalsContact O-N 3.12Å |
| 118 | M | 91.4 | Very high | 91 | Very high | 13 Ų | 13 | 76.5 Ų | 76.5 | 6% | 0.064 | 39% | 0.389 | C | S | . | . | S | Bend | trans | -128 | 92.5 | -176.5 | -175.6 | 59.6 | 71.9 | 0 | 0 | 109.6 | A40 D103 V106 Y114 D122 A123 M126 | A40-M118 HydrophobicContact CB-CG 3.72Å; A40-M118 HydrophobicContact CB-SD 4.44Å; D103-M118 HydrophobicContact CB-CE 4.44Å; V106-M118 HydrophobicContact CG1-CB 4.4Å; V106-M118 HydrophobicContact CG2-CE 4.37Å; Y114-M118 HydrophobicContact CD2-CB 4Å; Y114-M118 HydrophobicContact CE2-CB 3.59Å; Y114-M118 HydrophobicContact CE2-CG 3.81Å; Y114-M118 PolarHBondContact O-N 2.98Å; M118-D122 HydrophobicContact SD-CB 4.41Å; M118-A123 HydrophobicContact SD-CB 4.5Å; M118-M126 HydrophobicContact CE-SD 4.14Å |
| 119 | R | 92.2 | Very high | 91.7 | Very high | 98 Ų | 98 | 80.2 Ų | 80.2 | 37% | 0.37 | 40% | 0.398 | S | S | . | . | trans | -101 | 168 | 175.1 | -57.4 | 166.1 | -64.7 | -156.3 | -11.1 | 110.5 | R121 D122 A123 | R119-R121 HydrophobicContact CB-CG 4.32Å; R119-R121 PolarHBondContact O-N 3.34Å; R119-D122 VanDerWaalsContact CB-OD2 3.29Å; R119-D122 WeakPolarHBondContact CB-OD2 3.41Å; R119-D122 IonicContact CZ-OD2 3.12Å; R119-D122 PolarHBondContact N-OD2 2.91Å; R119-D122 IonicContact NE-OD1 3.64Å; R119-D122 IonicContact NE-OD2 2.78Å; R119-D122 PolarHBondContact NE-OD2 3.25Å; R119-D122 IonicContact NH2-OD1 3.68Å; R119-D122 PolarHBondContact NH2-OD1 3.1Å; R119-D122 IonicContact NH2-OD2 2.74Å; R119-D122 PolarHBondContact NH2-OD2 3.19Å; R119-D122 PolarHBondContact O-N 3.4Å; R119-D122 VanDerWaalsContact O-N 3.08Å; R119-A123 PolarHBondContact O-N 3.4Å | ||
| 120 | L | 90.9 | Very high | 92.2 | Very high | 79 Ų | 79 | 78.6 Ų | 78.6 | 41% | 0.414 | 39% | 0.389 | S | S | . | . | H | α-helix | trans | -55 | -37.6 | 175.5 | -77.7 | 160.7 | 0 | 0 | 0 | 112.7 | L43 A123 A124 | L43-L120 HydrophobicContact CD1-CD2 3.88Å; L43-L120 WeakPolarHBondContact CD1-O 3.23Å; L43-L120 HydrophobicContact CG-CD2 4.07Å; L120-A123 PolarHBondContact O-N 2.92Å; L120-A124 WeakPolarHBondContact O-CB 3.45Å; L120-A124 PolarHBondContact O-N 3.04Å |
| 121 | R | 93.6 | Very high | 92.8 | Very high | 147 Ų | 147 | 81 Ų | 81 | 56% | 0.555 | 40% | 0.396 | S | S | * | . | H | α-helix | trans | -64.5 | -40.4 | 177 | 75.7 | -172.8 | -165.4 | -178 | 9.9 | 112.8 | R119 A124 F125 | R119-R121 HydrophobicContact CB-CG 4.32Å; R119-R121 PolarHBondContact O-N 3.34Å; R121-A124 PolarHBondContact O-N 3.33Å; R121-F125 WeakPolarHBondContact O-CD2 3.35Å; R121-F125 WeakPolarHBondContact O-CG 3.4Å; R121-F125 PolarHBondContact O-N 3.34Å |
| 122 | D | 94.9 | Very high | 93.5 | Very high | 37 Ų | 37 | 83 Ų | 83 | 20% | 0.198 | 40% | 0.401 | C | S | . | . | H | α-helix | trans | -68.9 | -40.6 | -179.4 | -48.5 | -53.5 | 0 | 0 | 0 | 109.4 | M118 R119 F125 M126 | M118-D122 HydrophobicContact SD-CB 4.41Å; R119-D122 VanDerWaalsContact CB-OD2 3.29Å; R119-D122 WeakPolarHBondContact CB-OD2 3.41Å; R119-D122 IonicContact CZ-OD2 3.12Å; R119-D122 PolarHBondContact N-OD2 2.91Å; R119-D122 IonicContact NE-OD1 3.64Å; R119-D122 IonicContact NE-OD2 2.78Å; R119-D122 PolarHBondContact NE-OD2 3.25Å; R119-D122 IonicContact NH2-OD1 3.68Å; R119-D122 PolarHBondContact NH2-OD1 3.1Å; R119-D122 IonicContact NH2-OD2 2.74Å; R119-D122 PolarHBondContact NH2-OD2 3.19Å; R119-D122 PolarHBondContact O-N 3.4Å; R119-D122 VanDerWaalsContact O-N 3.08Å; D122-F125 PolarHBondContact O-N 3.12Å; D122-M126 WeakPolarHBondContact O-CG 3.32Å; D122-M126 PolarHBondContact O-N 2.9Å |
| 123 | A | 95.3 | Very high | 94 | Very high | 0 Ų | 0 | 76 Ų | 76 | 0% | 0 | 36% | 0.364 | C | S | . | . | H | α-helix | trans | -64.9 | -39.2 | 171.8 | 0 | 0 | 0 | 0 | 0 | 113.3 | A40 L43 F44 M118 R119 L120 M126 V127 | A40-A123 HydrophobicContact CB-CB 4.08Å; L43-A123 HydrophobicContact CD1-CB 4.12Å; F44-A123 HydrophobicContact CE1-CB 4.28Å; F44-A123 HydrophobicContact CE2-CB 3.9Å; F44-A123 HydrophobicContact CZ-CB 3.61Å; M118-A123 HydrophobicContact SD-CB 4.5Å; R119-A123 PolarHBondContact O-N 3.4Å; L120-A123 PolarHBondContact O-N 2.92Å; A123-M126 PolarHBondContact O-N 2.89Å; A123-V127 WeakPolarHBondContact O-CG2 3.19Å; A123-V127 PolarHBondContact O-N 2.95Å |
| 124 | A | 96.4 | Very high | 94.5 | Very high | 46 Ų | 46 | 73.2 Ų | 73.2 | 38% | 0.38 | 34% | 0.344 | S | S | . | . | H | α-helix | trans | -63.2 | -42 | 175.4 | 0 | 0 | 0 | 0 | 0 | 111.7 | L43 L120 R121 M126 V127 A128 | L43-A124 HydrophobicContact CD1-CB 4.14Å; L120-A124 WeakPolarHBondContact O-CB 3.45Å; L120-A124 PolarHBondContact O-N 3.04Å; R121-A124 PolarHBondContact O-N 3.33Å; A124-M126 VanDerWaalsContact C-N 3.34Å; A124-M126 PolarHBondContact O-N 3.37Å; A124-V127 PolarHBondContact O-N 3.36Å; A124-A128 WeakPolarHBondContact O-CB 3.47Å; A124-A128 PolarHBondContact O-N 2.91Å |
| 125 | F | 97.1 | Very high | 95 | Very high | 146 Ų | 146 | 74.8 Ų | 74.8 | 64% | 0.64 | 36% | 0.355 | S | S | * | . | H | α-helix | trans | -61.1 | -42.3 | 173.2 | -73.7 | -52.7 | 0 | 0 | 0 | 112.2 | R121 D122 A128 Y129 | R121-F125 WeakPolarHBondContact O-CD2 3.35Å; R121-F125 WeakPolarHBondContact O-CG 3.4Å; R121-F125 PolarHBondContact O-N 3.34Å; D122-F125 PolarHBondContact O-N 3.12Å; F125-A128 PolarHBondContact O-N 3.46Å; F125-Y129 PolarHBondContact O-N 3.27Å |
| 126 | M | 97 | Very high | 95.5 | Very high | 41 Ų | 41 | 67.3 Ų | 67.3 | 20% | 0.202 | 34% | 0.335 | C | S | . | . | H | α-helix | trans | -62.1 | -43.6 | 175.8 | -70.1 | 174.5 | 74.2 | 0 | 0 | 111.9 | F44 A99 I102 M118 D122 A123 A124 Y129 T130 | F44-M126 HydrophobicContact CE1-CB 3.71Å; F44-M126 HydrophobicContact CE1-CE 4.47Å; F44-M126 HydrophobicContact CE1-SD 4.4Å; F44-M126 HydrophobicContact CZ-CB 4Å; F44-M126 HydrophobicContact CZ-CE 4.1Å; F44-M126 HydrophobicContact CZ-SD 3.78Å; A99-M126 HydrophobicContact CB-CE 3.71Å; I102-M126 HydrophobicContact CB-CE 4Å; I102-M126 HydrophobicContact CD1-CE 4.14Å; I102-M126 HydrophobicContact CG2-CE 3.98Å; M118-M126 HydrophobicContact CE-SD 4.14Å; D122-M126 WeakPolarHBondContact O-CG 3.32Å; D122-M126 PolarHBondContact O-N 2.9Å; A123-M126 PolarHBondContact O-N 2.89Å; A124-M126 VanDerWaalsContact C-N 3.34Å; A124-M126 PolarHBondContact O-N 3.37Å; M126-Y129 WeakPolarHBondContact O-CB 3.34Å; M126-Y129 PolarHBondContact O-N 2.87Å; M126-T130 WeakPolarHBondContact O-CG2 3.35Å; M126-T130 PolarHBondContact O-N 3Å |
| 127 | V | 97.7 | Very high | 95.9 | Very high | 24 Ų | 24 | 64.5 Ų | 64.5 | 15% | 0.145 | 31% | 0.309 | C | S | . | . | H | α-helix | trans | -65.1 | -42.5 | 175.1 | 173.6 | 0 | 0 | 0 | 0 | 111.3 | F44 N47 A123 A124 Y129 T130 W131 | F44-V127 HydrophobicContact CD1-CG2 3.59Å; F44-V127 HydrophobicContact CE1-CG2 3.82Å; N47-V127 HydrophobicContact CB-CG1 4.3Å; A123-V127 WeakPolarHBondContact O-CG2 3.19Å; A123-V127 PolarHBondContact O-N 2.95Å; A124-V127 PolarHBondContact O-N 3.36Å; V127-Y129 VanDerWaalsContact C-N 3.28Å; V127-Y129 PolarHBondContact O-N 2.67Å; V127-T130 PolarHBondContact O-N 3.03Å; V127-T130 VanDerWaalsContact O-N 3.12Å; V127-T130 PolarHBondContact O-OG1 3.34Å; V127-W131 PolarHBondContact O-N 2.89Å |
| 128 | A | 97.9 | Very high | 96.4 | Very high | 46 Ų | 46 | 59.3 Ų | 59.3 | 38% | 0.38 | 29% | 0.286 | S | S | . | . | H | α-helix | trans | -59.4 | -41.5 | 176 | 0 | 0 | 0 | 0 | 0 | 111.3 | A124 F125 W131 L132 | A124-A128 WeakPolarHBondContact O-CB 3.47Å; A124-A128 PolarHBondContact O-N 2.91Å; F125-A128 PolarHBondContact O-N 3.46Å; A128-W131 PolarHBondContact O-N 2.99Å; A128-L132 WeakPolarHBondContact O-CG 3.18Å; A128-L132 PolarHBondContact O-N 3.37Å |
| 129 | Y | 97.4 | Very high | 96.7 | Very high | 129 Ų | 129 | 60.8 Ų | 60.8 | 51% | 0.506 | 30% | 0.3 | S | S | . | . | H | α-helix | trans | -60.3 | -45.6 | 172.8 | 171.1 | -96.1 | 0 | 0 | 0 | 112.3 | F125 M126 V127 W131 L132 H133 | F125-Y129 PolarHBondContact O-N 3.27Å; M126-Y129 WeakPolarHBondContact O-CB 3.34Å; M126-Y129 PolarHBondContact O-N 2.87Å; V127-Y129 VanDerWaalsContact C-N 3.28Å; V127-Y129 PolarHBondContact O-N 2.67Å; Y129-W131 VanDerWaalsContact C-N 3.27Å; Y129-W131 PolarHBondContact O-N 3.38Å; Y129-L132 PolarHBondContact O-N 2.71Å; Y129-H133 AromaticContact CE1-ND1 3.98Å; Y129-H133 HydrophobicContact CE2-CB 4.47Å; Y129-H133 AromaticContact CZ-ND1 3.61Å; Y129-H133 VanDerWaalsContact O-CB 3.26Å; Y129-H133 WeakPolarHBondContact O-CB 3.48Å; Y129-H133 PolarHBondContact O-N 2.62Å; Y129-H133 PolarHBondContact OH-ND1 3.42Å; Y129-H133 VanDerWaalsContact OH-ND1 3.11Å |
| 130 | T | 97.8 | Very high | 96.9 | Very high | 2 Ų | 2 | 59.1 Ų | 59.1 | 1% | 0.012 | 30% | 0.301 | C | S | . | . | H | α-helix | trans | -62.1 | -37.4 | 178.8 | 70.3 | 0 | 0 | 0 | 0 | 111.9 | N92 L95 M126 V127 A134 | N92-T130 WeakPolarHBondContact OD1-CB 3.49Å; N92-T130 PolarHBondContact OD1-OG1 2.92Å; L95-T130 HydrophobicContact CB-CG2 3.71Å; M126-T130 WeakPolarHBondContact O-CG2 3.35Å; M126-T130 PolarHBondContact O-N 3Å; V127-T130 PolarHBondContact O-N 3.03Å; V127-T130 VanDerWaalsContact O-N 3.12Å; V127-T130 PolarHBondContact O-OG1 3.34Å; T130-A134 WeakPolarHBondContact O-CB 3.26Å; T130-A134 PolarHBondContact O-N 2.82Å |
| 131 | W | 98.3 | Very high | 97.2 | Very high | 128 Ų | 128 | 55.3 Ų | 55.3 | 49% | 0.485 | 28% | 0.281 | S | S | . | . | H | α-helix | trans | -66.3 | -52.9 | 176.4 | -85.4 | 64.1 | 0 | 0 | 0 | 112.3 | N47 F88 V127 A128 Y129 H133 A134 L135 | N47-W131 PolarHBondContact OD1-NE1 2.89Å; F88-W131 HydrophobicContact CE1-CE3 4.46Å; F88-W131 HydrophobicContact CE1-CH2 4.33Å; F88-W131 HydrophobicContact CE1-CZ3 4.24Å; F88-W131 HydrophobicContact CE2-CE3 4.29Å; F88-W131 AromaticContact CZ-CD2 3.78Å; F88-W131 HydrophobicContact CZ-CD2 3.78Å; F88-W131 AromaticContact CZ-CE3 3.56Å; F88-W131 HydrophobicContact CZ-CE3 3.56Å; F88-W131 HydrophobicContact CZ-CG 4.38Å; F88-W131 HydrophobicContact CZ-CH2 4.17Å; F88-W131 HydrophobicContact CZ-CZ2 4.36Å; F88-W131 AromaticContact CZ-CZ3 3.76Å; F88-W131 HydrophobicContact CZ-CZ3 3.76Å; V127-W131 PolarHBondContact O-N 2.89Å; A128-W131 PolarHBondContact O-N 2.99Å; Y129-W131 VanDerWaalsContact C-N 3.27Å; Y129-W131 PolarHBondContact O-N 3.38Å; W131-H133 VanDerWaalsContact C-N 3.34Å; W131-H133 PolarHBondContact O-N 3.25Å; W131-A134 PolarHBondContact O-N 3.12Å; W131-L135 VanDerWaalsContact O-CB 3.26Å; W131-L135 WeakPolarHBondContact O-CB 3.24Å; W131-L135 PolarHBondContact O-N 3.13Å |
| 132 | L | 98.1 | Very high | 97.4 | Very high | 123 Ų | 123 | 52.5 Ų | 52.5 | 64% | 0.644 | 28% | 0.276 | S | S | * | . | H | α-helix | trans | -60.4 | -45.9 | -179 | -70.2 | 173.3 | 0 | 0 | 0 | 111 | A128 Y129 L135 T136 | A128-L132 WeakPolarHBondContact O-CG 3.18Å; A128-L132 PolarHBondContact O-N 3.37Å; Y129-L132 PolarHBondContact O-N 2.71Å; L132-L135 PolarHBondContact O-N 3.05Å; L132-T136 WeakPolarHBondContact O-CG2 3.44Å; L132-T136 PolarHBondContact O-N 3.1Å |
| 133 | H | 97.9 | Very high | 97.4 | Very high | 28 Ų | 28 | 54.6 Ų | 54.6 | 13% | 0.13 | 30% | 0.299 | C | S | . | . | H | α-helix | trans | -65.7 | -43.9 | 177.1 | -172.8 | 179.9 | 0 | 0 | 0 | 111.6 | L95 Y129 W131 L135 T136 F137 L179 | L95-H133 HydrophobicContact CD1-CB 3.88Å; Y129-H133 AromaticContact CE1-ND1 3.98Å; Y129-H133 HydrophobicContact CE2-CB 4.47Å; Y129-H133 AromaticContact CZ-ND1 3.61Å; Y129-H133 VanDerWaalsContact O-CB 3.26Å; Y129-H133 WeakPolarHBondContact O-CB 3.48Å; Y129-H133 PolarHBondContact O-N 2.62Å; Y129-H133 PolarHBondContact OH-ND1 3.42Å; Y129-H133 VanDerWaalsContact OH-ND1 3.11Å; W131-H133 VanDerWaalsContact C-N 3.34Å; W131-H133 PolarHBondContact O-N 3.25Å; H133-L135 VanDerWaalsContact C-N 3.27Å; H133-L135 PolarHBondContact O-N 3.18Å; H133-T136 PolarHBondContact O-N 3.46Å; H133-T136 PolarHBondContact O-OG1 2.88Å; H133-F137 AromaticContact CD2-CE2 3.66Å; H133-F137 AromaticContact NE2-CE2 3.67Å; H133-L179 PolarHBondContact CE1-O 3.44Å |
| 134 | A | 98.3 | Very high | 97.4 | Very high | 0 Ų | 0 | 57.8 Ų | 57.8 | 0% | 0 | 32% | 0.316 | C | S | . | . | H | α-helix | trans | -66.2 | -29 | 178.7 | 0 | 0 | 0 | 0 | 0 | 113.2 | F88 A91 N92 T130 W131 P138 | F88-A134 HydrophobicContact CD2-CB 3.87Å; F88-A134 HydrophobicContact CE2-CB 3.91Å; A91-A134 HydrophobicContact CB-CB 3.74Å; N92-A134 HydrophobicContact CB-CB 3.8Å; T130-A134 WeakPolarHBondContact O-CB 3.26Å; T130-A134 PolarHBondContact O-N 2.82Å; W131-A134 PolarHBondContact O-N 3.12Å; A134-P138 WeakPolarHBondContact O-CD 3.46Å; A134-P138 WeakPolarHBondContact O-CG 3.44Å |
| 135 | L | 98.4 | Very high | 97.3 | Very high | 75 Ų | 75 | 58.5 Ų | 58.5 | 39% | 0.393 | 32% | 0.318 | S | S | . | . | H | α-helix | trans | -74.4 | -27.5 | -177.8 | -173.8 | 63.5 | 0 | 0 | 0 | 113.1 | F84 F88 W131 L132 H133 F137 P138 A139 | F84-L135 HydrophobicContact CE1-CD1 4.25Å; F84-L135 HydrophobicContact CZ-CD1 3.63Å; F88-L135 HydrophobicContact CD2-CB 4.44Å; F88-L135 HydrophobicContact CD2-CD1 4.43Å; F88-L135 HydrophobicContact CE2-CB 4.37Å; W131-L135 VanDerWaalsContact O-CB 3.26Å; W131-L135 WeakPolarHBondContact O-CB 3.24Å; W131-L135 PolarHBondContact O-N 3.13Å; L132-L135 PolarHBondContact O-N 3.05Å; H133-L135 VanDerWaalsContact C-N 3.27Å; H133-L135 PolarHBondContact O-N 3.18Å; L135-F137 PolarHBondContact O-N 3.36Å; L135-P138 VanDerWaalsContact O-CD 3.32Å; L135-P138 WeakPolarHBondContact O-CD 3.36Å; L135-P138 WeakPolarHBondContact O-CG 3.28Å; L135-A139 WeakPolarHBondContact O-CB 3.48Å; L135-A139 PolarHBondContact O-N 3.19Å; L135-A139 VanDerWaalsContact O-N 3.12Å |
| 136 | T | 97.9 | Very high | 97.3 | Very high | 69 Ų | 69 | 52 Ų | 52 | 42% | 0.423 | 29% | 0.289 | S | S | . | . | H | α-helix | trans | -57.5 | -47.8 | -177.3 | 60.1 | 0 | 0 | 0 | 0 | 111.7 | L132 H133 A139 T140 | L132-T136 WeakPolarHBondContact O-CG2 3.44Å; L132-T136 PolarHBondContact O-N 3.1Å; H133-T136 PolarHBondContact O-N 3.46Å; H133-T136 PolarHBondContact O-OG1 2.88Å; T136-A139 PolarHBondContact O-N 3.5Å; T136-T140 WeakPolarHBondContact O-CB 3.48Å; T136-T140 PolarHBondContact O-N 3.44Å; T136-T140 PolarHBondContact O-OG1 2.96Å |
| 137 | F | 97.7 | Very high | 97.3 | Very high | 15 Ų | 15 | 50.4 Ų | 50.4 | 7% | 0.066 | 28% | 0.282 | C | S | . | . | H | α-helix | trans | -63.4 | -57 | -177.2 | -58.4 | -79.2 | 0 | 0 | 0 | 114.4 | T87 H133 L135 A139 T140 A141 F172 F176 L179 | T87-F137 HydrophobicContact CG2-CB 4.35Å; H133-F137 AromaticContact CD2-CE2 3.66Å; H133-F137 AromaticContact NE2-CE2 3.67Å; L135-F137 PolarHBondContact O-N 3.36Å; F137-A139 VanDerWaalsContact C-N 3.27Å; F137-A139 PolarHBondContact O-N 2.87Å; F137-T140 PolarHBondContact O-N 3.49Å; F137-A141 WeakPolarHBondContact O-CB 3.16Å; F137-A141 PolarHBondContact O-N 2.93Å; F137-F172 HydrophobicContact CB-CE2 4.45Å; F137-F172 HydrophobicContact CB-CZ 4.03Å; F137-F172 HydrophobicContact CD1-CE2 4Å; F137-F172 HydrophobicContact CD1-CZ 4.17Å; F137-F172 WeakPolarHBondContact O-CZ 3.41Å; F137-F176 HydrophobicContact CB-CD2 3.74Å; F137-F176 HydrophobicContact CB-CE2 4.2Å; F137-F176 HydrophobicContact CD1-CB 3.72Å; F137-F176 AromaticContact CD1-CD2 3.8Å; F137-F176 HydrophobicContact CD1-CD2 3.8Å; F137-F176 HydrophobicContact CD1-CG 4.25Å; F137-F176 AromaticContact CD2-CD2 3.75Å; F137-F176 HydrophobicContact CD2-CD2 3.75Å; F137-F176 HydrophobicContact CD2-CE2 4.33Å; F137-F176 VanDerWaalsContact CE1-CA 3.44Å; F137-F176 HydrophobicContact CE1-CB 3.93Å; F137-F176 HydrophobicContact CE1-CD2 4.34Å; F137-F176 HydrophobicContact CE2-CD2 4.27Å; F137-F176 HydrophobicContact CG-CB 4.31Å; F137-F176 AromaticContact CG-CD2 3.48Å; F137-F176 HydrophobicContact CG-CD2 3.48Å; F137-F176 VanDerWaalsContact CG-CD2 3.48Å; F137-F176 HydrophobicContact CG-CE2 4.26Å; F137-F176 HydrophobicContact CG-CG 4.36Å; F137-L179 HydrophobicContact CE1-CD1 4.46Å; F137-L179 HydrophobicContact CZ-CB 3.92Å; F137-L179 HydrophobicContact CZ-CD1 3.94Å |
| 138 | P | 98.1 | Very high | 97.2 | Very high | 0 Ų | 0 | 49.3 Ų | 49.3 | 0% | 0 | 28% | 0.275 | C | S | . | . | H | α-helix | trans | -64.2 | -30.9 | 179 | 27.4 | -35.7 | 0 | 0 | 0 | 112.4 | F84 T87 F88 A134 L135 L142 | F84-P138 HydrophobicContact CD1-CB 4.36Å; F84-P138 HydrophobicContact CD2-CB 3.63Å; F84-P138 HydrophobicContact CE1-CB 4.44Å; F84-P138 HydrophobicContact CE2-CB 3.73Å; F84-P138 HydrophobicContact CE2-CG 4.23Å; F84-P138 HydrophobicContact CG-CB 3.95Å; F84-P138 HydrophobicContact CZ-CB 4.14Å; F84-P138 HydrophobicContact CZ-CG 4.22Å; T87-P138 HydrophobicContact CG2-CB 4.2Å; F88-P138 HydrophobicContact CB-CG 3.91Å; A134-P138 WeakPolarHBondContact O-CD 3.46Å; A134-P138 WeakPolarHBondContact O-CG 3.44Å; L135-P138 VanDerWaalsContact O-CD 3.32Å; L135-P138 WeakPolarHBondContact O-CD 3.36Å; L135-P138 WeakPolarHBondContact O-CG 3.28Å; P138-L142 VanDerWaalsContact O-CB 3.31Å; P138-L142 WeakPolarHBondContact O-CB 3.44Å; P138-L142 PolarHBondContact O-N 2.87Å |
| 139 | A | 98 | Very high | 97.1 | Very high | 44 Ų | 44 | 48.2 Ų | 48.2 | 36% | 0.364 | 26% | 0.262 | S | S | . | . | H | α-helix | trans | -66.2 | -46.5 | 173.6 | 0 | 0 | 0 | 0 | 0 | 111.9 | L135 T136 F137 L142 A143 | L135-A139 WeakPolarHBondContact O-CB 3.48Å; L135-A139 PolarHBondContact O-N 3.19Å; L135-A139 VanDerWaalsContact O-N 3.12Å; T136-A139 PolarHBondContact O-N 3.5Å; F137-A139 VanDerWaalsContact C-N 3.27Å; F137-A139 PolarHBondContact O-N 2.87Å; A139-L142 PolarHBondContact O-N 3.4Å; A139-A143 PolarHBondContact O-N 3.3Å |
| 140 | T | 97.1 | Very high | 97 | Very high | 62 Ų | 62 | 43.6 Ų | 43.6 | 38% | 0.38 | 25% | 0.245 | S | C | . | . | H | α-helix | trans | -62.9 | -44.1 | 174.3 | -60.1 | 0 | 0 | 0 | 0 | 111.6 | T136 F137 L142 A143 L144 F172 | T136-T140 WeakPolarHBondContact O-CB 3.48Å; T136-T140 PolarHBondContact O-N 3.44Å; T136-T140 PolarHBondContact O-OG1 2.96Å; F137-T140 PolarHBondContact O-N 3.49Å; T140-L142 VanDerWaalsContact C-N 3.29Å; T140-L142 PolarHBondContact O-N 3.42Å; T140-A143 PolarHBondContact O-N 2.88Å; T140-L144 HydrophobicContact CG2-CD1 3.79Å; T140-L144 HydrophobicContact CG2-CG 4.43Å; T140-L144 WeakPolarHBondContact O-CG 3.43Å; T140-L144 PolarHBondContact O-N 3.47Å; T140-F172 HydrophobicContact CG2-CD2 4.22Å; T140-F172 HydrophobicContact CG2-CE2 3.88Å |
| 141 | A | 97.2 | Very high | 96.8 | Very high | 0 Ų | 0 | 48.8 Ų | 48.8 | 0% | 0 | 27% | 0.269 | C | S | . | . | H | α-helix | trans | -62.4 | -36.5 | 177.5 | 0 | 0 | 0 | 0 | 0 | 112.2 | F137 S145 W146 L147 L158 F172 | F137-A141 WeakPolarHBondContact O-CB 3.16Å; F137-A141 PolarHBondContact O-N 2.93Å; A141-S145 PolarHBondContact O-N 2.92Å; A141-S145 VanDerWaalsContact O-N 3.1Å; A141-W146 HydrophobicContact CB-CB 4.25Å; A141-W146 PolarHBondContact O-N 3.01Å; A141-L147 HydrophobicContact CB-CD2 3.81Å; A141-L147 HydrophobicContact CB-CG 4.07Å; A141-L158 HydrophobicContact CB-CD2 3.41Å; A141-L158 VanDerWaalsContact CB-CD2 3.41Å; A141-F172 HydrophobicContact CB-CE1 4.22Å; A141-F172 HydrophobicContact CB-CZ 4.02Å |
| 142 | L | 96.4 | Very high | 96.6 | Very high | 87 Ų | 87 | 43.9 Ų | 43.9 | 46% | 0.455 | 25% | 0.252 | S | S | . | . | H | α-helix | trans | -63.9 | -47.9 | 173.5 | -179.5 | 63.9 | 0 | 0 | 0 | 111.3 | F84 P138 A139 T140 L144 S145 L147 | F84-L142 HydrophobicContact CD2-CB 4.43Å; F84-L142 HydrophobicContact CD2-CD2 4.42Å; P138-L142 VanDerWaalsContact O-CB 3.31Å; P138-L142 WeakPolarHBondContact O-CB 3.44Å; P138-L142 PolarHBondContact O-N 2.87Å; A139-L142 PolarHBondContact O-N 3.4Å; T140-L142 VanDerWaalsContact C-N 3.29Å; T140-L142 PolarHBondContact O-N 3.42Å; L142-L144 VanDerWaalsContact C-N 3.27Å; L142-L144 PolarHBondContact O-N 3.1Å; L142-S145 PolarHBondContact O-N 3.47Å; L142-S145 VanDerWaalsContact O-N 3.11Å; L142-L147 HydrophobicContact CB-CD1 3.76Å; L142-L147 HydrophobicContact CD1-CD1 3.92Å; L142-L147 HydrophobicContact CG-CD1 4.45Å |
| 143 | A | 95.9 | Very high | 96.4 | Very high | 82 Ų | 82 | 38 Ų | 38 | 68% | 0.678 | 22% | 0.222 | S | C | * | . | H | α-helix | trans | -61.1 | -36 | 179.2 | 0 | 0 | 0 | 0 | 0 | 112.5 | A139 T140 S145 | A139-A143 PolarHBondContact O-N 3.3Å; T140-A143 PolarHBondContact O-N 2.88Å; A143-S145 VanDerWaalsContact C-N 3.33Å |
| 144 | L | 94.6 | Very high | 96.3 | Very high | 66 Ų | 66 | 37.1 Ų | 37.1 | 35% | 0.346 | 22% | 0.219 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -89.1 | 4.1 | 178.9 | -61.7 | 175.9 | 0 | 0 | 0 | 113.6 | T140 L142 W146 | T140-L144 HydrophobicContact CG2-CD1 3.79Å; T140-L144 HydrophobicContact CG2-CG 4.43Å; T140-L144 WeakPolarHBondContact O-CG 3.43Å; T140-L144 PolarHBondContact O-N 3.47Å; L142-L144 VanDerWaalsContact C-N 3.27Å; L142-L144 PolarHBondContact O-N 3.1Å; L144-W146 VanDerWaalsContact C-N 3.26Å; L144-W146 HydrophobicContact CB-CD2 3.75Å; L144-W146 HydrophobicContact CB-CE3 4Å; L144-W146 HydrophobicContact CB-CG 4.14Å; L144-W146 HydrophobicContact CB-CZ2 4.32Å; L144-W146 HydrophobicContact CB-CZ3 4.37Å; L144-W146 HydrophobicContact CD1-CD2 4.27Å; L144-W146 HydrophobicContact CD1-CE3 3.79Å; L144-W146 HydrophobicContact CD1-CH2 3.45Å; L144-W146 VanDerWaalsContact CD1-CH2 3.45Å; L144-W146 HydrophobicContact CD1-CZ2 3.95Å; L144-W146 HydrophobicContact CD1-CZ3 3.34Å; L144-W146 HydrophobicContact CG-CZ3 4.49Å; L144-W146 PolarHBondContact O-N 3.46Å |
| 145 | S | 94.7 | Very high | 96.3 | Very high | 62 Ų | 62 | 37.1 Ų | 37.1 | 43% | 0.434 | 22% | 0.219 | S | C | . | . | T | Hydrogen-bonded Turn | trans | 57.4 | 35 | -178 | -58.4 | 0 | 0 | 0 | 0 | 114.2 | A141 L142 A143 L147 | A141-S145 PolarHBondContact O-N 2.92Å; A141-S145 VanDerWaalsContact O-N 3.1Å; L142-S145 PolarHBondContact O-N 3.47Å; L142-S145 VanDerWaalsContact O-N 3.11Å; A143-S145 VanDerWaalsContact C-N 3.33Å; S145-L147 VanDerWaalsContact C-N 3.34Å |
| 146 | W | 96.7 | Very high | 96.2 | Very high | 8 Ų | 8 | 33.8 Ų | 33.8 | 3% | 0.03 | 20% | 0.202 | C | C | . | . | trans | -94.7 | 25.1 | 178.1 | -67.5 | -18.4 | 0 | 0 | 0 | 113.8 | A141 L144 L158 C159 E165 R168 F169 F172 | A141-W146 HydrophobicContact CB-CB 4.25Å; A141-W146 PolarHBondContact O-N 3.01Å; L144-W146 VanDerWaalsContact C-N 3.26Å; L144-W146 HydrophobicContact CB-CD2 3.75Å; L144-W146 HydrophobicContact CB-CE3 4Å; L144-W146 HydrophobicContact CB-CG 4.14Å; L144-W146 HydrophobicContact CB-CZ2 4.32Å; L144-W146 HydrophobicContact CB-CZ3 4.37Å; L144-W146 HydrophobicContact CD1-CD2 4.27Å; L144-W146 HydrophobicContact CD1-CE3 3.79Å; L144-W146 HydrophobicContact CD1-CH2 3.45Å; L144-W146 VanDerWaalsContact CD1-CH2 3.45Å; L144-W146 HydrophobicContact CD1-CZ2 3.95Å; L144-W146 HydrophobicContact CD1-CZ3 3.34Å; L144-W146 HydrophobicContact CG-CZ3 4.49Å; L144-W146 PolarHBondContact O-N 3.46Å; W146-L158 CarbonylContact O-C 3.46Å; W146-L158 VanDerWaalsContact O-CA 3.32Å; W146-L158 WeakPolarHBondContact O-CA 3.17Å; W146-C159 CarbonylContact C-O 3.47Å; W146-C159 VanDerWaalsContact CA-O 3.25Å; W146-C159 WeakPolarHBondContact CA-O 3.36Å; W146-C159 PolarHBondContact O-N 3.42Å; W146-E165 HydrophobicContact CZ2-CB 4.49Å; W146-E165 PolarHBondContact NE1-OE2 2.99Å; W146-R168 HydrophobicContact CH2-CB 3.95Å; W146-R168 HydrophobicContact CZ2-CB 3.97Å; W146-F169 HydrophobicContact CB-CD2 4.13Å; W146-F169 HydrophobicContact CB-CE2 4.03Å; W146-F169 AromaticContact CD2-CD2 3.64Å; W146-F169 HydrophobicContact CD2-CD2 3.64Å; W146-F169 HydrophobicContact CD2-CE2 4.4Å; W146-F169 AromaticContact CE3-CD2 3.91Å; W146-F169 HydrophobicContact CE3-CD2 3.91Å; W146-F169 AromaticContact CG-CD2 3.77Å; W146-F169 HydrophobicContact CG-CD2 3.77Å; W146-F169 HydrophobicContact CG-CE2 4.17Å; W146-F169 HydrophobicContact CH2-CB 4.49Å; W146-F169 HydrophobicContact CZ2-CB 4.15Å; W146-F172 HydrophobicContact CE3-CB 4.3Å; W146-F172 AromaticContact CE3-CD1 3.82Å; W146-F172 HydrophobicContact CE3-CD1 3.82Å; W146-F172 HydrophobicContact CE3-CD2 4.48Å; W146-F172 HydrophobicContact CE3-CE1 4.29Å; W146-F172 AromaticContact CE3-CG 3.94Å; W146-F172 HydrophobicContact CE3-CG 3.94Å; W146-F172 HydrophobicContact CH2-CB 4.13Å; W146-F172 HydrophobicContact CZ3-CB 3.47Å; W146-F172 VanDerWaalsContact CZ3-CB 3.47Å; W146-F172 AromaticContact CZ3-CD1 3.84Å; W146-F172 HydrophobicContact CZ3-CD1 3.84Å; W146-F172 AromaticContact CZ3-CD2 3.97Å; W146-F172 HydrophobicContact CZ3-CD2 3.97Å; W146-F172 AromaticContact CZ3-CG 3.47Å; W146-F172 HydrophobicContact CZ3-CG 3.47Å; W146-F172 VanDerWaalsContact CZ3-CG 3.47Å | ||
| 147 | L | 96.6 | Very high | 96.2 | Very high | 8 Ų | 8 | 30.6 Ų | 30.6 | 4% | 0.042 | 18% | 0.182 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -116 | 126.7 | 179.7 | -63 | 178.1 | 0 | 0 | 0 | 109.5 | R80 A83 F84 A141 L142 S145 L158 | R80-L147 HydrophobicContact CB-CB 4.47Å; R80-L147 HydrophobicContact CG-CB 4.41Å; A83-L147 HydrophobicContact CB-CB 3.99Å; A83-L147 HydrophobicContact CB-CD2 3.9Å; A83-L147 HydrophobicContact CB-CG 4.47Å; F84-L147 HydrophobicContact CB-CD1 4.02Å; F84-L147 HydrophobicContact CD2-CD1 4.31Å; A141-L147 HydrophobicContact CB-CD2 3.81Å; A141-L147 HydrophobicContact CB-CG 4.07Å; L142-L147 HydrophobicContact CB-CD1 3.76Å; L142-L147 HydrophobicContact CD1-CD1 3.92Å; L142-L147 HydrophobicContact CG-CD1 4.45Å; S145-L147 VanDerWaalsContact C-N 3.34Å; L147-L158 HydrophobicContact CD2-CD2 3.95Å |
| 148 | G | 95.6 | Very high | 96.1 | Very high | 1 Ų | 1 | 30 Ų | 30 | 1% | 0.01 | 18% | 0.18 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -179.6 | -178.4 | 179.8 | 0 | 0 | 0 | 0 | 0 | 114.5 | C156 T157 | G148-C156 WeakPolarHBondContact O-CA 2.99Å; G148-T157 PolarHBondContact N-O 3.02Å; G148-T157 PolarHBondContact O-N 3.31Å |
| 149 | F | 96.1 | Very high | 95.9 | Very high | 24 Ų | 24 | 30.8 Ų | 30.8 | 11% | 0.105 | 19% | 0.185 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -75.8 | 131 | 175.5 | -171.2 | -103.2 | 0 | 0 | 0 | 110.7 | Q72 C79 | Q72-F149 HydrophobicContact CB-CB 4.11Å; Q72-F149 HydrophobicContact CB-CD1 4.01Å; Q72-F149 HydrophobicContact CB-CD2 4.25Å; Q72-F149 HydrophobicContact CB-CG 3.86Å; Q72-F149 HydrophobicContact CG-CB 3.89Å; Q72-F149 HydrophobicContact CG-CD2 4.17Å; Q72-F149 HydrophobicContact CG-CG 3.99Å; C79-F149 PolarHBondContact SG-N 3.24Å; C79-F149 VanDerWaalsContact SG-N 3.36Å |
| 150 | H | 95.1 | Very high | 95.6 | Very high | 32 Ų | 32 | 30.1 Ų | 30.1 | 15% | 0.148 | 18% | 0.178 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -117.5 | 115.5 | 179.1 | -161.3 | -69.6 | 0 | 0 | 0 | 110.8 | L152 Y153 A154 S155 T157 E264 | H150-L152 VanDerWaalsContact C-N 3.34Å; H150-L152 WeakPolarHBondContact ND1-CB 3.23Å; H150-L152 PolarHBondContact ND1-N 3.34Å; H150-L152 PolarHBondContact O-N 2.54Å; H150-Y153 HydrophobicContact CB-CD2 4.04Å; H150-Y153 AromaticContact CG-CD2 3.71Å; H150-Y153 AromaticContact ND1-CD2 3.43Å; H150-Y153 WeakPolarHBondContact ND1-CD2 3.46Å; H150-Y153 AromaticContact ND1-CE2 3.76Å; H150-Y153 PolarHBondContact O-N 3.11Å; H150-Y153 VanDerWaalsContact O-N 3.17Å; H150-A154 PolarHBondContact O-N 3.03Å; H150-A154 VanDerWaalsContact O-N 3.07Å; H150-S155 PolarHBondContact N-O 3.12Å; H150-T157 HydrophobicContact CB-CG2 3.55Å; H150-E264 IonicContact CE1-OE1 3.9Å; H150-E264 PolarHBondContact CE1-OE1 3.4Å; H150-E264 IonicContact ND1-OE1 2.99Å; H150-E264 IonicContact NE2-OE1 3.96Å; H150-E264 PolarHBondContact NE2-OE1 3.28Å; H150-E264 VanDerWaalsContact NE2-OE1 3.11Å |
| 151 | Q | 93.3 | Very high | 94.9 | Very high | 111 Ų | 111 | 34.6 Ų | 34.6 | 52% | 0.519 | 19% | 0.188 | S | C | . | . | G | 310 helix | trans | -60.2 | -40.4 | -172.4 | -164 | 74.3 | 12.9 | 0 | 0 | 112.6 | Q70 Y153 A154 | Q70-Q151 PolarHBondContact O-NE2 3.13Å; Q151-Y153 PolarHBondContact O-N 3.45Å; Q151-A154 PolarHBondContact O-N 3.29Å; Q151-A154 VanDerWaalsContact O-N 3.17Å |
| 152 | L | 94 | Very high | 94.3 | Very high | 25 Ų | 25 | 40 Ų | 40 | 13% | 0.131 | 21% | 0.208 | C | C | . | . | G | 310 helix | trans | -56.5 | -34.8 | 179.3 | -178.5 | 62.8 | 0 | 0 | 0 | 113.2 | H150 E264 I271 G276 V277 | H150-L152 VanDerWaalsContact C-N 3.34Å; H150-L152 WeakPolarHBondContact ND1-CB 3.23Å; H150-L152 PolarHBondContact ND1-N 3.34Å; H150-L152 PolarHBondContact O-N 2.54Å; L152-E264 WeakPolarHBondContact CD2-OE1 3.43Å; L152-I271 HydrophobicContact CD1-CB 4.07Å; L152-I271 HydrophobicContact CD1-CG2 3.92Å; L152-I271 HydrophobicContact CD2-CB 4.17Å; L152-I271 HydrophobicContact CD2-CD1 4.21Å; L152-I271 HydrophobicContact CD2-CG2 4.17Å; L152-G276 CarbonylContact O-C 3.57Å; L152-G276 WeakPolarHBondContact O-CA 3.35Å; L152-V277 PolarHBondContact O-N 3.1Å |
| 153 | Y | 95.7 | Very high | 93.6 | Very high | 0 Ų | 0 | 41 Ų | 41 | 0% | 0 | 22% | 0.22 | C | C | . | . | G | 310 helix | trans | -104.6 | -0.7 | -176.2 | -56.1 | -67.9 | 0 | 0 | 0 | 112.7 | H150 Q151 S155 T157 Y257 T260 R261 E264 G276 | H150-Y153 HydrophobicContact CB-CD2 4.04Å; H150-Y153 AromaticContact CG-CD2 3.71Å; H150-Y153 AromaticContact ND1-CD2 3.43Å; H150-Y153 WeakPolarHBondContact ND1-CD2 3.46Å; H150-Y153 AromaticContact ND1-CE2 3.76Å; H150-Y153 PolarHBondContact O-N 3.11Å; H150-Y153 VanDerWaalsContact O-N 3.17Å; Q151-Y153 PolarHBondContact O-N 3.45Å; Y153-S155 VanDerWaalsContact CB-OG 3.26Å; Y153-S155 WeakPolarHBondContact CB-OG 3.13Å; Y153-S155 WeakPolarHBondContact O-CB 3.35Å; Y153-S155 PolarHBondContact O-N 3.44Å; Y153-S155 PolarHBondContact O-OG 2.87Å; Y153-S155 VanDerWaalsContact O-OG 3.11Å; Y153-T157 HydrophobicContact CD2-CG2 4.2Å; Y153-Y257 HydrophobicContact CD1-CD2 4.18Å; Y153-Y257 AromaticContact CD1-CE2 3.81Å; Y153-Y257 HydrophobicContact CD1-CE2 3.81Å; Y153-Y257 HydrophobicContact CE1-CD2 4.05Å; Y153-Y257 AromaticContact CE1-CE2 3.84Å; Y153-Y257 HydrophobicContact CE1-CE2 3.84Å; Y153-Y257 HydrophobicContact CG-CE2 4.22Å; Y153-T260 HydrophobicContact CE1-CG2 4.1Å; Y153-R261 VanDerWaalsContact CE2-CD 3.49Å; Y153-R261 VanDerWaalsContact CZ-CD 3.42Å; Y153-R261 WeakPolarHBondContact OH-CD 3.37Å; Y153-E264 PolarHBondContact OH-OE2 3.11Å; Y153-G276 WeakPolarHBondContact CD1-O 3.43Å |
| 154 | A | 95.9 | Very high | 93.1 | Very high | 9 Ų | 9 | 43.4 Ų | 43.4 | 7% | 0.074 | 22% | 0.217 | C | C | . | . | T | Hydrogen-bonded Turn | trans | 44.1 | 32.2 | -171.1 | 0 | 0 | 0 | 0 | 0 | 113.7 | T63 V67 H150 Q151 V277 | T63-A154 WeakPolarHBondContact CA-O 3.43Å; V67-A154 HydrophobicContact CG2-CB 3.64Å; H150-A154 PolarHBondContact O-N 3.03Å; H150-A154 VanDerWaalsContact O-N 3.07Å; Q151-A154 PolarHBondContact O-N 3.29Å; Q151-A154 VanDerWaalsContact O-N 3.17Å; A154-V277 HydrophobicContact CB-CG2 3.83Å |
| 155 | S | 96.8 | Very high | 92.9 | Very high | 0 Ų | 0 | 41.2 Ų | 41.2 | 0% | 0 | 21% | 0.205 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -141.5 | 157.7 | -170.5 | 57.4 | 0 | 0 | 0 | 0 | 112.1 | T63 H150 Y153 | T63-S155 VanDerWaalsContact OG1-CB 3.26Å; T63-S155 WeakPolarHBondContact OG1-CB 3.1Å; H150-S155 PolarHBondContact N-O 3.12Å; Y153-S155 VanDerWaalsContact CB-OG 3.26Å; Y153-S155 WeakPolarHBondContact CB-OG 3.13Å; Y153-S155 WeakPolarHBondContact O-CB 3.35Å; Y153-S155 PolarHBondContact O-N 3.44Å; Y153-S155 PolarHBondContact O-OG 2.87Å; Y153-S155 VanDerWaalsContact O-OG 3.11Å |
| 156 | C | 96.9 | Very high | 92.6 | Very high | 5 Ų | 5 | 44.5 Ų | 44.5 | 3% | 0.034 | 21% | 0.208 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -80.6 | 115.5 | 171.1 | -63.2 | 0 | 0 | 0 | 0 | 109.3 | C79 A82 A83 G148 | C79-C156 WeakPolarHBondContact CA-SG 3.48Å; C79-C156 HydrophobicContact CB-CB 4.16Å; C79-C156 WeakPolarHBondContact CB-SG 3.48Å; C79-C156 VanDerWaalsContact O-CB 3.27Å; C79-C156 WeakPolarHBondContact O-CB 3.29Å; C79-C156 WeakPolarHBondContact SG-CB 3.07Å; C79-C156 CovalentContact SG-SG 2.04Å; C79-C156 PolarHBondContact SG-SG 2.94Å; A82-C156 HydrophobicContact CB-CB 3.88Å; A83-C156 WeakPolarHBondContact CA-O 3.4Å; A83-C156 HydrophobicContact CB-CB 4.15Å; G148-C156 WeakPolarHBondContact O-CA 2.99Å |
| 157 | T | 96.9 | Very high | 92.4 | Very high | 1 Ų | 1 | 50.6 Ų | 50.6 | 1% | 0.006 | 24% | 0.24 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -152.5 | -172.5 | -171.8 | -172.6 | 0 | 0 | 0 | 0 | 110.8 | G148 H150 Y153 C159 Y257 | G148-T157 PolarHBondContact N-O 3.02Å; G148-T157 PolarHBondContact O-N 3.31Å; H150-T157 HydrophobicContact CB-CG2 3.55Å; Y153-T157 HydrophobicContact CD2-CG2 4.2Å; T157-C159 PolarHBondContact O-N 2.9Å; T157-Y257 PolarHBondContact OG1-OH 2.74Å |
| 158 | L | 96.3 | Very high | 92.3 | Very high | 4 Ų | 4 | 57 Ų | 57 | 2% | 0.021 | 26% | 0.264 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -61 | 119.4 | 169.3 | -71.1 | 174.2 | 0 | 0 | 0 | 110.1 | T87 A141 W146 L147 F169 F172 F176 R261 | T87-L158 HydrophobicContact CG2-CD1 4.18Å; T87-L158 HydrophobicContact CG2-CD2 4.41Å; T87-L158 HydrophobicContact CG2-CG 4.3Å; A141-L158 HydrophobicContact CB-CD2 3.41Å; A141-L158 VanDerWaalsContact CB-CD2 3.41Å; W146-L158 CarbonylContact O-C 3.46Å; W146-L158 VanDerWaalsContact O-CA 3.32Å; W146-L158 WeakPolarHBondContact O-CA 3.17Å; L147-L158 HydrophobicContact CD2-CD2 3.95Å; L158-F169 HydrophobicContact CB-CE2 4.17Å; L158-F169 HydrophobicContact CB-CZ 4.13Å; L158-F172 HydrophobicContact CD1-CE1 3.93Å; L158-F172 HydrophobicContact CD2-CE1 3.83Å; L158-F176 HydrophobicContact CD1-CD1 4.26Å; L158-F176 HydrophobicContact CD1-CE1 4.46Å; L158-R261 VanDerWaalsContact CB-NH2 3.33Å; L158-R261 PolarHBondContact O-NH1 3.07Å; L158-R261 PolarHBondContact O-NH2 3.33Å |
| 159 | C | 93.9 | Very high | 92.3 | Very high | 15 Ų | 15 | 57.5 Ų | 57.5 | 10% | 0.101 | 27% | 0.266 | C | S | . | . | trans | -147 | 123.5 | -177.5 | 178.9 | 0 | 0 | 0 | 0 | 109.7 | W146 T157 | W146-C159 CarbonylContact C-O 3.47Å; W146-C159 VanDerWaalsContact CA-O 3.25Å; W146-C159 WeakPolarHBondContact CA-O 3.36Å; W146-C159 PolarHBondContact O-N 3.42Å; T157-C159 PolarHBondContact O-N 2.9Å | ||
| 160 | S | 91.7 | Very high | 92.3 | Very high | 31 Ų | 31 | 56.6 Ų | 56.6 | 22% | 0.217 | 26% | 0.263 | C | S | . | . | trans | -95.9 | 127.2 | 167 | -179.8 | 0 | 0 | 0 | 0 | 109.6 | R162 | S160-R162 PolarHBondContact OG-N 3.1Å; S160-R162 PolarHBondContact OG-O 3.37Å | ||
| 161 | R | 81.9 | Confident | 92.3 | Very high | 156 Ų | 156 | 59.5 Ų | 59.5 | 59% | 0.589 | 28% | 0.282 | S | S | * | . | trans | -92.9 | -9 | 174.2 | -64.3 | -177.6 | 179.7 | 160.7 | 2.1 | 112.8 | D76 | D76-R161 IonicContact OD1-NH2 3.94Š| ||
| 162 | R | 85.7 | Confident | 92.5 | Very high | 113 Ų | 113 | 55.4 Ų | 55.4 | 43% | 0.426 | 26% | 0.263 | S | S | . | . | trans | -107.5 | 113.6 | -171.7 | -72.1 | -176.8 | -164.6 | 140.6 | 1.7 | 110.6 | S160 E164 E165 | S160-R162 PolarHBondContact OG-N 3.1Å; S160-R162 PolarHBondContact OG-O 3.37Å; R162-E164 HydrophobicContact CB-CG 4.38Å; R162-E164 WeakPolarHBondContact CB-OE1 3.1Å; R162-E164 WeakPolarHBondContact CD-OE1 3.35Å; R162-E164 WeakPolarHBondContact CG-OE1 3.16Å; R162-E164 PolarHBondContact O-N 2.69Å; R162-E165 HydrophobicContact CB-CB 4.25Å; R162-E165 HydrophobicContact CB-CG 4.27Å; R162-E165 WeakPolarHBondContact CD-OE1 3.38Å; R162-E165 IonicContact CZ-OE1 2.54Å; R162-E165 IonicContact NH1-OE1 3.8Å; R162-E165 PolarHBondContact NH1-OE1 3.49Å; R162-E165 IonicContact NH1-OE2 3.97Å; R162-E165 PolarHBondContact O-N 2.94Å; R162-E165 VanDerWaalsContact O-N 3.14Å | ||
| 163 | P | 80.8 | Confident | 92.6 | Very high | 108 Ų | 108 | 54.2 Ų | 54.2 | 70% | 0.701 | 26% | 0.257 | S | S | * | . | G | 310 helix | trans | -57.7 | -36.6 | 178.5 | -24 | 33.8 | 0 | 0 | 0 | 113.2 | E165 R166 | P163-E165 PolarHBondContact O-N 3.29Å; P163-E165 VanDerWaalsContact O-N 3.16Å; P163-R166 VanDerWaalsContact O-CB 3.25Å; P163-R166 WeakPolarHBondContact O-CB 3.07Å; P163-R166 PolarHBondContact O-N 3.39Å; P163-R166 VanDerWaalsContact O-N 3.08Å |
| 164 | E | 87.1 | Confident | 92.7 | Very high | 132 Ų | 132 | 55.6 Ų | 55.6 | 62% | 0.617 | 27% | 0.267 | S | S | * | . | G | 310 helix | trans | -64.1 | -17.7 | 179.4 | 63.3 | -86.2 | -174 | 0 | 0 | 114 | R162 | R162-E164 HydrophobicContact CB-CG 4.38Å; R162-E164 WeakPolarHBondContact CB-OE1 3.1Å; R162-E164 WeakPolarHBondContact CD-OE1 3.35Å; R162-E164 WeakPolarHBondContact CG-OE1 3.16Å; R162-E164 PolarHBondContact O-N 2.69Å |
| 165 | E | 89 | Confident | 92.8 | Very high | 21 Ų | 21 | 57.1 Ų | 57.1 | 10% | 0.098 | 28% | 0.279 | C | S | . | . | G | 310 helix | trans | -96.6 | 1.1 | 178.2 | -74.2 | 175 | -172.4 | 0 | 0 | 113 | W146 R162 P163 L167 R168 F169 | W146-E165 HydrophobicContact CZ2-CB 4.49Å; W146-E165 PolarHBondContact NE1-OE2 2.99Å; R162-E165 HydrophobicContact CB-CB 4.25Å; R162-E165 HydrophobicContact CB-CG 4.27Å; R162-E165 WeakPolarHBondContact CD-OE1 3.38Å; R162-E165 IonicContact CZ-OE1 2.54Å; R162-E165 IonicContact NH1-OE1 3.8Å; R162-E165 PolarHBondContact NH1-OE1 3.49Å; R162-E165 IonicContact NH1-OE2 3.97Å; R162-E165 PolarHBondContact O-N 2.94Å; R162-E165 VanDerWaalsContact O-N 3.14Å; P163-E165 PolarHBondContact O-N 3.29Å; P163-E165 VanDerWaalsContact O-N 3.16Å; E165-L167 VanDerWaalsContact C-N 3.32Å; E165-L167 PolarHBondContact O-N 2.88Å; E165-R168 PolarHBondContact O-N 3.43Å; E165-R168 VanDerWaalsContact O-N 3.08Å; E165-F169 WeakPolarHBondContact O-CB 3.2Å; E165-F169 PolarHBondContact O-N 3.35Å |
| 166 | R | 88.9 | Confident | 92.9 | Very high | 131 Ų | 131 | 57.5 Ų | 57.5 | 49% | 0.494 | 28% | 0.28 | S | S | . | . | H | α-helix | trans | -52.7 | -46.3 | -172.6 | -176 | 177.8 | 179.4 | -178.5 | 1.6 | 113 | P163 A170 L265 | P163-R166 VanDerWaalsContact O-CB 3.25Å; P163-R166 WeakPolarHBondContact O-CB 3.07Å; P163-R166 PolarHBondContact O-N 3.39Å; P163-R166 VanDerWaalsContact O-N 3.08Å; R166-A170 VanDerWaalsContact O-CB 3.24Å; R166-A170 WeakPolarHBondContact O-CB 3.27Å; R166-A170 PolarHBondContact O-N 3.44Å; R166-L265 PolarHBondContact NH2-O 3.39Å |
| 167 | L | 92.5 | Very high | 92.9 | Very high | 136 Ų | 136 | 57.6 Ų | 57.6 | 71% | 0.712 | 28% | 0.28 | S | S | * | . | H | α-helix | trans | -64.8 | -46.9 | 179.3 | -179.7 | 61.9 | 0 | 0 | 0 | 111.8 | E165 F169 A170 V171 | E165-L167 VanDerWaalsContact C-N 3.32Å; E165-L167 PolarHBondContact O-N 2.88Å; L167-F169 VanDerWaalsContact C-N 3.34Å; L167-F169 PolarHBondContact O-N 3.22Å; L167-A170 PolarHBondContact O-N 3.19Å; L167-V171 HydrophobicContact CD1-CG2 4.33Å; L167-V171 WeakPolarHBondContact O-CG2 3.18Å; L167-V171 PolarHBondContact O-N 3.37Å |
| 168 | R | 94.9 | Very high | 92.9 | Very high | 141 Ų | 141 | 59.7 Ų | 59.7 | 53% | 0.532 | 30% | 0.298 | S | S | . | . | H | α-helix | trans | -61.3 | -44 | 178.6 | -73.9 | -176.1 | -83.6 | 161.4 | -4.8 | 111.3 | W146 E165 V171 F172 | W146-R168 HydrophobicContact CH2-CB 3.95Å; W146-R168 HydrophobicContact CZ2-CB 3.97Å; E165-R168 PolarHBondContact O-N 3.43Å; E165-R168 VanDerWaalsContact O-N 3.08Å; R168-V171 PolarHBondContact O-N 2.93Å; R168-F172 WeakPolarHBondContact O-CB 3.45Å; R168-F172 PolarHBondContact O-N 2.89Å |
| 169 | F | 95.6 | Very high | 93 | Very high | 13 Ų | 13 | 63.5 Ų | 63.5 | 6% | 0.057 | 32% | 0.318 | C | S | . | . | H | α-helix | trans | -65.3 | -39 | 176.6 | -178.3 | -109.4 | 0 | 0 | 0 | 112.4 | W146 L158 E165 L167 F172 T173 L265 | W146-F169 HydrophobicContact CB-CD2 4.13Å; W146-F169 HydrophobicContact CB-CE2 4.03Å; W146-F169 AromaticContact CD2-CD2 3.64Å; W146-F169 HydrophobicContact CD2-CD2 3.64Å; W146-F169 HydrophobicContact CD2-CE2 4.4Å; W146-F169 AromaticContact CE3-CD2 3.91Å; W146-F169 HydrophobicContact CE3-CD2 3.91Å; W146-F169 AromaticContact CG-CD2 3.77Å; W146-F169 HydrophobicContact CG-CD2 3.77Å; W146-F169 HydrophobicContact CG-CE2 4.17Å; W146-F169 HydrophobicContact CH2-CB 4.49Å; W146-F169 HydrophobicContact CZ2-CB 4.15Å; L158-F169 HydrophobicContact CB-CE2 4.17Å; L158-F169 HydrophobicContact CB-CZ 4.13Å; E165-F169 WeakPolarHBondContact O-CB 3.2Å; E165-F169 PolarHBondContact O-N 3.35Å; L167-F169 VanDerWaalsContact C-N 3.34Å; L167-F169 PolarHBondContact O-N 3.22Å; F169-F172 PolarHBondContact O-N 3.25Å; F169-T173 WeakPolarHBondContact O-CB 3.33Å; F169-T173 PolarHBondContact O-N 3.03Å; F169-T173 PolarHBondContact O-OG1 3.13Å; F169-L265 HydrophobicContact CD1-CD2 3.63Å; F169-L265 HydrophobicContact CE1-CD2 3.79Å |
| 170 | A | 95.2 | Very high | 93.1 | Very high | 5 Ų | 5 | 62.8 Ų | 62.8 | 4% | 0.041 | 31% | 0.313 | C | S | . | . | H | α-helix | trans | -66.2 | -45.2 | 176.9 | 0 | 0 | 0 | 0 | 0 | 112 | R166 L167 T173 S174 L265 F266 | R166-A170 VanDerWaalsContact O-CB 3.24Å; R166-A170 WeakPolarHBondContact O-CB 3.27Å; R166-A170 PolarHBondContact O-N 3.44Å; L167-A170 PolarHBondContact O-N 3.19Å; A170-T173 PolarHBondContact O-N 2.93Å; A170-S174 VanDerWaalsContact O-CB 3.25Å; A170-S174 WeakPolarHBondContact O-CB 3.31Å; A170-S174 PolarHBondContact O-N 3.03Å; A170-S174 PolarHBondContact O-OG 3.14Å; A170-L265 HydrophobicContact CB-CB 4.22Å; A170-L265 HydrophobicContact CB-CD1 4.44Å; A170-L265 HydrophobicContact CB-CD2 4.08Å; A170-L265 HydrophobicContact CB-CG 4.48Å; A170-F266 HydrophobicContact CB-CE1 4.47Å |
| 171 | V | 96.2 | Very high | 93.4 | Very high | 92 Ų | 92 | 62.6 Ų | 62.6 | 56% | 0.558 | 31% | 0.308 | S | S | * | . | H | α-helix | trans | -60.3 | -47.5 | 174.5 | 171.4 | 0 | 0 | 0 | 0 | 110.3 | L167 R168 S174 A175 | L167-V171 HydrophobicContact CD1-CG2 4.33Å; L167-V171 WeakPolarHBondContact O-CG2 3.18Å; L167-V171 PolarHBondContact O-N 3.37Å; R168-V171 PolarHBondContact O-N 2.93Å; V171-S174 PolarHBondContact O-N 3.43Å; V171-A175 WeakPolarHBondContact O-CB 3.16Å; V171-A175 PolarHBondContact O-N 2.66Å |
| 172 | F | 97.3 | Very high | 94.1 | Very high | 25 Ų | 25 | 59.2 Ų | 59.2 | 11% | 0.11 | 30% | 0.302 | C | S | . | . | H | α-helix | trans | -59.1 | -49.6 | 177.6 | 170.9 | -94.6 | 0 | 0 | 0 | 112.6 | F137 T140 A141 W146 L158 R168 F169 S174 A175 F176 | F137-F172 HydrophobicContact CB-CE2 4.45Å; F137-F172 HydrophobicContact CB-CZ 4.03Å; F137-F172 HydrophobicContact CD1-CE2 4Å; F137-F172 HydrophobicContact CD1-CZ 4.17Å; F137-F172 WeakPolarHBondContact O-CZ 3.41Å; T140-F172 HydrophobicContact CG2-CD2 4.22Å; T140-F172 HydrophobicContact CG2-CE2 3.88Å; A141-F172 HydrophobicContact CB-CE1 4.22Å; A141-F172 HydrophobicContact CB-CZ 4.02Å; W146-F172 HydrophobicContact CE3-CB 4.3Å; W146-F172 AromaticContact CE3-CD1 3.82Å; W146-F172 HydrophobicContact CE3-CD1 3.82Å; W146-F172 HydrophobicContact CE3-CD2 4.48Å; W146-F172 HydrophobicContact CE3-CE1 4.29Å; W146-F172 AromaticContact CE3-CG 3.94Å; W146-F172 HydrophobicContact CE3-CG 3.94Å; W146-F172 HydrophobicContact CH2-CB 4.13Å; W146-F172 HydrophobicContact CZ3-CB 3.47Å; W146-F172 VanDerWaalsContact CZ3-CB 3.47Å; W146-F172 AromaticContact CZ3-CD1 3.84Å; W146-F172 HydrophobicContact CZ3-CD1 3.84Å; W146-F172 AromaticContact CZ3-CD2 3.97Å; W146-F172 HydrophobicContact CZ3-CD2 3.97Å; W146-F172 AromaticContact CZ3-CG 3.47Å; W146-F172 HydrophobicContact CZ3-CG 3.47Å; W146-F172 VanDerWaalsContact CZ3-CG 3.47Å; L158-F172 HydrophobicContact CD1-CE1 3.93Å; L158-F172 HydrophobicContact CD2-CE1 3.83Å; R168-F172 WeakPolarHBondContact O-CB 3.45Å; R168-F172 PolarHBondContact O-N 2.89Å; F169-F172 PolarHBondContact O-N 3.25Å; F172-S174 VanDerWaalsContact C-N 3.33Å; F172-S174 PolarHBondContact O-N 3.45Å; F172-A175 PolarHBondContact O-N 3.43Å; F172-F176 WeakPolarHBondContact O-CB 3.4Å; F172-F176 PolarHBondContact O-N 2.94Å |
| 173 | T | 96.6 | Very high | 94.6 | Very high | 0 Ų | 0 | 56.8 Ų | 56.8 | 0% | 0 | 30% | 0.297 | C | S | . | . | H | α-helix | trans | -67.3 | -36.1 | -178.2 | -57.5 | 0 | 0 | 0 | 0 | 111.4 | F169 A170 F176 H177 L265 | F169-T173 WeakPolarHBondContact O-CB 3.33Å; F169-T173 PolarHBondContact O-N 3.03Å; F169-T173 PolarHBondContact O-OG1 3.13Å; A170-T173 PolarHBondContact O-N 2.93Å; T173-F176 WeakPolarHBondContact O-CB 3.33Å; T173-F176 PolarHBondContact O-N 3.27Å; T173-H177 PolarHBondContact O-CD2 3.34Å; T173-H177 VanDerWaalsContact O-CD2 3.23Å; T173-H177 PolarHBondContact O-N 2.79Å; T173-L265 HydrophobicContact CG2-CD1 3.67Å |
| 174 | S | 97.2 | Very high | 95.4 | Very high | 30 Ų | 30 | 51.7 Ų | 51.7 | 21% | 0.21 | 26% | 0.264 | C | S | . | . | H | α-helix | trans | -65.4 | -44.9 | 174 | -58.9 | 0 | 0 | 0 | 0 | 111.4 | A170 V171 F172 F176 H177 A178 F266 | A170-S174 VanDerWaalsContact O-CB 3.25Å; A170-S174 WeakPolarHBondContact O-CB 3.31Å; A170-S174 PolarHBondContact O-N 3.03Å; A170-S174 PolarHBondContact O-OG 3.14Å; V171-S174 PolarHBondContact O-N 3.43Å; F172-S174 VanDerWaalsContact C-N 3.33Å; F172-S174 PolarHBondContact O-N 3.45Å; S174-F176 PolarHBondContact O-N 3.31Å; S174-H177 PolarHBondContact O-N 2.99Å; S174-A178 VanDerWaalsContact O-CB 3.32Å; S174-A178 WeakPolarHBondContact O-CB 3.41Å; S174-A178 PolarHBondContact O-N 2.83Å; S174-F266 WeakPolarHBondContact OG-CE2 3.47Å; S174-F266 WeakPolarHBondContact OG-CZ 3.29Å |
| 175 | A | 97.8 | Very high | 95.8 | Very high | 40 Ų | 40 | 48.1 Ų | 48.1 | 33% | 0.331 | 25% | 0.246 | S | C | . | . | H | α-helix | trans | -62.2 | -42.7 | 175.6 | 0 | 0 | 0 | 0 | 0 | 111.7 | V171 F172 H177 A178 L179 | V171-A175 WeakPolarHBondContact O-CB 3.16Å; V171-A175 PolarHBondContact O-N 2.66Å; F172-A175 PolarHBondContact O-N 3.43Å; A175-H177 PolarHBondContact O-N 3.42Å; A175-A178 PolarHBondContact O-N 2.81Å; A175-L179 VanDerWaalsContact O-CB 3.3Å; A175-L179 WeakPolarHBondContact O-CB 3.42Å; A175-L179 WeakPolarHBondContact O-CG 3.27Å; A175-L179 PolarHBondContact O-N 3.2Å |
| 176 | F | 97.8 | Very high | 96.2 | Very high | 8 Ų | 8 | 51.7 Ų | 51.7 | 4% | 0.035 | 27% | 0.265 | C | S | . | . | H | α-helix | trans | -54.4 | -52.3 | 173.3 | 168 | -111.5 | 0 | 0 | 0 | 111.6 | T87 A91 F137 L158 F172 T173 S174 S180 | T87-F176 HydrophobicContact CG2-CD2 4.46Å; T87-F176 HydrophobicContact CG2-CE2 3.76Å; T87-F176 HydrophobicContact CG2-CZ 3.88Å; A91-F176 HydrophobicContact CB-CE2 3.83Å; A91-F176 HydrophobicContact CB-CZ 4.46Å; F137-F176 HydrophobicContact CB-CD2 3.74Å; F137-F176 HydrophobicContact CB-CE2 4.2Å; F137-F176 HydrophobicContact CD1-CB 3.72Å; F137-F176 AromaticContact CD1-CD2 3.8Å; F137-F176 HydrophobicContact CD1-CD2 3.8Å; F137-F176 HydrophobicContact CD1-CG 4.25Å; F137-F176 AromaticContact CD2-CD2 3.75Å; F137-F176 HydrophobicContact CD2-CD2 3.75Å; F137-F176 HydrophobicContact CD2-CE2 4.33Å; F137-F176 VanDerWaalsContact CE1-CA 3.44Å; F137-F176 HydrophobicContact CE1-CB 3.93Å; F137-F176 HydrophobicContact CE1-CD2 4.34Å; F137-F176 HydrophobicContact CE2-CD2 4.27Å; F137-F176 HydrophobicContact CG-CB 4.31Å; F137-F176 AromaticContact CG-CD2 3.48Å; F137-F176 HydrophobicContact CG-CD2 3.48Å; F137-F176 VanDerWaalsContact CG-CD2 3.48Å; F137-F176 HydrophobicContact CG-CE2 4.26Å; F137-F176 HydrophobicContact CG-CG 4.36Å; L158-F176 HydrophobicContact CD1-CD1 4.26Å; L158-F176 HydrophobicContact CD1-CE1 4.46Å; F172-F176 WeakPolarHBondContact O-CB 3.4Å; F172-F176 PolarHBondContact O-N 2.94Å; T173-F176 WeakPolarHBondContact O-CB 3.33Å; T173-F176 PolarHBondContact O-N 3.27Å; S174-F176 PolarHBondContact O-N 3.31Å; F176-S180 VanDerWaalsContact O-CB 3.32Å; F176-S180 WeakPolarHBondContact O-CB 3.45Å; F176-S180 PolarHBondContact O-N 2.91Å; F176-S180 PolarHBondContact O-OG 3.34Å |
| 177 | H | 97.4 | Very high | 96.6 | Very high | 7 Ų | 7 | 47 Ų | 47 | 3% | 0.032 | 25% | 0.251 | C | S | . | . | H | α-helix | trans | -70 | -33.8 | -179.6 | -70.4 | -47.6 | 0 | 0 | 0 | 113.2 | T173 S174 A175 F181 L182 V258 | T173-H177 PolarHBondContact O-CD2 3.34Å; T173-H177 VanDerWaalsContact O-CD2 3.23Å; T173-H177 PolarHBondContact O-N 2.79Å; S174-H177 PolarHBondContact O-N 2.99Å; A175-H177 PolarHBondContact O-N 3.42Å; H177-F181 WeakPolarHBondContact O-CA 3.26Å; H177-F181 WeakPolarHBondContact O-CB 3.04Å; H177-F181 PolarHBondContact O-N 3.4Å; H177-L182 PolarHBondContact O-N 2.89Å; H177-L182 VanDerWaalsContact O-N 3.07Å; H177-V258 HydrophobicContact CB-CG1 3.85Å |
| 178 | A | 97.8 | Very high | 96.6 | Very high | 45 Ų | 45 | 40.6 Ų | 40.6 | 37% | 0.372 | 22% | 0.217 | S | C | . | . | I | π-helix | trans | -65.6 | -47.7 | 174.8 | 0 | 0 | 0 | 0 | 0 | 111.8 | S174 A175 L182 L183 | S174-A178 VanDerWaalsContact O-CB 3.32Å; S174-A178 WeakPolarHBondContact O-CB 3.41Å; S174-A178 PolarHBondContact O-N 2.83Å; A175-A178 PolarHBondContact O-N 2.81Å; A178-L182 WeakPolarHBondContact O-CB 3.31Å; A178-L183 PolarHBondContact O-N 3.44Å |
| 179 | L | 97.7 | Very high | 96.5 | Very high | 84 Ų | 84 | 35.5 Ų | 35.5 | 44% | 0.44 | 20% | 0.203 | S | C | . | . | I | π-helix | trans | -81.2 | -15.1 | -175.1 | -65 | 174.6 | 0 | 0 | 0 | 113.9 | H133 F137 A175 L183 | H133-L179 PolarHBondContact CE1-O 3.44Å; F137-L179 HydrophobicContact CE1-CD1 4.46Å; F137-L179 HydrophobicContact CZ-CB 3.92Å; F137-L179 HydrophobicContact CZ-CD1 3.94Å; A175-L179 VanDerWaalsContact O-CB 3.3Å; A175-L179 WeakPolarHBondContact O-CB 3.42Å; A175-L179 WeakPolarHBondContact O-CG 3.27Å; A175-L179 PolarHBondContact O-N 3.2Å; L179-L183 WeakPolarHBondContact O-CB 3.45Å; L179-L183 VanDerWaalsContact O-CD2 3.27Å; L179-L183 WeakPolarHBondContact O-CD2 3.48Å |
| 180 | S | 96.3 | Very high | 96.4 | Very high | 1 Ų | 1 | 40.2 Ų | 40.2 | 1% | 0.007 | 22% | 0.224 | C | C | . | . | I | π-helix | trans | -103.1 | -70.5 | 172.2 | 62.1 | 0 | 0 | 0 | 0 | 111.8 | F176 S184 | F176-S180 VanDerWaalsContact O-CB 3.32Å; F176-S180 WeakPolarHBondContact O-CB 3.45Å; F176-S180 PolarHBondContact O-N 2.91Å; F176-S180 PolarHBondContact O-OG 3.34Å; S180-S184 WeakPolarHBondContact O-CB 3.33Å; S180-S184 PolarHBondContact O-N 2.9Å; S180-S184 PolarHBondContact O-OG 2.92Å |
| 181 | F | 97.2 | Very high | 96.2 | Very high | 26 Ų | 26 | 40.1 Ų | 40.1 | 11% | 0.114 | 22% | 0.223 | C | C | . | . | I | π-helix | trans | -68.2 | -55.9 | -172.8 | 174.8 | -98.7 | 0 | 0 | 0 | 112.7 | M94 H177 S184 F185 F250 L251 F254 A255 V258 | M94-F181 HydrophobicContact SD-CB 3.65Å; M94-F181 HydrophobicContact SD-CD2 4.15Å; M94-F181 HydrophobicContact SD-CG 4.42Å; H177-F181 WeakPolarHBondContact O-CA 3.26Å; H177-F181 WeakPolarHBondContact O-CB 3.04Å; H177-F181 PolarHBondContact O-N 3.4Å; F181-S184 PolarHBondContact O-N 3.29Å; F181-F185 WeakPolarHBondContact O-CB 3.26Å; F181-F185 PolarHBondContact O-N 3.47Å; F181-F250 AromaticContact CD2-CE1 3.53Å; F181-F250 HydrophobicContact CD2-CE1 3.53Å; F181-F250 AromaticContact CD2-CZ 3.63Å; F181-F250 HydrophobicContact CD2-CZ 3.63Å; F181-F250 HydrophobicContact CE2-CD1 4.03Å; F181-F250 AromaticContact CE2-CE1 3.34Å; F181-F250 HydrophobicContact CE2-CE1 3.34Å; F181-F250 AromaticContact CE2-CZ 3.95Å; F181-F250 HydrophobicContact CE2-CZ 3.95Å; F181-F250 HydrophobicContact CG-CE1 4.45Å; F181-F250 HydrophobicContact CG-CZ 4.47Å; F181-F250 HydrophobicContact CZ-CE1 4.16Å; F181-L251 HydrophobicContact CE2-CD2 4.43Å; F181-L251 HydrophobicContact CZ-CD2 3.89Å; F181-F254 HydrophobicContact CD2-CB 3.7Å; F181-F254 HydrophobicContact CE2-CB 3.7Å; F181-A255 HydrophobicContact CE2-CB 4.25Å; F181-A255 HydrophobicContact CZ-CB 3.76Å; F181-V258 HydrophobicContact CB-CG2 4.17Å; F181-V258 HydrophobicContact CD1-CG1 4.16Å; F181-V258 HydrophobicContact CD1-CG2 4.48Å; F181-V258 HydrophobicContact CD2-CG2 4.19Å; F181-V258 HydrophobicContact CG-CG1 4.45Å; F181-V258 HydrophobicContact CG-CG2 4.02Å |
| 182 | L | 97.5 | Very high | 95.7 | Very high | 85 Ų | 85 | 36.1 Ų | 36.1 | 45% | 0.445 | 20% | 0.198 | S | C | . | . | I | π-helix | trans | -66.7 | -44.6 | -175.8 | 178.8 | 62.3 | 0 | 0 | 0 | 111.2 | H177 A178 S184 F185 I186 | H177-L182 PolarHBondContact O-N 2.89Å; H177-L182 VanDerWaalsContact O-N 3.07Å; A178-L182 WeakPolarHBondContact O-CB 3.31Å; L182-S184 VanDerWaalsContact C-N 3.35Å; L182-S184 PolarHBondContact O-N 2.93Å; L182-F185 PolarHBondContact O-N 3.47Å; L182-I186 HydrophobicContact CD1-CD1 3.99Å; L182-I186 HydrophobicContact CD1-CG1 4.18Å; L182-I186 HydrophobicContact CG-CD1 3.9Å; L182-I186 HydrophobicContact CG-CG1 4.48Å; L182-I186 WeakPolarHBondContact O-CG1 3.44Å; L182-I186 PolarHBondContact O-N 2.97Å |
| 183 | L | 96.9 | Very high | 95.3 | Very high | 62 Ų | 62 | 40.2 Ų | 40.2 | 33% | 0.325 | 22% | 0.22 | S | C | . | . | H | α-helix | trans | -54.4 | -51.4 | 173.3 | 177.5 | 62.1 | 0 | 0 | 0 | 111.2 | L95 A178 L179 F185 I186 V187 | L95-L183 HydrophobicContact CD2-CD2 4.26Å; A178-L183 PolarHBondContact O-N 3.44Å; L179-L183 WeakPolarHBondContact O-CB 3.45Å; L179-L183 VanDerWaalsContact O-CD2 3.27Å; L179-L183 WeakPolarHBondContact O-CD2 3.48Å; L183-F185 VanDerWaalsContact C-N 3.32Å; L183-F185 PolarHBondContact O-N 3.32Å; L183-I186 PolarHBondContact O-N 2.84Å; L183-V187 HydrophobicContact CD1-CG2 4.32Å; L183-V187 WeakPolarHBondContact O-CG2 3.38Å; L183-V187 PolarHBondContact O-N 3.19Å |
| 184 | S | 96.9 | Very high | 94.8 | Very high | 1 Ų | 1 | 44.6 Ų | 44.6 | 1% | 0.007 | 24% | 0.239 | C | C | . | . | H | α-helix | trans | -62.5 | -40.8 | -179.8 | -60.3 | 0 | 0 | 0 | 0 | 111.7 | M94 S180 F181 L182 V187 L188 | M94-S184 WeakPolarHBondContact O-CB 3.4Å; M94-S184 PolarHBondContact O-OG 3.35Å; M94-S184 VanDerWaalsContact O-OG 3.05Å; S180-S184 WeakPolarHBondContact O-CB 3.33Å; S180-S184 PolarHBondContact O-N 2.9Å; S180-S184 PolarHBondContact O-OG 2.92Å; F181-S184 PolarHBondContact O-N 3.29Å; L182-S184 VanDerWaalsContact C-N 3.35Å; L182-S184 PolarHBondContact O-N 2.93Å; S184-V187 PolarHBondContact O-N 3.41Å; S184-L188 WeakPolarHBondContact O-CB 3.49Å; S184-L188 PolarHBondContact O-N 2.94Å |
| 185 | F | 96.3 | Very high | 94.2 | Very high | 58 Ų | 58 | 43.7 Ų | 43.7 | 25% | 0.254 | 23% | 0.232 | S | C | . | . | H | α-helix | trans | -62.4 | -45 | 176.9 | -179.5 | -115.7 | 0 | 0 | 0 | 112.5 | F181 L182 L183 L188 C189 I247 F250 L251 | F181-F185 WeakPolarHBondContact O-CB 3.26Å; F181-F185 PolarHBondContact O-N 3.47Å; L182-F185 PolarHBondContact O-N 3.47Å; L183-F185 VanDerWaalsContact C-N 3.32Å; L183-F185 PolarHBondContact O-N 3.32Å; F185-L188 WeakPolarHBondContact O-CB 3.47Å; F185-L188 PolarHBondContact O-N 3.48Å; F185-C189 WeakPolarHBondContact CE2-SG 3.12Å; F185-C189 WeakPolarHBondContact CZ-SG 3.27Å; F185-C189 WeakPolarHBondContact O-CB 3.26Å; F185-C189 PolarHBondContact O-N 2.86Å; F185-C189 PolarHBondContact O-SG 3.45Å; F185-C189 VanDerWaalsContact O-SG 3.4Å; F185-I247 HydrophobicContact CE2-CG2 4.02Å; F185-F250 HydrophobicContact CB-CE1 3.97Å; F185-F250 HydrophobicContact CD2-CD1 4.4Å; F185-F250 HydrophobicContact CD2-CE1 4.42Å; F185-L251 HydrophobicContact CD2-CD2 3.73Å; F185-L251 HydrophobicContact CD2-CG 4.27Å; F185-L251 HydrophobicContact CE2-CD1 3.8Å; F185-L251 HydrophobicContact CE2-CD2 3.63Å; F185-L251 HydrophobicContact CE2-CG 3.92Å; F185-L251 HydrophobicContact CG-CD2 4.45Å; F185-L251 HydrophobicContact CZ-CD1 4.31Å; F185-L251 HydrophobicContact CZ-CD2 4.26Å |
| 186 | I | 96.8 | Very high | 93.4 | Very high | 95 Ų | 95 | 43.3 Ų | 43.3 | 49% | 0.487 | 22% | 0.224 | S | C | . | . | H | α-helix | trans | -61.8 | -47.7 | 177.3 | -70.4 | 168.9 | 0 | 0 | 0 | 110.3 | L182 L183 L188 C189 F190 | L182-I186 HydrophobicContact CD1-CD1 3.99Å; L182-I186 HydrophobicContact CD1-CG1 4.18Å; L182-I186 HydrophobicContact CG-CD1 3.9Å; L182-I186 HydrophobicContact CG-CG1 4.48Å; L182-I186 WeakPolarHBondContact O-CG1 3.44Å; L182-I186 PolarHBondContact O-N 2.97Å; L183-I186 PolarHBondContact O-N 2.84Å; I186-L188 VanDerWaalsContact C-N 3.33Å; I186-L188 PolarHBondContact O-N 3.36Å; I186-C189 PolarHBondContact O-N 3.27Å; I186-F190 VanDerWaalsContact O-CB 3.32Å; I186-F190 WeakPolarHBondContact O-CB 3.24Å; I186-F190 PolarHBondContact O-N 2.88Å |
| 187 | V | 96.2 | Very high | 92.8 | Very high | 33 Ų | 33 | 50.5 Ų | 50.5 | 20% | 0.2 | 26% | 0.256 | C | S | . | . | H | α-helix | trans | -60.4 | -44.7 | 177.3 | 173.2 | 0 | 0 | 0 | 0 | 110.6 | A98 I102 L183 S184 F190 T191 | A98-V187 HydrophobicContact CB-CB 4.06Å; A98-V187 HydrophobicContact CB-CG1 3.87Å; I102-V187 HydrophobicContact CD1-CG1 3.94Å; I102-V187 HydrophobicContact CG1-CG1 3.88Å; L183-V187 HydrophobicContact CD1-CG2 4.32Å; L183-V187 WeakPolarHBondContact O-CG2 3.38Å; L183-V187 PolarHBondContact O-N 3.19Å; S184-V187 PolarHBondContact O-N 3.41Å; V187-F190 PolarHBondContact O-N 2.97Å; V187-T191 HydrophobicContact CG1-CG2 4.12Å; V187-T191 WeakPolarHBondContact O-CB 3.31Å; V187-T191 VanDerWaalsContact O-CG2 3.3Å; V187-T191 WeakPolarHBondContact O-CG2 3.5Å; V187-T191 PolarHBondContact O-N 2.91Å; V187-T191 PolarHBondContact O-OG1 3.25Å |
| 188 | L | 93 | Very high | 92 | Very high | 1 Ų | 1 | 51.7 Ų | 51.7 | 1% | 0.005 | 26% | 0.264 | C | S | . | . | H | α-helix | trans | -58.5 | -50.7 | 178.1 | -163.6 | 69.4 | 0 | 0 | 0 | 111 | S184 F185 I186 T191 Y192 I247 F250 | S184-L188 WeakPolarHBondContact O-CB 3.49Å; S184-L188 PolarHBondContact O-N 2.94Å; F185-L188 WeakPolarHBondContact O-CB 3.47Å; F185-L188 PolarHBondContact O-N 3.48Å; I186-L188 VanDerWaalsContact C-N 3.33Å; I186-L188 PolarHBondContact O-N 3.36Å; L188-T191 PolarHBondContact O-OG1 3.34Å; L188-Y192 HydrophobicContact CD1-CD2 3.88Å; L188-Y192 HydrophobicContact CD1-CE2 3.3Å; L188-Y192 HydrophobicContact CG-CD2 3.8Å; L188-Y192 HydrophobicContact CG-CE2 3.69Å; L188-Y192 VanDerWaalsContact O-CB 3.29Å; L188-Y192 WeakPolarHBondContact O-CB 3.33Å; L188-Y192 WeakPolarHBondContact O-CD2 3.46Å; L188-Y192 PolarHBondContact O-N 3.31Å; L188-I247 HydrophobicContact CD2-CB 4.3Å; L188-I247 HydrophobicContact CD2-CG1 3.87Å; L188-I247 HydrophobicContact CG-CG1 4.01Å; L188-F250 HydrophobicContact CD2-CB 4.09Å; L188-F250 HydrophobicContact CD2-CD1 4.35Å; L188-F250 HydrophobicContact CD2-CG 4.13Å |
| 189 | C | 92.6 | Very high | 90.8 | Very high | 35 Ų | 35 | 50.8 Ų | 50.8 | 24% | 0.236 | 26% | 0.256 | C | S | . | . | H | α-helix | trans | -61.2 | -50.1 | 177.6 | -76 | 0 | 0 | 0 | 0 | 111.7 | F185 I186 Y192 L193 | F185-C189 WeakPolarHBondContact CE2-SG 3.12Å; F185-C189 WeakPolarHBondContact CZ-SG 3.27Å; F185-C189 WeakPolarHBondContact O-CB 3.26Å; F185-C189 PolarHBondContact O-N 2.86Å; F185-C189 PolarHBondContact O-SG 3.45Å; F185-C189 VanDerWaalsContact O-SG 3.4Å; I186-C189 PolarHBondContact O-N 3.27Å; C189-Y192 PolarHBondContact O-N 3.49Å; C189-L193 WeakPolarHBondContact O-CB 3.43Å; C189-L193 WeakPolarHBondContact O-CG 3.45Å; C189-L193 PolarHBondContact O-N 3.11Å |
| 190 | F | 93.6 | Very high | 89.7 | Confident | 111 Ų | 111 | 52.5 Ų | 52.5 | 49% | 0.487 | 26% | 0.257 | S | S | . | . | H | α-helix | trans | -60.7 | -51.9 | -178.8 | 175.4 | -98.9 | 0 | 0 | 0 | 112.3 | I186 V187 Y192 L193 K194 | I186-F190 VanDerWaalsContact O-CB 3.32Å; I186-F190 WeakPolarHBondContact O-CB 3.24Å; I186-F190 PolarHBondContact O-N 2.88Å; V187-F190 PolarHBondContact O-N 2.97Å; F190-Y192 VanDerWaalsContact C-N 3.31Å; F190-Y192 PolarHBondContact O-N 2.99Å; F190-L193 PolarHBondContact O-N 2.96Å; F190-K194 HydrophobicContact CE1-CG 4.29Å; F190-K194 HydrophobicContact CZ-CG 4.23Å; F190-K194 WeakPolarHBondContact O-CG 3.48Å; F190-K194 PolarHBondContact O-N 3.07Å; F190-K194 VanDerWaalsContact O-N 3.07Å |
| 191 | T | 91.9 | Very high | 88.7 | Confident | 4 Ų | 4 | 58.6 Ų | 58.6 | 3% | 0.025 | 28% | 0.283 | C | S | . | . | H | α-helix | trans | -61.5 | -40.7 | -179.9 | 52.2 | 0 | 0 | 0 | 0 | 111.2 | S101 I102 W105 V187 L188 K194 V195 | S101-T191 VanDerWaalsContact CB-OG1 3.27Å; S101-T191 WeakPolarHBondContact CB-OG1 3.39Å; S101-T191 PolarHBondContact OG-OG1 2.95Å; I102-T191 HydrophobicContact CG1-CG2 3.87Å; W105-T191 HydrophobicContact CB-CG2 4.27Å; V187-T191 HydrophobicContact CG1-CG2 4.12Å; V187-T191 WeakPolarHBondContact O-CB 3.31Å; V187-T191 VanDerWaalsContact O-CG2 3.3Å; V187-T191 WeakPolarHBondContact O-CG2 3.5Å; V187-T191 PolarHBondContact O-N 2.91Å; V187-T191 PolarHBondContact O-OG1 3.25Å; L188-T191 PolarHBondContact O-OG1 3.34Å; T191-K194 WeakPolarHBondContact O-CB 3.47Å; T191-K194 PolarHBondContact O-N 2.95Å; T191-V195 VanDerWaalsContact O-CG2 3.31Å; T191-V195 WeakPolarHBondContact O-CG2 3.11Å; T191-V195 PolarHBondContact O-N 3.47Å |
| 192 | Y | 85.3 | Confident | 87.4 | Confident | 8 Ų | 8 | 61 Ų | 61 | 3% | 0.031 | 30% | 0.295 | C | S | . | . | H | α-helix | trans | -73.1 | -33.9 | 177.9 | -78 | -47.6 | 0 | 0 | 0 | 114.5 | L188 C189 F190 K194 V195 L196 I243 F246 I247 | L188-Y192 HydrophobicContact CD1-CD2 3.88Å; L188-Y192 HydrophobicContact CD1-CE2 3.3Å; L188-Y192 HydrophobicContact CG-CD2 3.8Å; L188-Y192 HydrophobicContact CG-CE2 3.69Å; L188-Y192 VanDerWaalsContact O-CB 3.29Å; L188-Y192 WeakPolarHBondContact O-CB 3.33Å; L188-Y192 WeakPolarHBondContact O-CD2 3.46Å; L188-Y192 PolarHBondContact O-N 3.31Å; C189-Y192 PolarHBondContact O-N 3.49Å; F190-Y192 VanDerWaalsContact C-N 3.31Å; F190-Y192 PolarHBondContact O-N 2.99Å; Y192-K194 VanDerWaalsContact C-N 3.27Å; Y192-K194 PolarHBondContact O-N 2.96Å; Y192-V195 HydrophobicContact CD1-CB 4.45Å; Y192-V195 HydrophobicContact CD1-CG2 4.47Å; Y192-V195 PolarHBondContact O-N 2.77Å; Y192-L196 WeakPolarHBondContact O-CB 3.38Å; Y192-L196 WeakPolarHBondContact O-CG 3.28Å; Y192-L196 PolarHBondContact O-N 2.92Å; Y192-I243 HydrophobicContact CD1-CB 4.28Å; Y192-I243 HydrophobicContact CD1-CD1 4.15Å; Y192-I243 HydrophobicContact CD1-CG1 3.72Å; Y192-I243 HydrophobicContact CD1-CG2 3.8Å; Y192-I243 HydrophobicContact CD2-CG2 4.07Å; Y192-I243 HydrophobicContact CE1-CG1 3.98Å; Y192-I243 HydrophobicContact CE1-CG2 4.47Å; Y192-I243 HydrophobicContact CG-CG1 4.42Å; Y192-I243 HydrophobicContact CG-CG2 3.6Å; Y192-F246 HydrophobicContact CE2-CB 3.8Å; Y192-F246 HydrophobicContact CE2-CD1 4.27Å; Y192-F246 HydrophobicContact CE2-CG 4.25Å; Y192-F246 AromaticContact CZ-CG 3.96Å; Y192-F246 WeakPolarHBondContact OH-CD1 3.49Å; Y192-F246 WeakPolarHBondContact OH-CG 3.07Å; Y192-I247 HydrophobicContact CD2-CD1 3.82Å; Y192-I247 HydrophobicContact CD2-CG1 3.73Å; Y192-I247 HydrophobicContact CE2-CG1 4.13Å; Y192-I247 HydrophobicContact CG-CD1 4.43Å |
| 193 | L | 87.8 | Confident | 86.1 | Confident | 110 Ų | 110 | 58.6 Ų | 58.6 | 58% | 0.576 | 29% | 0.285 | S | S | * | . | H | α-helix | trans | -61.2 | -40 | 171 | -73.8 | 173 | 0 | 0 | 0 | 111 | C189 F190 L196 K197 | C189-L193 WeakPolarHBondContact O-CB 3.43Å; C189-L193 WeakPolarHBondContact O-CG 3.45Å; C189-L193 PolarHBondContact O-N 3.11Å; F190-L193 PolarHBondContact O-N 2.96Å; L193-L196 PolarHBondContact O-N 3.17Å; L193-K197 PolarHBondContact O-N 3Å |
| 194 | K | 87.8 | Confident | 84.8 | Confident | 92 Ų | 92 | 62.6 Ų | 62.6 | 40% | 0.4 | 30% | 0.299 | S | S | . | . | H | α-helix | trans | -64.1 | -46 | 173.4 | -69.2 | -75 | -172.5 | 170.5 | 0 | 111.6 | F190 T191 Y192 L196 K197 V198 | F190-K194 HydrophobicContact CE1-CG 4.29Å; F190-K194 HydrophobicContact CZ-CG 4.23Å; F190-K194 WeakPolarHBondContact O-CG 3.48Å; F190-K194 PolarHBondContact O-N 3.07Å; F190-K194 VanDerWaalsContact O-N 3.07Å; T191-K194 WeakPolarHBondContact O-CB 3.47Å; T191-K194 PolarHBondContact O-N 2.95Å; Y192-K194 VanDerWaalsContact C-N 3.27Å; Y192-K194 PolarHBondContact O-N 2.96Å; K194-L196 VanDerWaalsContact C-N 3.33Å; K194-L196 PolarHBondContact O-N 3.28Å; K194-K197 PolarHBondContact O-N 2.81Å; K194-V198 WeakPolarHBondContact O-CG2 3.37Å; K194-V198 PolarHBondContact O-N 3.34Å |
| 195 | V | 84.8 | Confident | 83.5 | Confident | 11 Ų | 11 | 70 Ų | 70 | 7% | 0.067 | 33% | 0.327 | C | S | . | . | H | α-helix | trans | -56.5 | -46.5 | 174.2 | 168.8 | 0 | 0 | 0 | 0 | 111 | W105 V108 T191 Y192 V198 A199 I243 | W105-V195 HydrophobicContact CB-CG2 3.99Å; V108-V195 HydrophobicContact CB-CG1 4.34Å; V108-V195 HydrophobicContact CB-CG2 4.34Å; V108-V195 HydrophobicContact CG1-CG1 4.12Å; V108-V195 HydrophobicContact CG2-CG1 4.14Å; T191-V195 VanDerWaalsContact O-CG2 3.31Å; T191-V195 WeakPolarHBondContact O-CG2 3.11Å; T191-V195 PolarHBondContact O-N 3.47Å; Y192-V195 HydrophobicContact CD1-CB 4.45Å; Y192-V195 HydrophobicContact CD1-CG2 4.47Å; Y192-V195 PolarHBondContact O-N 2.77Å; V195-V198 PolarHBondContact O-N 2.72Å; V195-A199 WeakPolarHBondContact O-CB 3.16Å; V195-A199 PolarHBondContact O-N 3.33Å; V195-I243 HydrophobicContact CB-CD1 4.47Å; V195-I243 HydrophobicContact CG1-CD1 3.71Å |
| 196 | L | 80.4 | Confident | 82.1 | Confident | 32 Ų | 32 | 71.5 Ų | 71.5 | 17% | 0.168 | 34% | 0.337 | C | S | . | . | H | α-helix | trans | -64.8 | -42.7 | 179.3 | -75.7 | 173.8 | 0 | 0 | 0 | 112.1 | Y192 L193 K194 R200 I243 | Y192-L196 WeakPolarHBondContact O-CB 3.38Å; Y192-L196 WeakPolarHBondContact O-CG 3.28Å; Y192-L196 PolarHBondContact O-N 2.92Å; L193-L196 PolarHBondContact O-N 3.17Å; K194-L196 VanDerWaalsContact C-N 3.33Å; K194-L196 PolarHBondContact O-N 3.28Å; L196-R200 VanDerWaalsContact O-CB 3.27Å; L196-R200 WeakPolarHBondContact O-CB 3.39Å; L196-R200 WeakPolarHBondContact O-CG 3.49Å; L196-R200 PolarHBondContact O-N 3.07Å; L196-I243 HydrophobicContact CD1-CG2 4.49Å; L196-I243 HydrophobicContact CD2-CD1 3.55Å; L196-I243 HydrophobicContact CG-CD1 3.78Å |
| 197 | K | 84.6 | Confident | 80.5 | Confident | 159 Ų | 159 | 69.2 Ų | 69.2 | 69% | 0.691 | 33% | 0.326 | S | S | * | . | H | α-helix | trans | -59.7 | -49.5 | 176 | -86.5 | -174.2 | 174.7 | 173.2 | 0 | 111.1 | L193 K194 R200 F201 | L193-K197 PolarHBondContact O-N 3Å; K194-K197 PolarHBondContact O-N 2.81Å; K197-R200 PolarHBondContact O-N 3Å; K197-F201 WeakPolarHBondContact O-CB 3.42Å; K197-F201 PolarHBondContact O-N 3.24Å |
| 198 | V | 79.9 | Confident | 79.2 | Confident | 33 Ų | 33 | 71.7 Ų | 71.7 | 20% | 0.2 | 34% | 0.341 | C | S | . | . | H | α-helix | trans | -68.4 | -42.7 | -178.2 | 172.7 | 0 | 0 | 0 | 0 | 111.6 | V108 V109 K194 V195 R200 F201 H202 | V108-V198 HydrophobicContact CG1-CG1 4.38Å; V109-V198 HydrophobicContact CG1-CG2 4.47Å; V109-V198 HydrophobicContact CG2-CB 4.13Å; V109-V198 HydrophobicContact CG2-CG1 4.25Å; V109-V198 HydrophobicContact CG2-CG2 3.79Å; K194-V198 WeakPolarHBondContact O-CG2 3.37Å; K194-V198 PolarHBondContact O-N 3.34Å; V195-V198 PolarHBondContact O-N 2.72Å; V198-R200 VanDerWaalsContact C-N 3.34Å; V198-R200 PolarHBondContact O-N 3.36Å; V198-F201 PolarHBondContact O-N 3.12Å; V198-H202 VanDerWaalsContact CG1-CD2 3.4Å; V198-H202 WeakPolarHBondContact CG1-CD2 3.42Å; V198-H202 WeakPolarHBondContact CG1-NE2 3.4Å; V198-H202 PolarHBondContact O-CD2 3.36Å; V198-H202 PolarHBondContact O-N 2.84Å |
| 199 | A | 72.6 | Confident | 77.9 | Confident | 26 Ų | 26 | 75.8 Ų | 75.8 | 22% | 0.215 | 36% | 0.362 | C | S | . | . | H | α-helix | trans | -60.7 | -42.4 | 174.6 | 0 | 0 | 0 | 0 | 0 | 112 | V195 H202 C203 | V195-A199 WeakPolarHBondContact O-CB 3.16Å; V195-A199 PolarHBondContact O-N 3.33Å; A199-H202 PolarHBondContact O-N 3.47Å; A199-C203 WeakPolarHBondContact O-CB 3.4Å; A199-C203 PolarHBondContact O-N 3.11Å; A199-C203 PolarHBondContact O-SG 3.43Å |
| 200 | R | 74.9 | Confident | 76.7 | Confident | 120 Ų | 120 | 75.8 Ų | 75.8 | 45% | 0.453 | 36% | 0.361 | S | S | . | . | H | α-helix | trans | -65.2 | -38.9 | 175.4 | -75.1 | 178.7 | -173.8 | -174.1 | 2.2 | 111.9 | L196 K197 V198 C203 K204 | L196-R200 VanDerWaalsContact O-CB 3.27Å; L196-R200 WeakPolarHBondContact O-CB 3.39Å; L196-R200 WeakPolarHBondContact O-CG 3.49Å; L196-R200 PolarHBondContact O-N 3.07Å; K197-R200 PolarHBondContact O-N 3Å; V198-R200 VanDerWaalsContact C-N 3.34Å; V198-R200 PolarHBondContact O-N 3.36Å; R200-C203 PolarHBondContact O-N 3.24Å; R200-K204 WeakPolarHBondContact O-CG 3.18Å; R200-K204 PolarHBondContact O-N 2.94Å |
| 201 | F | 76.3 | Confident | 75.2 | Confident | 128 Ų | 128 | 72.5 Ų | 72.5 | 56% | 0.561 | 35% | 0.348 | S | S | * | . | H | α-helix | trans | -63.9 | -48.3 | 175.7 | -179.6 | -96.6 | 0 | 0 | 0 | 111.8 | K197 V198 C203 K204 R205 | K197-F201 WeakPolarHBondContact O-CB 3.42Å; K197-F201 PolarHBondContact O-N 3.24Å; V198-F201 PolarHBondContact O-N 3.12Å; F201-C203 VanDerWaalsContact C-N 3.35Å; F201-C203 PolarHBondContact O-N 3.48Å; F201-K204 PolarHBondContact O-N 3.04Å; F201-R205 PolarHBondContact O-N 3.47Å |
| 202 | H | 70.5 | Confident | 74 | Confident | 77 Ų | 77 | 78.1 Ų | 78.1 | 36% | 0.356 | 37% | 0.374 | S | S | . | . | H | α-helix | trans | -62.2 | -40.5 | 175.8 | -73.9 | -59.8 | 0 | 0 | 0 | 112.4 | V198 A199 R205 I206 | V198-H202 VanDerWaalsContact CG1-CD2 3.4Å; V198-H202 WeakPolarHBondContact CG1-CD2 3.42Å; V198-H202 WeakPolarHBondContact CG1-NE2 3.4Å; V198-H202 PolarHBondContact O-CD2 3.36Å; V198-H202 PolarHBondContact O-N 2.84Å; A199-H202 PolarHBondContact O-N 3.47Å; H202-R205 PolarHBondContact O-N 3.38Å; H202-I206 WeakPolarHBondContact O-CB 3.15Å; H202-I206 WeakPolarHBondContact O-CD1 3.26Å; H202-I206 WeakPolarHBondContact O-CG1 3.34Å; H202-I206 PolarHBondContact O-N 2.91Å |
| 203 | C | 68.2 | Low | 72.9 | Confident | 35 Ų | 35 | 81.3 Ų | 81.3 | 24% | 0.236 | 39% | 0.394 | C | S | . | . | H | α-helix | trans | -59.9 | -52.9 | 173.6 | -66.6 | 0 | 0 | 0 | 0 | 110.3 | A199 R200 F201 R205 I206 D207 | A199-C203 WeakPolarHBondContact O-CB 3.4Å; A199-C203 PolarHBondContact O-N 3.11Å; A199-C203 PolarHBondContact O-SG 3.43Å; R200-C203 PolarHBondContact O-N 3.24Å; F201-C203 VanDerWaalsContact C-N 3.35Å; F201-C203 PolarHBondContact O-N 3.48Å; C203-R205 VanDerWaalsContact C-N 3.28Å; C203-R205 PolarHBondContact O-N 3.49Å; C203-I206 CarbonylContact O-C 3.19Å; C203-I206 PolarHBondContact O-N 3.4Å; C203-I206 VanDerWaalsContact O-N 3.09Å; C203-D207 WeakPolarHBondContact O-CB 3.43Å; C203-D207 PolarHBondContact O-N 3.38Å |
| 204 | K | 69.9 | Low | 71.7 | Confident | 145 Ų | 145 | 77.4 Ų | 77.4 | 63% | 0.63 | 37% | 0.373 | S | S | * | . | H | α-helix | trans | -54.9 | -41.7 | 177.9 | -77.2 | -172.8 | 175.6 | -167.3 | 0 | 113.1 | R200 F201 D207 V208 | R200-K204 WeakPolarHBondContact O-CG 3.18Å; R200-K204 PolarHBondContact O-N 2.94Å; F201-K204 PolarHBondContact O-N 3.04Å; K204-D207 WeakPolarHBondContact O-CB 3.14Å; K204-D207 PolarHBondContact O-N 2.81Å; K204-V208 WeakPolarHBondContact O-CG2 3.37Å; K204-V208 PolarHBondContact O-N 3.47Å |
| 205 | R | 71.3 | Confident | 70.6 | Confident | 156 Ų | 156 | 78.4 Ų | 78.4 | 59% | 0.589 | 39% | 0.387 | S | S | * | . | H | α-helix | trans | -68 | -41.1 | 178.9 | -169 | 179.4 | 177 | -173.6 | -0.6 | 111.9 | F201 H202 C203 D207 V208 I209 | F201-R205 PolarHBondContact O-N 3.47Å; H202-R205 PolarHBondContact O-N 3.38Å; C203-R205 VanDerWaalsContact C-N 3.28Å; C203-R205 PolarHBondContact O-N 3.49Å; R205-D207 VanDerWaalsContact C-N 3.33Å; R205-V208 PolarHBondContact O-N 3.25Å; R205-I209 HydrophobicContact CG-CD1 4.24Å; R205-I209 WeakPolarHBondContact O-CG1 3.17Å; R205-I209 PolarHBondContact O-N 2.86Å |
| 206 | I | 65.6 | Low | 69.5 | Low | 90 Ų | 90 | 84.8 Ų | 84.8 | 46% | 0.462 | 42% | 0.42 | S | S | . | . | H | α-helix | trans | -63.5 | -42.5 | 172.6 | -67 | 165.4 | 0 | 0 | 0 | 109.7 | H202 C203 V208 I209 T210 | H202-I206 WeakPolarHBondContact O-CB 3.15Å; H202-I206 WeakPolarHBondContact O-CD1 3.26Å; H202-I206 WeakPolarHBondContact O-CG1 3.34Å; H202-I206 PolarHBondContact O-N 2.91Å; C203-I206 CarbonylContact O-C 3.19Å; C203-I206 PolarHBondContact O-N 3.4Å; C203-I206 VanDerWaalsContact O-N 3.09Å; I206-V208 VanDerWaalsContact C-N 3.34Å; I206-V208 PolarHBondContact O-N 3.29Å; I206-I209 PolarHBondContact O-N 2.92Å; I206-T210 HydrophobicContact CG2-CG2 3.94Å; I206-T210 WeakPolarHBondContact O-CB 3.46Å; I206-T210 VanDerWaalsContact O-CG2 3.31Å; I206-T210 WeakPolarHBondContact O-CG2 3.29Å; I206-T210 PolarHBondContact O-N 3.33Å; I206-T210 PolarHBondContact O-OG1 3.39Å |
| 207 | D | 63.6 | Low | 68.6 | Low | 48 Ų | 48 | 88.1 Ų | 88.1 | 26% | 0.257 | 44% | 0.437 | S | S | . | . | H | α-helix | trans | -58.3 | -45.6 | 176.9 | -57.5 | -10.9 | 0 | 0 | 0 | 110.5 | C203 K204 R205 T210 M211 Q232 | C203-D207 WeakPolarHBondContact O-CB 3.43Å; C203-D207 PolarHBondContact O-N 3.38Å; K204-D207 WeakPolarHBondContact O-CB 3.14Å; K204-D207 PolarHBondContact O-N 2.81Å; R205-D207 VanDerWaalsContact C-N 3.33Å; D207-T210 WeakPolarHBondContact CA-OG1 3.21Å; D207-T210 PolarHBondContact O-OG1 2.97Å; D207-M211 WeakPolarHBondContact O-CB 3.4Å; D207-M211 WeakPolarHBondContact O-CG 3.31Å; D207-M211 PolarHBondContact O-N 3.48Å; D207-Q232 WeakPolarHBondContact OD1-CG 3.43Å; D207-Q232 PolarHBondContact OD1-NE2 2.91Å; D207-Q232 PolarHBondContact OD1-OE1 3.46Å |
| 208 | V | 68.4 | Low | 67.2 | Low | 84 Ų | 84 | 86.6 Ų | 86.6 | 51% | 0.509 | 44% | 0.441 | S | S | . | . | H | α-helix | trans | -62.6 | -46.5 | 175.8 | 171.6 | 0 | 0 | 0 | 0 | 112.1 | K204 R205 I206 M211 Q212 | K204-V208 WeakPolarHBondContact O-CG2 3.37Å; K204-V208 PolarHBondContact O-N 3.47Å; R205-V208 PolarHBondContact O-N 3.25Å; I206-V208 VanDerWaalsContact C-N 3.34Å; I206-V208 PolarHBondContact O-N 3.29Å; V208-M211 PolarHBondContact O-N 3.42Å; V208-Q212 WeakPolarHBondContact O-CB 3.19Å; V208-Q212 PolarHBondContact O-N 2.76Å |
| 209 | I | 66.9 | Low | 66.1 | Low | 87 Ų | 87 | 92.5 Ų | 92.5 | 45% | 0.446 | 47% | 0.471 | S | S | . | . | H | α-helix | trans | -65.8 | -48 | 179.9 | -66.3 | 166.7 | 0 | 0 | 0 | 110.6 | R205 I206 M211 Q212 T213 | R205-I209 HydrophobicContact CG-CD1 4.24Å; R205-I209 WeakPolarHBondContact O-CG1 3.17Å; R205-I209 PolarHBondContact O-N 2.86Å; I206-I209 PolarHBondContact O-N 2.92Å; I209-M211 VanDerWaalsContact C-N 3.32Å; I209-M211 PolarHBondContact O-N 2.81Å; I209-Q212 PolarHBondContact O-N 3.26Å; I209-T213 WeakPolarHBondContact O-CB 2.91Å; I209-T213 PolarHBondContact O-N 2.91Å; I209-T213 PolarHBondContact O-OG1 3.39Å |
| 210 | T | 65.9 | Low | 65.5 | Low | 35 Ų | 35 | 94.1 Ų | 94.1 | 22% | 0.215 | 48% | 0.476 | C | S | . | . | H | α-helix | trans | -60.9 | -40.3 | 176.9 | 53.5 | 0 | 0 | 0 | 0 | 111.7 | I206 D207 T213 L214 Q232 | I206-T210 HydrophobicContact CG2-CG2 3.94Å; I206-T210 WeakPolarHBondContact O-CB 3.46Å; I206-T210 VanDerWaalsContact O-CG2 3.31Å; I206-T210 WeakPolarHBondContact O-CG2 3.29Å; I206-T210 PolarHBondContact O-N 3.33Å; I206-T210 PolarHBondContact O-OG1 3.39Å; D207-T210 WeakPolarHBondContact CA-OG1 3.21Å; D207-T210 PolarHBondContact O-OG1 2.97Å; T210-T213 PolarHBondContact O-N 3.46Å; T210-L214 VanDerWaalsContact O-CB 3.24Å; T210-L214 WeakPolarHBondContact O-CB 3.42Å; T210-L214 WeakPolarHBondContact O-CD1 3.39Å; T210-L214 PolarHBondContact O-N 3.06Å; T210-Q232 PolarHBondContact OG1-NE2 3.37Å; T210-Q232 VanDerWaalsContact OG1-NE2 3.13Å |
| 211 | M | 63.2 | Low | 64.9 | Low | 43 Ų | 43 | 94.5 Ų | 94.5 | 21% | 0.212 | 48% | 0.482 | C | S | . | . | H | α-helix | trans | -66.1 | -42.6 | 174.2 | -73.6 | -72.9 | 130.7 | 0 | 0 | 111.7 | D207 V208 I209 L214 V215 R225 L229 | D207-M211 WeakPolarHBondContact O-CB 3.4Å; D207-M211 WeakPolarHBondContact O-CG 3.31Å; D207-M211 PolarHBondContact O-N 3.48Å; V208-M211 PolarHBondContact O-N 3.42Å; I209-M211 VanDerWaalsContact C-N 3.32Å; I209-M211 PolarHBondContact O-N 2.81Å; M211-L214 HydrophobicContact CE-CD1 4.38Å; M211-L214 PolarHBondContact O-N 3.16Å; M211-V215 WeakPolarHBondContact O-CB 3.3Å; M211-V215 WeakPolarHBondContact O-CG2 3.46Å; M211-V215 PolarHBondContact O-N 2.97Å; M211-R225 HydrophobicContact CE-CG 4.25Å; M211-L229 HydrophobicContact CE-CD1 4.2Å; M211-L229 HydrophobicContact CE-CD2 3.74Å; M211-L229 HydrophobicContact CE-CG 3.87Å |
| 212 | Q | 65.7 | Low | 64.6 | Low | 122 Ų | 122 | 93 Ų | 93 | 57% | 0.57 | 49% | 0.485 | S | S | * | . | H | α-helix | trans | -62.4 | -43.2 | 174.3 | -86.2 | 178.9 | -36.8 | 0 | 0 | 112 | V208 I209 V215 L216 | V208-Q212 WeakPolarHBondContact O-CB 3.19Å; V208-Q212 PolarHBondContact O-N 2.76Å; I209-Q212 PolarHBondContact O-N 3.26Å; Q212-V215 PolarHBondContact O-N 3.48Å; Q212-L216 WeakPolarHBondContact O-CB 3.32Å; Q212-L216 PolarHBondContact O-N 2.87Å |
| 213 | T | 62.6 | Low | 64.6 | Low | 74 Ų | 74 | 91.2 Ų | 91.2 | 45% | 0.454 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -65.3 | -39.7 | 175.2 | -57.3 | 0 | 0 | 0 | 0 | 111.7 | I209 T210 L216 L217 | I209-T213 WeakPolarHBondContact O-CB 2.91Å; I209-T213 PolarHBondContact O-N 2.91Å; I209-T213 PolarHBondContact O-OG1 3.39Å; T210-T213 PolarHBondContact O-N 3.46Å; T213-L216 PolarHBondContact O-N 2.92Å; T213-L217 HydrophobicContact CG2-CD1 3.79Å; T213-L217 WeakPolarHBondContact O-CB 3.27Å; T213-L217 WeakPolarHBondContact O-CD1 3.35Å; T213-L217 PolarHBondContact O-N 2.88Å |
| 214 | L | 63.8 | Low | 64.6 | Low | 29 Ų | 29 | 92.6 Ų | 92.6 | 15% | 0.152 | 49% | 0.489 | C | S | . | . | H | α-helix | trans | -66.7 | -32.8 | 174.6 | -103.1 | 137.5 | 0 | 0 | 0 | 113.1 | T210 M211 L217 I220 R225 | T210-L214 VanDerWaalsContact O-CB 3.24Å; T210-L214 WeakPolarHBondContact O-CB 3.42Å; T210-L214 WeakPolarHBondContact O-CD1 3.39Å; T210-L214 PolarHBondContact O-N 3.06Å; M211-L214 HydrophobicContact CE-CD1 4.38Å; M211-L214 PolarHBondContact O-N 3.16Å; L214-L217 VanDerWaalsContact O-O 3.04Å; L214-I220 HydrophobicContact CD2-CB 3.84Å; L214-I220 HydrophobicContact CD2-CD1 3.72Å; L214-I220 HydrophobicContact CD2-CG1 4.37Å; L214-I220 HydrophobicContact CD2-CG2 3.63Å; L214-I220 HydrophobicContact CG-CD1 3.85Å; L214-R225 HydrophobicContact CD2-CB 3.94Å; L214-R225 HydrophobicContact CD2-CG 4.26Å |
| 215 | V | 63.3 | Low | 64.4 | Low | 113 Ų | 113 | 92.3 Ų | 92.3 | 69% | 0.685 | 48% | 0.484 | S | S | * | . | H | α-helix | trans | -78.5 | -34.4 | 177.1 | 169.3 | 0 | 0 | 0 | 0 | 111.4 | M211 Q212 | M211-V215 WeakPolarHBondContact O-CB 3.3Å; M211-V215 WeakPolarHBondContact O-CG2 3.46Å; M211-V215 PolarHBondContact O-N 2.97Å; Q212-V215 PolarHBondContact O-N 3.48Å |
| 216 | L | 61.8 | Low | 64.5 | Low | 145 Ų | 145 | 91.2 Ų | 91.2 | 76% | 0.759 | 49% | 0.486 | S | S | * | . | H | α-helix | trans | -72.3 | -28.6 | 173 | -90.2 | 155.5 | 0 | 0 | 0 | 113 | Q212 T213 V218 | Q212-L216 WeakPolarHBondContact O-CB 3.32Å; Q212-L216 PolarHBondContact O-N 2.87Å; T213-L216 PolarHBondContact O-N 2.92Å; L216-V218 PolarHBondContact O-N 3.26Å |
| 217 | L | 61.5 | Low | 65 | Low | 101 Ų | 101 | 94.4 Ų | 94.4 | 53% | 0.529 | 49% | 0.492 | S | S | . | . | S | Bend | trans | -89.6 | 79.8 | 170.3 | -79.2 | 152 | 0 | 0 | 0 | 109.2 | T213 L214 D219 I220 | T213-L217 HydrophobicContact CG2-CD1 3.79Å; T213-L217 WeakPolarHBondContact O-CB 3.27Å; T213-L217 WeakPolarHBondContact O-CD1 3.35Å; T213-L217 PolarHBondContact O-N 2.88Å; L214-L217 VanDerWaalsContact O-O 3.04Å; L217-D219 PolarHBondContact O-N 3.05Å; L217-I220 HydrophobicContact CB-CD1 3.77Å; L217-I220 HydrophobicContact CB-CG1 4.09Å; L217-I220 HydrophobicContact CD1-CD1 4.28Å; L217-I220 PolarHBondContact O-N 3.05Å |
| 218 | V | 56 | Low | 65.3 | Low | 127 Ų | 127 | 93.9 Ų | 93.9 | 77% | 0.77 | 49% | 0.491 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -53.8 | -12.2 | -172.3 | 171.3 | 0 | 0 | 0 | 0 | 115.4 | L216 | L216-V218 PolarHBondContact O-N 3.26Š|
| 219 | D | 56.8 | Low | 65.4 | Low | 157 Ų | 157 | 93.6 Ų | 93.6 | 84% | 0.84 | 49% | 0.487 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -112.2 | 22.4 | -173.6 | -73.7 | -52 | 0 | 0 | 0 | 116.4 | L217 H221 | L217-D219 PolarHBondContact O-N 3.05Å; D219-H221 PolarHBondContact O-N 2.64Å |
| 220 | I | 59.9 | Low | 65.9 | Low | 60 Ų | 60 | 94.1 Ų | 94.1 | 31% | 0.308 | 49% | 0.487 | S | S | . | . | trans | -83.5 | 107.2 | 179 | -60.9 | 177.9 | 0 | 0 | 0 | 111.1 | L214 L217 V224 | L214-I220 HydrophobicContact CD2-CB 3.84Å; L214-I220 HydrophobicContact CD2-CD1 3.72Å; L214-I220 HydrophobicContact CD2-CG1 4.37Å; L214-I220 HydrophobicContact CD2-CG2 3.63Å; L214-I220 HydrophobicContact CG-CD1 3.85Å; L217-I220 HydrophobicContact CB-CD1 3.77Å; L217-I220 HydrophobicContact CB-CG1 4.09Å; L217-I220 HydrophobicContact CD1-CD1 4.28Å; L217-I220 PolarHBondContact O-N 3.05Å; I220-V224 HydrophobicContact CG2-CB 3.4Å; I220-V224 VanDerWaalsContact CG2-CB 3.4Å; I220-V224 HydrophobicContact CG2-CG1 3.54Å; I220-V224 HydrophobicContact CG2-CG2 4.2Å | ||
| 221 | H | 62.8 | Low | 66.3 | Low | 128 Ų | 128 | 97.4 Ų | 97.4 | 59% | 0.593 | 50% | 0.5 | S | S | * | . | trans | -43.8 | 134.3 | 173.5 | -164.7 | -99.6 | 0 | 0 | 0 | 111.7 | D219 S223 V224 | D219-H221 PolarHBondContact O-N 2.64Å; H221-S223 PolarHBondContact ND1-OG 3.44Å; H221-S223 PolarHBondContact O-N 3.32Å; H221-V224 PolarHBondContact O-N 3.43Å | ||
| 222 | P | 68.3 | Low | 66.5 | Low | 96 Ų | 96 | 96.4 Ų | 96.4 | 62% | 0.623 | 50% | 0.495 | S | S | * | . | H | α-helix | trans | -51.2 | -30.6 | -172.3 | 14.9 | -29.4 | 0 | 0 | 0 | 114.3 | V224 R225 E226 | P222-V224 VanDerWaalsContact C-N 3.28Å; P222-V224 PolarHBondContact O-N 3.39Å; P222-R225 PolarHBondContact O-N 3.01Å; P222-E226 PolarHBondContact O-N 2.85Å; P222-E226 VanDerWaalsContact O-N 3.16Å |
| 223 | S | 70.6 | Confident | 66.8 | Low | 40 Ų | 40 | 95.7 Ų | 95.7 | 28% | 0.28 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -59.4 | -25.5 | 174.2 | 68.9 | 0 | 0 | 0 | 0 | 116.1 | H221 R227 | H221-S223 PolarHBondContact ND1-OG 3.44Å; H221-S223 PolarHBondContact O-N 3.32Å; S223-R227 WeakPolarHBondContact O-CG 3.45Å; S223-R227 PolarHBondContact O-N 2.86Å; S223-R227 PolarHBondContact O-NE 2.87Å; S223-R227 VanDerWaalsContact O-NE 3.12Å |
| 224 | V | 69.8 | Low | 67.4 | Low | 64 Ų | 64 | 99 Ų | 99 | 39% | 0.388 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -86.8 | -36.9 | -178.6 | 175.8 | 0 | 0 | 0 | 0 | 109.9 | I220 H221 P222 R227 C228 | I220-V224 HydrophobicContact CG2-CB 3.4Å; I220-V224 VanDerWaalsContact CG2-CB 3.4Å; I220-V224 HydrophobicContact CG2-CG1 3.54Å; I220-V224 HydrophobicContact CG2-CG2 4.2Å; H221-V224 PolarHBondContact O-N 3.43Å; P222-V224 VanDerWaalsContact C-N 3.28Å; P222-V224 PolarHBondContact O-N 3.39Å; V224-R227 PolarHBondContact O-N 2.87Å; V224-C228 PolarHBondContact O-N 2.9Å |
| 225 | R | 65.8 | Low | 67.7 | Low | 139 Ų | 139 | 104.7 Ų | 104.7 | 53% | 0.525 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -59.6 | -46.1 | 171.2 | -175.5 | -177.6 | 178.8 | -166.3 | -0.1 | 111.3 | M211 L214 P222 C228 L229 | M211-R225 HydrophobicContact CE-CG 4.25Å; L214-R225 HydrophobicContact CD2-CB 3.94Å; L214-R225 HydrophobicContact CD2-CG 4.26Å; P222-R225 PolarHBondContact O-N 3.01Å; R225-C228 PolarHBondContact O-N 3.44Å; R225-L229 HydrophobicContact CG-CD1 4.27Å; R225-L229 PolarHBondContact O-N 2.93Å; R225-L229 VanDerWaalsContact O-N 3.1Å |
| 226 | E | 73.1 | Confident | 67.9 | Low | 134 Ų | 134 | 105.1 Ų | 105.1 | 63% | 0.626 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -63.8 | -43.1 | 178.3 | -167.7 | 174.6 | -170.4 | 0 | 0 | 112 | P222 C228 L229 E230 | P222-E226 PolarHBondContact O-N 2.85Å; P222-E226 VanDerWaalsContact O-N 3.16Å; E226-C228 VanDerWaalsContact C-N 3.33Å; E226-C228 PolarHBondContact O-N 3.07Å; E226-L229 PolarHBondContact O-N 3.4Å; E226-E230 WeakPolarHBondContact O-CB 3.4Å; E226-E230 PolarHBondContact O-N 3.42Å |
| 227 | R | 75.1 | Confident | 68.4 | Low | 156 Ų | 156 | 103.9 Ų | 103.9 | 59% | 0.589 | 49% | 0.493 | S | S | * | . | H | α-helix | trans | -59.2 | -40.8 | 173.7 | -82.9 | -175.6 | -79.3 | -164.2 | -1.5 | 112.9 | S223 V224 E231 | S223-R227 WeakPolarHBondContact O-CG 3.45Å; S223-R227 PolarHBondContact O-N 2.86Å; S223-R227 PolarHBondContact O-NE 2.87Å; S223-R227 VanDerWaalsContact O-NE 3.12Å; V224-R227 PolarHBondContact O-N 2.87Å; R227-E231 WeakPolarHBondContact O-CB 3.32Å; R227-E231 WeakPolarHBondContact O-CG 3.39Å; R227-E231 PolarHBondContact O-N 3.36Å |
| 228 | C | 69.4 | Low | 69.1 | Low | 37 Ų | 37 | 105.7 Ų | 105.7 | 25% | 0.25 | 49% | 0.493 | C | S | . | . | H | α-helix | trans | -66.1 | -44.5 | 178.7 | -158.7 | 0 | 0 | 0 | 0 | 112 | V224 R225 E226 E231 Q232 | V224-C228 PolarHBondContact O-N 2.9Å; R225-C228 PolarHBondContact O-N 3.44Å; E226-C228 VanDerWaalsContact C-N 3.33Å; E226-C228 PolarHBondContact O-N 3.07Å; C228-E231 PolarHBondContact O-N 3.32Å; C228-Q232 WeakPolarHBondContact O-CG 3.12Å; C228-Q232 PolarHBondContact O-N 3.35Å |
| 229 | L | 70.7 | Confident | 69.8 | Low | 78 Ų | 78 | 101.6 Ų | 101.6 | 41% | 0.408 | 47% | 0.473 | S | S | . | . | H | α-helix | trans | -63.6 | -43.4 | 176.1 | -74.9 | 165.8 | 0 | 0 | 0 | 112.3 | M211 R225 E226 Q232 K233 | M211-L229 HydrophobicContact CE-CD1 4.2Å; M211-L229 HydrophobicContact CE-CD2 3.74Å; M211-L229 HydrophobicContact CE-CG 3.87Å; R225-L229 HydrophobicContact CG-CD1 4.27Å; R225-L229 PolarHBondContact O-N 2.93Å; R225-L229 VanDerWaalsContact O-N 3.1Å; E226-L229 PolarHBondContact O-N 3.4Å; L229-Q232 PolarHBondContact O-N 3.49Å; L229-K233 WeakPolarHBondContact O-CB 3.26Å; L229-K233 PolarHBondContact O-N 3.46Å |
| 230 | E | 77.4 | Confident | 70.6 | Confident | 99 Ų | 99 | 96.2 Ų | 96.2 | 46% | 0.463 | 45% | 0.445 | S | S | . | . | H | α-helix | trans | -64.4 | -39.8 | 175.4 | -88.3 | -67.1 | 138.5 | 0 | 0 | 111.6 | E226 Q232 K233 R234 | E226-E230 WeakPolarHBondContact O-CB 3.4Å; E226-E230 PolarHBondContact O-N 3.42Å; E230-Q232 PolarHBondContact O-N 3.12Å; E230-K233 PolarHBondContact O-N 2.87Å; E230-K233 IonicContact OE1-NZ 3.35Å; E230-K233 PolarHBondContact OE1-NZ 3.11Å; E230-R234 VanDerWaalsContact O-CB 3.23Å; E230-R234 WeakPolarHBondContact O-CB 3.42Å; E230-R234 PolarHBondContact O-N 3.44Å |
| 231 | E | 74.4 | Confident | 71.5 | Confident | 103 Ų | 103 | 100.8 Ų | 100.8 | 48% | 0.481 | 46% | 0.463 | S | S | . | . | H | α-helix | trans | -61.2 | -42.6 | 171.9 | -83.6 | -162.4 | -169.9 | 0 | 0 | 112.9 | R227 C228 R234 R235 | R227-E231 WeakPolarHBondContact O-CB 3.32Å; R227-E231 WeakPolarHBondContact O-CG 3.39Å; R227-E231 PolarHBondContact O-N 3.36Å; C228-E231 PolarHBondContact O-N 3.32Å; E231-R234 PolarHBondContact O-N 3.33Å; E231-R235 WeakPolarHBondContact O-CB 3.45Å; E231-R235 VanDerWaalsContact O-CG 3.22Å; E231-R235 WeakPolarHBondContact O-CG 3.48Å; E231-R235 PolarHBondContact O-N 3.04Å; E231-R235 IonicContact OE2-CZ 2.86Å; E231-R235 IonicContact OE2-NE 3.92Å; E231-R235 IonicContact OE2-NH2 3.62Å; E231-R235 PolarHBondContact OE2-NH2 2.9Å |
| 232 | Q | 67.9 | Low | 72.2 | Confident | 23 Ų | 23 | 99.1 Ų | 99.1 | 11% | 0.107 | 45% | 0.454 | C | S | . | . | H | α-helix | trans | -62.5 | -48.1 | 176.8 | -78.2 | 166.7 | -33 | 0 | 0 | 111.6 | D207 T210 C228 L229 E230 R234 R235 R236 | D207-Q232 WeakPolarHBondContact OD1-CG 3.43Å; D207-Q232 PolarHBondContact OD1-NE2 2.91Å; D207-Q232 PolarHBondContact OD1-OE1 3.46Å; T210-Q232 PolarHBondContact OG1-NE2 3.37Å; T210-Q232 VanDerWaalsContact OG1-NE2 3.13Å; C228-Q232 WeakPolarHBondContact O-CG 3.12Å; C228-Q232 PolarHBondContact O-N 3.35Å; L229-Q232 PolarHBondContact O-N 3.49Å; E230-Q232 PolarHBondContact O-N 3.12Å; Q232-R234 VanDerWaalsContact C-N 3.3Å; Q232-R234 PolarHBondContact O-N 3Å; Q232-R235 PolarHBondContact O-N 2.95Å; Q232-R236 PolarHBondContact O-N 3.35Å |
| 233 | K | 71.3 | Confident | 72.7 | Confident | 107 Ų | 107 | 95.2 Ų | 95.2 | 47% | 0.465 | 43% | 0.428 | S | S | . | . | H | α-helix | trans | -56.9 | -44.8 | 174.3 | -177.3 | -179.7 | 170.3 | -167.3 | 0 | 111.1 | L229 E230 R235 R236 Q237 | L229-K233 WeakPolarHBondContact O-CB 3.26Å; L229-K233 PolarHBondContact O-N 3.46Å; E230-K233 PolarHBondContact O-N 2.87Å; E230-K233 IonicContact OE1-NZ 3.35Å; E230-K233 PolarHBondContact OE1-NZ 3.11Å; K233-R235 PolarHBondContact O-N 2.99Å; K233-R236 PolarHBondContact O-N 3.33Å; K233-Q237 WeakPolarHBondContact O-CB 3.34Å; K233-Q237 WeakPolarHBondContact O-CG 3.46Å; K233-Q237 PolarHBondContact O-N 3.24Å |
| 234 | R | 76.3 | Confident | 73.2 | Confident | 144 Ų | 144 | 96.7 Ų | 96.7 | 54% | 0.543 | 44% | 0.438 | S | S | . | . | H | α-helix | trans | -63.6 | -41.1 | 177 | -164.6 | 178.1 | -173.1 | -146.4 | 4.7 | 112.1 | E230 E231 Q232 Q237 R238 | E230-R234 VanDerWaalsContact O-CB 3.23Å; E230-R234 WeakPolarHBondContact O-CB 3.42Å; E230-R234 PolarHBondContact O-N 3.44Å; E231-R234 PolarHBondContact O-N 3.33Å; Q232-R234 VanDerWaalsContact C-N 3.3Å; Q232-R234 PolarHBondContact O-N 3Å; R234-Q237 PolarHBondContact O-N 3.47Å; R234-R238 WeakPolarHBondContact O-CB 3.26Å; R234-R238 WeakPolarHBondContact O-CD 3.39Å; R234-R238 WeakPolarHBondContact O-CG 3.38Å; R234-R238 PolarHBondContact O-N 2.84Å |
| 235 | R | 69.4 | Low | 74 | Confident | 147 Ų | 147 | 96.6 Ų | 96.6 | 56% | 0.555 | 44% | 0.438 | S | S | * | . | H | α-helix | trans | -62.5 | -45.1 | 174.8 | -71.2 | 169.7 | -164.1 | -156.2 | 7.3 | 111.2 | E231 Q232 K233 R238 A239 | E231-R235 WeakPolarHBondContact O-CB 3.45Å; E231-R235 VanDerWaalsContact O-CG 3.22Å; E231-R235 WeakPolarHBondContact O-CG 3.48Å; E231-R235 PolarHBondContact O-N 3.04Å; E231-R235 IonicContact OE2-CZ 2.86Å; E231-R235 IonicContact OE2-NE 3.92Å; E231-R235 IonicContact OE2-NH2 3.62Å; E231-R235 PolarHBondContact OE2-NH2 2.9Å; Q232-R235 PolarHBondContact O-N 2.95Å; K233-R235 PolarHBondContact O-N 2.99Å; R235-R238 PolarHBondContact O-N 3.44Å; R235-A239 PolarHBondContact O-N 3.41Å; R235-A239 VanDerWaalsContact O-N 3.12Å |
| 236 | R | 68.6 | Low | 74.9 | Confident | 122 Ų | 122 | 90.1 Ų | 90.1 | 46% | 0.46 | 41% | 0.413 | S | S | . | . | H | α-helix | trans | -64.1 | -42.4 | 176.9 | -176.5 | 176.7 | 172.5 | -171.4 | -4.3 | 112.6 | Q232 K233 A239 T240 | Q232-R236 PolarHBondContact O-N 3.35Å; K233-R236 PolarHBondContact O-N 3.33Å; R236-A239 PolarHBondContact O-N 2.88Å; R236-T240 PolarHBondContact O-N 3.23Å; R236-T240 PolarHBondContact O-OG1 2.91Å |
| 237 | Q | 72.1 | Confident | 75.8 | Confident | 119 Ų | 119 | 85.4 Ų | 85.4 | 56% | 0.556 | 39% | 0.392 | S | S | * | . | H | α-helix | trans | -63.8 | -42.1 | 175.7 | -77.5 | 178.4 | -11.4 | 0 | 0 | 111.7 | K233 R234 A239 T240 K241 | K233-Q237 WeakPolarHBondContact O-CB 3.34Å; K233-Q237 WeakPolarHBondContact O-CG 3.46Å; K233-Q237 PolarHBondContact O-N 3.24Å; R234-Q237 PolarHBondContact O-N 3.47Å; Q237-A239 PolarHBondContact O-N 2.92Å; Q237-T240 PolarHBondContact O-N 3.32Å; Q237-K241 VanDerWaalsContact O-CB 3.24Å; Q237-K241 WeakPolarHBondContact O-CB 3.31Å; Q237-K241 PolarHBondContact O-N 3.37Å |
| 238 | R | 76 | Confident | 76.6 | Confident | 139 Ų | 139 | 79.4 Ų | 79.4 | 53% | 0.525 | 38% | 0.379 | S | S | . | . | H | α-helix | trans | -60 | -44.9 | 176.2 | -74.9 | 166 | 176.5 | -172.4 | -3 | 112.3 | R234 R235 K242 | R234-R238 WeakPolarHBondContact O-CB 3.26Å; R234-R238 WeakPolarHBondContact O-CD 3.39Å; R234-R238 WeakPolarHBondContact O-CG 3.38Å; R234-R238 PolarHBondContact O-N 2.84Å; R235-R238 PolarHBondContact O-N 3.44Å; R238-K242 PolarHBondContact O-N 2.75Å; R238-K242 VanDerWaalsContact O-N 3.13Å |
| 239 | A | 69.9 | Low | 77.7 | Confident | 41 Ų | 41 | 79 Ų | 79 | 34% | 0.339 | 38% | 0.375 | S | S | . | . | H | α-helix | trans | -62.8 | -46.9 | 177.4 | 0 | 0 | 0 | 0 | 0 | 111.5 | R235 R236 Q237 K242 I243 | R235-A239 PolarHBondContact O-N 3.41Å; R235-A239 VanDerWaalsContact O-N 3.12Å; R236-A239 PolarHBondContact O-N 2.88Å; Q237-A239 PolarHBondContact O-N 2.92Å; A239-K242 PolarHBondContact O-N 2.96Å; A239-I243 WeakPolarHBondContact O-CG1 3.05Å; A239-I243 PolarHBondContact O-N 2.96Å |
| 240 | T | 73.8 | Confident | 78.9 | Confident | 44 Ų | 44 | 75.4 Ų | 75.4 | 27% | 0.27 | 36% | 0.356 | S | S | . | . | H | α-helix | trans | -63.9 | -46.3 | 178.8 | -51.2 | 0 | 0 | 0 | 0 | 111.5 | R236 Q237 K242 I243 S244 | R236-T240 PolarHBondContact O-N 3.23Å; R236-T240 PolarHBondContact O-OG1 2.91Å; Q237-T240 PolarHBondContact O-N 3.32Å; T240-K242 VanDerWaalsContact C-N 3.32Å; T240-K242 PolarHBondContact O-N 3.08Å; T240-I243 PolarHBondContact O-N 2.91Å; T240-I243 VanDerWaalsContact O-N 3.11Å; T240-S244 PolarHBondContact O-N 3.14Å; T240-S244 PolarHBondContact O-OG 3.43Å |
| 241 | K | 79 | Confident | 79.8 | Confident | 156 Ų | 156 | 73.3 Ų | 73.3 | 68% | 0.678 | 35% | 0.348 | S | S | * | . | H | α-helix | trans | -56.1 | -46 | 178.4 | -176.3 | 172.5 | -177.4 | 171.6 | 0 | 111.5 | Q237 I243 S244 T245 | Q237-K241 VanDerWaalsContact O-CB 3.24Å; Q237-K241 WeakPolarHBondContact O-CB 3.31Å; Q237-K241 PolarHBondContact O-N 3.37Å; K241-I243 VanDerWaalsContact C-N 3.3Å; K241-I243 PolarHBondContact O-N 3.24Å; K241-S244 PolarHBondContact O-N 3.4Å; K241-T245 PolarHBondContact O-N 2.87Å; K241-T245 PolarHBondContact O-OG1 2.92Å |
| 242 | K | 76.6 | Confident | 80.9 | Confident | 94 Ų | 94 | 72.7 Ų | 72.7 | 41% | 0.409 | 35% | 0.351 | S | S | . | . | H | α-helix | trans | -61.3 | -37.9 | 179 | -170.7 | 176.3 | -179.8 | 176.9 | 0 | 112.6 | R238 A239 T240 F246 | R238-K242 PolarHBondContact O-N 2.75Å; R238-K242 VanDerWaalsContact O-N 3.13Å; A239-K242 PolarHBondContact O-N 2.96Å; T240-K242 VanDerWaalsContact C-N 3.32Å; T240-K242 PolarHBondContact O-N 3.08Å; K242-F246 PolarHBondContact O-N 2.95Å |
| 243 | I | 78.6 | Confident | 82.2 | Confident | 14 Ų | 14 | 72 Ų | 72 | 7% | 0.072 | 35% | 0.349 | C | S | . | . | H | α-helix | trans | -71.2 | -47.5 | 178.4 | -69.2 | 168.8 | 0 | 0 | 0 | 110.9 | Y192 V195 L196 A239 T240 K241 T245 F246 I247 | Y192-I243 HydrophobicContact CD1-CB 4.28Å; Y192-I243 HydrophobicContact CD1-CD1 4.15Å; Y192-I243 HydrophobicContact CD1-CG1 3.72Å; Y192-I243 HydrophobicContact CD1-CG2 3.8Å; Y192-I243 HydrophobicContact CD2-CG2 4.07Å; Y192-I243 HydrophobicContact CE1-CG1 3.98Å; Y192-I243 HydrophobicContact CE1-CG2 4.47Å; Y192-I243 HydrophobicContact CG-CG1 4.42Å; Y192-I243 HydrophobicContact CG-CG2 3.6Å; V195-I243 HydrophobicContact CB-CD1 4.47Å; V195-I243 HydrophobicContact CG1-CD1 3.71Å; L196-I243 HydrophobicContact CD1-CG2 4.49Å; L196-I243 HydrophobicContact CD2-CD1 3.55Å; L196-I243 HydrophobicContact CG-CD1 3.78Å; A239-I243 WeakPolarHBondContact O-CG1 3.05Å; A239-I243 PolarHBondContact O-N 2.96Å; T240-I243 PolarHBondContact O-N 2.91Å; T240-I243 VanDerWaalsContact O-N 3.11Å; K241-I243 VanDerWaalsContact C-N 3.3Å; K241-I243 PolarHBondContact O-N 3.24Å; I243-T245 VanDerWaalsContact C-N 3.28Å; I243-T245 PolarHBondContact O-N 3.5Å; I243-F246 WeakPolarHBondContact O-CB 3.27Å; I243-F246 PolarHBondContact O-N 3.38Å; I243-I247 HydrophobicContact CG2-CD1 4.13Å; I243-I247 PolarHBondContact O-N 3.21Å; I243-I247 VanDerWaalsContact O-N 3.12Å |
| 244 | S | 81.9 | Confident | 83.5 | Confident | 71 Ų | 71 | 67.4 Ų | 67.4 | 50% | 0.497 | 33% | 0.329 | S | S | . | . | H | α-helix | trans | -59.5 | -39 | 176.7 | -62.2 | 0 | 0 | 0 | 0 | 111.8 | T240 K241 F246 G248 | T240-S244 PolarHBondContact O-N 3.14Å; T240-S244 PolarHBondContact O-OG 3.43Å; K241-S244 PolarHBondContact O-N 3.4Å; S244-F246 VanDerWaalsContact C-N 3.34Å; S244-F246 PolarHBondContact O-N 3.47Å; S244-G248 WeakPolarHBondContact O-CA 3.04Å; S244-G248 PolarHBondContact O-N 3.13Å |
| 245 | T | 86.3 | Confident | 84.5 | Confident | 61 Ų | 61 | 61.3 Ų | 61.3 | 37% | 0.374 | 31% | 0.309 | S | S | . | . | H | α-helix | trans | -62.1 | -40.6 | 174.1 | -59.1 | 0 | 0 | 0 | 0 | 112 | K241 I243 T249 V293 | K241-T245 PolarHBondContact O-N 2.87Å; K241-T245 PolarHBondContact O-OG1 2.92Å; I243-T245 VanDerWaalsContact C-N 3.28Å; I243-T245 PolarHBondContact O-N 3.5Å; T245-T249 HydrophobicContact CG2-CG2 4.24Å; T245-T249 WeakPolarHBondContact O-CB 3.42Å; T245-T249 VanDerWaalsContact O-CG2 3.27Å; T245-T249 WeakPolarHBondContact O-CG2 3.13Å; T245-T249 PolarHBondContact O-N 3.3Å; T245-T249 PolarHBondContact O-OG1 3.01Å; T245-V293 HydrophobicContact CG2-CG2 4.03Å |
| 246 | F | 85.6 | Confident | 85.9 | Confident | 3 Ų | 3 | 55.6 Ų | 55.6 | 1% | 0.013 | 29% | 0.291 | C | S | . | . | H | α-helix | trans | -63.8 | -47.8 | 179.4 | -116.4 | -91.3 | 0 | 0 | 0 | 112.7 | M97 Y192 K242 I243 S244 T249 F250 V293 | M97-F246 HydrophobicContact CE-CD1 3.45Å; M97-F246 VanDerWaalsContact CE-CD1 3.45Å; M97-F246 HydrophobicContact CE-CE1 3.54Å; M97-F246 HydrophobicContact SD-CE1 4.12Å; Y192-F246 HydrophobicContact CE2-CB 3.8Å; Y192-F246 HydrophobicContact CE2-CD1 4.27Å; Y192-F246 HydrophobicContact CE2-CG 4.25Å; Y192-F246 AromaticContact CZ-CG 3.96Å; Y192-F246 WeakPolarHBondContact OH-CD1 3.49Å; Y192-F246 WeakPolarHBondContact OH-CG 3.07Å; K242-F246 PolarHBondContact O-N 2.95Å; I243-F246 WeakPolarHBondContact O-CB 3.27Å; I243-F246 PolarHBondContact O-N 3.38Å; S244-F246 VanDerWaalsContact C-N 3.34Å; S244-F246 PolarHBondContact O-N 3.47Å; F246-T249 PolarHBondContact O-OG1 2.65Å; F246-F250 PolarHBondContact O-N 3.08Å; F246-V293 HydrophobicContact CB-CG1 4.43Å; F246-V293 HydrophobicContact CD1-CG1 4.16Å; F246-V293 HydrophobicContact CD2-CG1 3.19Å; F246-V293 HydrophobicContact CE1-CG1 4.27Å; F246-V293 HydrophobicContact CE2-CG1 3.32Å; F246-V293 HydrophobicContact CG-CG1 3.66Å; F246-V293 HydrophobicContact CZ-CG1 3.89Å |
| 247 | I | 90.6 | Very high | 87.3 | Confident | 36 Ų | 36 | 50.8 Ų | 50.8 | 19% | 0.185 | 27% | 0.273 | C | S | . | . | H | α-helix | trans | -70.8 | -44.7 | 179.5 | -60.8 | 169.9 | 0 | 0 | 0 | 110.5 | F185 L188 Y192 I243 T249 F250 L251 | F185-I247 HydrophobicContact CE2-CG2 4.02Å; L188-I247 HydrophobicContact CD2-CB 4.3Å; L188-I247 HydrophobicContact CD2-CG1 3.87Å; L188-I247 HydrophobicContact CG-CG1 4.01Å; Y192-I247 HydrophobicContact CD2-CD1 3.82Å; Y192-I247 HydrophobicContact CD2-CG1 3.73Å; Y192-I247 HydrophobicContact CE2-CG1 4.13Å; Y192-I247 HydrophobicContact CG-CD1 4.43Å; I243-I247 HydrophobicContact CG2-CD1 4.13Å; I243-I247 PolarHBondContact O-N 3.21Å; I243-I247 VanDerWaalsContact O-N 3.12Å; I247-T249 PolarHBondContact O-N 2.8Å; I247-F250 PolarHBondContact O-N 2.81Å; I247-L251 HydrophobicContact CG2-CD1 4.08Å; I247-L251 HydrophobicContact CG2-CG 4.46Å; I247-L251 PolarHBondContact O-N 3.04Å |
| 248 | G | 92.4 | Very high | 88.5 | Confident | 29 Ų | 29 | 45.4 Ų | 45.4 | 30% | 0.299 | 25% | 0.248 | S | C | . | . | H | α-helix | trans | -61.5 | -45.9 | -178.2 | 0 | 0 | 0 | 0 | 0 | 112.6 | S244 L251 V252 | S244-G248 WeakPolarHBondContact O-CA 3.04Å; S244-G248 PolarHBondContact O-N 3.13Å; G248-L251 PolarHBondContact O-N 3.05Å; G248-V252 WeakPolarHBondContact O-CB 3.25Å; G248-V252 VanDerWaalsContact O-CG2 3.29Å; G248-V252 WeakPolarHBondContact O-CG2 3.43Å; G248-V252 PolarHBondContact O-N 3.07Å |
| 249 | T | 93.9 | Very high | 89.5 | Confident | 30 Ų | 30 | 43.6 Ų | 43.6 | 18% | 0.184 | 25% | 0.248 | C | C | . | . | H | α-helix | trans | -65.3 | -39.1 | 177.1 | 51.7 | 0 | 0 | 0 | 0 | 112.4 | T245 F246 I247 L251 C253 V293 | T245-T249 HydrophobicContact CG2-CG2 4.24Å; T245-T249 WeakPolarHBondContact O-CB 3.42Å; T245-T249 VanDerWaalsContact O-CG2 3.27Å; T245-T249 WeakPolarHBondContact O-CG2 3.13Å; T245-T249 PolarHBondContact O-N 3.3Å; T245-T249 PolarHBondContact O-OG1 3.01Å; F246-T249 PolarHBondContact O-OG1 2.65Å; I247-T249 PolarHBondContact O-N 2.8Å; T249-L251 PolarHBondContact O-N 2.04Å; T249-C253 VanDerWaalsContact O-CB 3.25Å; T249-C253 WeakPolarHBondContact O-CB 3.38Å; T249-C253 PolarHBondContact O-N 3.17Å; T249-C253 VanDerWaalsContact O-N 3.07Å; T249-C253 PolarHBondContact O-SG 3.44Å; T249-C253 VanDerWaalsContact O-SG 3.33Å; T249-V293 HydrophobicContact CG2-CG2 4.09Å |
| 250 | F | 94.8 | Very high | 90.8 | Very high | 1 Ų | 1 | 41.9 Ų | 41.9 | 0% | 0.004 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -58.8 | -47.6 | 174.2 | 179.1 | -89.6 | 0 | 0 | 0 | 111.9 | M94 M97 F181 F185 L188 F246 I247 F254 | M94-F250 HydrophobicContact CB-CE2 4.15Å; M94-F250 HydrophobicContact CG-CE2 3.92Å; M94-F250 HydrophobicContact CG-CZ 4.26Å; M97-F250 HydrophobicContact CB-CD2 4.41Å; F181-F250 AromaticContact CD2-CE1 3.53Å; F181-F250 HydrophobicContact CD2-CE1 3.53Å; F181-F250 AromaticContact CD2-CZ 3.63Å; F181-F250 HydrophobicContact CD2-CZ 3.63Å; F181-F250 HydrophobicContact CE2-CD1 4.03Å; F181-F250 AromaticContact CE2-CE1 3.34Å; F181-F250 HydrophobicContact CE2-CE1 3.34Å; F181-F250 AromaticContact CE2-CZ 3.95Å; F181-F250 HydrophobicContact CE2-CZ 3.95Å; F181-F250 HydrophobicContact CG-CE1 4.45Å; F181-F250 HydrophobicContact CG-CZ 4.47Å; F181-F250 HydrophobicContact CZ-CE1 4.16Å; F185-F250 HydrophobicContact CB-CE1 3.97Å; F185-F250 HydrophobicContact CD2-CD1 4.4Å; F185-F250 HydrophobicContact CD2-CE1 4.42Å; L188-F250 HydrophobicContact CD2-CB 4.09Å; L188-F250 HydrophobicContact CD2-CD1 4.35Å; L188-F250 HydrophobicContact CD2-CG 4.13Å; F246-F250 PolarHBondContact O-N 3.08Å; I247-F250 PolarHBondContact O-N 2.81Å; F250-F254 AromaticContact CD2-CD2 3.72Å; F250-F254 HydrophobicContact CD2-CD2 3.72Å; F250-F254 AromaticContact CD2-CE2 3.93Å; F250-F254 HydrophobicContact CD2-CE2 3.93Å; F250-F254 AromaticContact CE2-CD2 3.72Å; F250-F254 HydrophobicContact CE2-CD2 3.72Å; F250-F254 AromaticContact CE2-CE2 3.95Å; F250-F254 HydrophobicContact CE2-CE2 3.95Å; F250-F254 HydrophobicContact CG-CD2 4.26Å; F250-F254 HydrophobicContact CZ-CD2 4.25Å; F250-F254 WeakPolarHBondContact O-CB 3.29Å; F250-F254 WeakPolarHBondContact O-CD2 3.4Å; F250-F254 PolarHBondContact O-N 3.08Å; F250-F254 VanDerWaalsContact O-N 3.08Å |
| 251 | L | 96.7 | Very high | 91.8 | Very high | 56 Ų | 56 | 39.9 Ų | 39.9 | 29% | 0.293 | 22% | 0.221 | S | C | . | . | H | α-helix | trans | -68.1 | -51 | -180 | -72.2 | 177.7 | 0 | 0 | 0 | 112.4 | F181 F185 I247 G248 T249 C253 F254 A255 P256 | F181-L251 HydrophobicContact CE2-CD2 4.43Å; F181-L251 HydrophobicContact CZ-CD2 3.89Å; F185-L251 HydrophobicContact CD2-CD2 3.73Å; F185-L251 HydrophobicContact CD2-CG 4.27Å; F185-L251 HydrophobicContact CE2-CD1 3.8Å; F185-L251 HydrophobicContact CE2-CD2 3.63Å; F185-L251 HydrophobicContact CE2-CG 3.92Å; F185-L251 HydrophobicContact CG-CD2 4.45Å; F185-L251 HydrophobicContact CZ-CD1 4.31Å; F185-L251 HydrophobicContact CZ-CD2 4.26Å; I247-L251 HydrophobicContact CG2-CD1 4.08Å; I247-L251 HydrophobicContact CG2-CG 4.46Å; I247-L251 PolarHBondContact O-N 3.04Å; G248-L251 PolarHBondContact O-N 3.05Å; T249-L251 PolarHBondContact O-N 2.04Å; L251-C253 PolarHBondContact O-N 3.38Å; L251-F254 PolarHBondContact O-N 3.33Å; L251-A255 WeakPolarHBondContact O-CA 3.25Å; L251-A255 WeakPolarHBondContact O-CB 3.26Å; L251-A255 PolarHBondContact O-N 3.19Å; L251-P256 WeakPolarHBondContact O-CD 3.48Å |
| 252 | V | 96.4 | Very high | 92.5 | Very high | 90 Ų | 90 | 35 Ų | 35 | 55% | 0.545 | 20% | 0.202 | S | C | . | . | H | α-helix | trans | -61.2 | -35.3 | -177.3 | 169.9 | 0 | 0 | 0 | 0 | 111.6 | G248 P256 | G248-V252 WeakPolarHBondContact O-CB 3.25Å; G248-V252 VanDerWaalsContact O-CG2 3.29Å; G248-V252 WeakPolarHBondContact O-CG2 3.43Å; G248-V252 PolarHBondContact O-N 3.07Å; V252-P256 WeakPolarHBondContact O-CD 3.33Å; V252-P256 WeakPolarHBondContact O-CG 3.49Å |
| 253 | C | 97.1 | Very high | 93.4 | Very high | 8 Ų | 8 | 33.5 Ų | 33.5 | 5% | 0.054 | 20% | 0.2 | C | C | . | . | H | α-helix | trans | -78.5 | -47.1 | 178.9 | -70.3 | 0 | 0 | 0 | 0 | 113.1 | T249 L251 L282 A283 K286 | T249-C253 VanDerWaalsContact O-CB 3.25Å; T249-C253 WeakPolarHBondContact O-CB 3.38Å; T249-C253 PolarHBondContact O-N 3.17Å; T249-C253 VanDerWaalsContact O-N 3.07Å; T249-C253 PolarHBondContact O-SG 3.44Å; T249-C253 VanDerWaalsContact O-SG 3.33Å; L251-C253 PolarHBondContact O-N 3.38Å; C253-L282 VanDerWaalsContact CA-O 3.26Å; C253-L282 WeakPolarHBondContact CA-O 3.35Å; C253-L282 VanDerWaalsContact CB-O 3.25Å; C253-L282 WeakPolarHBondContact CB-O 3.39Å; C253-L282 CarbonylContact O-C 3.54Å; C253-L282 VanDerWaalsContact O-C 3.27Å; C253-L282 PolarHBondContact SG-O 3.12Å; C253-L282 VanDerWaalsContact SG-O 3.38Å; C253-A283 WeakPolarHBondContact O-CA 3.42Å; C253-A283 PolarHBondContact O-N 2.77Å; C253-A283 VanDerWaalsContact O-N 3.07Å; C253-K286 HydrophobicContact CB-CB 3.88Å; C253-K286 HydrophobicContact CB-CD 3.97Å; C253-K286 HydrophobicContact CB-CG 4.46Å |
| 254 | F | 97.7 | Very high | 94.1 | Very high | 11 Ų | 11 | 35 Ų | 35 | 5% | 0.048 | 21% | 0.207 | C | C | . | . | H | α-helix | trans | -95.4 | -37.6 | -171.2 | -68.3 | -57.6 | 0 | 0 | 0 | 114.3 | M94 F181 F250 L251 Y257 V258 A283 K286 | M94-F254 HydrophobicContact CG-CD1 4.45Å; M94-F254 HydrophobicContact CG-CD2 3.89Å; M94-F254 HydrophobicContact CG-CE1 4.23Å; M94-F254 HydrophobicContact CG-CE2 3.59Å; M94-F254 HydrophobicContact CG-CG 4.3Å; M94-F254 HydrophobicContact CG-CZ 3.78Å; M94-F254 HydrophobicContact SD-CD1 4.43Å; M94-F254 HydrophobicContact SD-CD2 4.42Å; M94-F254 HydrophobicContact SD-CG 4.31Å; F181-F254 HydrophobicContact CD2-CB 3.7Å; F181-F254 HydrophobicContact CE2-CB 3.7Å; F250-F254 AromaticContact CD2-CD2 3.72Å; F250-F254 HydrophobicContact CD2-CD2 3.72Å; F250-F254 AromaticContact CD2-CE2 3.93Å; F250-F254 HydrophobicContact CD2-CE2 3.93Å; F250-F254 AromaticContact CE2-CD2 3.72Å; F250-F254 HydrophobicContact CE2-CD2 3.72Å; F250-F254 AromaticContact CE2-CE2 3.95Å; F250-F254 HydrophobicContact CE2-CE2 3.95Å; F250-F254 HydrophobicContact CG-CD2 4.26Å; F250-F254 HydrophobicContact CZ-CD2 4.25Å; F250-F254 WeakPolarHBondContact O-CB 3.29Å; F250-F254 WeakPolarHBondContact O-CD2 3.4Å; F250-F254 PolarHBondContact O-N 3.08Å; F250-F254 VanDerWaalsContact O-N 3.08Å; L251-F254 PolarHBondContact O-N 3.33Å; F254-Y257 PolarHBondContact O-N 2.88Å; F254-V258 VanDerWaalsContact O-CG2 3.31Å; F254-V258 WeakPolarHBondContact O-CG2 3.35Å; F254-V258 PolarHBondContact O-N 2.78Å; F254-A283 HydrophobicContact CD1-CB 4.47Å; F254-K286 HydrophobicContact CE1-CB 4.42Å; F254-K286 HydrophobicContact CE1-CG 4.4Å; F254-K286 HydrophobicContact CE2-CD 3.93Å; F254-K286 HydrophobicContact CE2-CG 3.75Å; F254-K286 HydrophobicContact CZ-CB 4.1Å; F254-K286 HydrophobicContact CZ-CD 4.32Å; F254-K286 HydrophobicContact CZ-CG 3.62Å |
| 255 | A | 97.9 | Very high | 94.5 | Very high | 16 Ų | 16 | 32.3 Ų | 32.3 | 13% | 0.132 | 19% | 0.187 | C | C | . | . | H | α-helix | trans | -60.3 | -43.1 | -171.7 | 0 | 0 | 0 | 0 | 0 | 113.2 | F181 L251 Y257 V258 I259 | F181-A255 HydrophobicContact CE2-CB 4.25Å; F181-A255 HydrophobicContact CZ-CB 3.76Å; L251-A255 WeakPolarHBondContact O-CA 3.25Å; L251-A255 WeakPolarHBondContact O-CB 3.26Å; L251-A255 PolarHBondContact O-N 3.19Å; A255-Y257 VanDerWaalsContact C-N 3.33Å; A255-Y257 PolarHBondContact O-N 3.3Å; A255-V258 PolarHBondContact O-N 2.88Å; A255-I259 HydrophobicContact CB-CD1 4.3Å; A255-I259 WeakPolarHBondContact O-CB 3.36Å; A255-I259 WeakPolarHBondContact O-CD1 3.42Å; A255-I259 WeakPolarHBondContact O-CG1 3.44Å; A255-I259 PolarHBondContact O-N 3.07Å |
| 256 | P | 98.2 | Very high | 94.6 | Very high | 26 Ų | 26 | 36.1 Ų | 36.1 | 17% | 0.169 | 20% | 0.199 | C | C | . | . | H | α-helix | trans | -58 | -43.9 | 178.6 | -26.9 | 37 | 0 | 0 | 0 | 112.7 | L251 V252 T260 W275 L282 | L251-P256 WeakPolarHBondContact O-CD 3.48Å; V252-P256 WeakPolarHBondContact O-CD 3.33Å; V252-P256 WeakPolarHBondContact O-CG 3.49Å; P256-T260 VanDerWaalsContact O-CB 3.29Å; P256-T260 WeakPolarHBondContact O-CB 3.44Å; P256-T260 PolarHBondContact O-N 3.28Å; P256-T260 PolarHBondContact O-OG1 2.6Å; P256-W275 HydrophobicContact CB-CZ2 4.45Å; P256-L282 HydrophobicContact CB-CD1 4.04Å; P256-L282 HydrophobicContact CG-CD1 3.89Å |
| 257 | Y | 97.7 | Very high | 94.7 | Very high | 21 Ų | 21 | 38.2 Ų | 38.2 | 8% | 0.082 | 21% | 0.214 | C | C | . | . | H | α-helix | trans | -67.1 | -46.7 | 177.8 | 177.7 | -107.7 | 0 | 0 | 0 | 111.8 | Y153 T157 F254 A255 I259 T260 R261 K280 A283 | Y153-Y257 HydrophobicContact CD1-CD2 4.18Å; Y153-Y257 AromaticContact CD1-CE2 3.81Å; Y153-Y257 HydrophobicContact CD1-CE2 3.81Å; Y153-Y257 HydrophobicContact CE1-CD2 4.05Å; Y153-Y257 AromaticContact CE1-CE2 3.84Å; Y153-Y257 HydrophobicContact CE1-CE2 3.84Å; Y153-Y257 HydrophobicContact CG-CE2 4.22Å; T157-Y257 PolarHBondContact OG1-OH 2.74Å; F254-Y257 PolarHBondContact O-N 2.88Å; A255-Y257 VanDerWaalsContact C-N 3.33Å; A255-Y257 PolarHBondContact O-N 3.3Å; Y257-I259 PolarHBondContact O-N 3.49Å; Y257-T260 PolarHBondContact O-N 3.49Å; Y257-R261 HydrophobicContact CD1-CG 4.44Å; Y257-R261 HydrophobicContact CD2-CG 4.39Å; Y257-R261 HydrophobicContact CE1-CG 4.07Å; Y257-R261 HydrophobicContact CE2-CG 4Å; Y257-R261 WeakPolarHBondContact O-CB 3.32Å; Y257-R261 WeakPolarHBondContact O-CG 3.49Å; Y257-R261 PolarHBondContact O-N 3.35Å; Y257-K280 HydrophobicContact CD2-CB 4.46Å; Y257-K280 HydrophobicContact CD2-CD 4.03Å; Y257-K280 HydrophobicContact CE2-CD 3.67Å; Y257-A283 HydrophobicContact CG-CB 4.49Å |
| 258 | V | 97.4 | Very high | 94.3 | Very high | 7 Ų | 7 | 43 Ų | 43 | 4% | 0.042 | 25% | 0.245 | C | C | . | . | H | α-helix | trans | -60.2 | -47.3 | 178.9 | 173.1 | 0 | 0 | 0 | 0 | 111.1 | H177 F181 F254 A255 T260 R261 L262 | H177-V258 HydrophobicContact CB-CG1 3.85Å; F181-V258 HydrophobicContact CB-CG2 4.17Å; F181-V258 HydrophobicContact CD1-CG1 4.16Å; F181-V258 HydrophobicContact CD1-CG2 4.48Å; F181-V258 HydrophobicContact CD2-CG2 4.19Å; F181-V258 HydrophobicContact CG-CG1 4.45Å; F181-V258 HydrophobicContact CG-CG2 4.02Å; F254-V258 VanDerWaalsContact O-CG2 3.31Å; F254-V258 WeakPolarHBondContact O-CG2 3.35Å; F254-V258 PolarHBondContact O-N 2.78Å; A255-V258 PolarHBondContact O-N 2.88Å; V258-T260 PolarHBondContact O-N 2.84Å; V258-R261 PolarHBondContact O-N 2.87Å; V258-L262 HydrophobicContact CG1-CD1 4.09Å; V258-L262 WeakPolarHBondContact O-CG 3.48Å; V258-L262 PolarHBondContact O-N 3.03Å |
| 259 | I | 96.8 | Very high | 94.1 | Very high | 100 Ų | 100 | 44.2 Ų | 44.2 | 51% | 0.513 | 25% | 0.252 | S | S | . | . | H | α-helix | trans | -62.2 | -46.1 | 178.1 | -67.7 | 165.5 | 0 | 0 | 0 | 109.9 | A255 Y257 R261 L262 V263 | A255-I259 HydrophobicContact CB-CD1 4.3Å; A255-I259 WeakPolarHBondContact O-CB 3.36Å; A255-I259 WeakPolarHBondContact O-CD1 3.42Å; A255-I259 WeakPolarHBondContact O-CG1 3.44Å; A255-I259 PolarHBondContact O-N 3.07Å; Y257-I259 PolarHBondContact O-N 3.49Å; I259-R261 VanDerWaalsContact C-N 3.29Å; I259-R261 PolarHBondContact O-N 3.25Å; I259-L262 PolarHBondContact O-N 3.36Å; I259-L262 VanDerWaalsContact O-N 3.16Å; I259-V263 HydrophobicContact CG2-CG2 4.15Å; I259-V263 WeakPolarHBondContact O-CB 3.45Å; I259-V263 VanDerWaalsContact O-CG2 3.3Å; I259-V263 WeakPolarHBondContact O-CG2 3.44Å; I259-V263 PolarHBondContact O-N 2.89Å |
| 260 | T | 96.4 | Very high | 93.8 | Very high | 6 Ų | 6 | 49.1 Ų | 49.1 | 4% | 0.037 | 28% | 0.284 | C | S | . | . | H | α-helix | trans | -60.3 | -40.1 | 179.1 | -55.4 | 0 | 0 | 0 | 0 | 111.4 | Y153 P256 Y257 V258 V263 E264 I271 W275 | Y153-T260 HydrophobicContact CE1-CG2 4.1Å; P256-T260 VanDerWaalsContact O-CB 3.29Å; P256-T260 WeakPolarHBondContact O-CB 3.44Å; P256-T260 PolarHBondContact O-N 3.28Å; P256-T260 PolarHBondContact O-OG1 2.6Å; Y257-T260 PolarHBondContact O-N 3.49Å; V258-T260 PolarHBondContact O-N 2.84Å; T260-V263 PolarHBondContact O-N 3.02Å; T260-E264 WeakPolarHBondContact O-CB 3.39Å; T260-E264 PolarHBondContact O-N 2.96Å; T260-I271 HydrophobicContact CG2-CD1 4.04Å; T260-I271 HydrophobicContact CG2-CG2 3.92Å; T260-W275 PolarHBondContact OG1-NE1 3.49Å |
| 261 | R | 95.5 | Very high | 93.7 | Very high | 1 Ų | 1 | 51.1 Ų | 51.1 | 0% | 0.004 | 30% | 0.295 | C | S | . | . | H | α-helix | trans | -65 | -40.1 | 175 | -75.1 | -68.2 | -68 | 176.6 | -12.6 | 113.2 | Y153 L158 Y257 V258 I259 E264 L265 | Y153-R261 VanDerWaalsContact CE2-CD 3.49Å; Y153-R261 VanDerWaalsContact CZ-CD 3.42Å; Y153-R261 WeakPolarHBondContact OH-CD 3.37Å; L158-R261 VanDerWaalsContact CB-NH2 3.33Å; L158-R261 PolarHBondContact O-NH1 3.07Å; L158-R261 PolarHBondContact O-NH2 3.33Å; Y257-R261 HydrophobicContact CD1-CG 4.44Å; Y257-R261 HydrophobicContact CD2-CG 4.39Å; Y257-R261 HydrophobicContact CE1-CG 4.07Å; Y257-R261 HydrophobicContact CE2-CG 4Å; Y257-R261 WeakPolarHBondContact O-CB 3.32Å; Y257-R261 WeakPolarHBondContact O-CG 3.49Å; Y257-R261 PolarHBondContact O-N 3.35Å; V258-R261 PolarHBondContact O-N 2.87Å; I259-R261 VanDerWaalsContact C-N 3.29Å; I259-R261 PolarHBondContact O-N 3.25Å; R261-E264 IonicContact CZ-OE2 3.88Å; R261-E264 IonicContact NE-OE2 2.84Å; R261-E264 IonicContact NH1-OE2 3.57Å; R261-E264 PolarHBondContact NH1-OE2 3.1Å; R261-L265 WeakPolarHBondContact O-CD1 3.34Å; R261-L265 VanDerWaalsContact O-CG 3.27Å; R261-L265 WeakPolarHBondContact O-CG 3.3Å; R261-L265 PolarHBondContact O-N 3.41Å |
| 262 | L | 95.1 | Very high | 93.5 | Very high | 54 Ų | 54 | 50.6 Ų | 50.6 | 28% | 0.283 | 30% | 0.303 | S | S | . | . | H | α-helix | trans | -69.2 | -43.3 | 176.5 | -66.2 | 172.2 | 0 | 0 | 0 | 111.1 | V258 I259 E264 L265 F266 | V258-L262 HydrophobicContact CG1-CD1 4.09Å; V258-L262 WeakPolarHBondContact O-CG 3.48Å; V258-L262 PolarHBondContact O-N 3.03Å; I259-L262 PolarHBondContact O-N 3.36Å; I259-L262 VanDerWaalsContact O-N 3.16Å; L262-E264 VanDerWaalsContact C-N 3.32Å; L262-E264 PolarHBondContact O-N 2.9Å; L262-L265 PolarHBondContact O-N 3.22Å; L262-L265 VanDerWaalsContact O-N 3.13Å; L262-F266 HydrophobicContact CD2-CE2 4.21Å; L262-F266 WeakPolarHBondContact O-CD2 3.33Å; L262-F266 PolarHBondContact O-N 2.81Å; L262-F266 VanDerWaalsContact O-N 3.13Å |
| 263 | V | 94.5 | Very high | 93.2 | Very high | 62 Ų | 62 | 49.4 Ų | 49.4 | 38% | 0.376 | 30% | 0.299 | S | S | . | . | H | α-helix | trans | -60.7 | -42.8 | 176.5 | 172.5 | 0 | 0 | 0 | 0 | 110.9 | I259 T260 L265 F266 S267 I271 | I259-V263 HydrophobicContact CG2-CG2 4.15Å; I259-V263 WeakPolarHBondContact O-CB 3.45Å; I259-V263 VanDerWaalsContact O-CG2 3.3Å; I259-V263 WeakPolarHBondContact O-CG2 3.44Å; I259-V263 PolarHBondContact O-N 2.89Å; T260-V263 PolarHBondContact O-N 3.02Å; V263-L265 PolarHBondContact O-N 3.35Å; V263-F266 PolarHBondContact O-N 2.85Å; V263-S267 WeakPolarHBondContact O-CA 3.45Å; V263-S267 WeakPolarHBondContact O-CB 3.33Å; V263-S267 PolarHBondContact O-N 3.31Å; V263-I271 HydrophobicContact CG1-CD1 4.18Å |
| 264 | E | 92.5 | Very high | 93 | Very high | 47 Ų | 47 | 52.3 Ų | 52.3 | 22% | 0.22 | 31% | 0.311 | C | S | . | . | H | α-helix | trans | -56.5 | -35.6 | 175.4 | 176.2 | 179.7 | -128.2 | 0 | 0 | 113 | H150 L152 Y153 T260 R261 L262 I271 | H150-E264 IonicContact CE1-OE1 3.9Å; H150-E264 PolarHBondContact CE1-OE1 3.4Å; H150-E264 IonicContact ND1-OE1 2.99Å; H150-E264 IonicContact NE2-OE1 3.96Å; H150-E264 PolarHBondContact NE2-OE1 3.28Å; H150-E264 VanDerWaalsContact NE2-OE1 3.11Å; L152-E264 WeakPolarHBondContact CD2-OE1 3.43Å; Y153-E264 PolarHBondContact OH-OE2 3.11Å; T260-E264 WeakPolarHBondContact O-CB 3.39Å; T260-E264 PolarHBondContact O-N 2.96Å; R261-E264 IonicContact CZ-OE2 3.88Å; R261-E264 IonicContact NE-OE2 2.84Å; R261-E264 IonicContact NH1-OE2 3.57Å; R261-E264 PolarHBondContact NH1-OE2 3.1Å; L262-E264 VanDerWaalsContact C-N 3.32Å; L262-E264 PolarHBondContact O-N 2.9Å; E264-I271 HydrophobicContact CB-CD1 3.8Å |
| 265 | L | 91.1 | Very high | 92.9 | Very high | 13 Ų | 13 | 57.6 Ų | 57.6 | 7% | 0.068 | 33% | 0.331 | C | S | . | . | H | α-helix | trans | -77.2 | -43.3 | -178.1 | -68.3 | 165.5 | 0 | 0 | 0 | 112.4 | R166 F169 A170 T173 R261 L262 V263 | R166-L265 PolarHBondContact NH2-O 3.39Å; F169-L265 HydrophobicContact CD1-CD2 3.63Å; F169-L265 HydrophobicContact CE1-CD2 3.79Å; A170-L265 HydrophobicContact CB-CB 4.22Å; A170-L265 HydrophobicContact CB-CD1 4.44Å; A170-L265 HydrophobicContact CB-CD2 4.08Å; A170-L265 HydrophobicContact CB-CG 4.48Å; T173-L265 HydrophobicContact CG2-CD1 3.67Å; R261-L265 WeakPolarHBondContact O-CD1 3.34Å; R261-L265 VanDerWaalsContact O-CG 3.27Å; R261-L265 WeakPolarHBondContact O-CG 3.3Å; R261-L265 PolarHBondContact O-N 3.41Å; L262-L265 PolarHBondContact O-N 3.22Å; L262-L265 VanDerWaalsContact O-N 3.13Å; V263-L265 PolarHBondContact O-N 3.35Å |
| 266 | F | 88.8 | Confident | 92.8 | Very high | 141 Ų | 141 | 56.9 Ų | 56.9 | 62% | 0.618 | 33% | 0.325 | S | S | * | . | H | α-helix | trans | -101.7 | -19.9 | -168.1 | -63.3 | -65.9 | 0 | 0 | 0 | 114.6 | A170 S174 L262 V263 | A170-F266 HydrophobicContact CB-CE1 4.47Å; S174-F266 WeakPolarHBondContact OG-CE2 3.47Å; S174-F266 WeakPolarHBondContact OG-CZ 3.29Å; L262-F266 HydrophobicContact CD2-CE2 4.21Å; L262-F266 WeakPolarHBondContact O-CD2 3.33Å; L262-F266 PolarHBondContact O-N 2.81Å; L262-F266 VanDerWaalsContact O-N 3.13Å; V263-F266 PolarHBondContact O-N 2.85Å |
| 267 | S | 87 | Confident | 92.7 | Very high | 47 Ų | 47 | 56.1 Ų | 56.1 | 33% | 0.329 | 32% | 0.32 | S | S | . | . | trans | -103.8 | 149.8 | 179.7 | -168.8 | 0 | 0 | 0 | 0 | 111.4 | V263 A269 | V263-S267 WeakPolarHBondContact O-CA 3.45Å; V263-S267 WeakPolarHBondContact O-CB 3.33Å; V263-S267 PolarHBondContact O-N 3.31Å; S267-A269 VanDerWaalsContact OG-CB 3.28Å; S267-A269 WeakPolarHBondContact OG-CB 3.44Å; S267-A269 PolarHBondContact OG-N 3.27Å; S267-A269 VanDerWaalsContact OG-N 3.07Å | ||
| 268 | T | 83.3 | Confident | 92.7 | Very high | 137 Ų | 137 | 57.9 Ų | 57.9 | 84% | 0.84 | 33% | 0.33 | S | S | * | . | trans | -91.8 | -4 | 166.9 | 52.5 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 269 | A | 87.1 | Confident | 92.7 | Very high | 54 Ų | 54 | 57.6 Ų | 57.6 | 45% | 0.446 | 33% | 0.328 | S | S | . | . | S | Bend | trans | -63.7 | 132.3 | -179.1 | 0 | 0 | 0 | 0 | 0 | 110.8 | S267 I271 | S267-A269 VanDerWaalsContact OG-CB 3.28Å; S267-A269 WeakPolarHBondContact OG-CB 3.44Å; S267-A269 PolarHBondContact OG-N 3.27Å; S267-A269 VanDerWaalsContact OG-N 3.07Å; A269-I271 PolarHBondContact O-N 2.98Å |
| 270 | P | 88.6 | Confident | 92.7 | Very high | 133 Ų | 133 | 53 Ų | 53 | 86% | 0.864 | 31% | 0.305 | S | S | * | . | P | Polyproline II helix | trans | -66.3 | 128 | 178.3 | 27.3 | -33.2 | 0 | 0 | 0 | 110.1 | ||
| 271 | I | 92.6 | Very high | 92.8 | Very high | 44 Ų | 44 | 52.8 Ų | 52.8 | 23% | 0.226 | 30% | 0.303 | C | S | . | . | P | Polyproline II helix | trans | -95.3 | 127.1 | 174 | -55.4 | 175.2 | 0 | 0 | 0 | 107.9 | L152 T260 V263 E264 A269 S273 | L152-I271 HydrophobicContact CD1-CB 4.07Å; L152-I271 HydrophobicContact CD1-CG2 3.92Å; L152-I271 HydrophobicContact CD2-CB 4.17Å; L152-I271 HydrophobicContact CD2-CD1 4.21Å; L152-I271 HydrophobicContact CD2-CG2 4.17Å; T260-I271 HydrophobicContact CG2-CD1 4.04Å; T260-I271 HydrophobicContact CG2-CG2 3.92Å; V263-I271 HydrophobicContact CG1-CD1 4.18Å; E264-I271 HydrophobicContact CB-CD1 3.8Å; A269-I271 PolarHBondContact O-N 2.98Å; I271-S273 PolarHBondContact O-N 2.87Å |
| 272 | G | 92.3 | Very high | 92.9 | Very high | 45 Ų | 45 | 54.9 Ų | 54.9 | 46% | 0.464 | 31% | 0.314 | S | S | . | . | P | Polyproline II helix | trans | -62 | 134.9 | 176.4 | 0 | 0 | 0 | 0 | 0 | 112 | H274 W275 G276 | G272-H274 VanDerWaalsContact C-N 3.3Å; G272-H274 PolarHBondContact O-N 2.97Å; G272-W275 WeakPolarHBondContact O-CB 3.42Å; G272-W275 PolarHBondContact O-N 3.15Å; G272-W275 VanDerWaalsContact O-N 3.08Å; G272-G276 PolarHBondContact O-N 3.45Å; G272-G276 VanDerWaalsContact O-N 3.11Å |
| 273 | S | 89.1 | Confident | 93 | Very high | 65 Ų | 65 | 52.9 Ų | 52.9 | 46% | 0.455 | 31% | 0.305 | S | S | . | . | H | α-helix | trans | -54.7 | -43.7 | 178.2 | 54.5 | 0 | 0 | 0 | 0 | 112.7 | I271 W275 G276 V277 | I271-S273 PolarHBondContact O-N 2.87Å; S273-W275 VanDerWaalsContact C-N 3.31Å; S273-W275 PolarHBondContact O-N 3.33Å; S273-G276 PolarHBondContact O-N 3.47Å; S273-V277 WeakPolarHBondContact O-CG2 3.37Å; S273-V277 PolarHBondContact O-N 2.96Å; S273-V277 VanDerWaalsContact O-N 3.09Å |
| 274 | H | 93.4 | Very high | 93.2 | Very high | 68 Ų | 68 | 50.3 Ų | 50.3 | 32% | 0.315 | 29% | 0.289 | S | S | . | . | H | α-helix | trans | -62.7 | -36.1 | 178.4 | -56 | -57.3 | 0 | 0 | 0 | 112.7 | D5 L8 G272 L278 | D5-H274 IonicContact OD1-CE1 2.71Å; D5-H274 IonicContact OD1-ND1 2.86Å; L8-H274 HydrophobicContact CD1-CB 4.47Å; G272-H274 VanDerWaalsContact C-N 3.3Å; G272-H274 PolarHBondContact O-N 2.97Å; H274-L278 WeakPolarHBondContact O-CB 3.47Å; H274-L278 PolarHBondContact O-N 2.87Å |
| 275 | W | 95.9 | Very high | 93.4 | Very high | 123 Ų | 123 | 49.3 Ų | 49.3 | 47% | 0.466 | 29% | 0.287 | S | S | . | . | H | α-helix | trans | -69 | -42.2 | 176 | 177.3 | -100.1 | 0 | 0 | 0 | 111.7 | P256 T260 G272 S273 V277 L278 S279 | P256-W275 HydrophobicContact CB-CZ2 4.45Å; T260-W275 PolarHBondContact OG1-NE1 3.49Å; G272-W275 WeakPolarHBondContact O-CB 3.42Å; G272-W275 PolarHBondContact O-N 3.15Å; G272-W275 VanDerWaalsContact O-N 3.08Å; S273-W275 VanDerWaalsContact C-N 3.31Å; S273-W275 PolarHBondContact O-N 3.33Å; W275-V277 PolarHBondContact O-N 2.86Å; W275-L278 HydrophobicContact CE3-CD2 4.15Å; W275-L278 HydrophobicContact CZ3-CD2 4.2Å; W275-L278 PolarHBondContact O-N 2.92Å; W275-S279 WeakPolarHBondContact O-CB 3.25Å; W275-S279 PolarHBondContact O-N 3.13Å; W275-S279 PolarHBondContact O-OG 3Å |
| 276 | G | 95.7 | Very high | 93.6 | Very high | 0 Ų | 0 | 48.8 Ų | 48.8 | 0% | 0 | 29% | 0.285 | C | S | . | . | H | α-helix | trans | -54.9 | -53.6 | 175 | 0 | 0 | 0 | 0 | 0 | 111.5 | L152 Y153 G272 S273 L278 S279 K280 | L152-G276 CarbonylContact O-C 3.57Å; L152-G276 WeakPolarHBondContact O-CA 3.35Å; Y153-G276 WeakPolarHBondContact CD1-O 3.43Å; G272-G276 PolarHBondContact O-N 3.45Å; G272-G276 VanDerWaalsContact O-N 3.11Å; S273-G276 PolarHBondContact O-N 3.47Å; G276-L278 PolarHBondContact O-N 3.06Å; G276-S279 PolarHBondContact O-N 3.12Å; G276-S279 PolarHBondContact O-OG 3.45Å; G276-K280 PolarHBondContact O-N 2.84Å; G276-K280 VanDerWaalsContact O-N 3.12Å |
| 277 | V | 96.1 | Very high | 94 | Very high | 11 Ų | 11 | 42.3 Ų | 42.3 | 7% | 0.067 | 26% | 0.257 | C | S | . | . | H | α-helix | trans | -61.8 | -44.3 | 176.9 | -179.3 | 0 | 0 | 0 | 0 | 111.8 | L8 V67 L152 A154 S273 W275 S279 K280 C281 | L8-V277 HydrophobicContact CB-CG1 4.26Å; L8-V277 HydrophobicContact CD1-CB 4.02Å; L8-V277 HydrophobicContact CD1-CG1 3.9Å; L8-V277 HydrophobicContact CD2-CG1 4.26Å; L8-V277 HydrophobicContact CG-CG1 4.37Å; V67-V277 HydrophobicContact CG2-CG1 3.73Å; L152-V277 PolarHBondContact O-N 3.1Å; A154-V277 HydrophobicContact CB-CG2 3.83Å; S273-V277 WeakPolarHBondContact O-CG2 3.37Å; S273-V277 PolarHBondContact O-N 2.96Å; S273-V277 VanDerWaalsContact O-N 3.09Å; W275-V277 PolarHBondContact O-N 2.86Å; V277-S279 PolarHBondContact O-N 2.88Å; V277-K280 WeakPolarHBondContact O-CB 3.44Å; V277-K280 PolarHBondContact O-N 3.42Å; V277-C281 PolarHBondContact O-N 2.92Å; V277-C281 PolarHBondContact O-SG 3.17Å |
| 278 | L | 97.5 | Very high | 94.4 | Very high | 58 Ų | 58 | 40.6 Ų | 40.6 | 30% | 0.304 | 25% | 0.245 | S | C | . | . | H | α-helix | trans | -59.9 | -45.6 | 178.1 | 179.1 | 61.9 | 0 | 0 | 0 | 112 | L8 L11 H274 W275 G276 K280 C281 L282 | L8-L278 HydrophobicContact CD2-CB 4.05Å; L8-L278 HydrophobicContact CD2-CD1 4.22Å; L11-L278 HydrophobicContact CD2-CD1 4.02Å; H274-L278 WeakPolarHBondContact O-CB 3.47Å; H274-L278 PolarHBondContact O-N 2.87Å; W275-L278 HydrophobicContact CE3-CD2 4.15Å; W275-L278 HydrophobicContact CZ3-CD2 4.2Å; W275-L278 PolarHBondContact O-N 2.92Å; G276-L278 PolarHBondContact O-N 3.06Å; L278-K280 VanDerWaalsContact C-N 3.26Å; L278-K280 PolarHBondContact O-N 2.78Å; L278-C281 WeakPolarHBondContact O-CB 3.4Å; L278-C281 PolarHBondContact O-N 3.49Å; L278-C281 VanDerWaalsContact O-N 3.12Å; L278-L282 WeakPolarHBondContact O-CG 3.43Å; L278-L282 PolarHBondContact O-N 3.32Å |
| 279 | S | 98 | Very high | 94.8 | Very high | 0 Ų | 0 | 35.3 Ų | 35.3 | 0% | 0 | 21% | 0.214 | C | C | . | . | H | α-helix | trans | -60.7 | -37.9 | 177.6 | 76.8 | 0 | 0 | 0 | 0 | 111.6 | W275 G276 V277 L282 A283 | W275-S279 WeakPolarHBondContact O-CB 3.25Å; W275-S279 PolarHBondContact O-N 3.13Å; W275-S279 PolarHBondContact O-OG 3Å; G276-S279 PolarHBondContact O-N 3.12Å; G276-S279 PolarHBondContact O-OG 3.45Å; V277-S279 PolarHBondContact O-N 2.88Å; S279-L282 PolarHBondContact O-N 3.17Å; S279-A283 PolarHBondContact O-N 3.35Å; S279-A283 VanDerWaalsContact O-N 3.17Å |
| 280 | K | 97.4 | Very high | 95 | Very high | 5 Ų | 5 | 32.8 Ų | 32.8 | 2% | 0.022 | 19% | 0.193 | C | C | . | . | H | α-helix | trans | -67.1 | -40.4 | 173.9 | -171.7 | 68.4 | -178.3 | 177.6 | 0 | 111.9 | D86 Y257 G276 V277 L278 L282 A283 Y284 | D86-K280 WeakPolarHBondContact OD1-CE 3.26Å; D86-K280 IonicContact OD1-NZ 3.19Å; D86-K280 PolarHBondContact OD1-NZ 3.36Å; D86-K280 IonicContact OD2-NZ 2.96Å; D86-K280 PolarHBondContact OD2-NZ 3.29Å; Y257-K280 HydrophobicContact CD2-CB 4.46Å; Y257-K280 HydrophobicContact CD2-CD 4.03Å; Y257-K280 HydrophobicContact CE2-CD 3.67Å; G276-K280 PolarHBondContact O-N 2.84Å; G276-K280 VanDerWaalsContact O-N 3.12Å; V277-K280 WeakPolarHBondContact O-CB 3.44Å; V277-K280 PolarHBondContact O-N 3.42Å; L278-K280 VanDerWaalsContact C-N 3.26Å; L278-K280 PolarHBondContact O-N 2.78Å; K280-L282 VanDerWaalsContact C-N 3.33Å; K280-L282 PolarHBondContact O-N 3.11Å; K280-A283 WeakPolarHBondContact O-CB 3.07Å; K280-A283 PolarHBondContact O-N 3.37Å; K280-Y284 HydrophobicContact CD-CE2 4.49Å; K280-Y284 WeakPolarHBondContact CE-OH 3.43Å; K280-Y284 HydrophobicContact CG-CD2 4.4Å; K280-Y284 HydrophobicContact CG-CE2 3.94Å; K280-Y284 PolarHBondContact O-N 3.26Å |
| 281 | C | 97.4 | Very high | 95.2 | Very high | 0 Ų | 0 | 26.4 Ų | 26.4 | 0% | 0 | 15% | 0.152 | C | C | . | . | H | α-helix | trans | -61.2 | -41.5 | 174.1 | -63.8 | 0 | 0 | 0 | 0 | 111.5 | L11 L12 V277 L278 A283 Y284 S285 | L11-C281 HydrophobicContact CD2-CB 3.83Å; L11-C281 HydrophobicContact CG-CB 4.44Å; L12-C281 HydrophobicContact CD2-CB 4.42Å; L12-C281 VanDerWaalsContact CD2-SG 3.58Å; V277-C281 PolarHBondContact O-N 2.92Å; V277-C281 PolarHBondContact O-SG 3.17Å; L278-C281 WeakPolarHBondContact O-CB 3.4Å; L278-C281 PolarHBondContact O-N 3.49Å; L278-C281 VanDerWaalsContact O-N 3.12Å; C281-A283 VanDerWaalsContact C-N 3.29Å; C281-A283 PolarHBondContact O-N 3.19Å; C281-Y284 PolarHBondContact O-N 2.92Å; C281-Y284 VanDerWaalsContact O-N 3.14Å; C281-S285 PolarHBondContact O-N 2.98Å; C281-S285 PolarHBondContact O-OG 3.07Å; C281-S285 VanDerWaalsContact O-OG 3.13Å |
| 282 | L | 97.9 | Very high | 95 | Very high | 45 Ų | 45 | 28.4 Ų | 28.4 | 24% | 0.236 | 16% | 0.159 | C | C | . | . | H | α-helix | trans | -60.4 | -39.2 | 174.8 | -69.4 | 174.1 | 0 | 0 | 0 | 112 | C253 P256 L278 S279 K280 S285 | C253-L282 VanDerWaalsContact CA-O 3.26Å; C253-L282 WeakPolarHBondContact CA-O 3.35Å; C253-L282 VanDerWaalsContact CB-O 3.25Å; C253-L282 WeakPolarHBondContact CB-O 3.39Å; C253-L282 CarbonylContact O-C 3.54Å; C253-L282 VanDerWaalsContact O-C 3.27Å; C253-L282 PolarHBondContact SG-O 3.12Å; C253-L282 VanDerWaalsContact SG-O 3.38Å; P256-L282 HydrophobicContact CB-CD1 4.04Å; P256-L282 HydrophobicContact CG-CD1 3.89Å; L278-L282 WeakPolarHBondContact O-CG 3.43Å; L278-L282 PolarHBondContact O-N 3.32Å; S279-L282 PolarHBondContact O-N 3.17Å; K280-L282 VanDerWaalsContact C-N 3.33Å; K280-L282 PolarHBondContact O-N 3.11Å; L282-S285 WeakPolarHBondContact O-CB 3.1Å; L282-S285 PolarHBondContact O-N 2.91Å |
| 283 | A | 97.9 | Very high | 94.6 | Very high | 12 Ų | 12 | 27 Ų | 27 | 10% | 0.099 | 14% | 0.142 | C | C | . | . | H | α-helix | trans | -63.5 | -41.8 | 174 | 0 | 0 | 0 | 0 | 0 | 111.6 | C253 F254 Y257 S279 K280 C281 S285 K286 | C253-A283 WeakPolarHBondContact O-CA 3.42Å; C253-A283 PolarHBondContact O-N 2.77Å; C253-A283 VanDerWaalsContact O-N 3.07Å; F254-A283 HydrophobicContact CD1-CB 4.47Å; Y257-A283 HydrophobicContact CG-CB 4.49Å; S279-A283 PolarHBondContact O-N 3.35Å; S279-A283 VanDerWaalsContact O-N 3.17Å; K280-A283 WeakPolarHBondContact O-CB 3.07Å; K280-A283 PolarHBondContact O-N 3.37Å; C281-A283 VanDerWaalsContact C-N 3.29Å; C281-A283 PolarHBondContact O-N 3.19Å; A283-S285 PolarHBondContact O-N 2.91Å; A283-K286 WeakPolarHBondContact O-CB 3.5Å; A283-K286 PolarHBondContact O-N 3.29Å; A283-K286 VanDerWaalsContact O-N 3.17Å |
| 284 | Y | 97.6 | Very high | 94.2 | Very high | 8 Ų | 8 | 24.1 Ų | 24.1 | 3% | 0.031 | 12% | 0.121 | C | C | . | . | H | α-helix | trans | -66.8 | -32.5 | 174.7 | -71.9 | -31 | 0 | 0 | 0 | 113.9 | L12 N59 M60 T63 D86 K280 C281 K286 A287 | L12-Y284 HydrophobicContact CD2-CD2 3.9Å; N59-Y284 HydrophobicContact CB-CE1 4.18Å; M60-Y284 HydrophobicContact CE-CD1 4.11Å; M60-Y284 HydrophobicContact CE-CG 4.08Å; M60-Y284 HydrophobicContact CG-CD1 4.05Å; M60-Y284 HydrophobicContact CG-CD2 3.92Å; M60-Y284 HydrophobicContact CG-CE1 4.4Å; M60-Y284 HydrophobicContact CG-CE2 4.25Å; M60-Y284 HydrophobicContact CG-CG 3.81Å; M60-Y284 HydrophobicContact SD-CG 4.38Å; T63-Y284 HydrophobicContact CG2-CE2 4.1Å; T63-Y284 WeakPolarHBondContact OG1-CE2 3.48Å; T63-Y284 PolarHBondContact OG1-OH 3.41Å; D86-Y284 PolarHBondContact OD1-OH 3.29Å; K280-Y284 HydrophobicContact CD-CE2 4.49Å; K280-Y284 WeakPolarHBondContact CE-OH 3.43Å; K280-Y284 HydrophobicContact CG-CD2 4.4Å; K280-Y284 HydrophobicContact CG-CE2 3.94Å; K280-Y284 PolarHBondContact O-N 3.26Å; C281-Y284 PolarHBondContact O-N 2.92Å; C281-Y284 VanDerWaalsContact O-N 3.14Å; Y284-K286 PolarHBondContact O-N 2.87Å; Y284-A287 WeakPolarHBondContact O-CB 3.5Å; Y284-A287 PolarHBondContact O-N 3.06Å |
| 285 | S | 96.8 | Very high | 93.6 | Very high | 27 Ų | 27 | 20.9 Ų | 20.9 | 19% | 0.189 | 11% | 0.106 | C | C | . | . | H | α-helix | trans | -58.4 | -16.6 | 172.4 | -64.3 | 0 | 0 | 0 | 0 | 113.1 | C281 L282 A283 A287 A288 S289 | C281-S285 PolarHBondContact O-N 2.98Å; C281-S285 PolarHBondContact O-OG 3.07Å; C281-S285 VanDerWaalsContact O-OG 3.13Å; L282-S285 WeakPolarHBondContact O-CB 3.1Å; L282-S285 PolarHBondContact O-N 2.91Å; A283-S285 PolarHBondContact O-N 2.91Å; S285-A287 VanDerWaalsContact C-N 3.33Å; S285-A287 PolarHBondContact O-N 3.29Å; S285-A288 PolarHBondContact O-N 2.85Å; S285-S289 WeakPolarHBondContact O-CB 3.35Å; S285-S289 PolarHBondContact O-N 3.23Å; S285-S289 PolarHBondContact O-OG 3.48Å |
| 286 | K | 95.3 | Very high | 92.6 | Very high | 2 Ų | 2 | 16.2 Ų | 16.2 | 1% | 0.009 | 9% | 0.09 | C | C | . | . | H | α-helix | trans | -58.9 | -45.2 | 170.3 | -169.2 | 64.2 | 165 | 59.7 | 0 | 111.9 | M97 C253 F254 A283 Y284 A288 S289 D290 | M97-K286 PolarHBondContact SD-NZ 3.01Å; C253-K286 HydrophobicContact CB-CB 3.88Å; C253-K286 HydrophobicContact CB-CD 3.97Å; C253-K286 HydrophobicContact CB-CG 4.46Å; F254-K286 HydrophobicContact CE1-CB 4.42Å; F254-K286 HydrophobicContact CE1-CG 4.4Å; F254-K286 HydrophobicContact CE2-CD 3.93Å; F254-K286 HydrophobicContact CE2-CG 3.75Å; F254-K286 HydrophobicContact CZ-CB 4.1Å; F254-K286 HydrophobicContact CZ-CD 4.32Å; F254-K286 HydrophobicContact CZ-CG 3.62Å; A283-K286 WeakPolarHBondContact O-CB 3.5Å; A283-K286 PolarHBondContact O-N 3.29Å; A283-K286 VanDerWaalsContact O-N 3.17Å; Y284-K286 PolarHBondContact O-N 2.87Å; K286-A288 PolarHBondContact O-N 2.77Å; K286-S289 WeakPolarHBondContact CA-OG 3.33Å; K286-S289 PolarHBondContact O-N 2.89Å; K286-S289 PolarHBondContact O-OG 2.74Å; K286-S289 VanDerWaalsContact O-OG 3.07Å; K286-D290 IonicContact NZ-OD1 3.8Å; K286-D290 PolarHBondContact NZ-OD1 2.86Å; K286-D290 IonicContact NZ-OD2 3.6Å; K286-D290 PolarHBondContact NZ-OD2 3.29Å; K286-D290 VanDerWaalsContact O-CB 3.29Å; K286-D290 WeakPolarHBondContact O-CB 3.48Å; K286-D290 VanDerWaalsContact O-CG 3.3Å; K286-D290 PolarHBondContact O-N 2.86Å |
| 287 | A | 96.5 | Very high | 91.6 | Very high | 4 Ų | 4 | 21.2 Ų | 21.2 | 3% | 0.033 | 12% | 0.116 | C | C | . | . | H | α-helix | trans | -61.9 | -35.9 | -179.1 | 0 | 0 | 0 | 0 | 0 | 111.8 | N23 N52 M60 Y284 S285 P291 | N23-A287 PolarHBondContact ND2-O 2.83Å; N52-A287 HydrophobicContact CB-CB 3.83Å; M60-A287 HydrophobicContact CE-CB 3.74Å; Y284-A287 WeakPolarHBondContact O-CB 3.5Å; Y284-A287 PolarHBondContact O-N 3.06Å; S285-A287 VanDerWaalsContact C-N 3.33Å; S285-A287 PolarHBondContact O-N 3.29Å; A287-P291 WeakPolarHBondContact O-CD 3.32Å |
| 288 | A | 95.2 | Very high | 90.6 | Very high | 11 Ų | 11 | 23 Ų | 23 | 9% | 0.091 | 12% | 0.122 | C | C | . | . | H | α-helix | trans | -74.3 | -40 | 176.3 | 0 | 0 | 0 | 0 | 0 | 113.3 | T15 V18 S285 K286 F292 | T15-A288 HydrophobicContact CG2-CB 4.17Å; V18-A288 HydrophobicContact CB-CB 4.28Å; V18-A288 HydrophobicContact CG1-CB 3.97Å; S285-A288 PolarHBondContact O-N 2.85Å; K286-A288 PolarHBondContact O-N 2.77Å; A288-F292 WeakPolarHBondContact O-CD2 3.32Å; A288-F292 WeakPolarHBondContact O-CE2 3.33Å |
| 289 | S | 92.9 | Very high | 89.4 | Confident | 27 Ų | 27 | 27.6 Ų | 27.6 | 19% | 0.189 | 14% | 0.141 | C | C | . | . | H | α-helix | trans | -75 | -29.5 | -176.5 | 55.2 | 0 | 0 | 0 | 0 | 113.4 | S285 K286 F292 V293 | S285-S289 WeakPolarHBondContact O-CB 3.35Å; S285-S289 PolarHBondContact O-N 3.23Å; S285-S289 PolarHBondContact O-OG 3.48Å; K286-S289 WeakPolarHBondContact CA-OG 3.33Å; K286-S289 PolarHBondContact O-N 2.89Å; K286-S289 PolarHBondContact O-OG 2.74Å; K286-S289 VanDerWaalsContact O-OG 3.07Å; S289-F292 WeakPolarHBondContact O-CB 3.33Å; S289-F292 PolarHBondContact O-N 2.9Å; S289-F292 VanDerWaalsContact O-N 3.12Å; S289-V293 WeakPolarHBondContact O-CG2 3.31Å; S289-V293 PolarHBondContact O-N 3.34Å |
| 290 | D | 91.3 | Very high | 88.3 | Confident | 0 Ų | 0 | 31.7 Ų | 31.7 | 0% | 0 | 16% | 0.16 | C | C | . | . | H | α-helix | trans | -54.9 | -53.3 | -171.9 | -99.5 | -13.9 | 0 | 0 | 0 | 115.5 | N52 K286 F292 V293 Y294 | N52-D290 PolarHBondContact ND2-OD2 3.5Å; K286-D290 IonicContact NZ-OD1 3.8Å; K286-D290 PolarHBondContact NZ-OD1 2.86Å; K286-D290 IonicContact NZ-OD2 3.6Å; K286-D290 PolarHBondContact NZ-OD2 3.29Å; K286-D290 VanDerWaalsContact O-CB 3.29Å; K286-D290 WeakPolarHBondContact O-CB 3.48Å; K286-D290 VanDerWaalsContact O-CG 3.3Å; K286-D290 PolarHBondContact O-N 2.86Å; D290-F292 PolarHBondContact O-N 3.39Å; D290-F292 VanDerWaalsContact O-N 3.13Å; D290-V293 PolarHBondContact O-N 3.45Å; D290-V293 VanDerWaalsContact O-N 3.1Å; D290-Y294 HydrophobicContact CB-CD1 4.23Å; D290-Y294 HydrophobicContact CB-CE1 3.32Å; D290-Y294 WeakPolarHBondContact O-CD1 3.35Å; D290-Y294 WeakPolarHBondContact O-CE1 3.36Å; D290-Y294 PolarHBondContact O-N 3.46Å; D290-Y294 VanDerWaalsContact O-N 3.11Å |
| 291 | P | 91.5 | Very high | 87.4 | Confident | 0 Ų | 0 | 31.9 Ų | 31.9 | 0% | 0 | 16% | 0.161 | C | C | . | . | H | α-helix | trans | -50.8 | -38.6 | 175.3 | -34.5 | 41.5 | 0 | 0 | 0 | 114.1 | N23 V26 A287 S295 L296 | N23-P291 HydrophobicContact CB-CG 4.3Å; N23-P291 VanDerWaalsContact CG-CG 3.45Å; N23-P291 VanDerWaalsContact OD1-CG 3.28Å; N23-P291 WeakPolarHBondContact OD1-CG 3.25Å; V26-P291 HydrophobicContact CG2-CB 3.75Å; V26-P291 HydrophobicContact CG2-CG 4.39Å; A287-P291 WeakPolarHBondContact O-CD 3.32Å; P291-S295 CarbonylContact O-C 3.54Å; P291-S295 WeakPolarHBondContact O-CA 3.2Å; P291-S295 WeakPolarHBondContact O-CB 3.32Å; P291-S295 PolarHBondContact O-N 2.89Å; P291-L296 HydrophobicContact CB-CD1 3.82Å; P291-L296 HydrophobicContact CB-CG 4.18Å; P291-L296 PolarHBondContact O-N 3.45Å |
| 292 | F | 88.8 | Confident | 86.7 | Confident | 86 Ų | 86 | 38 Ų | 38 | 38% | 0.377 | 18% | 0.184 | S | C | . | . | I | π-helix | trans | -71.1 | -45.3 | -179.7 | -58.7 | -81.8 | 0 | 0 | 0 | 111.1 | V18 A288 S289 D290 Y294 L296 L297 | V18-F292 HydrophobicContact CG1-CE2 3.95Å; V18-F292 HydrophobicContact CG1-CZ 4.29Å; A288-F292 WeakPolarHBondContact O-CD2 3.32Å; A288-F292 WeakPolarHBondContact O-CE2 3.33Å; S289-F292 WeakPolarHBondContact O-CB 3.33Å; S289-F292 PolarHBondContact O-N 2.9Å; S289-F292 VanDerWaalsContact O-N 3.12Å; D290-F292 PolarHBondContact O-N 3.39Å; D290-F292 VanDerWaalsContact O-N 3.13Å; F292-Y294 PolarHBondContact O-N 3.05Å; F292-L296 HydrophobicContact CD1-CD1 4.19Å; F292-L296 HydrophobicContact CE1-CD1 4.08Å; F292-L296 HydrophobicContact CZ-CD1 4.48Å; F292-L297 WeakPolarHBondContact O-CB 3.49Å; F292-L297 WeakPolarHBondContact O-CD1 3.38Å; F292-L297 WeakPolarHBondContact O-CG 3.21Å |
| 293 | V | 84.1 | Confident | 86 | Confident | 15 Ų | 15 | 43 Ų | 43 | 9% | 0.091 | 20% | 0.2 | C | C | . | . | I | π-helix | trans | -64.9 | -42.2 | -175.3 | 174.1 | 0 | 0 | 0 | 0 | 111.7 | T245 F246 T249 S289 D290 | T245-V293 HydrophobicContact CG2-CG2 4.03Å; F246-V293 HydrophobicContact CB-CG1 4.43Å; F246-V293 HydrophobicContact CD1-CG1 4.16Å; F246-V293 HydrophobicContact CD2-CG1 3.19Å; F246-V293 HydrophobicContact CE1-CG1 4.27Å; F246-V293 HydrophobicContact CE2-CG1 3.32Å; F246-V293 HydrophobicContact CG-CG1 3.66Å; F246-V293 HydrophobicContact CZ-CG1 3.89Å; T249-V293 HydrophobicContact CG2-CG2 4.09Å; S289-V293 WeakPolarHBondContact O-CG2 3.31Å; S289-V293 PolarHBondContact O-N 3.34Å; D290-V293 PolarHBondContact O-N 3.45Å; D290-V293 VanDerWaalsContact O-N 3.1Å |
| 294 | Y | 80.4 | Confident | 85.2 | Confident | 5 Ų | 5 | 42.7 Ų | 42.7 | 2% | 0.02 | 20% | 0.197 | C | C | . | . | I | π-helix | trans | -114.8 | -16.1 | -173.3 | 64 | -110.3 | 0 | 0 | 0 | 116.8 | T45 L48 L100 D290 F292 R298 | T45-Y294 HydrophobicContact CG2-CD2 4.01Å; T45-Y294 HydrophobicContact CG2-CE2 3.61Å; L48-Y294 HydrophobicContact CB-CE1 4.49Å; L48-Y294 WeakPolarHBondContact CB-OH 3.35Å; L48-Y294 HydrophobicContact CD1-CD1 4.41Å; L48-Y294 HydrophobicContact CD1-CE1 3.78Å; L100-Y294 HydrophobicContact CD1-CD1 4.3Å; L100-Y294 HydrophobicContact CD1-CG 4.42Å; D290-Y294 HydrophobicContact CB-CD1 4.23Å; D290-Y294 HydrophobicContact CB-CE1 3.32Å; D290-Y294 WeakPolarHBondContact O-CD1 3.35Å; D290-Y294 WeakPolarHBondContact O-CE1 3.36Å; D290-Y294 PolarHBondContact O-N 3.46Å; D290-Y294 VanDerWaalsContact O-N 3.11Å; F292-Y294 PolarHBondContact O-N 3.05Å; Y294-R298 VanDerWaalsContact O-CD 3.32Å; Y294-R298 WeakPolarHBondContact O-CD 3.36Å; Y294-R298 PolarHBondContact O-NE 2.96Å |
| 295 | S | 81.4 | Confident | 84.5 | Confident | 0 Ų | 0 | 43.5 Ų | 43.5 | 0% | 0 | 20% | 0.203 | C | C | . | . | I | π-helix | trans | -119.9 | -69.6 | -176.1 | -73.2 | 0 | 0 | 0 | 0 | 113.5 | T45 P291 L297 R298 Y301 | T45-S295 VanDerWaalsContact CG2-OG 3.25Å; T45-S295 WeakPolarHBondContact CG2-OG 3.46Å; P291-S295 CarbonylContact O-C 3.54Å; P291-S295 WeakPolarHBondContact O-CA 3.2Å; P291-S295 WeakPolarHBondContact O-CB 3.32Å; P291-S295 PolarHBondContact O-N 2.89Å; S295-L297 PolarHBondContact O-N 2.87Å; S295-L297 VanDerWaalsContact O-N 3.1Å; S295-R298 VanDerWaalsContact O-CB 3.25Å; S295-R298 WeakPolarHBondContact O-CB 3.39Å; S295-R298 PolarHBondContact O-N 2.85Å; S295-Y301 VanDerWaalsContact O-CB 3.31Å; S295-Y301 WeakPolarHBondContact O-CB 3.43Å; S295-Y301 WeakPolarHBondContact O-CD2 3.29Å |
| 296 | L | 75.9 | Confident | 83.9 | Confident | 25 Ų | 25 | 49 Ų | 49 | 13% | 0.131 | 22% | 0.224 | C | C | . | . | I | π-helix | trans | -65.3 | -20.4 | -165.8 | -61.5 | 176.7 | 0 | 0 | 0 | 113.8 | L25 V26 P291 F292 R298 R302 | L25-L296 HydrophobicContact CB-CD2 4.47Å; V26-L296 HydrophobicContact CG2-CD1 4.43Å; V26-L296 HydrophobicContact CG2-CD2 3.76Å; V26-L296 HydrophobicContact CG2-CG 3.86Å; P291-L296 HydrophobicContact CB-CD1 3.82Å; P291-L296 HydrophobicContact CB-CG 4.18Å; P291-L296 PolarHBondContact O-N 3.45Å; F292-L296 HydrophobicContact CD1-CD1 4.19Å; F292-L296 HydrophobicContact CE1-CD1 4.08Å; F292-L296 HydrophobicContact CZ-CD1 4.48Å; L296-R298 VanDerWaalsContact C-N 3.33Å; L296-R302 VanDerWaalsContact O-CG 3.23Å; L296-R302 WeakPolarHBondContact O-CG 3.3Å; L296-R302 PolarHBondContact O-NE 3.32Å |
| 297 | L | 72.7 | Confident | 83.4 | Confident | 105 Ų | 105 | 52.4 Ų | 52.4 | 55% | 0.55 | 24% | 0.24 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -84.6 | -4.3 | 173.1 | -63.2 | -179.9 | 0 | 0 | 0 | 113.6 | F292 S295 R302 | F292-L297 WeakPolarHBondContact O-CB 3.49Å; F292-L297 WeakPolarHBondContact O-CD1 3.38Å; F292-L297 WeakPolarHBondContact O-CG 3.21Å; S295-L297 PolarHBondContact O-N 2.87Å; S295-L297 VanDerWaalsContact O-N 3.1Å; L297-R302 VanDerWaalsContact CD2-NH2 3.28Å |
| 298 | R | 75.9 | Confident | 82.9 | Confident | 49 Ų | 49 | 53.3 Ų | 53.3 | 19% | 0.185 | 24% | 0.244 | C | C | . | . | S | Bend | trans | -86.4 | 143.1 | 176.6 | -61.5 | -174 | -177.9 | -105.4 | -13.4 | 111.9 | Y294 S295 L296 Q300 Y301 R302 | Y294-R298 VanDerWaalsContact O-CD 3.32Å; Y294-R298 WeakPolarHBondContact O-CD 3.36Å; Y294-R298 PolarHBondContact O-NE 2.96Å; S295-R298 VanDerWaalsContact O-CB 3.25Å; S295-R298 WeakPolarHBondContact O-CB 3.39Å; S295-R298 PolarHBondContact O-N 2.85Å; L296-R298 VanDerWaalsContact C-N 3.33Å; R298-Q300 VanDerWaalsContact C-N 3.3Å; R298-Q300 PolarHBondContact O-N 3.34Å; R298-Y301 HydrophobicContact CB-CD2 4.17Å; R298-Y301 PolarHBondContact O-N 3.2Å; R298-R302 WeakPolarHBondContact O-CG 3.5Å; R298-R302 PolarHBondContact O-N 3.47Å |
| 299 | H | 73.3 | Confident | 82.4 | Confident | 153 Ų | 153 | 56.8 Ų | 56.8 | 71% | 0.708 | 26% | 0.261 | S | S | * | . | H | α-helix | trans | -53.8 | -43.5 | 178.6 | -175.4 | -95.1 | 0 | 0 | 0 | 113.3 | Y301 R302 R303 | H299-Y301 PolarHBondContact O-N 2.77Å; H299-R302 PolarHBondContact O-N 3.03Å; H299-R303 WeakPolarHBondContact O-CB 3.42Å; H299-R303 PolarHBondContact O-N 2.95Å |
| 300 | Q | 74.3 | Confident | 82.1 | Confident | 86 Ų | 86 | 60.1 Ų | 60.1 | 40% | 0.402 | 28% | 0.276 | S | S | . | . | H | α-helix | trans | -63.4 | -43.3 | -178.7 | -65.1 | 174 | -2 | 0 | 0 | 112.8 | R298 R303 S304 | R298-Q300 VanDerWaalsContact C-N 3.3Å; R298-Q300 PolarHBondContact O-N 3.34Å; Q300-R303 PolarHBondContact O-N 3.32Å; Q300-S304 PolarHBondContact O-N 3.23Å |
| 301 | Y | 77.6 | Confident | 81.6 | Confident | 9 Ų | 9 | 67.8 Ų | 67.8 | 4% | 0.035 | 31% | 0.305 | C | S | . | . | H | α-helix | trans | -69 | -42.3 | 176.1 | -79.2 | -92.3 | 0 | 0 | 0 | 111.4 | V26 C29 L30 I36 T45 S295 R298 H299 R303 S304 C305 | V26-Y301 HydrophobicContact CG1-CE1 4.07Å; C29-Y301 HydrophobicContact CB-CD1 3.75Å; C29-Y301 HydrophobicContact CB-CE1 4.04Å; L30-Y301 HydrophobicContact CG-CE1 4.43Å; I36-Y301 HydrophobicContact CD1-CD1 4.16Å; I36-Y301 HydrophobicContact CD1-CD2 4.39Å; I36-Y301 HydrophobicContact CD1-CE1 4.18Å; I36-Y301 HydrophobicContact CD1-CE2 4.42Å; I36-Y301 HydrophobicContact CD1-CG 4.27Å; I36-Y301 HydrophobicContact CG2-CE1 4.25Å; I36-Y301 HydrophobicContact CG2-CE2 4.02Å; I36-Y301 WeakPolarHBondContact CG2-OH 3.16Å; T45-Y301 WeakPolarHBondContact CG2-OH 3.34Å; S295-Y301 VanDerWaalsContact O-CB 3.31Å; S295-Y301 WeakPolarHBondContact O-CB 3.43Å; S295-Y301 WeakPolarHBondContact O-CD2 3.29Å; R298-Y301 HydrophobicContact CB-CD2 4.17Å; R298-Y301 PolarHBondContact O-N 3.2Å; H299-Y301 PolarHBondContact O-N 2.77Å; Y301-R303 VanDerWaalsContact C-N 3.28Å; Y301-R303 PolarHBondContact O-N 3.09Å; Y301-S304 PolarHBondContact O-N 3.37Å; Y301-C305 PolarHBondContact O-N 3.33Å; Y301-C305 PolarHBondContact O-SG 3.32Å |
| 302 | R | 83.4 | Confident | 81.1 | Confident | 130 Ų | 130 | 71.2 Ų | 71.2 | 49% | 0.491 | 32% | 0.323 | S | S | . | . | H | α-helix | trans | -59.3 | -39.7 | 175 | -70.4 | -178.6 | 176.5 | -170 | -4.2 | 112.4 | L296 L297 R298 H299 K306 | L296-R302 VanDerWaalsContact O-CG 3.23Å; L296-R302 WeakPolarHBondContact O-CG 3.3Å; L296-R302 PolarHBondContact O-NE 3.32Å; L297-R302 VanDerWaalsContact CD2-NH2 3.28Å; R298-R302 WeakPolarHBondContact O-CG 3.5Å; R298-R302 PolarHBondContact O-N 3.47Å; H299-R302 PolarHBondContact O-N 3.03Å; R302-K306 WeakPolarHBondContact O-CG 3.27Å; R302-K306 PolarHBondContact O-N 3.39Å |
| 303 | R | 83.7 | Confident | 80.6 | Confident | 149 Ų | 149 | 72.9 Ų | 72.9 | 56% | 0.562 | 33% | 0.33 | S | S | * | . | H | α-helix | trans | -62.1 | -50.6 | 174.5 | 179.4 | 179.4 | 172.2 | 175 | 3.1 | 110.9 | H299 Q300 Y301 C305 K306 E307 | H299-R303 WeakPolarHBondContact O-CB 3.42Å; H299-R303 PolarHBondContact O-N 2.95Å; Q300-R303 PolarHBondContact O-N 3.32Å; Y301-R303 VanDerWaalsContact C-N 3.28Å; Y301-R303 PolarHBondContact O-N 3.09Å; R303-C305 VanDerWaalsContact C-N 3.34Å; R303-C305 PolarHBondContact O-N 3.11Å; R303-K306 PolarHBondContact O-N 3.19Å; R303-K306 VanDerWaalsContact O-N 3.16Å; R303-E307 WeakPolarHBondContact CG-OE1 3.35Å; R303-E307 IonicContact CZ-OE1 2.94Å; R303-E307 IonicContact NE-OE1 2.81Å; R303-E307 PolarHBondContact NE-OE1 3.11Å; R303-E307 IonicContact NH2-OE1 2.65Å; R303-E307 WeakPolarHBondContact O-CG 3.33Å; R303-E307 PolarHBondContact O-N 2.64Å |
| 304 | S | 80.1 | Confident | 80.1 | Confident | 6 Ų | 6 | 77.1 Ų | 77.1 | 4% | 0.042 | 35% | 0.352 | C | S | . | . | H | α-helix | trans | -59.3 | -42.2 | 176.9 | -170 | 0 | 0 | 0 | 0 | 112.3 | Q300 Y301 K306 E307 L308 | Q300-S304 PolarHBondContact O-N 3.23Å; Y301-S304 PolarHBondContact O-N 3.37Å; S304-K306 PolarHBondContact O-N 3.49Å; S304-E307 PolarHBondContact O-N 2.98Å; S304-L308 WeakPolarHBondContact O-CB 3.48Å; S304-L308 PolarHBondContact O-N 2.71Å |
| 305 | C | 83.3 | Confident | 79.4 | Confident | 25 Ų | 25 | 86.4 Ų | 86.4 | 17% | 0.169 | 39% | 0.387 | C | S | . | . | H | α-helix | trans | -59.5 | -45.4 | 173.8 | -68.5 | 0 | 0 | 0 | 0 | 112.3 | C29 Y301 R303 L308 L309 | C29-C305 PolarHBondContact SG-SG 3.08Å; Y301-C305 PolarHBondContact O-N 3.33Å; Y301-C305 PolarHBondContact O-SG 3.32Å; R303-C305 VanDerWaalsContact C-N 3.34Å; R303-C305 PolarHBondContact O-N 3.11Å; C305-L308 PolarHBondContact O-N 3.43Å; C305-L309 WeakPolarHBondContact O-CB 3.44Å; C305-L309 VanDerWaalsContact O-CG 3.29Å; C305-L309 WeakPolarHBondContact O-CG 3.39Å; C305-L309 PolarHBondContact O-N 2.84Å |
| 306 | K | 85.1 | Confident | 78.5 | Confident | 142 Ų | 142 | 94.7 Ų | 94.7 | 62% | 0.617 | 42% | 0.419 | S | S | * | . | H | α-helix | trans | -62.7 | -43.6 | 177.4 | -75.3 | -180 | 178.6 | -170.2 | 0 | 111.6 | R302 R303 S304 L308 L309 N310 | R302-K306 WeakPolarHBondContact O-CG 3.27Å; R302-K306 PolarHBondContact O-N 3.39Å; R303-K306 PolarHBondContact O-N 3.19Å; R303-K306 VanDerWaalsContact O-N 3.16Å; S304-K306 PolarHBondContact O-N 3.49Å; K306-L308 VanDerWaalsContact C-N 3.34Å; K306-L308 PolarHBondContact O-N 2.94Å; K306-L309 PolarHBondContact O-N 3.33Å; K306-N310 WeakPolarHBondContact O-CB 3.24Å; K306-N310 PolarHBondContact O-N 3.3Å; K306-N310 PolarHBondContact O-OD1 3.35Å |
| 307 | E | 85.1 | Confident | 77.9 | Confident | 74 Ų | 74 | 96.3 Ų | 96.3 | 35% | 0.346 | 43% | 0.432 | S | S | . | . | H | α-helix | trans | -62.1 | -42.1 | 176.6 | -71.6 | 170.4 | -172 | 0 | 0 | 111.4 | R303 S304 R311 | R303-E307 WeakPolarHBondContact CG-OE1 3.35Å; R303-E307 IonicContact CZ-OE1 2.94Å; R303-E307 IonicContact NE-OE1 2.81Å; R303-E307 PolarHBondContact NE-OE1 3.11Å; R303-E307 IonicContact NH2-OE1 2.65Å; R303-E307 WeakPolarHBondContact O-CG 3.33Å; R303-E307 PolarHBondContact O-N 2.64Å; S304-E307 PolarHBondContact O-N 2.98Å; E307-R311 VanDerWaalsContact O-CG 3.3Å; E307-R311 WeakPolarHBondContact O-CG 3.4Å; E307-R311 PolarHBondContact O-N 2.94Å |
| 308 | L | 85.9 | Confident | 77.3 | Confident | 22 Ų | 22 | 97 Ų | 97 | 12% | 0.115 | 44% | 0.435 | C | S | . | . | H | α-helix | trans | -64.7 | -47.1 | 176.4 | -165.4 | 108.9 | 0 | 0 | 0 | 111.8 | H32 S304 C305 K306 R311 I312 | H32-L308 HydrophobicContact CB-CD1 4.38Å; S304-L308 WeakPolarHBondContact O-CB 3.48Å; S304-L308 PolarHBondContact O-N 2.71Å; C305-L308 PolarHBondContact O-N 3.43Å; K306-L308 VanDerWaalsContact C-N 3.34Å; K306-L308 PolarHBondContact O-N 2.94Å; L308-R311 PolarHBondContact O-N 3.24Å; L308-I312 HydrophobicContact CD2-CD1 3.78Å; L308-I312 HydrophobicContact CG-CD1 4.12Å; L308-I312 VanDerWaalsContact O-CG1 3.3Å; L308-I312 WeakPolarHBondContact O-CG1 3.38Å; L308-I312 PolarHBondContact O-N 3.5Å |
| 309 | L | 84.8 | Confident | 76.3 | Confident | 85 Ų | 85 | 103.7 Ų | 103.7 | 45% | 0.445 | 46% | 0.46 | S | S | . | . | H | α-helix | trans | -60 | -48.8 | 176.8 | -74.8 | 168.6 | 0 | 0 | 0 | 110.8 | C305 K306 R311 I312 F313 | C305-L309 WeakPolarHBondContact O-CB 3.44Å; C305-L309 VanDerWaalsContact O-CG 3.29Å; C305-L309 WeakPolarHBondContact O-CG 3.39Å; C305-L309 PolarHBondContact O-N 2.84Å; K306-L309 PolarHBondContact O-N 3.33Å; L309-R311 VanDerWaalsContact C-N 3.28Å; L309-R311 PolarHBondContact O-N 3.48Å; L309-I312 PolarHBondContact O-N 2.85Å; L309-I312 VanDerWaalsContact O-N 3.08Å; L309-F313 HydrophobicContact CB-CD2 4.21Å; L309-F313 HydrophobicContact CB-CE2 4.17Å; L309-F313 HydrophobicContact CD2-CE2 4.04Å; L309-F313 WeakPolarHBondContact O-CD2 3.48Å; L309-F313 PolarHBondContact O-N 3.16Å |
| 310 | N | 85.5 | Confident | 75.6 | Confident | 97 Ų | 97 | 100.2 Ų | 100.2 | 52% | 0.519 | 45% | 0.453 | S | S | . | . | H | α-helix | trans | -58.8 | -39.6 | 178 | -71.9 | -4.6 | 0 | 0 | 0 | 111.8 | K306 N314 | K306-N310 WeakPolarHBondContact O-CB 3.24Å; K306-N310 PolarHBondContact O-N 3.3Å; K306-N310 PolarHBondContact O-OD1 3.35Å; N310-N314 WeakPolarHBondContact O-CB 3.25Å; N310-N314 PolarHBondContact O-N 2.99Å |
| 311 | R | 81 | Confident | 74.7 | Confident | 160 Ų | 160 | 105 Ų | 105 | 60% | 0.604 | 47% | 0.467 | S | S | * | . | H | α-helix | trans | -65.3 | -40.5 | 174.5 | -73.9 | 176.9 | -174.4 | -170.9 | 3.6 | 112.6 | E307 L308 L309 R315 | E307-R311 VanDerWaalsContact O-CG 3.3Å; E307-R311 WeakPolarHBondContact O-CG 3.4Å; E307-R311 PolarHBondContact O-N 2.94Å; L308-R311 PolarHBondContact O-N 3.24Å; L309-R311 VanDerWaalsContact C-N 3.28Å; L309-R311 PolarHBondContact O-N 3.48Å; R311-R315 WeakPolarHBondContact O-CB 3.35Å; R311-R315 WeakPolarHBondContact O-CG 3.48Å; R311-R315 PolarHBondContact O-N 3.37Å |
| 312 | I | 81.6 | Confident | 73.5 | Confident | 73 Ų | 73 | 107.6 Ų | 107.6 | 37% | 0.374 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -67.5 | -45.7 | 178 | -67.5 | 165.8 | 0 | 0 | 0 | 110.6 | L308 L309 R315 R316 | L308-I312 HydrophobicContact CD2-CD1 3.78Å; L308-I312 HydrophobicContact CG-CD1 4.12Å; L308-I312 VanDerWaalsContact O-CG1 3.3Å; L308-I312 WeakPolarHBondContact O-CG1 3.38Å; L308-I312 PolarHBondContact O-N 3.5Å; L309-I312 PolarHBondContact O-N 2.85Å; L309-I312 VanDerWaalsContact O-N 3.08Å; I312-R315 PolarHBondContact O-N 3.25Å; I312-R316 WeakPolarHBondContact O-CG 3.12Å; I312-R316 PolarHBondContact O-N 2.87Å |
| 313 | F | 77 | Confident | 72.2 | Confident | 121 Ų | 121 | 105.7 Ų | 105.7 | 53% | 0.531 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -65.6 | -42.5 | 177.6 | -75 | -66.4 | 0 | 0 | 0 | 112 | L309 R316 S317 | L309-F313 HydrophobicContact CB-CD2 4.21Å; L309-F313 HydrophobicContact CB-CE2 4.17Å; L309-F313 HydrophobicContact CD2-CE2 4.04Å; L309-F313 WeakPolarHBondContact O-CD2 3.48Å; L309-F313 PolarHBondContact O-N 3.16Å; F313-R316 PolarHBondContact O-N 3.25Å; F313-S317 PolarHBondContact O-N 3.48Å |
| 314 | N | 74.3 | Confident | 70.7 | Confident | 103 Ų | 103 | 100.8 Ų | 100.8 | 55% | 0.551 | 49% | 0.485 | S | S | * | . | H | α-helix | trans | -66.9 | -38 | 176.5 | -73.5 | -6.5 | 0 | 0 | 0 | 112.3 | N310 R316 S317 I318 | N310-N314 WeakPolarHBondContact O-CB 3.25Å; N310-N314 PolarHBondContact O-N 2.99Å; N314-R316 VanDerWaalsContact C-N 3.33Å; N314-R316 PolarHBondContact O-N 3.35Å; N314-S317 PolarHBondContact O-N 2.74Å; N314-I318 WeakPolarHBondContact O-CG1 3.41Å; N314-I318 PolarHBondContact O-N 3.21Å |
| 315 | R | 66 | Low | 69.4 | Low | 201 Ų | 201 | 106.9 Ų | 106.9 | 76% | 0.758 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -62.9 | -37.7 | 172.3 | -80.7 | -175.9 | 177 | -166.9 | -0.7 | 112.4 | R311 I312 R319 | R311-R315 WeakPolarHBondContact O-CB 3.35Å; R311-R315 WeakPolarHBondContact O-CG 3.48Å; R311-R315 PolarHBondContact O-N 3.37Å; I312-R315 PolarHBondContact O-N 3.25Å; R315-R319 WeakPolarHBondContact O-CB 3.15Å; R315-R319 PolarHBondContact O-N 2.85Å |
| 316 | R | 63.1 | Low | 67.8 | Low | 174 Ų | 174 | 111 Ų | 111 | 66% | 0.657 | 54% | 0.541 | S | S | * | . | H | α-helix | trans | -66.3 | -40.8 | 174.3 | -76.3 | -177.2 | 178.1 | -173.7 | -0.8 | 112.1 | I312 F313 N314 R319 S320 | I312-R316 WeakPolarHBondContact O-CG 3.12Å; I312-R316 PolarHBondContact O-N 2.87Å; F313-R316 PolarHBondContact O-N 3.25Å; N314-R316 VanDerWaalsContact C-N 3.33Å; N314-R316 PolarHBondContact O-N 3.35Å; R316-R319 PolarHBondContact O-N 3.08Å; R316-S320 PolarHBondContact O-N 3.46Å; R316-S320 PolarHBondContact O-OG 3.5Å |
| 317 | S | 62.2 | Low | 65.9 | Low | 59 Ų | 59 | 107 Ų | 107 | 41% | 0.413 | 54% | 0.54 | S | S | . | . | H | α-helix | trans | -65.4 | -39 | 176.5 | 177.4 | 0 | 0 | 0 | 0 | 113.2 | F313 N314 S320 R321 | F313-S317 PolarHBondContact O-N 3.48Å; N314-S317 PolarHBondContact O-N 2.74Å; S317-S320 PolarHBondContact O-OG 2.93Å; S317-R321 PolarHBondContact O-N 3Å; S317-R321 VanDerWaalsContact O-N 3.14Å |
| 318 | I | 59.7 | Low | 63.9 | Low | 118 Ų | 118 | 110.7 Ų | 110.7 | 61% | 0.605 | 56% | 0.562 | S | S | * | * | H | α-helix | trans | -67.9 | -42.4 | 175.1 | -66.2 | 166.5 | 0 | 0 | 0 | 110.5 | N314 R321 S322 | N314-I318 WeakPolarHBondContact O-CG1 3.41Å; N314-I318 PolarHBondContact O-N 3.21Å; I318-R321 PolarHBondContact O-N 3.48Å; I318-S322 PolarHBondContact O-N 3.13Å |
| 319 | R | 55.8 | Low | 61.8 | Low | 191 Ų | 191 | 114.3 Ų | 114.3 | 72% | 0.721 | 59% | 0.589 | S | S | * | * | H | α-helix | trans | -67.5 | -33.5 | 178.2 | -168.7 | 174.9 | 178.3 | -176.8 | -0.8 | 112.9 | R315 R316 S322 V323 | R315-R319 WeakPolarHBondContact O-CB 3.15Å; R315-R319 PolarHBondContact O-N 2.85Å; R316-R319 PolarHBondContact O-N 3.08Å; R319-S322 PolarHBondContact O-OG 3.06Å; R319-S322 VanDerWaalsContact O-OG 3.07Å; R319-V323 VanDerWaalsContact O-CG2 3.29Å; R319-V323 WeakPolarHBondContact O-CG2 3.25Å; R319-V323 PolarHBondContact O-N 3.26Å |
| 320 | S | 58.9 | Low | 59.6 | Low | 79 Ų | 79 | 119.4 Ų | 119.4 | 55% | 0.552 | 61% | 0.61 | S | S | * | * | H | α-helix | trans | -70.8 | -35.1 | 173.6 | 63.5 | 0 | 0 | 0 | 0 | 112.2 | R316 S317 G324 | R316-S320 PolarHBondContact O-N 3.46Å; R316-S320 PolarHBondContact O-OG 3.5Å; S317-S320 PolarHBondContact O-OG 2.93Å; S320-G324 PolarHBondContact O-N 3.13Å; S320-G324 VanDerWaalsContact O-N 3.13Å |
| 321 | R | 54.3 | Low | 57.5 | Low | 188 Ų | 188 | 119.6 Ų | 119.6 | 71% | 0.709 | 62% | 0.619 | S | S | * | * | H | α-helix | trans | -68.1 | -41 | 173.1 | -88.3 | 179.7 | 168 | 175.5 | -4.1 | 112.7 | S317 I318 V323 G324 L325 | S317-R321 PolarHBondContact O-N 3Å; S317-R321 VanDerWaalsContact O-N 3.14Å; I318-R321 PolarHBondContact O-N 3.48Å; R321-V323 VanDerWaalsContact C-N 3.35Å; R321-V323 PolarHBondContact O-N 3.44Å; R321-G324 PolarHBondContact O-N 3.38Å; R321-L325 WeakPolarHBondContact O-CD1 3.28Å; R321-L325 PolarHBondContact O-N 2.81Å; R321-L325 VanDerWaalsContact O-N 3.13Å |
| 322 | S | 53.7 | Low | 55.5 | Low | 62 Ų | 62 | 120.3 Ų | 120.3 | 43% | 0.434 | 63% | 0.629 | S | S | . | * | H | α-helix | trans | -67.4 | -34.9 | 178.9 | 69.3 | 0 | 0 | 0 | 0 | 112.8 | I318 R319 T326 | I318-S322 PolarHBondContact O-N 3.13Å; R319-S322 PolarHBondContact O-OG 3.06Å; R319-S322 VanDerWaalsContact O-OG 3.07Å; S322-T326 PolarHBondContact O-N 3.31Å; S322-T326 PolarHBondContact O-OG1 3.08Å |
| 323 | V | 55.1 | Low | 53.2 | Low | 91 Ų | 91 | 124.5 Ų | 124.5 | 55% | 0.552 | 65% | 0.652 | S | S | * | * | H | α-helix | trans | -73.8 | -33.5 | 176.4 | 173.7 | 0 | 0 | 0 | 0 | 111.8 | R319 R321 T326 G327 | R319-V323 VanDerWaalsContact O-CG2 3.29Å; R319-V323 WeakPolarHBondContact O-CG2 3.25Å; R319-V323 PolarHBondContact O-N 3.26Å; R321-V323 VanDerWaalsContact C-N 3.35Å; R321-V323 PolarHBondContact O-N 3.44Å; V323-T326 PolarHBondContact O-N 3.14Å; V323-T326 PolarHBondContact O-OG1 3.16Å; V323-G327 PolarHBondContact O-N 3.34Å |
| 324 | G | 52 | Low | 51.7 | Low | 46 Ų | 46 | 126.9 Ų | 126.9 | 47% | 0.474 | 67% | 0.669 | S | S | . | * | H | α-helix | trans | -67.1 | -34.8 | 173.4 | 0 | 0 | 0 | 0 | 0 | 113.7 | S320 R321 T326 G327 | S320-G324 PolarHBondContact O-N 3.13Å; S320-G324 VanDerWaalsContact O-N 3.13Å; R321-G324 PolarHBondContact O-N 3.38Å; G324-T326 VanDerWaalsContact C-N 3.35Å; G324-G327 PolarHBondContact O-N 3.07Å |
| 325 | L | 52.2 | Low | 49.9 | Very low | 134 Ų | 134 | 129.9 Ų | 129.9 | 70% | 0.702 | 68% | 0.684 | S | S | * | * | H | α-helix | trans | -74.5 | -21.2 | 177.8 | -79 | 154.8 | 0 | 0 | 0 | 113.8 | R321 | R321-L325 WeakPolarHBondContact O-CD1 3.28Å; R321-L325 PolarHBondContact O-N 2.81Å; R321-L325 VanDerWaalsContact O-N 3.13Å |
| 326 | T | 50.6 | Low | 48.9 | Very low | 111 Ų | 111 | 125.5 Ų | 125.5 | 68% | 0.681 | 68% | 0.681 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -90.1 | -6.7 | 175.4 | 48.8 | 0 | 0 | 0 | 0 | 113.9 | S322 V323 G324 | S322-T326 PolarHBondContact O-N 3.31Å; S322-T326 PolarHBondContact O-OG1 3.08Å; V323-T326 PolarHBondContact O-N 3.14Å; V323-T326 PolarHBondContact O-OG1 3.16Å; G324-T326 VanDerWaalsContact C-N 3.35Å |
| 327 | G | 45.1 | Very low | 47.7 | Very low | 59 Ų | 59 | 124.2 Ų | 124.2 | 61% | 0.608 | 69% | 0.693 | S | S | * | * | S | Bend | trans | -88.7 | -16.7 | -179.3 | 0 | 0 | 0 | 0 | 0 | 115.3 | V323 G324 | V323-G327 PolarHBondContact O-N 3.34Å; G324-G327 PolarHBondContact O-N 3.07Å |
| 328 | D | 44.2 | Very low | 46.9 | Very low | 151 Ų | 151 | 126 Ų | 126 | 81% | 0.807 | 71% | 0.705 | S | S | * | * | S | Bend | trans | -106.3 | 11 | -171.5 | -89.3 | -10.9 | 0 | 0 | 0 | 114.5 | ||
| 329 | S | 40.8 | Very low | 45.7 | Very low | 97 Ų | 97 | 133.1 Ų | 133.1 | 68% | 0.678 | 74% | 0.736 | S | S | * | * | S | Bend | trans | -99.9 | 13.6 | -177.5 | -53.1 | 0 | 0 | 0 | 0 | 115.4 | ||
| 330 | H | 39.2 | Very low | 45.1 | Very low | 192 Ų | 192 | 130.3 Ų | 130.3 | 89% | 0.889 | 74% | 0.737 | S | S | * | * | S | Bend | trans | -127.1 | 53.6 | 177.9 | -96.1 | -49.7 | 0 | 0 | 0 | 113.2 | ||
| 331 | S | 41 | Very low | 44.4 | Very low | 101 Ų | 101 | 132.9 Ų | 132.9 | 71% | 0.706 | 75% | 0.747 | S | S | * | * | trans | -149.9 | 131.6 | 163 | -58.7 | 0 | 0 | 0 | 0 | 108.8 | ||||
| 332 | H | 38.3 | Very low | 43.9 | Very low | 176 Ų | 176 | 129.9 Ų | 129.9 | 82% | 0.815 | 75% | 0.749 | S | S | * | * | trans | 86.4 | 88.6 | -179.1 | -58.2 | -72.4 | 0 | 0 | 0 | 116.7 | ||||
| 333 | N | 34.9 | Very low | 43.3 | Very low | 160 Ų | 160 | 133.9 Ų | 133.9 | 86% | 0.856 | 77% | 0.767 | S | S | * | * | -177.4 | 96.7 | 104.9 | -87.5 | -21.6 | 0 | 0 | 0 | 110 | |||||
| 334 | I | 44 | Very low | 42.6 | Very low | 171 Ų | 171 | 136.6 Ų | 136.6 | 88% | 0.877 | 78% | 0.781 | S | S | * | * | trans | -128.7 | 104.6 | 155.8 | -57.7 | 179.8 | 0 | 0 | 0 | 105.9 | ||||
| 335 | L | 36.3 | Very low | 41.9 | Very low | 167 Ų | 167 | 142.6 Ų | 142.6 | 87% | 0.874 | 80% | 0.801 | S | S | * | * | trans | -129.7 | 150.1 | 156.7 | -92 | 171.2 | 0 | 0 | 0 | 108.1 | ||||
| 336 | P | 44.7 | Very low | 41.2 | Very low | 108 Ų | 108 | 143.2 Ų | 143.2 | 70% | 0.701 | 81% | 0.808 | S | S | * | * | P | Polyproline II helix | trans | -92.5 | 152 | -149.7 | 36.3 | -34.7 | 0 | 0 | 0 | 112.1 | ||
| 337 | V | 39.6 | Very low | 40.5 | Very low | 147 Ų | 147 | 145.7 Ų | 145.7 | 89% | 0.891 | 82% | 0.818 | S | S | * | * | P | Polyproline II helix | trans | -96.5 | 116.2 | 157.5 | 176.4 | 0 | 0 | 0 | 0 | 107.1 | ||
| 338 | S | 44.4 | Very low | 40.1 | Very low | 97 Ų | 97 | 152.9 Ų | 152.9 | 68% | 0.678 | 84% | 0.835 | S | S | * | * | P | Polyproline II helix | trans | -61.3 | 140.8 | 165 | 46.8 | 0 | 0 | 0 | 0 | 112.5 | ||
| 339 | E | 33.7 | Very low | 39.7 | Very low | 268 Ų | 268 | 153.1 Ų | 153.1 | 100% | 1.252 | 84% | 0.838 | S | S | * | * | -90 | 0 | 122.2 | -79.4 | -171.3 | 132.2 | 0 | 0 | 108.9 |
Retrieved 339 of 339 residues in 58.5 ms
(Link to these results)