| 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 | 43.2 | Very low | 67.4 | Low | 229 Ų | 229 | 111.6 Ų | 111.6 | 100% | 1.128 | 53% | 0.532 | S | S | * | . | 0 | -30.1 | 0 | -95.2 | 159.7 | 67.9 | 0 | 0 | 113.7 | |||||
| 2 | S | 48.9 | Very low | 69.3 | Low | 75 Ų | 75 | 109 Ų | 109 | 52% | 0.524 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -60.2 | -52.2 | 177.1 | -134.2 | 0 | 0 | 0 | 0 | 114 | G4 R5 G6 E135 | S2-G4 PolarHBondContact O-N 3.47Å; S2-R5 WeakPolarHBondContact O-CB 3.43Å; S2-R5 PolarHBondContact O-N 3.13Å; S2-G6 PolarHBondContact O-N 3.01Å; S2-E135 PolarHBondContact OG-OE2 3.4Å |
| 3 | Q | 49.4 | Very low | 70.9 | Confident | 163 Ų | 163 | 100.6 Ų | 100.6 | 76% | 0.762 | 48% | 0.482 | S | S | * | . | H | α-helix | trans | -64.1 | -18.6 | -172.1 | -154.8 | 177.6 | 20.7 | 0 | 0 | 115.3 | ||
| 4 | G | 58.1 | Low | 72.3 | Confident | 33 Ų | 33 | 95.3 Ų | 95.3 | 34% | 0.34 | 46% | 0.457 | S | S | . | . | H | α-helix | trans | -76.2 | -41 | 171.7 | 0 | 0 | 0 | 0 | 0 | 111.5 | S2 K7 Y8 | S2-G4 PolarHBondContact O-N 3.47Å; G4-K7 PolarHBondContact O-N 3.06Å; G4-Y8 WeakPolarHBondContact O-CD2 3.29Å; G4-Y8 PolarHBondContact O-N 3.07Å |
| 5 | R | 61.4 | Low | 73.6 | Confident | 163 Ų | 163 | 91.5 Ų | 91.5 | 62% | 0.615 | 45% | 0.453 | S | S | * | . | H | α-helix | trans | -66.7 | -45 | -174.3 | -158.7 | 176.3 | -170.5 | 176.1 | 1.2 | 112.2 | S2 K7 Y8 D9 | S2-R5 WeakPolarHBondContact O-CB 3.43Å; S2-R5 PolarHBondContact O-N 3.13Å; R5-K7 VanDerWaalsContact C-N 3.31Å; R5-K7 PolarHBondContact O-N 3.06Å; R5-Y8 PolarHBondContact O-N 3.32Å; R5-Y8 VanDerWaalsContact O-N 3.12Å; R5-D9 PolarHBondContact O-N 2.68Å |
| 6 | G | 67.7 | Low | 74.9 | Confident | 21 Ų | 21 | 88.4 Ų | 88.4 | 22% | 0.216 | 44% | 0.439 | C | S | . | . | H | α-helix | trans | -61.1 | -34.9 | 175.7 | 0 | 0 | 0 | 0 | 0 | 114.5 | S2 F10 E135 | S2-G6 PolarHBondContact O-N 3.01Å; G6-F10 WeakPolarHBondContact O-CB 3.34Å; G6-F10 PolarHBondContact O-N 2.96Å; G6-E135 WeakPolarHBondContact CA-OE1 3.49Å; G6-E135 PolarHBondContact N-OE1 2.81Å; G6-E135 VanDerWaalsContact N-OE1 3.08Å |
| 7 | K | 75.3 | Confident | 75.9 | Confident | 133 Ų | 133 | 83.3 Ų | 83.3 | 58% | 0.578 | 41% | 0.413 | S | S | * | . | H | α-helix | trans | -65.8 | -43.1 | 173.8 | -71 | -176.9 | -178.9 | -179.6 | 0 | 111.4 | G4 R5 F10 Y11 | G4-K7 PolarHBondContact O-N 3.06Å; R5-K7 VanDerWaalsContact C-N 3.31Å; R5-K7 PolarHBondContact O-N 3.06Å; K7-F10 PolarHBondContact O-N 3.32Å; K7-Y11 WeakPolarHBondContact O-CD2 3.24Å; K7-Y11 PolarHBondContact O-N 3.35Å; K7-Y11 VanDerWaalsContact O-N 3.16Å |
| 8 | Y | 81.4 | Confident | 76.8 | Confident | 167 Ų | 167 | 84 Ų | 84 | 66% | 0.655 | 42% | 0.417 | S | S | * | . | H | α-helix | trans | -64.3 | -45.1 | 176.9 | -71.9 | -69 | 0 | 0 | 0 | 111.7 | G4 R5 F10 Y11 I12 | G4-Y8 WeakPolarHBondContact O-CD2 3.29Å; G4-Y8 PolarHBondContact O-N 3.07Å; R5-Y8 PolarHBondContact O-N 3.32Å; R5-Y8 VanDerWaalsContact O-N 3.12Å; Y8-F10 VanDerWaalsContact C-N 3.33Å; Y8-F10 PolarHBondContact O-N 3.03Å; Y8-Y11 PolarHBondContact O-N 2.79Å; Y8-I12 VanDerWaalsContact O-CG1 3.24Å; Y8-I12 WeakPolarHBondContact O-CG1 3.5Å; Y8-I12 PolarHBondContact O-N 3.43Å |
| 9 | D | 82.2 | Confident | 77.7 | Confident | 41 Ų | 41 | 81.5 Ų | 81.5 | 22% | 0.219 | 41% | 0.408 | C | S | . | . | H | α-helix | trans | -59.7 | -43.3 | 177.3 | -85.4 | 28.7 | 0 | 0 | 0 | 111.3 | R5 Y11 I12 G13 F79 K204 | R5-D9 PolarHBondContact O-N 2.68Å; D9-Y11 PolarHBondContact O-N 2.89Å; D9-I12 WeakPolarHBondContact O-CB 3.26Å; D9-I12 PolarHBondContact O-N 3.26Å; D9-G13 PolarHBondContact O-N 3.46Å; D9-F79 CarbonylContact C-O 3.59Å; D9-F79 HydrophobicContact CB-CD1 4.26Å; D9-K204 IonicContact OD2-NZ 2.68Å; D9-K204 PolarHBondContact OD2-NZ 3.12Å |
| 10 | F | 85.4 | Confident | 78.6 | Confident | 48 Ų | 48 | 77.5 Ų | 77.5 | 21% | 0.211 | 39% | 0.388 | C | S | . | . | H | α-helix | trans | -58.2 | -48.4 | 175.2 | 178.5 | -92.7 | 0 | 0 | 0 | 112.7 | G6 K7 Y8 I12 G13 L14 P81 L84 A130 | G6-F10 WeakPolarHBondContact O-CB 3.34Å; G6-F10 PolarHBondContact O-N 2.96Å; K7-F10 PolarHBondContact O-N 3.32Å; Y8-F10 VanDerWaalsContact C-N 3.33Å; Y8-F10 PolarHBondContact O-N 3.03Å; F10-I12 VanDerWaalsContact C-N 3.33Å; F10-I12 PolarHBondContact O-N 2.89Å; F10-G13 PolarHBondContact O-N 3.46Å; F10-L14 WeakPolarHBondContact O-CB 3.34Å; F10-L14 PolarHBondContact O-N 2.77Å; F10-P81 HydrophobicContact CD2-CG 4.46Å; F10-P81 HydrophobicContact CE2-CG 4.19Å; F10-L84 HydrophobicContact CE2-CD1 3.76Å; F10-L84 HydrophobicContact CZ-CD1 3.57Å; F10-A130 HydrophobicContact CE2-CB 4.42Å; F10-A130 HydrophobicContact CZ-CB 4.46Å |
| 11 | Y | 88.6 | Confident | 79.2 | Confident | 155 Ų | 155 | 74 Ų | 74 | 61% | 0.608 | 37% | 0.371 | S | S | * | . | H | α-helix | trans | -66.9 | -34.3 | 178.6 | -73.3 | -63.2 | 0 | 0 | 0 | 112.6 | K7 Y8 D9 G15 | K7-Y11 WeakPolarHBondContact O-CD2 3.24Å; K7-Y11 PolarHBondContact O-N 3.35Å; K7-Y11 VanDerWaalsContact O-N 3.16Å; Y8-Y11 PolarHBondContact O-N 2.79Å; D9-Y11 PolarHBondContact O-N 2.89Å; Y11-G15 PolarHBondContact O-N 3.47Å |
| 12 | I | 90.3 | Very high | 81.6 | Confident | 80 Ų | 80 | 67.7 Ų | 67.7 | 41% | 0.41 | 34% | 0.341 | S | S | . | . | H | α-helix | trans | -61.5 | -49.2 | 172.4 | -70.3 | 165.1 | 0 | 0 | 0 | 109.5 | Y8 D9 F10 L14 G15 L16 F79 | Y8-I12 VanDerWaalsContact O-CG1 3.24Å; Y8-I12 WeakPolarHBondContact O-CG1 3.5Å; Y8-I12 PolarHBondContact O-N 3.43Å; D9-I12 WeakPolarHBondContact O-CB 3.26Å; D9-I12 PolarHBondContact O-N 3.26Å; F10-I12 VanDerWaalsContact C-N 3.33Å; F10-I12 PolarHBondContact O-N 2.89Å; I12-L14 PolarHBondContact O-N 3.3Å; I12-G15 PolarHBondContact O-N 2.93Å; I12-L16 HydrophobicContact CG2-CD1 3.76Å; I12-L16 HydrophobicContact CG2-CG 4.39Å; I12-L16 WeakPolarHBondContact O-CB 3.38Å; I12-L16 VanDerWaalsContact O-CG 3.25Å; I12-L16 WeakPolarHBondContact O-CG 3.42Å; I12-L16 PolarHBondContact O-N 2.93Å; I12-F79 HydrophobicContact CG2-CB 4.47Å; I12-F79 HydrophobicContact CG2-CD1 4.18Å; I12-F79 HydrophobicContact CG2-CD2 4.23Å; I12-F79 HydrophobicContact CG2-CG 4.06Å |
| 13 | G | 89.5 | Confident | 83.7 | Confident | 0 Ų | 0 | 68.8 Ų | 68.8 | 0% | 0 | 34% | 0.336 | C | S | . | . | H | α-helix | trans | -62.6 | -42 | 178.5 | 0 | 0 | 0 | 0 | 0 | 113 | D9 F10 L16 A17 A76 | D9-G13 PolarHBondContact O-N 3.46Å; F10-G13 PolarHBondContact O-N 3.46Å; G13-L16 PolarHBondContact O-N 3.44Å; G13-A17 WeakPolarHBondContact O-CB 3.32Å; G13-A17 PolarHBondContact O-N 3.45Å; G13-A76 WeakPolarHBondContact O-CB 3.47Å |
| 14 | L | 90.8 | Very high | 85.7 | Confident | 26 Ų | 26 | 61.7 Ų | 61.7 | 14% | 0.136 | 30% | 0.304 | C | S | . | . | H | α-helix | trans | -60.7 | -47.1 | 174.1 | 177.5 | 62.6 | 0 | 0 | 0 | 111.7 | F10 I12 L16 A17 M18 L84 L88 V127 | F10-L14 WeakPolarHBondContact O-CB 3.34Å; F10-L14 PolarHBondContact O-N 2.77Å; I12-L14 PolarHBondContact O-N 3.3Å; L14-L16 VanDerWaalsContact C-N 3.34Å; L14-L16 PolarHBondContact O-N 3.12Å; L14-A17 PolarHBondContact O-N 3.24Å; L14-M18 HydrophobicContact CD1-CG 4.37Å; L14-M18 HydrophobicContact CD1-SD 4.4Å; L14-M18 HydrophobicContact CG-SD 4.45Å; L14-M18 WeakPolarHBondContact O-CG 3.44Å; L14-M18 PolarHBondContact O-N 2.94Å; L14-L84 HydrophobicContact CD1-CD1 4.48Å; L14-L84 HydrophobicContact CD1-CD2 4.13Å; L14-L88 HydrophobicContact CD1-CD1 3.74Å; L14-V127 HydrophobicContact CD1-CG1 4.12Å; L14-V127 HydrophobicContact CD1-CG2 4Å; L14-V127 HydrophobicContact CD2-CG1 3.98Å |
| 15 | G | 92.4 | Very high | 87.1 | Confident | 38 Ų | 38 | 60.1 Ų | 60.1 | 39% | 0.392 | 29% | 0.288 | S | S | . | . | H | α-helix | trans | -62.1 | -39.9 | 177 | 0 | 0 | 0 | 0 | 0 | 112.7 | Y11 I12 S19 | Y11-G15 PolarHBondContact O-N 3.47Å; I12-G15 PolarHBondContact O-N 2.93Å; G15-S19 WeakPolarHBondContact O-CB 3.24Å; G15-S19 PolarHBondContact O-N 3.15Å; G15-S19 PolarHBondContact O-OG 2.93Å |
| 16 | L | 93.3 | Very high | 88.4 | Confident | 43 Ų | 43 | 53 Ų | 53 | 23% | 0.225 | 26% | 0.264 | C | S | . | . | H | α-helix | trans | -64.5 | -41.8 | 174.2 | -73.4 | 169.1 | 0 | 0 | 0 | 111.9 | I12 G13 L14 S19 S20 A72 A75 A76 F79 | I12-L16 HydrophobicContact CG2-CD1 3.76Å; I12-L16 HydrophobicContact CG2-CG 4.39Å; I12-L16 WeakPolarHBondContact O-CB 3.38Å; I12-L16 VanDerWaalsContact O-CG 3.25Å; I12-L16 WeakPolarHBondContact O-CG 3.42Å; I12-L16 PolarHBondContact O-N 2.93Å; G13-L16 PolarHBondContact O-N 3.44Å; L14-L16 VanDerWaalsContact C-N 3.34Å; L14-L16 PolarHBondContact O-N 3.12Å; L16-S19 WeakPolarHBondContact CA-OG 3.24Å; L16-S19 PolarHBondContact O-OG 3.45Å; L16-S20 WeakPolarHBondContact O-CB 3.39Å; L16-S20 PolarHBondContact O-N 3.07Å; L16-A72 HydrophobicContact CD2-CB 4.48Å; L16-A75 HydrophobicContact CD1-CB 3.9Å; L16-A76 HydrophobicContact CB-CB 3.82Å; L16-F79 HydrophobicContact CD1-CD2 3.87Å; L16-F79 HydrophobicContact CD1-CE2 4.34Å |
| 17 | A | 92.6 | Very high | 89.5 | Confident | 1 Ų | 1 | 52 Ų | 52 | 1% | 0.008 | 25% | 0.254 | C | S | . | . | H | α-helix | trans | -66.1 | -41.9 | 177.2 | 0 | 0 | 0 | 0 | 0 | 112.5 | G13 L14 S20 S21 A76 V85 L88 | G13-A17 WeakPolarHBondContact O-CB 3.32Å; G13-A17 PolarHBondContact O-N 3.45Å; L14-A17 PolarHBondContact O-N 3.24Å; A17-S20 WeakPolarHBondContact O-CB 3.45Å; A17-S21 PolarHBondContact O-N 3.29Å; A17-S21 PolarHBondContact O-OG 3.32Å; A17-A76 HydrophobicContact CB-CB 3.98Å; A17-V85 HydrophobicContact CB-CG1 4.33Å; A17-V85 HydrophobicContact CB-CG2 4.43Å; A17-L88 HydrophobicContact CB-CB 4.46Å; A17-L88 HydrophobicContact CB-CD1 3.88Å |
| 18 | M | 92.9 | Very high | 90.1 | Very high | 96 Ų | 96 | 50.4 Ų | 50.4 | 47% | 0.473 | 25% | 0.247 | S | C | . | . | H | α-helix | trans | -67.1 | -45.2 | 176.7 | -71.7 | -174.6 | 69.5 | 0 | 0 | 111.9 | L14 S21 I22 | L14-M18 HydrophobicContact CD1-CG 4.37Å; L14-M18 HydrophobicContact CD1-SD 4.4Å; L14-M18 HydrophobicContact CG-SD 4.45Å; L14-M18 WeakPolarHBondContact O-CG 3.44Å; L14-M18 PolarHBondContact O-N 2.94Å; M18-S21 WeakPolarHBondContact O-CB 3.5Å; M18-S21 PolarHBondContact O-N 3.1Å; M18-I22 WeakPolarHBondContact O-CG1 3.44Å; M18-I22 PolarHBondContact O-N 2.95Å; M18-I22 VanDerWaalsContact O-N 3.1Å |
| 19 | S | 93.4 | Very high | 90.3 | Very high | 37 Ų | 37 | 42.9 Ų | 42.9 | 26% | 0.259 | 22% | 0.218 | S | C | . | . | H | α-helix | trans | -64 | -43 | 177.3 | 58 | 0 | 0 | 0 | 0 | 111.8 | G15 L16 S21 I22 F23 | G15-S19 WeakPolarHBondContact O-CB 3.24Å; G15-S19 PolarHBondContact O-N 3.15Å; G15-S19 PolarHBondContact O-OG 2.93Å; L16-S19 WeakPolarHBondContact CA-OG 3.24Å; L16-S19 PolarHBondContact O-OG 3.45Å; S19-S21 VanDerWaalsContact C-N 3.31Å; S19-S21 PolarHBondContact O-N 3Å; S19-I22 PolarHBondContact O-N 2.68Å; S19-I22 VanDerWaalsContact O-N 3.16Å; S19-F23 WeakPolarHBondContact O-CD2 3.28Å; S19-F23 PolarHBondContact O-N 3.1Å |
| 20 | S | 94.5 | Very high | 90.5 | Very high | 1 Ų | 1 | 44 Ų | 44 | 1% | 0.007 | 22% | 0.224 | C | C | . | . | H | α-helix | trans | -50.4 | -51.1 | 170.1 | 163.4 | 0 | 0 | 0 | 0 | 111.6 | L16 A17 I22 F23 I24 G69 N73 | L16-S20 WeakPolarHBondContact O-CB 3.39Å; L16-S20 PolarHBondContact O-N 3.07Å; A17-S20 WeakPolarHBondContact O-CB 3.45Å; S20-I22 VanDerWaalsContact C-N 3.28Å; S20-I22 PolarHBondContact O-N 2.93Å; S20-F23 PolarHBondContact O-N 3.3Å; S20-F23 VanDerWaalsContact O-N 3.15Å; S20-I24 WeakPolarHBondContact O-CB 3.34Å; S20-I24 WeakPolarHBondContact O-CG1 3.42Å; S20-I24 PolarHBondContact O-N 3.01Å; S20-I24 WeakPolarHBondContact OG-CD1 3.44Å; S20-G69 WeakPolarHBondContact CB-O 3.47Å; S20-G69 PolarHBondContact OG-O 3.47Å; S20-N73 WeakPolarHBondContact OG-CB 3.42Å |
| 21 | S | 92.4 | Very high | 90.5 | Very high | 3 Ų | 3 | 43.2 Ų | 43.2 | 2% | 0.021 | 22% | 0.22 | C | C | . | . | H | α-helix | trans | -59.8 | -39.3 | -179.3 | -64.6 | 0 | 0 | 0 | 0 | 112.5 | A17 M18 S19 G25 L88 S92 | A17-S21 PolarHBondContact O-N 3.29Å; A17-S21 PolarHBondContact O-OG 3.32Å; M18-S21 WeakPolarHBondContact O-CB 3.5Å; M18-S21 PolarHBondContact O-N 3.1Å; S19-S21 VanDerWaalsContact C-N 3.31Å; S19-S21 PolarHBondContact O-N 3Å; S21-G25 PolarHBondContact O-N 2.92Å; S21-L88 PolarHBondContact OG-O 3.22Å; S21-L88 VanDerWaalsContact OG-O 3.13Å; S21-S92 WeakPolarHBondContact O-CA 3.45Å; S21-S92 WeakPolarHBondContact O-CB 3.2Å |
| 22 | I | 92.6 | Very high | 90.3 | Very high | 98 Ų | 98 | 39.3 Ų | 39.3 | 50% | 0.503 | 21% | 0.207 | S | C | . | . | H | α-helix | trans | -66 | -47.1 | 176.1 | -65.6 | 165.8 | 0 | 0 | 0 | 111 | M18 S19 S20 G26 V95 | M18-I22 WeakPolarHBondContact O-CG1 3.44Å; M18-I22 PolarHBondContact O-N 2.95Å; M18-I22 VanDerWaalsContact O-N 3.1Å; S19-I22 PolarHBondContact O-N 2.68Å; S19-I22 VanDerWaalsContact O-N 3.16Å; S20-I22 VanDerWaalsContact C-N 3.28Å; S20-I22 PolarHBondContact O-N 2.93Å; I22-G26 PolarHBondContact O-N 3.32Å; I22-V95 HydrophobicContact CG1-CG2 4.37Å |
| 23 | F | 93.8 | Very high | 90 | Very high | 97 Ų | 97 | 39.3 Ų | 39.3 | 43% | 0.425 | 20% | 0.203 | S | C | . | . | H | α-helix | trans | -64.6 | -43.7 | 179.7 | -79.8 | -61.2 | 0 | 0 | 0 | 112.5 | S19 S20 S27 S65 | S19-F23 WeakPolarHBondContact O-CD2 3.28Å; S19-F23 PolarHBondContact O-N 3.1Å; S20-F23 PolarHBondContact O-N 3.3Å; S20-F23 VanDerWaalsContact O-N 3.15Å; F23-S27 VanDerWaalsContact O-CB 3.29Å; F23-S27 WeakPolarHBondContact O-CB 3.28Å; F23-S27 PolarHBondContact O-N 3.26Å; F23-S65 PolarHBondContact O-OG 3.18Å |
| 24 | I | 91.6 | Very high | 89.7 | Confident | 15 Ų | 15 | 39.3 Ų | 39.3 | 8% | 0.077 | 20% | 0.203 | C | C | . | . | H | α-helix | trans | -66.2 | -50.6 | 176.8 | -66.2 | 173.9 | 0 | 0 | 0 | 109.7 | S20 G26 S27 F28 | S20-I24 WeakPolarHBondContact O-CB 3.34Å; S20-I24 WeakPolarHBondContact O-CG1 3.42Å; S20-I24 PolarHBondContact O-N 3.01Å; S20-I24 WeakPolarHBondContact OG-CD1 3.44Å; I24-G26 PolarHBondContact O-N 3.2Å; I24-S27 WeakPolarHBondContact O-CB 3.18Å; I24-S27 PolarHBondContact O-N 3Å; I24-S27 VanDerWaalsContact O-N 3.15Å; I24-S27 PolarHBondContact O-OG 3.48Å; I24-F28 HydrophobicContact CG2-CD2 4.47Å; I24-F28 HydrophobicContact CG2-CE2 3.79Å; I24-F28 WeakPolarHBondContact O-CD2 3.18Å |
| 25 | G | 87.8 | Confident | 89.5 | Confident | 0 Ų | 0 | 41.1 Ų | 41.1 | 0% | 0 | 21% | 0.213 | C | C | . | . | H | α-helix | trans | -59.8 | -43.7 | 180 | 0 | 0 | 0 | 0 | 0 | 113.1 | S21 S92 S96 | S21-G25 PolarHBondContact O-N 2.92Å; G25-S92 WeakPolarHBondContact CA-O 3.48Å; G25-S96 WeakPolarHBondContact O-CB 3.47Å; G25-S96 PolarHBondContact O-OG 3.48Å |
| 26 | G | 88.8 | Confident | 89 | Confident | 12 Ų | 12 | 42.8 Ų | 42.8 | 12% | 0.124 | 21% | 0.212 | C | C | . | . | H | α-helix | trans | -66.6 | -34.7 | 175.4 | 0 | 0 | 0 | 0 | 0 | 113.5 | I22 I24 F28 I29 L30 | I22-G26 PolarHBondContact O-N 3.32Å; I24-G26 PolarHBondContact O-N 3.2Å; G26-F28 VanDerWaalsContact C-N 3.27Å; G26-F28 PolarHBondContact O-N 2.83Å; G26-I29 PolarHBondContact O-N 3.4Å; G26-L30 PolarHBondContact O-N 3.45Å |
| 27 | S | 90.8 | Very high | 88.5 | Confident | 0 Ų | 0 | 46.1 Ų | 46.1 | 0% | 0 | 22% | 0.222 | C | C | . | . | H | α-helix | trans | -57.3 | -40.3 | 179.5 | 79.5 | 0 | 0 | 0 | 0 | 112.7 | F23 I24 I29 L30 K31 G62 | F23-S27 VanDerWaalsContact O-CB 3.29Å; F23-S27 WeakPolarHBondContact O-CB 3.28Å; F23-S27 PolarHBondContact O-N 3.26Å; I24-S27 WeakPolarHBondContact O-CB 3.18Å; I24-S27 PolarHBondContact O-N 3Å; I24-S27 VanDerWaalsContact O-N 3.15Å; I24-S27 PolarHBondContact O-OG 3.48Å; S27-I29 VanDerWaalsContact C-N 3.3Å; S27-I29 PolarHBondContact O-N 2.84Å; S27-L30 PolarHBondContact O-N 3.46Å; S27-K31 WeakPolarHBondContact O-CB 3.24Å; S27-K31 VanDerWaalsContact O-CG 3.28Å; S27-K31 WeakPolarHBondContact O-CG 3.44Å; S27-K31 PolarHBondContact O-N 3.27Å; S27-G62 VanDerWaalsContact CB-O 3.25Å; S27-G62 WeakPolarHBondContact CB-O 3.44Å |
| 28 | F | 86.3 | Confident | 88 | Confident | 101 Ų | 101 | 46.9 Ų | 46.9 | 44% | 0.443 | 23% | 0.226 | S | C | . | . | H | α-helix | trans | -62.2 | -39.6 | 177.7 | -72 | -68.3 | 0 | 0 | 0 | 111.6 | I24 G26 K32 S96 | I24-F28 HydrophobicContact CG2-CD2 4.47Å; I24-F28 HydrophobicContact CG2-CE2 3.79Å; I24-F28 WeakPolarHBondContact O-CD2 3.18Å; G26-F28 VanDerWaalsContact C-N 3.27Å; G26-F28 PolarHBondContact O-N 2.83Å; F28-K32 VanDerWaalsContact O-CB 3.23Å; F28-K32 WeakPolarHBondContact O-CB 3.32Å; F28-K32 PolarHBondContact O-N 2.88Å; F28-S96 WeakPolarHBondContact CB-OG 3.48Å |
| 29 | I | 87.6 | Confident | 87.4 | Confident | 9 Ų | 9 | 44.1 Ų | 44.1 | 5% | 0.046 | 22% | 0.218 | C | C | . | . | H | α-helix | trans | -72.8 | -42.1 | -179.4 | -58 | -48.9 | 0 | 0 | 0 | 111.5 | G26 S27 K32 K33 S96 L99 F103 L104 | G26-I29 PolarHBondContact O-N 3.4Å; S27-I29 VanDerWaalsContact C-N 3.3Å; S27-I29 PolarHBondContact O-N 2.84Å; I29-K32 PolarHBondContact O-N 3.42Å; I29-K33 VanDerWaalsContact O-CB 3.22Å; I29-K33 WeakPolarHBondContact O-CB 3.13Å; I29-K33 PolarHBondContact O-N 3.19Å; I29-S96 WeakPolarHBondContact CD1-O 3.48Å; I29-L99 HydrophobicContact CB-CB 4.45Å; I29-L99 HydrophobicContact CG1-CB 3.73Å; I29-L99 HydrophobicContact CG2-CB 4.49Å; I29-F103 HydrophobicContact CG2-CB 4.09Å; I29-F103 HydrophobicContact CG2-CD2 4.43Å; I29-L104 HydrophobicContact CG2-CD1 3.74Å |
| 30 | L | 86.4 | Confident | 87 | Confident | 63 Ų | 63 | 51.7 Ų | 51.7 | 33% | 0.33 | 24% | 0.241 | S | C | . | . | H | α-helix | trans | -60.6 | -46.4 | 175 | -68.9 | 176.8 | 0 | 0 | 0 | 111.4 | G26 S27 K33 G34 | G26-L30 PolarHBondContact O-N 3.45Å; S27-L30 PolarHBondContact O-N 3.46Å; L30-K33 PolarHBondContact O-N 2.91Å; L30-G34 PolarHBondContact O-N 2.94Å |
| 31 | K | 84.7 | Confident | 86.4 | Confident | 33 Ų | 33 | 57.5 Ų | 57.5 | 14% | 0.143 | 27% | 0.266 | C | S | . | . | H | α-helix | trans | -60.5 | -49.1 | 175.3 | -70.9 | 173.8 | -172.9 | 175.9 | 0 | 111.3 | S27 K33 G34 L35 G62 M66 | S27-K31 WeakPolarHBondContact O-CB 3.24Å; S27-K31 VanDerWaalsContact O-CG 3.28Å; S27-K31 WeakPolarHBondContact O-CG 3.44Å; S27-K31 PolarHBondContact O-N 3.27Å; K31-K33 PolarHBondContact O-N 3.38Å; K31-G34 PolarHBondContact O-N 3.22Å; K31-L35 WeakPolarHBondContact O-CG 3.46Å; K31-L35 PolarHBondContact O-N 3.39Å; K31-G62 VanDerWaalsContact CE-C 3.44Å; K31-G62 WeakPolarHBondContact CE-O 3.36Å; K31-M66 PolarHBondContact NZ-SD 2.88Å |
| 32 | K | 83.6 | Confident | 85.7 | Confident | 73 Ų | 73 | 60.6 Ų | 60.6 | 32% | 0.317 | 30% | 0.299 | S | S | . | . | H | α-helix | trans | -60.8 | -44.2 | 179.4 | -168.5 | 176.1 | 172.5 | -174 | 0 | 111.6 | F28 I29 L35 L36 L104 E106 | F28-K32 VanDerWaalsContact O-CB 3.23Å; F28-K32 WeakPolarHBondContact O-CB 3.32Å; F28-K32 PolarHBondContact O-N 2.88Å; I29-K32 PolarHBondContact O-N 3.42Å; K32-L35 PolarHBondContact O-N 3.29Å; K32-L36 HydrophobicContact CG-CD1 4.3Å; K32-L36 WeakPolarHBondContact O-CB 3.46Å; K32-L36 VanDerWaalsContact O-CG 3.31Å; K32-L36 WeakPolarHBondContact O-CG 3.3Å; K32-L36 PolarHBondContact O-N 3.4Å; K32-L104 HydrophobicContact CB-CD2 4.47Å; K32-L104 HydrophobicContact CD-CD2 3.38Å; K32-L104 HydrophobicContact CG-CD2 3.73Å; K32-E106 WeakPolarHBondContact CE-OE1 3.17Å; K32-E106 IonicContact NZ-OE1 2.62Å; K32-E106 PolarHBondContact NZ-OE1 2.81Å; K32-E106 IonicContact NZ-OE2 2.89Å; K32-E106 PolarHBondContact NZ-OE2 3.01Å |
| 33 | K | 84.9 | Confident | 84.9 | Confident | 79 Ų | 79 | 57.9 Ų | 57.9 | 34% | 0.343 | 29% | 0.288 | S | S | . | . | H | α-helix | trans | -65.1 | -40 | 177.3 | -168.3 | 172.5 | -176.1 | 174.5 | 0 | 112.2 | I29 L30 K31 L36 R37 L58 | I29-K33 VanDerWaalsContact O-CB 3.22Å; I29-K33 WeakPolarHBondContact O-CB 3.13Å; I29-K33 PolarHBondContact O-N 3.19Å; L30-K33 PolarHBondContact O-N 2.91Å; K31-K33 PolarHBondContact O-N 3.38Å; K33-L36 PolarHBondContact O-N 2.87Å; K33-R37 WeakPolarHBondContact O-CB 3.31Å; K33-R37 PolarHBondContact O-N 3.47Å; K33-L58 HydrophobicContact CD-CD2 4.21Å; K33-L58 HydrophobicContact CG-CD2 4.27Å |
| 34 | G | 83.1 | Confident | 84.1 | Confident | 0 Ų | 0 | 58.7 Ų | 58.7 | 0% | 0 | 30% | 0.295 | C | S | . | . | H | α-helix | trans | -58.9 | -50.3 | 172.9 | 0 | 0 | 0 | 0 | 0 | 111.9 | L30 K31 L36 R37 L38 | L30-G34 PolarHBondContact O-N 2.94Å; K31-G34 PolarHBondContact O-N 3.22Å; G34-L36 PolarHBondContact O-N 3.07Å; G34-R37 WeakPolarHBondContact O-CB 3.21Å; G34-R37 PolarHBondContact O-N 2.85Å; G34-R37 VanDerWaalsContact O-N 3.16Å; G34-L38 WeakPolarHBondContact O-CD1 3.27Å; G34-L38 PolarHBondContact O-N 3.48Å; G34-L38 VanDerWaalsContact O-N 3.14Å |
| 35 | L | 85.3 | Confident | 83.2 | Confident | 65 Ų | 65 | 65.5 Ų | 65.5 | 34% | 0.34 | 32% | 0.32 | S | S | . | . | H | α-helix | trans | -61.4 | -42.5 | 177.6 | -67.9 | 174 | 0 | 0 | 0 | 112.7 | K31 K32 R37 L38 A39 A46 Y53 | K31-L35 WeakPolarHBondContact O-CG 3.46Å; K31-L35 PolarHBondContact O-N 3.39Å; K32-L35 PolarHBondContact O-N 3.29Å; L35-R37 VanDerWaalsContact C-N 3.3Å; L35-R37 PolarHBondContact O-N 3.48Å; L35-L38 PolarHBondContact O-N 2.87Å; L35-A39 PolarHBondContact O-N 3.28Å; L35-A46 HydrophobicContact CD2-CB 4.02Å; L35-Y53 HydrophobicContact CD2-CG 4.28Å |
| 36 | L | 82.3 | Confident | 82.5 | Confident | 72 Ų | 72 | 67.7 Ų | 67.7 | 38% | 0.377 | 34% | 0.338 | S | S | . | . | H | α-helix | trans | -65.3 | -31.9 | 176 | -72.3 | 171.4 | 0 | 0 | 0 | 112.7 | K32 K33 G34 R40 L104 | K32-L36 HydrophobicContact CG-CD1 4.3Å; K32-L36 WeakPolarHBondContact O-CB 3.46Å; K32-L36 VanDerWaalsContact O-CG 3.31Å; K32-L36 WeakPolarHBondContact O-CG 3.3Å; K32-L36 PolarHBondContact O-N 3.4Å; K33-L36 PolarHBondContact O-N 2.87Å; G34-L36 PolarHBondContact O-N 3.07Å; L36-R40 WeakPolarHBondContact O-CG 3.47Å; L36-R40 PolarHBondContact O-N 3.32Å; L36-R40 VanDerWaalsContact O-N 3.15Å; L36-R40 PolarHBondContact O-NE 3.44Å; L36-L104 HydrophobicContact CD1-CD2 3.75Å; L36-L104 HydrophobicContact CD1-CG 4.24Å |
| 37 | R | 83.3 | Confident | 81.3 | Confident | 114 Ų | 114 | 71 Ų | 71 | 43% | 0.43 | 37% | 0.372 | S | S | . | . | H | α-helix | trans | -68.3 | -37.9 | 174.8 | -167.5 | -179.7 | -174.4 | -171.2 | 8.7 | 111.6 | K33 G34 L35 K41 E56 | K33-R37 WeakPolarHBondContact O-CB 3.31Å; K33-R37 PolarHBondContact O-N 3.47Å; G34-R37 WeakPolarHBondContact O-CB 3.21Å; G34-R37 PolarHBondContact O-N 2.85Å; G34-R37 VanDerWaalsContact O-N 3.16Å; L35-R37 VanDerWaalsContact C-N 3.3Å; L35-R37 PolarHBondContact O-N 3.48Å; R37-K41 WeakPolarHBondContact O-CG 3.46Å; R37-K41 PolarHBondContact O-N 3.34Å; R37-E56 WeakPolarHBondContact CD-OE1 3.36Å; R37-E56 IonicContact CZ-OE1 3.66Å; R37-E56 IonicContact NE-OE1 3.83Å; R37-E56 IonicContact NH1-OE1 2.82Å; R37-E56 PolarHBondContact NH1-OE1 3.49Å |
| 38 | L | 82.7 | Confident | 80.4 | Confident | 17 Ų | 17 | 77.1 Ų | 77.1 | 9% | 0.089 | 40% | 0.401 | C | S | . | . | H | α-helix | trans | -69.9 | -42.4 | 175.4 | -72.9 | 145.9 | 0 | 0 | 0 | 112.3 | G34 L35 R40 K41 G42 S43 A52 E56 | G34-L38 WeakPolarHBondContact O-CD1 3.27Å; G34-L38 PolarHBondContact O-N 3.48Å; G34-L38 VanDerWaalsContact O-N 3.14Å; L35-L38 PolarHBondContact O-N 2.87Å; L38-R40 VanDerWaalsContact C-N 3.25Å; L38-R40 PolarHBondContact O-N 3.15Å; L38-K41 WeakPolarHBondContact O-CB 3.29Å; L38-K41 PolarHBondContact O-N 3.27Å; L38-G42 PolarHBondContact O-N 3.21Å; L38-S43 PolarHBondContact O-N 2.99Å; L38-A52 HydrophobicContact CD2-CB 4.1Å; L38-A52 WeakPolarHBondContact CD2-O 3.44Å; L38-E56 HydrophobicContact CD1-CB 3.75Å; L38-E56 HydrophobicContact CD1-CG 4.18Å; L38-E56 HydrophobicContact CD2-CB 4.34Å; L38-E56 HydrophobicContact CG-CB 4.14Å; L38-E56 HydrophobicContact CG-CG 4.39Å |
| 39 | A | 80.8 | Confident | 79.6 | Confident | 37 Ų | 37 | 74.8 Ų | 74.8 | 31% | 0.306 | 41% | 0.405 | S | S | . | . | H | α-helix | trans | -58.7 | -39.5 | 175.5 | 0 | 0 | 0 | 0 | 0 | 111.5 | L35 K41 G42 R45 | L35-A39 PolarHBondContact O-N 3.28Å; A39-K41 VanDerWaalsContact C-N 3.3Å; A39-K41 PolarHBondContact O-N 2.75Å; A39-G42 PolarHBondContact O-N 2.94Å; A39-R45 HydrophobicContact CB-CG 4.46Å |
| 40 | R | 83 | Confident | 79 | Confident | 196 Ų | 196 | 74.6 Ų | 74.6 | 74% | 0.74 | 41% | 0.405 | S | S | * | . | H | α-helix | trans | -66.7 | -26.5 | 174.2 | -78.1 | -173.9 | -73.7 | 161.1 | -7.2 | 114.3 | L36 L38 G42 | L36-R40 WeakPolarHBondContact O-CG 3.47Å; L36-R40 PolarHBondContact O-N 3.32Å; L36-R40 VanDerWaalsContact O-N 3.15Å; L36-R40 PolarHBondContact O-NE 3.44Å; L38-R40 VanDerWaalsContact C-N 3.25Å; L38-R40 PolarHBondContact O-N 3.15Å; R40-G42 PolarHBondContact O-N 2.88Å |
| 41 | K | 82.6 | Confident | 78.7 | Confident | 123 Ų | 123 | 78 Ų | 78 | 54% | 0.535 | 42% | 0.419 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -80.3 | 2.5 | 175.6 | -70.2 | 170.9 | 179.9 | 173.7 | 0 | 112.8 | R37 L38 A39 S43 E56 | R37-K41 WeakPolarHBondContact O-CG 3.46Å; R37-K41 PolarHBondContact O-N 3.34Å; L38-K41 WeakPolarHBondContact O-CB 3.29Å; L38-K41 PolarHBondContact O-N 3.27Å; A39-K41 VanDerWaalsContact C-N 3.3Å; A39-K41 PolarHBondContact O-N 2.75Å; K41-S43 PolarHBondContact O-N 2.88Å; K41-E56 IonicContact NZ-OE2 2.96Å; K41-E56 PolarHBondContact NZ-OE2 3.19Å |
| 42 | G | 77 | Confident | 78.4 | Confident | 69 Ų | 69 | 77.9 Ų | 77.9 | 71% | 0.711 | 42% | 0.424 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 74.8 | 7.4 | -177.5 | 0 | 0 | 0 | 0 | 0 | 114.1 | L38 A39 R40 | L38-G42 PolarHBondContact O-N 3.21Å; A39-G42 PolarHBondContact O-N 2.94Å; R40-G42 PolarHBondContact O-N 2.88Å |
| 43 | S | 76.1 | Confident | 78 | Confident | 40 Ų | 40 | 77.1 Ų | 77.1 | 28% | 0.28 | 42% | 0.42 | S | S | . | . | P | Polyproline II helix | trans | -67.8 | 142.5 | 175.9 | -60.7 | 0 | 0 | 0 | 0 | 110.5 | L38 K41 R45 | L38-S43 PolarHBondContact O-N 2.99Å; K41-S43 PolarHBondContact O-N 2.88Å; S43-R45 PolarHBondContact O-N 2.99Å |
| 44 | M | 77.4 | Confident | 77.9 | Confident | 114 Ų | 114 | 76.9 Ų | 76.9 | 56% | 0.562 | 42% | 0.422 | S | S | * | . | P | Polyproline II helix | trans | -51.1 | 127.5 | 174.4 | -162.2 | -169.3 | -155.4 | 0 | 0 | 110 | Q48 | M44-Q48 HydrophobicContact CE-CB 4.06Å; M44-Q48 WeakPolarHBondContact CE-O 3.45Å; M44-Q48 HydrophobicContact CG-CB 4.15Å |
| 45 | R | 73.6 | Confident | 77.7 | Confident | 158 Ų | 158 | 86.1 Ų | 86.1 | 60% | 0.596 | 46% | 0.462 | S | S | * | . | P | Polyproline II helix | trans | -65.6 | 146.6 | -176.9 | -64.9 | 176 | 81.6 | 154.4 | 0.6 | 109.2 | A39 S43 G47 Q48 G50 | A39-R45 HydrophobicContact CB-CG 4.46Å; S43-R45 PolarHBondContact O-N 2.99Å; R45-G47 PolarHBondContact O-N 2.72Å; R45-Q48 PolarHBondContact O-N 2.85Å; R45-G50 PolarHBondContact O-N 3.3Å |
| 46 | A | 71.8 | Confident | 77.7 | Confident | 47 Ų | 47 | 83.6 Ų | 83.6 | 39% | 0.388 | 45% | 0.448 | S | S | . | . | G | 310 helix | trans | -55.5 | -36.4 | 177.8 | 0 | 0 | 0 | 0 | 0 | 112.5 | L35 Q48 G49 G50 Y53 | L35-A46 HydrophobicContact CD2-CB 4.02Å; A46-Q48 PolarHBondContact O-N 3.25Å; A46-Q48 VanDerWaalsContact O-N 3.16Å; A46-G49 PolarHBondContact O-N 3.46Å; A46-G50 WeakPolarHBondContact CA-O 3.41Å; A46-Y53 HydrophobicContact CB-CD1 3.77Å; A46-Y53 HydrophobicContact CB-CE1 4.19Å |
| 47 | G | 64.6 | Low | 77.9 | Confident | 81 Ų | 81 | 89.3 Ų | 89.3 | 84% | 0.835 | 47% | 0.465 | S | S | * | . | G | 310 helix | trans | -69 | -5.8 | 176.4 | 0 | 0 | 0 | 0 | 0 | 115.6 | R45 | R45-G47 PolarHBondContact O-N 2.72Š|
| 48 | Q | 71.1 | Confident | 78 | Confident | 129 Ų | 129 | 85.6 Ų | 85.6 | 60% | 0.603 | 45% | 0.454 | S | S | * | . | G | 310 helix | trans | -109.4 | 11.9 | 175.8 | -65.1 | 174.8 | -31.9 | 0 | 0 | 112 | M44 R45 A46 | M44-Q48 HydrophobicContact CE-CB 4.06Å; M44-Q48 WeakPolarHBondContact CE-O 3.45Å; M44-Q48 HydrophobicContact CG-CB 4.15Å; R45-Q48 PolarHBondContact O-N 2.85Å; A46-Q48 PolarHBondContact O-N 3.25Å; A46-Q48 VanDerWaalsContact O-N 3.16Å |
| 49 | G | 69.5 | Low | 78.3 | Confident | 51 Ų | 51 | 86.6 Ų | 86.6 | 53% | 0.526 | 46% | 0.456 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 91.6 | 7.7 | -177.9 | 0 | 0 | 0 | 0 | 0 | 114.8 | A46 | A46-G49 PolarHBondContact O-N 3.46Š|
| 50 | G | 74.6 | Confident | 78.7 | Confident | 6 Ų | 6 | 90.1 Ų | 90.1 | 6% | 0.062 | 46% | 0.462 | C | S | . | . | trans | -77.5 | 121.1 | 179 | 0 | 0 | 0 | 0 | 0 | 113.5 | R45 A46 A52 Y53 | R45-G50 PolarHBondContact O-N 3.3Å; A46-G50 WeakPolarHBondContact CA-O 3.41Å; G50-A52 VanDerWaalsContact C-N 3.3Å; G50-A52 PolarHBondContact O-N 3.16Å; G50-Y53 WeakPolarHBondContact O-CD1 3.3Å | ||
| 51 | H | 79.9 | Confident | 79 | Confident | 135 Ų | 135 | 82 Ų | 82 | 63% | 0.625 | 44% | 0.437 | S | S | * | . | G | 310 helix | trans | -87 | 10.1 | 175.8 | -61.2 | -67.6 | 0 | 0 | 0 | 114.6 | Y53 L54 | H51-Y53 PolarHBondContact O-N 3.14Å; H51-L54 HydrophobicContact CB-CD1 4.27Å; H51-L54 PolarHBondContact O-N 2.85Å; H51-L54 VanDerWaalsContact O-N 3.16Å |
| 52 | A | 78.4 | Confident | 79.2 | Confident | 30 Ų | 30 | 76.1 Ų | 76.1 | 25% | 0.248 | 41% | 0.411 | C | S | . | . | G | 310 helix | trans | -60.7 | -21.5 | -176.5 | 0 | 0 | 0 | 0 | 0 | 113.5 | L38 G50 L54 K55 | L38-A52 HydrophobicContact CD2-CB 4.1Å; L38-A52 WeakPolarHBondContact CD2-O 3.44Å; G50-A52 VanDerWaalsContact C-N 3.3Å; G50-A52 PolarHBondContact O-N 3.16Å; A52-L54 VanDerWaalsContact C-N 3.26Å; A52-L54 PolarHBondContact O-N 3.36Å; A52-K55 PolarHBondContact O-N 3.05Å |
| 53 | Y | 76.3 | Confident | 79.7 | Confident | 56 Ų | 56 | 75.9 Ų | 75.9 | 22% | 0.22 | 39% | 0.393 | C | S | . | . | G | 310 helix | trans | -65.6 | -25.8 | 178.2 | 70.5 | -92.4 | 0 | 0 | 0 | 114.5 | L35 A46 G50 H51 K55 E56 W59 | L35-Y53 HydrophobicContact CD2-CG 4.28Å; A46-Y53 HydrophobicContact CB-CD1 3.77Å; A46-Y53 HydrophobicContact CB-CE1 4.19Å; G50-Y53 WeakPolarHBondContact O-CD1 3.3Å; H51-Y53 PolarHBondContact O-N 3.14Å; Y53-K55 PolarHBondContact O-N 3.5Å; Y53-K55 VanDerWaalsContact O-N 3.16Å; Y53-E56 PolarHBondContact O-N 2.88Å; Y53-E56 VanDerWaalsContact O-N 3.08Å; Y53-W59 AromaticContact CD2-CD1 3.89Å; Y53-W59 AromaticContact CD2-CD2 3.57Å; Y53-W59 HydrophobicContact CD2-CD2 3.57Å; Y53-W59 AromaticContact CD2-CE2 3.35Å; Y53-W59 HydrophobicContact CD2-CE3 4.09Å; Y53-W59 AromaticContact CD2-CG 3.94Å; Y53-W59 HydrophobicContact CD2-CG 3.94Å; Y53-W59 HydrophobicContact CD2-CH2 4.25Å; Y53-W59 AromaticContact CD2-CZ2 3.74Å; Y53-W59 HydrophobicContact CD2-CZ2 3.74Å; Y53-W59 HydrophobicContact CD2-CZ3 4.4Å; Y53-W59 AromaticContact CD2-NE1 3.53Å; Y53-W59 HydrophobicContact CE2-CD2 4.1Å; Y53-W59 AromaticContact CE2-CE2 3.54Å; Y53-W59 HydrophobicContact CE2-CE3 4.42Å; Y53-W59 AromaticContact CE2-CH2 3.78Å; Y53-W59 HydrophobicContact CE2-CH2 3.78Å; Y53-W59 AromaticContact CE2-CZ2 3.38Å; Y53-W59 HydrophobicContact CE2-CZ2 3.38Å; Y53-W59 HydrophobicContact CE2-CZ3 4.27Å; Y53-W59 AromaticContact CE2-NE1 3.97Å |
| 54 | L | 82.6 | Confident | 80.5 | Confident | 74 Ų | 74 | 79.6 Ų | 79.6 | 39% | 0.387 | 41% | 0.409 | S | S | . | . | G | 310 helix | trans | -64.4 | -18.4 | 176.5 | -64.7 | 174.8 | 0 | 0 | 0 | 112.7 | H51 A52 W59 W60 | H51-L54 HydrophobicContact CB-CD1 4.27Å; H51-L54 PolarHBondContact O-N 2.85Å; H51-L54 VanDerWaalsContact O-N 3.16Å; A52-L54 VanDerWaalsContact C-N 3.26Å; A52-L54 PolarHBondContact O-N 3.36Å; L54-W59 HydrophobicContact CD2-CE3 4.44Å; L54-W59 HydrophobicContact CD2-CH2 3.88Å; L54-W59 HydrophobicContact CD2-CZ3 3.75Å; L54-W60 HydrophobicContact CD2-CZ2 4.37Å; L54-W60 PolarHBondContact O-NE1 2.97Å |
| 55 | K | 78.6 | Confident | 81.1 | Confident | 195 Ų | 195 | 75 Ų | 75 | 85% | 0.848 | 39% | 0.389 | S | S | * | . | G | 310 helix | trans | -88.8 | -10.9 | 176.9 | -62 | -176.4 | 179.4 | -178.2 | 0 | 113.4 | A52 Y53 | A52-K55 PolarHBondContact O-N 3.05Å; Y53-K55 PolarHBondContact O-N 3.5Å; Y53-K55 VanDerWaalsContact O-N 3.16Å |
| 56 | E | 85.2 | Confident | 82 | Confident | 11 Ų | 11 | 70.3 Ų | 70.3 | 5% | 0.051 | 37% | 0.374 | C | S | . | . | trans | -93.1 | 118.5 | -175.4 | -174 | 68.6 | -134.3 | 0 | 0 | 110.9 | R37 L38 K41 Y53 L58 W59 | R37-E56 WeakPolarHBondContact CD-OE1 3.36Å; R37-E56 IonicContact CZ-OE1 3.66Å; R37-E56 IonicContact NE-OE1 3.83Å; R37-E56 IonicContact NH1-OE1 2.82Å; R37-E56 PolarHBondContact NH1-OE1 3.49Å; L38-E56 HydrophobicContact CD1-CB 3.75Å; L38-E56 HydrophobicContact CD1-CG 4.18Å; L38-E56 HydrophobicContact CD2-CB 4.34Å; L38-E56 HydrophobicContact CG-CB 4.14Å; L38-E56 HydrophobicContact CG-CG 4.39Å; K41-E56 IonicContact NZ-OE2 2.96Å; K41-E56 PolarHBondContact NZ-OE2 3.19Å; Y53-E56 PolarHBondContact O-N 2.88Å; Y53-E56 VanDerWaalsContact O-N 3.08Å; E56-L58 VanDerWaalsContact C-N 3.28Å; E56-L58 HydrophobicContact CG-CB 4.39Å; E56-L58 PolarHBondContact O-N 2.98Å; E56-L58 WeakPolarHBondContact OE1-CD1 3.12Å; E56-W59 WeakPolarHBondContact O-CB 3.19Å; E56-W59 PolarHBondContact O-N 3.35Å | ||
| 57 | W | 87.2 | Confident | 82.7 | Confident | 192 Ų | 192 | 69.9 Ų | 69.9 | 73% | 0.727 | 38% | 0.375 | S | S | * | . | H | α-helix | trans | -55.8 | -38 | -179.3 | 169.5 | -98.8 | 0 | 0 | 0 | 113.5 | W59 W60 A61 | W57-W59 PolarHBondContact O-N 3.5Å; W57-W60 PolarHBondContact O-N 3.45Å; W57-A61 WeakPolarHBondContact O-CB 3.15Å; W57-A61 PolarHBondContact O-N 2.84Å |
| 58 | L | 86.1 | Confident | 83.9 | Confident | 36 Ų | 36 | 68.2 Ų | 68.2 | 19% | 0.188 | 35% | 0.353 | C | S | . | . | H | α-helix | trans | -62.6 | -31.3 | 178.7 | -80.3 | 104.1 | 0 | 0 | 0 | 113 | K33 E56 G62 | K33-L58 HydrophobicContact CD-CD2 4.21Å; K33-L58 HydrophobicContact CG-CD2 4.27Å; E56-L58 VanDerWaalsContact C-N 3.28Å; E56-L58 HydrophobicContact CG-CB 4.39Å; E56-L58 PolarHBondContact O-N 2.98Å; E56-L58 WeakPolarHBondContact OE1-CD1 3.12Å; L58-G62 PolarHBondContact O-N 3.38Å |
| 59 | W | 88.4 | Confident | 84.9 | Confident | 39 Ų | 39 | 62.1 Ų | 62.1 | 15% | 0.148 | 32% | 0.324 | C | S | . | . | H | α-helix | trans | -69.6 | -44.3 | 177.2 | -178.7 | 89.9 | 0 | 0 | 0 | 110.9 | Y53 L54 E56 W57 G62 L63 | Y53-W59 AromaticContact CD2-CD1 3.89Å; Y53-W59 AromaticContact CD2-CD2 3.57Å; Y53-W59 HydrophobicContact CD2-CD2 3.57Å; Y53-W59 AromaticContact CD2-CE2 3.35Å; Y53-W59 HydrophobicContact CD2-CE3 4.09Å; Y53-W59 AromaticContact CD2-CG 3.94Å; Y53-W59 HydrophobicContact CD2-CG 3.94Å; Y53-W59 HydrophobicContact CD2-CH2 4.25Å; Y53-W59 AromaticContact CD2-CZ2 3.74Å; Y53-W59 HydrophobicContact CD2-CZ2 3.74Å; Y53-W59 HydrophobicContact CD2-CZ3 4.4Å; Y53-W59 AromaticContact CD2-NE1 3.53Å; Y53-W59 HydrophobicContact CE2-CD2 4.1Å; Y53-W59 AromaticContact CE2-CE2 3.54Å; Y53-W59 HydrophobicContact CE2-CE3 4.42Å; Y53-W59 AromaticContact CE2-CH2 3.78Å; Y53-W59 HydrophobicContact CE2-CH2 3.78Å; Y53-W59 AromaticContact CE2-CZ2 3.38Å; Y53-W59 HydrophobicContact CE2-CZ2 3.38Å; Y53-W59 HydrophobicContact CE2-CZ3 4.27Å; Y53-W59 AromaticContact CE2-NE1 3.97Å; L54-W59 HydrophobicContact CD2-CE3 4.44Å; L54-W59 HydrophobicContact CD2-CH2 3.88Å; L54-W59 HydrophobicContact CD2-CZ3 3.75Å; E56-W59 WeakPolarHBondContact O-CB 3.19Å; E56-W59 PolarHBondContact O-N 3.35Å; W57-W59 PolarHBondContact O-N 3.5Å; W59-G62 PolarHBondContact O-N 3.39Å; W59-L63 HydrophobicContact CH2-CD2 3.91Å; W59-L63 HydrophobicContact CZ3-CD2 4Å; W59-L63 PolarHBondContact O-N 3.31Å |
| 60 | W | 88.3 | Confident | 85.8 | Confident | 110 Ų | 110 | 63.8 Ų | 63.8 | 42% | 0.417 | 32% | 0.318 | S | S | . | . | H | α-helix | trans | -64.4 | -41.5 | 174.6 | -79.3 | 103.9 | 0 | 0 | 0 | 112.7 | L54 W57 G62 L63 L64 | L54-W60 HydrophobicContact CD2-CZ2 4.37Å; L54-W60 PolarHBondContact O-NE1 2.97Å; W57-W60 PolarHBondContact O-N 3.45Å; W60-G62 VanDerWaalsContact C-N 3.26Å; W60-G62 PolarHBondContact O-N 2.81Å; W60-L63 HydrophobicContact CE3-CD2 3.81Å; W60-L63 HydrophobicContact CH2-CD2 4.49Å; W60-L63 HydrophobicContact CZ3-CD2 3.65Å; W60-L63 PolarHBondContact O-N 2.91Å; W60-L63 VanDerWaalsContact O-N 3.07Å; W60-L64 WeakPolarHBondContact O-CG 3.21Å; W60-L64 PolarHBondContact O-N 2.87Å |
| 61 | A | 89.3 | Confident | 86.5 | Confident | 26 Ų | 26 | 68.3 Ų | 68.3 | 22% | 0.215 | 35% | 0.345 | C | S | . | . | H | α-helix | trans | -58.2 | -41.3 | 173.2 | 0 | 0 | 0 | 0 | 0 | 111.3 | W57 S65 | W57-A61 WeakPolarHBondContact O-CB 3.15Å; W57-A61 PolarHBondContact O-N 2.84Å; A61-S65 VanDerWaalsContact O-CB 3.27Å; A61-S65 WeakPolarHBondContact O-CB 3.14Å; A61-S65 PolarHBondContact O-N 2.69Å |
| 62 | G | 88.3 | Confident | 87.1 | Confident | 0 Ų | 0 | 62.5 Ų | 62.5 | 0% | 0 | 32% | 0.32 | C | S | . | . | H | α-helix | trans | -64.9 | -40.3 | 172.3 | 0 | 0 | 0 | 0 | 0 | 113.1 | S27 K31 L58 W59 W60 M66 | S27-G62 VanDerWaalsContact CB-O 3.25Å; S27-G62 WeakPolarHBondContact CB-O 3.44Å; K31-G62 VanDerWaalsContact CE-C 3.44Å; K31-G62 WeakPolarHBondContact CE-O 3.36Å; L58-G62 PolarHBondContact O-N 3.38Å; W59-G62 PolarHBondContact O-N 3.39Å; W60-G62 VanDerWaalsContact C-N 3.26Å; W60-G62 PolarHBondContact O-N 2.81Å; G62-M66 PolarHBondContact O-N 3.45Å |
| 63 | L | 87.4 | Confident | 87.8 | Confident | 64 Ų | 64 | 62.6 Ų | 62.6 | 34% | 0.335 | 32% | 0.316 | S | S | . | . | H | α-helix | trans | -63.8 | -46.6 | 176.4 | -172.5 | 69.5 | 0 | 0 | 0 | 112.1 | W59 W60 M66 G67 | W59-L63 HydrophobicContact CH2-CD2 3.91Å; W59-L63 HydrophobicContact CZ3-CD2 4Å; W59-L63 PolarHBondContact O-N 3.31Å; W60-L63 HydrophobicContact CE3-CD2 3.81Å; W60-L63 HydrophobicContact CH2-CD2 4.49Å; W60-L63 HydrophobicContact CZ3-CD2 3.65Å; W60-L63 PolarHBondContact O-N 2.91Å; W60-L63 VanDerWaalsContact O-N 3.07Å; L63-M66 WeakPolarHBondContact O-CB 3.34Å; L63-M66 PolarHBondContact O-N 3.25Å; L63-G67 PolarHBondContact O-N 2.93Å |
| 64 | L | 91.4 | Very high | 88.4 | Confident | 117 Ų | 117 | 63.6 Ų | 63.6 | 61% | 0.613 | 32% | 0.322 | S | S | * | . | H | α-helix | trans | -62.7 | -42.7 | 177 | -71.4 | 170.7 | 0 | 0 | 0 | 111.7 | W60 M66 G67 A68 | W60-L64 WeakPolarHBondContact O-CG 3.21Å; W60-L64 PolarHBondContact O-N 2.87Å; L64-M66 VanDerWaalsContact C-N 3.32Å; L64-M66 PolarHBondContact O-N 2.81Å; L64-G67 PolarHBondContact O-N 3.35Å; L64-A68 PolarHBondContact O-N 3.15Å |
| 65 | S | 91.3 | Very high | 88.8 | Confident | 19 Ų | 19 | 61.3 Ų | 61.3 | 13% | 0.133 | 31% | 0.314 | C | S | . | . | H | α-helix | trans | -59.4 | -41.5 | 174.8 | -175.2 | 0 | 0 | 0 | 0 | 112.1 | F23 A61 A68 G69 | F23-S65 PolarHBondContact O-OG 3.18Å; A61-S65 VanDerWaalsContact O-CB 3.27Å; A61-S65 WeakPolarHBondContact O-CB 3.14Å; A61-S65 PolarHBondContact O-N 2.69Å; S65-A68 PolarHBondContact O-N 2.88Å; S65-G69 PolarHBondContact O-N 2.78Å |
| 66 | M | 91.2 | Very high | 89.4 | Confident | 58 Ų | 58 | 52 Ų | 52 | 29% | 0.286 | 27% | 0.274 | S | S | . | . | H | α-helix | trans | -62.8 | -46.6 | 175.6 | -175.5 | 178.2 | 175.2 | 0 | 0 | 111.1 | K31 G62 L63 L64 A68 G69 E70 | K31-M66 PolarHBondContact NZ-SD 2.88Å; G62-M66 PolarHBondContact O-N 3.45Å; L63-M66 WeakPolarHBondContact O-CB 3.34Å; L63-M66 PolarHBondContact O-N 3.25Å; L64-M66 VanDerWaalsContact C-N 3.32Å; L64-M66 PolarHBondContact O-N 2.81Å; M66-A68 PolarHBondContact O-N 3.29Å; M66-G69 PolarHBondContact O-N 2.89Å; M66-E70 WeakPolarHBondContact O-CG 3.5Å; M66-E70 PolarHBondContact O-N 3.36Å |
| 67 | G | 86.4 | Confident | 89.5 | Confident | 39 Ų | 39 | 52.4 Ų | 52.4 | 40% | 0.402 | 28% | 0.275 | S | S | . | . | H | α-helix | trans | -59.9 | -44.8 | 177.9 | 0 | 0 | 0 | 0 | 0 | 112.8 | L63 L64 G69 E70 V71 | L63-G67 PolarHBondContact O-N 2.93Å; L64-G67 PolarHBondContact O-N 3.35Å; G67-G69 VanDerWaalsContact C-N 3.31Å; G67-G69 PolarHBondContact O-N 3.01Å; G67-E70 PolarHBondContact O-N 3.22Å; G67-V71 WeakPolarHBondContact O-CG2 3.36Å; G67-V71 PolarHBondContact O-N 3.36Å |
| 68 | A | 91.3 | Very high | 89.4 | Confident | 46 Ų | 46 | 44.1 Ų | 44.1 | 38% | 0.38 | 25% | 0.247 | S | C | . | . | H | α-helix | trans | -60.9 | -40.9 | 175.2 | 0 | 0 | 0 | 0 | 0 | 112.1 | L64 S65 M66 V71 A72 | L64-A68 PolarHBondContact O-N 3.15Å; S65-A68 PolarHBondContact O-N 2.88Å; M66-A68 PolarHBondContact O-N 3.29Å; A68-V71 PolarHBondContact O-N 3.3Å; A68-A72 WeakPolarHBondContact O-CB 3.21Å; A68-A72 PolarHBondContact O-N 3.33Å |
| 69 | G | 91 | Very high | 89.4 | Confident | 0 Ų | 0 | 45.5 Ų | 45.5 | 0% | 0 | 25% | 0.252 | C | S | . | . | H | α-helix | trans | -62 | -47 | 175.6 | 0 | 0 | 0 | 0 | 0 | 112.9 | S20 S65 M66 G67 V71 A72 N73 | S20-G69 WeakPolarHBondContact CB-O 3.47Å; S20-G69 PolarHBondContact OG-O 3.47Å; S65-G69 PolarHBondContact O-N 2.78Å; M66-G69 PolarHBondContact O-N 2.89Å; G67-G69 VanDerWaalsContact C-N 3.31Å; G67-G69 PolarHBondContact O-N 3.01Å; G69-V71 PolarHBondContact O-N 2.92Å; G69-A72 PolarHBondContact O-N 3.25Å; G69-N73 WeakPolarHBondContact O-CB 3.49Å; G69-N73 PolarHBondContact O-N 3.11Å |
| 70 | E | 89.6 | Confident | 89.3 | Confident | 86 Ų | 86 | 43.7 Ų | 43.7 | 40% | 0.402 | 25% | 0.245 | S | C | . | . | H | α-helix | trans | -63.5 | -39.1 | 177.4 | -67.6 | -62.8 | 164.3 | 0 | 0 | 112.6 | M66 G67 N73 F74 | M66-E70 WeakPolarHBondContact O-CG 3.5Å; M66-E70 PolarHBondContact O-N 3.36Å; G67-E70 PolarHBondContact O-N 3.22Å; E70-N73 WeakPolarHBondContact O-CB 3.43Å; E70-N73 PolarHBondContact O-N 3.01Å; E70-F74 WeakPolarHBondContact O-CB 3.32Å; E70-F74 PolarHBondContact O-N 2.64Å |
| 71 | V | 89 | Confident | 89.2 | Confident | 102 Ų | 102 | 38.6 Ų | 38.6 | 62% | 0.618 | 23% | 0.226 | S | C | * | . | H | α-helix | trans | -63.9 | -43.6 | 174.4 | 171.9 | 0 | 0 | 0 | 0 | 110.9 | G67 A68 G69 N73 F74 A75 | G67-V71 WeakPolarHBondContact O-CG2 3.36Å; G67-V71 PolarHBondContact O-N 3.36Å; A68-V71 PolarHBondContact O-N 3.3Å; G69-V71 PolarHBondContact O-N 2.92Å; V71-N73 VanDerWaalsContact C-N 3.31Å; V71-N73 PolarHBondContact O-N 3.12Å; V71-F74 PolarHBondContact O-N 3.41Å; V71-A75 WeakPolarHBondContact O-CB 3.43Å; V71-A75 PolarHBondContact O-N 3.2Å |
| 72 | A | 92.6 | Very high | 89 | Confident | 13 Ų | 13 | 37.4 Ų | 37.4 | 11% | 0.107 | 22% | 0.216 | C | C | . | . | H | α-helix | trans | -63.7 | -37.4 | 175 | 0 | 0 | 0 | 0 | 0 | 111.8 | L16 A68 G69 A75 A76 | L16-A72 HydrophobicContact CD2-CB 4.48Å; A68-A72 WeakPolarHBondContact O-CB 3.21Å; A68-A72 PolarHBondContact O-N 3.33Å; G69-A72 PolarHBondContact O-N 3.25Å; A72-A75 PolarHBondContact O-N 3.24Å; A72-A76 WeakPolarHBondContact O-CB 3.5Å; A72-A76 PolarHBondContact O-N 3.28Å |
| 73 | N | 92.3 | Very high | 88.9 | Confident | 31 Ų | 31 | 37.5 Ų | 37.5 | 17% | 0.166 | 22% | 0.216 | C | C | . | . | H | α-helix | trans | -63.3 | -47.4 | 175.5 | -161.6 | 36.3 | 0 | 0 | 0 | 111.7 | S20 G69 E70 V71 A75 A76 Y77 | S20-N73 WeakPolarHBondContact OG-CB 3.42Å; G69-N73 WeakPolarHBondContact O-CB 3.49Å; G69-N73 PolarHBondContact O-N 3.11Å; E70-N73 WeakPolarHBondContact O-CB 3.43Å; E70-N73 PolarHBondContact O-N 3.01Å; V71-N73 VanDerWaalsContact C-N 3.31Å; V71-N73 PolarHBondContact O-N 3.12Å; N73-A75 VanDerWaalsContact C-N 3.32Å; N73-A75 PolarHBondContact O-N 3.4Å; N73-A76 WeakPolarHBondContact O-CB 3.49Å; N73-A76 PolarHBondContact O-N 3.22Å; N73-Y77 VanDerWaalsContact O-CD2 3.25Å; N73-Y77 WeakPolarHBondContact O-CD2 3.4Å; N73-Y77 PolarHBondContact O-N 2.95Å |
| 74 | F | 89.3 | Confident | 88.9 | Confident | 78 Ų | 78 | 34.6 Ų | 34.6 | 34% | 0.342 | 20% | 0.201 | S | C | . | . | H | α-helix | trans | -59.9 | -45.3 | 176.1 | -180 | -88.3 | 0 | 0 | 0 | 111 | E70 V71 A76 Y77 V196 | E70-F74 WeakPolarHBondContact O-CB 3.32Å; E70-F74 PolarHBondContact O-N 2.64Å; V71-F74 PolarHBondContact O-N 3.41Å; F74-A76 VanDerWaalsContact C-N 3.32Å; F74-A76 PolarHBondContact O-N 3.02Å; F74-Y77 PolarHBondContact O-N 3.42Å; F74-V196 HydrophobicContact CD2-CB 4.36Å; F74-V196 HydrophobicContact CD2-CG1 3.46Å; F74-V196 VanDerWaalsContact CD2-CG1 3.46Å; F74-V196 HydrophobicContact CD2-CG2 4.12Å; F74-V196 HydrophobicContact CE2-CB 4.12Å; F74-V196 HydrophobicContact CE2-CG1 3.51Å; F74-V196 HydrophobicContact CE2-CG2 3.96Å; F74-V196 HydrophobicContact CG-CG1 4.3Å; F74-V196 HydrophobicContact CZ-CG1 4.36Å |
| 75 | A | 90.2 | Very high | 88.8 | Confident | 26 Ų | 26 | 29 Ų | 29 | 22% | 0.215 | 17% | 0.172 | C | C | . | . | H | α-helix | trans | -60.7 | -42 | 175.4 | 0 | 0 | 0 | 0 | 0 | 111.2 | L16 V71 A72 N73 Y77 A78 F79 | L16-A75 HydrophobicContact CD1-CB 3.9Å; V71-A75 WeakPolarHBondContact O-CB 3.43Å; V71-A75 PolarHBondContact O-N 3.2Å; A72-A75 PolarHBondContact O-N 3.24Å; N73-A75 VanDerWaalsContact C-N 3.32Å; N73-A75 PolarHBondContact O-N 3.4Å; A75-Y77 VanDerWaalsContact C-N 3.31Å; A75-Y77 PolarHBondContact O-N 3.14Å; A75-A78 WeakPolarHBondContact O-CB 3.31Å; A75-A78 PolarHBondContact O-N 2.91Å; A75-F79 WeakPolarHBondContact O-CD2 2.79Å; A75-F79 PolarHBondContact O-N 3.42Å |
| 76 | A | 91.6 | Very high | 88.7 | Confident | 0 Ų | 0 | 28.4 Ų | 28.4 | 0% | 0 | 17% | 0.168 | C | C | . | . | H | α-helix | trans | -55.9 | -42.6 | 178.4 | 0 | 0 | 0 | 0 | 0 | 112.6 | G13 L16 A17 A72 N73 F74 A78 F79 A80 V85 | G13-A76 WeakPolarHBondContact O-CB 3.47Å; L16-A76 HydrophobicContact CB-CB 3.82Å; A17-A76 HydrophobicContact CB-CB 3.98Å; A72-A76 WeakPolarHBondContact O-CB 3.5Å; A72-A76 PolarHBondContact O-N 3.28Å; N73-A76 WeakPolarHBondContact O-CB 3.49Å; N73-A76 PolarHBondContact O-N 3.22Å; F74-A76 VanDerWaalsContact C-N 3.32Å; F74-A76 PolarHBondContact O-N 3.02Å; A76-A78 PolarHBondContact O-N 3.25Å; A76-F79 PolarHBondContact O-N 3.31Å; A76-A80 PolarHBondContact O-N 3.43Å; A76-V85 HydrophobicContact CB-CG1 3.95Å; A76-V85 HydrophobicContact CB-CG2 4.06Å |
| 77 | Y | 88 | Confident | 88.4 | Confident | 19 Ų | 19 | 25.9 Ų | 25.9 | 8% | 0.075 | 16% | 0.155 | C | C | . | . | H | α-helix | trans | -63 | -20.5 | 175.9 | -75.7 | -66.8 | 0 | 0 | 0 | 114.4 | N73 F74 A75 A82 V85 T86 V193 V196 K197 | N73-Y77 VanDerWaalsContact O-CD2 3.25Å; N73-Y77 WeakPolarHBondContact O-CD2 3.4Å; N73-Y77 PolarHBondContact O-N 2.95Å; F74-Y77 PolarHBondContact O-N 3.42Å; A75-Y77 VanDerWaalsContact C-N 3.31Å; A75-Y77 PolarHBondContact O-N 3.14Å; Y77-A82 HydrophobicContact CD1-CB 4.12Å; Y77-A82 HydrophobicContact CE1-CB 4.03Å; Y77-V85 HydrophobicContact CD1-CB 3.9Å; Y77-V85 HydrophobicContact CD1-CG1 3.88Å; Y77-V85 HydrophobicContact CD1-CG2 4.44Å; Y77-V85 HydrophobicContact CD2-CG1 4.02Å; Y77-V85 HydrophobicContact CE1-CB 3.67Å; Y77-V85 HydrophobicContact CE1-CG1 3.64Å; Y77-V85 HydrophobicContact CE2-CG1 3.78Å; Y77-V85 HydrophobicContact CG-CG1 4.07Å; Y77-T86 PolarHBondContact OH-OG1 2.72Å; Y77-V193 HydrophobicContact CD1-CG1 3.84Å; Y77-V193 HydrophobicContact CE1-CG1 3.45Å; Y77-V193 VanDerWaalsContact CE1-CG1 3.45Å; Y77-V196 HydrophobicContact CD2-CG1 4.08Å; Y77-V196 HydrophobicContact CG-CG1 4.19Å; Y77-K197 WeakPolarHBondContact O-CG 3.25Å |
| 78 | A | 85.7 | Confident | 88.4 | Confident | 17 Ų | 17 | 24.3 Ų | 24.3 | 14% | 0.14 | 14% | 0.138 | C | C | . | . | H | α-helix | trans | -81.3 | -19.7 | 175.1 | 0 | 0 | 0 | 0 | 0 | 112.8 | A75 A76 K204 | A75-A78 WeakPolarHBondContact O-CB 3.31Å; A75-A78 PolarHBondContact O-N 2.91Å; A76-A78 PolarHBondContact O-N 3.25Å; A78-K204 WeakPolarHBondContact O-CE 3.4Å; A78-K204 PolarHBondContact O-NZ 3.26Å |
| 79 | F | 85.1 | Confident | 88.1 | Confident | 66 Ų | 66 | 23.4 Ų | 23.4 | 29% | 0.289 | 13% | 0.133 | S | C | . | . | H | α-helix | trans | -116.2 | -21.7 | -173.2 | -70.5 | -79.6 | 0 | 0 | 0 | 114 | D9 I12 L16 A75 A76 K204 | D9-F79 CarbonylContact C-O 3.59Å; D9-F79 HydrophobicContact CB-CD1 4.26Å; I12-F79 HydrophobicContact CG2-CB 4.47Å; I12-F79 HydrophobicContact CG2-CD1 4.18Å; I12-F79 HydrophobicContact CG2-CD2 4.23Å; I12-F79 HydrophobicContact CG2-CG 4.06Å; L16-F79 HydrophobicContact CD1-CD2 3.87Å; L16-F79 HydrophobicContact CD1-CE2 4.34Å; A75-F79 WeakPolarHBondContact O-CD2 2.79Å; A75-F79 PolarHBondContact O-N 3.42Å; A76-F79 PolarHBondContact O-N 3.31Å; F79-K204 VanDerWaalsContact CD1-CE 3.44Å; F79-K204 VanDerWaalsContact CZ-CE 3.49Å |
| 80 | A | 87.2 | Confident | 87.7 | Confident | 0 Ų | 0 | 23.6 Ų | 23.6 | 0% | 0 | 14% | 0.135 | C | C | . | . | S | Bend | trans | -134.6 | 158.8 | -176.7 | 0 | 0 | 0 | 0 | 0 | 112.3 | A76 L84 V85 | A76-A80 PolarHBondContact O-N 3.43Å; A80-L84 HydrophobicContact CB-CD2 4.28Å; A80-V85 HydrophobicContact CB-CG2 3.83Å |
| 81 | P | 84.5 | Confident | 87.6 | Confident | 4 Ų | 4 | 20.7 Ų | 20.7 | 3% | 0.026 | 12% | 0.122 | C | C | . | . | trans | -58.8 | 138.9 | -179.2 | 5.1 | -16.3 | 0 | 0 | 0 | 114.7 | F10 T83 L84 V85 E133 | F10-P81 HydrophobicContact CD2-CG 4.46Å; F10-P81 HydrophobicContact CE2-CG 4.19Å; P81-T83 PolarHBondContact O-N 3.43Å; P81-L84 HydrophobicContact CB-CB 4.41Å; P81-L84 HydrophobicContact CG-CB 4.05Å; P81-L84 PolarHBondContact O-N 3.02Å; P81-V85 WeakPolarHBondContact O-CG2 3.45Å; P81-V85 PolarHBondContact O-N 2.96Å; P81-E133 WeakPolarHBondContact CA-OE1 3.28Å; P81-E133 VanDerWaalsContact CB-CD 3.43Å; P81-E133 HydrophobicContact CB-CG 3.7Å; P81-E133 WeakPolarHBondContact CB-OE1 3.35Å; P81-E133 HydrophobicContact CG-CG 4.07Å | ||
| 82 | A | 86.1 | Confident | 87.6 | Confident | 1 Ų | 1 | 16.5 Ų | 16.5 | 1% | 0.008 | 10% | 0.097 | C | C | . | . | H | α-helix | trans | -59 | -36.1 | 171.4 | 0 | 0 | 0 | 0 | 0 | 111.2 | Y77 L84 V85 T86 V193 V260 S264 | Y77-A82 HydrophobicContact CD1-CB 4.12Å; Y77-A82 HydrophobicContact CE1-CB 4.03Å; A82-L84 PolarHBondContact O-N 3.49Å; A82-L84 VanDerWaalsContact O-N 3.14Å; A82-V85 PolarHBondContact O-N 3.31Å; A82-T86 WeakPolarHBondContact O-CB 3.15Å; A82-T86 PolarHBondContact O-N 2.87Å; A82-T86 PolarHBondContact O-OG1 2.98Å; A82-V193 HydrophobicContact CB-CG1 3.63Å; A82-V260 HydrophobicContact CB-CG1 4.1Å; A82-S264 WeakPolarHBondContact CB-OG 3.37Å |
| 83 | T | 85.2 | Confident | 87.2 | Confident | 1 Ų | 1 | 18.4 Ų | 18.4 | 1% | 0.006 | 11% | 0.107 | C | C | . | . | H | α-helix | trans | -49.4 | -33.8 | 170.2 | -62.2 | 0 | 0 | 0 | 0 | 113.1 | P81 P87 M126 P131 L261 E270 T282 | P81-T83 PolarHBondContact O-N 3.43Å; T83-P87 WeakPolarHBondContact O-CD 3.29Å; T83-P87 VanDerWaalsContact O-CG 3.29Å; T83-P87 WeakPolarHBondContact O-CG 3.24Å; T83-M126 WeakPolarHBondContact O-CE 3.4Å; T83-P131 HydrophobicContact CG2-CG 3.9Å; T83-L261 HydrophobicContact CG2-CD1 3.25Å; T83-E270 PolarHBondContact OG1-OE2 3.39Å; T83-T282 HydrophobicContact CG2-CG2 4.34Å |
| 84 | L | 88.1 | Confident | 86.9 | Confident | 3 Ų | 3 | 17.4 Ų | 17.4 | 2% | 0.016 | 10% | 0.102 | C | C | . | . | H | α-helix | trans | -97.8 | -42.8 | -179.9 | 172.9 | 148.5 | 0 | 0 | 0 | 112.7 | F10 L14 A80 P81 A82 P87 L88 V127 A130 | F10-L84 HydrophobicContact CE2-CD1 3.76Å; F10-L84 HydrophobicContact CZ-CD1 3.57Å; L14-L84 HydrophobicContact CD1-CD1 4.48Å; L14-L84 HydrophobicContact CD1-CD2 4.13Å; A80-L84 HydrophobicContact CB-CD2 4.28Å; P81-L84 HydrophobicContact CB-CB 4.41Å; P81-L84 HydrophobicContact CG-CB 4.05Å; P81-L84 PolarHBondContact O-N 3.02Å; A82-L84 PolarHBondContact O-N 3.49Å; A82-L84 VanDerWaalsContact O-N 3.14Å; L84-P87 WeakPolarHBondContact O-CD 3.21Å; L84-L88 HydrophobicContact CD2-CD1 3.33Å; L84-L88 HydrophobicContact CG-CD1 3.77Å; L84-L88 WeakPolarHBondContact O-CB 3.35Å; L84-L88 VanDerWaalsContact O-CD1 3.32Å; L84-L88 WeakPolarHBondContact O-CD1 3.28Å; L84-L88 VanDerWaalsContact O-CG 3.26Å; L84-L88 WeakPolarHBondContact O-CG 3.35Å; L84-L88 PolarHBondContact O-N 3.38Å; L84-V127 HydrophobicContact CD1-CB 4.24Å; L84-V127 HydrophobicContact CD1-CG1 4.15Å; L84-V127 HydrophobicContact CD1-CG2 3.89Å; L84-V127 HydrophobicContact CG-CG2 4.21Å; L84-A130 HydrophobicContact CB-CB 4.36Å; L84-A130 HydrophobicContact CD1-CB 3.78Å |
| 85 | V | 90 | Very high | 86.8 | Confident | 1 Ų | 1 | 15.1 Ų | 15.1 | 1% | 0.006 | 9% | 0.094 | C | C | . | . | H | α-helix | trans | -68.9 | -41.3 | -173.9 | 177.6 | 0 | 0 | 0 | 0 | 111.2 | A17 A76 Y77 A80 P81 A82 L88 G89 | A17-V85 HydrophobicContact CB-CG1 4.33Å; A17-V85 HydrophobicContact CB-CG2 4.43Å; A76-V85 HydrophobicContact CB-CG1 3.95Å; A76-V85 HydrophobicContact CB-CG2 4.06Å; Y77-V85 HydrophobicContact CD1-CB 3.9Å; Y77-V85 HydrophobicContact CD1-CG1 3.88Å; Y77-V85 HydrophobicContact CD1-CG2 4.44Å; Y77-V85 HydrophobicContact CD2-CG1 4.02Å; Y77-V85 HydrophobicContact CE1-CB 3.67Å; Y77-V85 HydrophobicContact CE1-CG1 3.64Å; Y77-V85 HydrophobicContact CE2-CG1 3.78Å; Y77-V85 HydrophobicContact CG-CG1 4.07Å; A80-V85 HydrophobicContact CB-CG2 3.83Å; P81-V85 WeakPolarHBondContact O-CG2 3.45Å; P81-V85 PolarHBondContact O-N 2.96Å; A82-V85 PolarHBondContact O-N 3.31Å; V85-L88 PolarHBondContact O-N 2.79Å; V85-G89 PolarHBondContact O-N 2.73Å |
| 86 | T | 89.1 | Confident | 86.6 | Confident | 6 Ų | 6 | 14.9 Ų | 14.9 | 4% | 0.037 | 9% | 0.091 | C | C | . | . | H | α-helix | trans | -62.8 | -48.1 | -178.3 | -62.9 | 0 | 0 | 0 | 0 | 112.8 | Y77 A82 L88 G89 F256 T257 V260 | Y77-T86 PolarHBondContact OH-OG1 2.72Å; A82-T86 WeakPolarHBondContact O-CB 3.15Å; A82-T86 PolarHBondContact O-N 2.87Å; A82-T86 PolarHBondContact O-OG1 2.98Å; T86-L88 PolarHBondContact O-N 3.33Å; T86-G89 PolarHBondContact O-N 3.49Å; T86-G89 VanDerWaalsContact O-N 3.16Å; T86-F256 HydrophobicContact CG2-CD1 3.9Å; T86-F256 HydrophobicContact CG2-CE1 3.57Å; T86-T257 HydrophobicContact CG2-CG2 4.25Å; T86-V260 HydrophobicContact CG2-CB 4.21Å; T86-V260 HydrophobicContact CG2-CG1 4.25Å; T86-V260 HydrophobicContact CG2-CG2 4.2Å; T86-V260 WeakPolarHBondContact OG1-CG1 3.32Å |
| 87 | P | 84.3 | Confident | 86.2 | Confident | 4 Ų | 4 | 15.8 Ų | 15.8 | 3% | 0.026 | 10% | 0.098 | C | C | . | . | H | α-helix | trans | -68 | -35.4 | 179.7 | -25.4 | 39.6 | 0 | 0 | 0 | 112.9 | T83 L84 G89 A90 M126 Y253 T257 I289 | T83-P87 WeakPolarHBondContact O-CD 3.29Å; T83-P87 VanDerWaalsContact O-CG 3.29Å; T83-P87 WeakPolarHBondContact O-CG 3.24Å; L84-P87 WeakPolarHBondContact O-CD 3.21Å; P87-G89 PolarHBondContact O-N 3.02Å; P87-A90 WeakPolarHBondContact O-CB 3.35Å; P87-A90 PolarHBondContact O-N 2.95Å; P87-M126 HydrophobicContact CB-CE 3.88Å; P87-M126 HydrophobicContact CB-SD 3.6Å; P87-M126 HydrophobicContact CG-CE 3.46Å; P87-M126 VanDerWaalsContact CG-CE 3.46Å; P87-M126 HydrophobicContact CG-SD 3.72Å; P87-Y253 VanDerWaalsContact CA-OH 3.23Å; P87-Y253 WeakPolarHBondContact CA-OH 3.44Å; P87-Y253 PolarHBondContact O-OH 3.37Å; P87-T257 HydrophobicContact CB-CG2 4.36Å; P87-T257 HydrophobicContact CG-CG2 3.65Å; P87-I289 HydrophobicContact CB-CD1 4.01Å |
| 88 | L | 86.9 | Confident | 86 | Confident | 7 Ų | 7 | 18.8 Ų | 18.8 | 4% | 0.037 | 12% | 0.115 | C | C | . | . | H | α-helix | trans | -58.7 | -25.8 | 173.9 | -78 | 167.4 | 0 | 0 | 0 | 112.6 | L14 A17 S21 L84 V85 T86 A90 L91 V127 | L14-L88 HydrophobicContact CD1-CD1 3.74Å; A17-L88 HydrophobicContact CB-CB 4.46Å; A17-L88 HydrophobicContact CB-CD1 3.88Å; S21-L88 PolarHBondContact OG-O 3.22Å; S21-L88 VanDerWaalsContact OG-O 3.13Å; L84-L88 HydrophobicContact CD2-CD1 3.33Å; L84-L88 HydrophobicContact CG-CD1 3.77Å; L84-L88 WeakPolarHBondContact O-CB 3.35Å; L84-L88 VanDerWaalsContact O-CD1 3.32Å; L84-L88 WeakPolarHBondContact O-CD1 3.28Å; L84-L88 VanDerWaalsContact O-CG 3.26Å; L84-L88 WeakPolarHBondContact O-CG 3.35Å; L84-L88 PolarHBondContact O-N 3.38Å; V85-L88 PolarHBondContact O-N 2.79Å; T86-L88 PolarHBondContact O-N 3.33Å; L88-A90 PolarHBondContact O-N 3.19Å; L88-A90 VanDerWaalsContact O-N 3.1Å; L88-L91 HydrophobicContact CD2-CD1 3.4Å; L88-L91 HydrophobicContact CD2-CG 4.28Å; L88-L91 WeakPolarHBondContact O-CB 3.41Å; L88-L91 WeakPolarHBondContact O-CG 3.49Å; L88-L91 PolarHBondContact O-N 3.46Å; L88-V127 HydrophobicContact CD1-CG2 4.31Å; L88-V127 HydrophobicContact CD2-CG2 4.2Å |
| 89 | G | 84.1 | Confident | 85.9 | Confident | 27 Ų | 27 | 20.2 Ų | 20.2 | 28% | 0.278 | 12% | 0.12 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -54.1 | -27.8 | 171.3 | 0 | 0 | 0 | 0 | 0 | 113.7 | V85 T86 P87 L91 S92 | V85-G89 PolarHBondContact O-N 2.73Å; T86-G89 PolarHBondContact O-N 3.49Å; T86-G89 VanDerWaalsContact O-N 3.16Å; P87-G89 PolarHBondContact O-N 3.02Å; G89-L91 PolarHBondContact O-N 3.11Å; G89-S92 WeakPolarHBondContact O-CB 3.48Å; G89-S92 PolarHBondContact O-N 2.71Å; G89-S92 VanDerWaalsContact O-N 3.09Å; G89-S92 PolarHBondContact O-OG 2.87Å |
| 90 | A | 83.9 | Confident | 85.8 | Confident | 4 Ų | 4 | 17.6 Ų | 17.6 | 3% | 0.033 | 11% | 0.11 | C | C | . | . | H | α-helix | trans | -60.8 | -28.7 | 172.2 | 0 | 0 | 0 | 0 | 0 | 113.5 | P87 L88 S92 V93 L94 Y253 I289 I293 | P87-A90 WeakPolarHBondContact O-CB 3.35Å; P87-A90 PolarHBondContact O-N 2.95Å; L88-A90 PolarHBondContact O-N 3.19Å; L88-A90 VanDerWaalsContact O-N 3.1Å; A90-S92 PolarHBondContact O-N 3.3Å; A90-V93 WeakPolarHBondContact O-CB 3.29Å; A90-V93 PolarHBondContact O-N 2.84Å; A90-V93 VanDerWaalsContact O-N 3.08Å; A90-L94 PolarHBondContact O-N 3.05Å; A90-Y253 HydrophobicContact CB-CD2 4.43Å; A90-Y253 HydrophobicContact CB-CE2 3.56Å; A90-Y253 WeakPolarHBondContact CB-OH 3.33Å; A90-I289 HydrophobicContact CB-CG2 4.09Å; A90-I293 HydrophobicContact CB-CD1 3.64Å; A90-I293 HydrophobicContact CB-CG1 4.37Å |
| 91 | L | 87.2 | Confident | 85.6 | Confident | 25 Ų | 25 | 19.3 Ų | 19.3 | 13% | 0.131 | 12% | 0.121 | C | C | . | . | H | α-helix | trans | -63.1 | -25 | 177.1 | -61.8 | -178.9 | 0 | 0 | 0 | 111.5 | L88 G89 V93 L94 V95 | L88-L91 HydrophobicContact CD2-CD1 3.4Å; L88-L91 HydrophobicContact CD2-CG 4.28Å; L88-L91 WeakPolarHBondContact O-CB 3.41Å; L88-L91 WeakPolarHBondContact O-CG 3.49Å; L88-L91 PolarHBondContact O-N 3.46Å; G89-L91 PolarHBondContact O-N 3.11Å; L91-V93 VanDerWaalsContact C-N 3.31Å; L91-V93 PolarHBondContact O-N 2.57Å; L91-L94 HydrophobicContact CD2-CD2 3.82Å; L91-L94 WeakPolarHBondContact O-CB 3.41Å; L91-L94 PolarHBondContact O-N 2.94Å; L91-V95 WeakPolarHBondContact O-CB 3.49Å; L91-V95 VanDerWaalsContact O-CG2 3.26Å; L91-V95 WeakPolarHBondContact O-CG2 3.31Å; L91-V95 PolarHBondContact O-N 3.45Å |
| 92 | S | 87.6 | Confident | 85.5 | Confident | 14 Ų | 14 | 27.4 Ų | 27.4 | 10% | 0.098 | 15% | 0.153 | C | C | . | . | H | α-helix | trans | -63.4 | -38.3 | 173.7 | 72.1 | 0 | 0 | 0 | 0 | 112.4 | S21 G25 G89 A90 V95 S96 | S21-S92 WeakPolarHBondContact O-CA 3.45Å; S21-S92 WeakPolarHBondContact O-CB 3.2Å; G25-S92 WeakPolarHBondContact CA-O 3.48Å; G89-S92 WeakPolarHBondContact O-CB 3.48Å; G89-S92 PolarHBondContact O-N 2.71Å; G89-S92 VanDerWaalsContact O-N 3.09Å; G89-S92 PolarHBondContact O-OG 2.87Å; A90-S92 PolarHBondContact O-N 3.3Å; S92-V95 PolarHBondContact O-N 2.72Å; S92-S96 WeakPolarHBondContact O-CB 3.49Å; S92-S96 PolarHBondContact O-N 3.42Å |
| 93 | V | 84.9 | Confident | 85.2 | Confident | 52 Ų | 52 | 32.1 Ų | 32.1 | 32% | 0.315 | 17% | 0.173 | S | C | . | . | H | α-helix | trans | -67.2 | -43.6 | 176.1 | -177.6 | 0 | 0 | 0 | 0 | 110 | A90 L91 S96 A97 L296 | A90-V93 WeakPolarHBondContact O-CB 3.29Å; A90-V93 PolarHBondContact O-N 2.84Å; A90-V93 VanDerWaalsContact O-N 3.08Å; L91-V93 VanDerWaalsContact C-N 3.31Å; L91-V93 PolarHBondContact O-N 2.57Å; V93-S96 WeakPolarHBondContact O-CB 3.49Å; V93-S96 PolarHBondContact O-N 3.26Å; V93-A97 WeakPolarHBondContact O-CB 3.31Å; V93-A97 PolarHBondContact O-N 2.96Å; V93-L296 HydrophobicContact CG1-CD2 3.86Å |
| 94 | L | 86.6 | Confident | 84.9 | Confident | 11 Ų | 11 | 33.7 Ų | 33.7 | 6% | 0.058 | 18% | 0.181 | C | C | . | . | H | α-helix | trans | -58.6 | -51.6 | 174.3 | 170.1 | 64.9 | 0 | 0 | 0 | 112 | A90 L91 S96 A97 I98 C116 I120 | A90-L94 PolarHBondContact O-N 3.05Å; L91-L94 HydrophobicContact CD2-CD2 3.82Å; L91-L94 WeakPolarHBondContact O-CB 3.41Å; L91-L94 PolarHBondContact O-N 2.94Å; L94-S96 VanDerWaalsContact C-N 3.26Å; L94-S96 PolarHBondContact O-N 2.87Å; L94-A97 PolarHBondContact O-N 2.95Å; L94-A97 VanDerWaalsContact O-N 3.11Å; L94-I98 HydrophobicContact CD1-CD1 3.65Å; L94-I98 HydrophobicContact CD1-CG1 4.07Å; L94-I98 HydrophobicContact CG-CD1 3.88Å; L94-I98 WeakPolarHBondContact O-CG1 3.29Å; L94-I98 PolarHBondContact O-N 3.29Å; L94-C116 HydrophobicContact CD1-CB 3.32Å; L94-C116 WeakPolarHBondContact CD1-SG 3.43Å; L94-I120 HydrophobicContact CD2-CD1 3.91Å; L94-I120 HydrophobicContact CD2-CG1 3.39Å |
| 95 | V | 86.9 | Confident | 84.2 | Confident | 30 Ų | 30 | 40.4 Ų | 40.4 | 18% | 0.182 | 22% | 0.217 | C | C | . | . | H | α-helix | trans | -58.6 | -43.4 | 178.5 | 169.3 | 0 | 0 | 0 | 0 | 109.8 | I22 L91 S92 A97 I98 L99 | I22-V95 HydrophobicContact CG1-CG2 4.37Å; L91-V95 WeakPolarHBondContact O-CB 3.49Å; L91-V95 VanDerWaalsContact O-CG2 3.26Å; L91-V95 WeakPolarHBondContact O-CG2 3.31Å; L91-V95 PolarHBondContact O-N 3.45Å; S92-V95 PolarHBondContact O-N 2.72Å; V95-A97 PolarHBondContact O-N 2.94Å; V95-I98 PolarHBondContact O-N 3.08Å; V95-L99 HydrophobicContact CG1-CD1 3.52Å; V95-L99 HydrophobicContact CG1-CG 4.1Å; V95-L99 VanDerWaalsContact O-CB 3.27Å; V95-L99 WeakPolarHBondContact O-CB 3.48Å; V95-L99 WeakPolarHBondContact O-CG 3.5Å; V95-L99 PolarHBondContact O-N 3.36Å |
| 96 | S | 84.8 | Confident | 83.6 | Confident | 21 Ų | 21 | 44.1 Ų | 44.1 | 15% | 0.147 | 24% | 0.235 | C | C | . | . | H | α-helix | trans | -59.7 | -46.1 | 175.1 | -159.5 | 0 | 0 | 0 | 0 | 111.9 | G25 F28 I29 S92 V93 L94 L99 S100 | G25-S96 WeakPolarHBondContact O-CB 3.47Å; G25-S96 PolarHBondContact O-OG 3.48Å; F28-S96 WeakPolarHBondContact CB-OG 3.48Å; I29-S96 WeakPolarHBondContact CD1-O 3.48Å; S92-S96 WeakPolarHBondContact O-CB 3.49Å; S92-S96 PolarHBondContact O-N 3.42Å; V93-S96 WeakPolarHBondContact O-CB 3.49Å; V93-S96 PolarHBondContact O-N 3.26Å; L94-S96 VanDerWaalsContact C-N 3.26Å; L94-S96 PolarHBondContact O-N 2.87Å; S96-L99 PolarHBondContact O-N 2.98Å; S96-S100 VanDerWaalsContact O-CB 3.29Å; S96-S100 WeakPolarHBondContact O-CB 3.34Å; S96-S100 PolarHBondContact O-N 2.89Å |
| 97 | A | 83.1 | Confident | 82.8 | Confident | 19 Ų | 19 | 55.2 Ų | 55.2 | 16% | 0.157 | 28% | 0.276 | C | S | . | . | H | α-helix | trans | -62.2 | -45.2 | 179.5 | 0 | 0 | 0 | 0 | 0 | 112.6 | V93 L94 V95 S100 S101 L108 L296 | V93-A97 WeakPolarHBondContact O-CB 3.31Å; V93-A97 PolarHBondContact O-N 2.96Å; L94-A97 PolarHBondContact O-N 2.95Å; L94-A97 VanDerWaalsContact O-N 3.11Å; V95-A97 PolarHBondContact O-N 2.94Å; A97-S100 PolarHBondContact O-N 3.07Å; A97-S101 PolarHBondContact O-N 3.44Å; A97-L108 HydrophobicContact CB-CD2 4.33Å; A97-L296 HydrophobicContact CB-CD1 4.28Å; A97-L296 HydrophobicContact CB-CD2 4.47Å |
| 98 | I | 85.1 | Confident | 82.1 | Confident | 82 Ų | 82 | 57.4 Ų | 57.4 | 42% | 0.421 | 29% | 0.287 | S | S | . | . | H | α-helix | trans | -63.7 | -49.5 | 177.7 | -66 | 169.9 | 0 | 0 | 0 | 110.4 | L94 V95 S100 S101 Y102 | L94-I98 HydrophobicContact CD1-CD1 3.65Å; L94-I98 HydrophobicContact CD1-CG1 4.07Å; L94-I98 HydrophobicContact CG-CD1 3.88Å; L94-I98 WeakPolarHBondContact O-CG1 3.29Å; L94-I98 PolarHBondContact O-N 3.29Å; V95-I98 PolarHBondContact O-N 3.08Å; I98-S100 VanDerWaalsContact C-N 3.3Å; I98-S100 PolarHBondContact O-N 3.23Å; I98-S101 WeakPolarHBondContact O-CB 3.37Å; I98-S101 PolarHBondContact O-N 3.15Å; I98-Y102 PolarHBondContact O-N 3.33Å |
| 99 | L | 84.2 | Confident | 81.7 | Confident | 47 Ų | 47 | 58.9 Ų | 58.9 | 25% | 0.246 | 30% | 0.295 | C | S | . | . | H | α-helix | trans | -65.4 | -33.3 | 179.1 | -69.3 | 175.7 | 0 | 0 | 0 | 111.9 | I29 V95 S96 Y102 F103 | I29-L99 HydrophobicContact CB-CB 4.45Å; I29-L99 HydrophobicContact CG1-CB 3.73Å; I29-L99 HydrophobicContact CG2-CB 4.49Å; V95-L99 HydrophobicContact CG1-CD1 3.52Å; V95-L99 HydrophobicContact CG1-CG 4.1Å; V95-L99 VanDerWaalsContact O-CB 3.27Å; V95-L99 WeakPolarHBondContact O-CB 3.48Å; V95-L99 WeakPolarHBondContact O-CG 3.5Å; V95-L99 PolarHBondContact O-N 3.36Å; S96-L99 PolarHBondContact O-N 2.98Å; L99-Y102 PolarHBondContact O-N 3.43Å; L99-F103 HydrophobicContact CB-CD2 4.25Å; L99-F103 HydrophobicContact CD2-CD2 4Å; L99-F103 HydrophobicContact CD2-CE2 3.68Å; L99-F103 WeakPolarHBondContact O-CB 3.41Å; L99-F103 WeakPolarHBondContact O-CD2 3.42Å; L99-F103 PolarHBondContact O-N 3.46Å |
| 100 | S | 83 | Confident | 81.6 | Confident | 11 Ų | 11 | 60.9 Ų | 60.9 | 8% | 0.077 | 30% | 0.299 | C | S | . | . | H | α-helix | trans | -64.8 | -42.7 | 173.8 | -143.6 | 0 | 0 | 0 | 0 | 111.2 | S96 A97 I98 Y102 L104 E106 | S96-S100 VanDerWaalsContact O-CB 3.29Å; S96-S100 WeakPolarHBondContact O-CB 3.34Å; S96-S100 PolarHBondContact O-N 2.89Å; A97-S100 PolarHBondContact O-N 3.07Å; I98-S100 VanDerWaalsContact C-N 3.3Å; I98-S100 PolarHBondContact O-N 3.23Å; S100-Y102 VanDerWaalsContact C-N 3.33Å; S100-Y102 PolarHBondContact O-N 3.02Å; S100-L104 WeakPolarHBondContact O-CA 3.28Å; S100-L104 VanDerWaalsContact O-CB 3.28Å; S100-L104 WeakPolarHBondContact O-CB 3.12Å; S100-L104 PolarHBondContact O-N 2.85Å; S100-E106 PolarHBondContact OG-OE2 3.1Å; S100-E106 VanDerWaalsContact OG-OE2 3.11Å |
| 101 | S | 82.1 | Confident | 81.5 | Confident | 35 Ų | 35 | 62.9 Ų | 62.9 | 25% | 0.245 | 31% | 0.307 | C | S | . | . | H | α-helix | trans | -62 | -42.6 | 176.5 | -162.9 | 0 | 0 | 0 | 0 | 112.3 | A97 I98 N105 E106 L108 | A97-S101 PolarHBondContact O-N 3.44Å; I98-S101 WeakPolarHBondContact O-CB 3.37Å; I98-S101 PolarHBondContact O-N 3.15Å; S101-N105 VanDerWaalsContact O-CA 3.3Å; S101-N105 WeakPolarHBondContact O-CA 2.99Å; S101-N105 PolarHBondContact O-N 3.14Å; S101-E106 WeakPolarHBondContact CA-O 3.32Å; S101-E106 WeakPolarHBondContact CB-O 3.26Å; S101-E106 PolarHBondContact OG-O 3.05Å; S101-L108 VanDerWaalsContact CB-CD1 3.49Å |
| 102 | Y | 82.8 | Confident | 81.4 | Confident | 175 Ų | 175 | 62 Ų | 62 | 69% | 0.686 | 30% | 0.304 | S | S | * | . | H | α-helix | trans | -74 | -48.6 | -179.5 | -172.5 | -100.1 | 0 | 0 | 0 | 113.5 | I98 L99 S100 | I98-Y102 PolarHBondContact O-N 3.33Å; L99-Y102 PolarHBondContact O-N 3.43Å; S100-Y102 VanDerWaalsContact C-N 3.33Å; S100-Y102 PolarHBondContact O-N 3.02Å |
| 103 | F | 80.4 | Confident | 81.3 | Confident | 100 Ų | 100 | 67.5 Ų | 67.5 | 44% | 0.439 | 33% | 0.327 | S | S | . | . | H | α-helix | trans | -89.1 | -24.3 | -172.1 | -76.8 | -70.7 | 0 | 0 | 0 | 114.8 | I29 L99 | I29-F103 HydrophobicContact CG2-CB 4.09Å; I29-F103 HydrophobicContact CG2-CD2 4.43Å; L99-F103 HydrophobicContact CB-CD2 4.25Å; L99-F103 HydrophobicContact CD2-CD2 4Å; L99-F103 HydrophobicContact CD2-CE2 3.68Å; L99-F103 WeakPolarHBondContact O-CB 3.41Å; L99-F103 WeakPolarHBondContact O-CD2 3.42Å; L99-F103 PolarHBondContact O-N 3.46Å |
| 104 | L | 77 | Confident | 81.5 | Confident | 34 Ų | 34 | 68.5 Ų | 68.5 | 18% | 0.178 | 33% | 0.329 | C | S | . | . | H | α-helix | trans | -109.2 | 0.7 | 179.7 | -77 | 69.9 | 0 | 0 | 0 | 112.5 | I29 K32 L36 S100 E106 | I29-L104 HydrophobicContact CG2-CD1 3.74Å; K32-L104 HydrophobicContact CB-CD2 4.47Å; K32-L104 HydrophobicContact CD-CD2 3.38Å; K32-L104 HydrophobicContact CG-CD2 3.73Å; L36-L104 HydrophobicContact CD1-CD2 3.75Å; L36-L104 HydrophobicContact CD1-CG 4.24Å; S100-L104 WeakPolarHBondContact O-CA 3.28Å; S100-L104 VanDerWaalsContact O-CB 3.28Å; S100-L104 WeakPolarHBondContact O-CB 3.12Å; S100-L104 PolarHBondContact O-N 2.85Å; L104-E106 HydrophobicContact CB-CG 4.07Å; L104-E106 PolarHBondContact O-N 3.18Å |
| 105 | N | 73.9 | Confident | 81.7 | Confident | 144 Ų | 144 | 68 Ų | 68 | 77% | 0.77 | 33% | 0.327 | S | S | * | . | trans | 54.3 | 29.8 | -174.9 | -71.4 | -36.3 | 0 | 0 | 0 | 113.2 | S101 | S101-N105 VanDerWaalsContact O-CA 3.3Å; S101-N105 WeakPolarHBondContact O-CA 2.99Å; S101-N105 PolarHBondContact O-N 3.14Å | ||
| 106 | E | 77.8 | Confident | 81.7 | Confident | 79 Ų | 79 | 67.1 Ų | 67.1 | 37% | 0.369 | 32% | 0.322 | S | S | . | . | P | Polyproline II helix | trans | -75.3 | 127.4 | 174.1 | -71.2 | -178.5 | -179.8 | 0 | 0 | 109.4 | K32 S100 S101 L104 L108 | K32-E106 WeakPolarHBondContact CE-OE1 3.17Å; K32-E106 IonicContact NZ-OE1 2.62Å; K32-E106 PolarHBondContact NZ-OE1 2.81Å; K32-E106 IonicContact NZ-OE2 2.89Å; K32-E106 PolarHBondContact NZ-OE2 3.01Å; S100-E106 PolarHBondContact OG-OE2 3.1Å; S100-E106 VanDerWaalsContact OG-OE2 3.11Å; S101-E106 WeakPolarHBondContact CA-O 3.32Å; S101-E106 WeakPolarHBondContact CB-O 3.26Å; S101-E106 PolarHBondContact OG-O 3.05Å; L104-E106 HydrophobicContact CB-CG 4.07Å; L104-E106 PolarHBondContact O-N 3.18Å; E106-L108 PolarHBondContact O-N 3.43Å |
| 107 | R | 71.3 | Confident | 82 | Confident | 238 Ų | 238 | 71 Ų | 71 | 90% | 0.898 | 34% | 0.34 | S | S | * | . | P | Polyproline II helix | trans | -75.2 | 122.2 | -179.7 | -62.7 | -130.6 | -158.8 | -170.5 | 8 | 109.8 | ||
| 108 | L | 71.4 | Confident | 82.5 | Confident | 51 Ų | 51 | 72.2 Ų | 72.2 | 27% | 0.267 | 34% | 0.344 | S | S | . | . | P | Polyproline II helix | trans | -79.5 | 119.4 | 168.4 | -70.6 | 167.2 | 0 | 0 | 0 | 109.5 | A97 S101 E106 K113 | A97-L108 HydrophobicContact CB-CD2 4.33Å; S101-L108 VanDerWaalsContact CB-CD1 3.49Å; E106-L108 PolarHBondContact O-N 3.43Å; L108-K113 HydrophobicContact CB-CG 4.28Å |
| 109 | N | 78.1 | Confident | 82.8 | Confident | 37 Ų | 37 | 68.5 Ų | 68.5 | 20% | 0.198 | 33% | 0.325 | C | S | . | . | P | Polyproline II helix | trans | -58.5 | 157 | 172.3 | -68.4 | -21.8 | 0 | 0 | 0 | 110.8 | H111 G112 K113 F299 K300 V302 | N109-H111 VanDerWaalsContact C-N 3.26Å; N109-H111 PolarHBondContact O-N 3.32Å; N109-G112 WeakPolarHBondContact O-CA 3.41Å; N109-G112 PolarHBondContact O-N 3.25Å; N109-K113 PolarHBondContact O-N 2.87Å; N109-F299 PolarHBondContact ND2-O 3.44Å; N109-F299 VanDerWaalsContact ND2-O 3.12Å; N109-K300 PolarHBondContact ND2-O 2.93Å; N109-K300 VanDerWaalsContact ND2-O 3.14Å; N109-V302 PolarHBondContact ND2-O 2.73Å |
| 110 | L | 82.1 | Confident | 83.1 | Confident | 69 Ų | 69 | 69.8 Ų | 69.8 | 36% | 0.361 | 33% | 0.332 | S | S | . | . | H | α-helix | trans | -53.9 | -45 | 178.2 | -176.5 | 69.2 | 0 | 0 | 0 | 111.5 | G112 K113 I114 L306 | L110-G112 VanDerWaalsContact C-N 3.28Å; L110-G112 PolarHBondContact O-N 3.43Å; L110-K113 WeakPolarHBondContact O-CB 3.43Å; L110-K113 PolarHBondContact O-N 3.38Å; L110-K113 VanDerWaalsContact O-N 3.1Å; L110-I114 HydrophobicContact CG-CD1 4.01Å; L110-I114 WeakPolarHBondContact O-CG1 3.27Å; L110-I114 PolarHBondContact O-N 3.13Å; L110-L306 HydrophobicContact CD2-CD2 3.85Å; L110-L306 HydrophobicContact CD2-CG 4.19Å |
| 111 | H | 82.3 | Confident | 83.6 | Confident | 46 Ų | 46 | 73.7 Ų | 73.7 | 21% | 0.213 | 35% | 0.351 | C | S | . | . | H | α-helix | trans | -58.5 | -38.1 | 174.2 | -63 | 90.3 | 0 | 0 | 0 | 112.6 | N109 I114 G115 F299 F304 | N109-H111 VanDerWaalsContact C-N 3.26Å; N109-H111 PolarHBondContact O-N 3.32Å; H111-I114 PolarHBondContact O-N 3.18Å; H111-G115 PolarHBondContact O-N 3.37Å; H111-F299 HydrophobicContact CB-CB 3.71Å; H111-F299 HydrophobicContact CB-CD2 4.34Å; H111-F299 HydrophobicContact CB-CG 4.19Å; H111-F304 AromaticContact CE1-CD2 3.82Å |
| 112 | G | 83.5 | Confident | 84.1 | Confident | 6 Ų | 6 | 72 Ų | 72 | 6% | 0.062 | 34% | 0.339 | C | S | . | . | H | α-helix | trans | -64.1 | -41.5 | 174.2 | 0 | 0 | 0 | 0 | 0 | 112.3 | N109 L110 G115 C116 | N109-G112 WeakPolarHBondContact O-CA 3.41Å; N109-G112 PolarHBondContact O-N 3.25Å; L110-G112 VanDerWaalsContact C-N 3.28Å; L110-G112 PolarHBondContact O-N 3.43Å; G112-G115 PolarHBondContact O-N 3.41Å; G112-C116 WeakPolarHBondContact O-CB 3.46Å; G112-C116 PolarHBondContact O-N 3.07Å; G112-C116 PolarHBondContact O-SG 3.43Å |
| 113 | K | 86 | Confident | 84.5 | Confident | 131 Ų | 131 | 64 Ų | 64 | 57% | 0.57 | 31% | 0.308 | S | S | * | . | H | α-helix | trans | -65.3 | -43.7 | 175.5 | -64.4 | -176.8 | -179.6 | -176.2 | 0 | 112.4 | L108 N109 L110 G115 C116 L117 | L108-K113 HydrophobicContact CB-CG 4.28Å; N109-K113 PolarHBondContact O-N 2.87Å; L110-K113 WeakPolarHBondContact O-CB 3.43Å; L110-K113 PolarHBondContact O-N 3.38Å; L110-K113 VanDerWaalsContact O-N 3.1Å; K113-G115 VanDerWaalsContact C-N 3.35Å; K113-C116 WeakPolarHBondContact O-CB 3Å; K113-C116 PolarHBondContact O-N 3.5Å; K113-L117 PolarHBondContact O-N 3.33Å |
| 114 | I | 89.6 | Confident | 85.1 | Confident | 73 Ų | 73 | 62.5 Ų | 62.5 | 37% | 0.374 | 31% | 0.308 | S | S | . | . | H | α-helix | trans | -64 | -43.4 | 176.4 | -65.1 | 168.8 | 0 | 0 | 0 | 109.9 | L110 H111 C116 L117 L118 L295 | L110-I114 HydrophobicContact CG-CD1 4.01Å; L110-I114 WeakPolarHBondContact O-CG1 3.27Å; L110-I114 PolarHBondContact O-N 3.13Å; H111-I114 PolarHBondContact O-N 3.18Å; I114-C116 VanDerWaalsContact C-N 3.34Å; I114-C116 PolarHBondContact O-N 3.13Å; I114-L117 PolarHBondContact O-N 3.45Å; I114-L118 HydrophobicContact CG2-CD1 3.69Å; I114-L118 PolarHBondContact O-N 3.18Å; I114-L295 HydrophobicContact CG2-CD1 4.01Å |
| 115 | G | 89.9 | Confident | 85.9 | Confident | 0 Ų | 0 | 63 Ų | 63 | 0% | 0 | 31% | 0.313 | C | S | . | . | H | α-helix | trans | -59.4 | -43.5 | 175.3 | 0 | 0 | 0 | 0 | 0 | 112.5 | H111 G112 K113 L117 L118 S119 G292 | H111-G115 PolarHBondContact O-N 3.37Å; G112-G115 PolarHBondContact O-N 3.41Å; K113-G115 VanDerWaalsContact C-N 3.35Å; G115-L117 PolarHBondContact O-N 3.41Å; G115-L118 PolarHBondContact O-N 3.18Å; G115-S119 WeakPolarHBondContact O-CB 2.92Å; G115-S119 PolarHBondContact O-N 3.34Å; G115-S119 PolarHBondContact O-OG 3.09Å; G115-S119 VanDerWaalsContact O-OG 3.09Å; G115-G292 VanDerWaalsContact CA-O 3.31Å; G115-G292 WeakPolarHBondContact CA-O 3.5Å; G115-G292 WeakPolarHBondContact O-CA 3.41Å |
| 116 | C | 88.1 | Confident | 86.6 | Confident | 11 Ų | 11 | 56.4 Ų | 56.4 | 7% | 0.074 | 28% | 0.277 | C | S | . | . | H | α-helix | trans | -58.2 | -47.2 | 173.1 | -71.3 | 0 | 0 | 0 | 0 | 112.5 | L94 G112 K113 I114 S119 I120 | L94-C116 HydrophobicContact CD1-CB 3.32Å; L94-C116 WeakPolarHBondContact CD1-SG 3.43Å; G112-C116 WeakPolarHBondContact O-CB 3.46Å; G112-C116 PolarHBondContact O-N 3.07Å; G112-C116 PolarHBondContact O-SG 3.43Å; K113-C116 WeakPolarHBondContact O-CB 3Å; K113-C116 PolarHBondContact O-N 3.5Å; I114-C116 VanDerWaalsContact C-N 3.34Å; I114-C116 PolarHBondContact O-N 3.13Å; C116-S119 PolarHBondContact O-N 2.85Å; C116-I120 WeakPolarHBondContact O-CG1 3.39Å; C116-I120 PolarHBondContact O-N 3.33Å; C116-I120 VanDerWaalsContact O-N 3.12Å |
| 117 | L | 91.1 | Very high | 87.2 | Confident | 103 Ų | 103 | 54.1 Ų | 54.1 | 54% | 0.539 | 27% | 0.268 | S | S | . | . | H | α-helix | trans | -62.4 | -46.3 | 179.2 | -178.6 | 64.6 | 0 | 0 | 0 | 111.6 | K113 I114 G115 S119 I120 L121 | K113-L117 PolarHBondContact O-N 3.33Å; I114-L117 PolarHBondContact O-N 3.45Å; G115-L117 PolarHBondContact O-N 3.41Å; L117-S119 PolarHBondContact O-N 3.45Å; L117-I120 PolarHBondContact O-N 2.87Å; L117-L121 HydrophobicContact CD1-CD1 4.35Å; L117-L121 HydrophobicContact CD1-CG 4.43Å; L117-L121 HydrophobicContact CG-CD1 4.07Å; L117-L121 WeakPolarHBondContact O-CG 3.33Å; L117-L121 PolarHBondContact O-N 2.85Å |
| 118 | L | 92.5 | Very high | 88.1 | Confident | 45 Ų | 45 | 48.4 Ų | 48.4 | 24% | 0.236 | 25% | 0.254 | C | S | . | . | H | α-helix | trans | -60.9 | -43.3 | 177 | -78.8 | 155.8 | 0 | 0 | 0 | 111.9 | I114 G115 I120 L121 G122 T288 V291 L295 | I114-L118 HydrophobicContact CG2-CD1 3.69Å; I114-L118 PolarHBondContact O-N 3.18Å; G115-L118 PolarHBondContact O-N 3.18Å; L118-I120 VanDerWaalsContact C-N 3.32Å; L118-I120 PolarHBondContact O-N 2.86Å; L118-L121 PolarHBondContact O-N 2.8Å; L118-G122 PolarHBondContact O-N 3.49Å; L118-T288 HydrophobicContact CB-CG2 4.3Å; L118-T288 HydrophobicContact CD2-CG2 3.66Å; L118-T288 WeakPolarHBondContact O-CG2 3.35Å; L118-V291 HydrophobicContact CD1-CG1 4.06Å; L118-L295 HydrophobicContact CD1-CD1 3.48Å; L118-L295 VanDerWaalsContact CD1-CD1 3.48Å |
| 119 | S | 91.3 | Very high | 89 | Confident | 3 Ų | 3 | 48.2 Ų | 48.2 | 2% | 0.021 | 25% | 0.252 | C | S | . | . | H | α-helix | trans | -62.2 | -37.7 | 176.9 | -64.6 | 0 | 0 | 0 | 0 | 112.6 | G115 C116 L117 S123 | G115-S119 WeakPolarHBondContact O-CB 2.92Å; G115-S119 PolarHBondContact O-N 3.34Å; G115-S119 PolarHBondContact O-OG 3.09Å; G115-S119 VanDerWaalsContact O-OG 3.09Å; C116-S119 PolarHBondContact O-N 2.85Å; L117-S119 PolarHBondContact O-N 3.45Å; S119-S123 VanDerWaalsContact O-CB 3.28Å; S119-S123 WeakPolarHBondContact O-CB 3.48Å; S119-S123 PolarHBondContact O-N 3.23Å; S119-S123 PolarHBondContact O-OG 2.87Å |
| 120 | I | 91.4 | Very high | 89.2 | Confident | 75 Ų | 75 | 47.1 Ų | 47.1 | 39% | 0.385 | 25% | 0.248 | S | C | . | . | H | α-helix | trans | -67.4 | -47.8 | 175 | -66.4 | 168.9 | 0 | 0 | 0 | 111 | L94 C116 L117 L118 S123 T124 | L94-I120 HydrophobicContact CD2-CD1 3.91Å; L94-I120 HydrophobicContact CD2-CG1 3.39Å; C116-I120 WeakPolarHBondContact O-CG1 3.39Å; C116-I120 PolarHBondContact O-N 3.33Å; C116-I120 VanDerWaalsContact O-N 3.12Å; L117-I120 PolarHBondContact O-N 2.87Å; L118-I120 VanDerWaalsContact C-N 3.32Å; L118-I120 PolarHBondContact O-N 2.86Å; I120-S123 PolarHBondContact O-N 2.88Å; I120-T124 WeakPolarHBondContact O-CB 3.36Å; I120-T124 PolarHBondContact O-N 2.76Å; I120-T124 PolarHBondContact O-OG1 3.1Å |
| 121 | L | 93.2 | Very high | 88.9 | Confident | 92 Ų | 92 | 44 Ų | 44 | 48% | 0.482 | 23% | 0.232 | S | C | . | . | H | α-helix | trans | -62.7 | -48.2 | -179.6 | -70.8 | 174.7 | 0 | 0 | 0 | 110.9 | L117 L118 S123 T124 V125 | L117-L121 HydrophobicContact CD1-CD1 4.35Å; L117-L121 HydrophobicContact CD1-CG 4.43Å; L117-L121 HydrophobicContact CG-CD1 4.07Å; L117-L121 WeakPolarHBondContact O-CG 3.33Å; L117-L121 PolarHBondContact O-N 2.85Å; L118-L121 PolarHBondContact O-N 2.8Å; L121-S123 PolarHBondContact O-N 3.36Å; L121-T124 PolarHBondContact O-N 3.08Å; L121-V125 WeakPolarHBondContact O-CG2 3.45Å; L121-V125 PolarHBondContact O-N 3.17Å |
| 122 | G | 93.2 | Very high | 88.2 | Confident | 0 Ų | 0 | 51.2 Ų | 51.2 | 0% | 0 | 26% | 0.263 | C | S | . | . | H | α-helix | trans | -61.8 | -41.7 | 178.2 | 0 | 0 | 0 | 0 | 0 | 112.9 | L118 T124 V125 M126 G285 I289 | L118-G122 PolarHBondContact O-N 3.49Å; G122-T124 PolarHBondContact O-N 3.14Å; G122-V125 PolarHBondContact O-N 2.93Å; G122-M126 WeakPolarHBondContact O-CB 3.38Å; G122-M126 PolarHBondContact O-N 3.06Å; G122-G285 WeakPolarHBondContact CA-O 3.25Å; G122-I289 VanDerWaalsContact C-CG1 3.47Å |
| 123 | S | 91.1 | Very high | 87.2 | Confident | 6 Ų | 6 | 53 Ų | 53 | 4% | 0.042 | 27% | 0.269 | C | S | . | . | H | α-helix | trans | -63.8 | -41 | 175.3 | -58.7 | 0 | 0 | 0 | 0 | 111.7 | S119 I120 L121 M126 V127 | S119-S123 VanDerWaalsContact O-CB 3.28Å; S119-S123 WeakPolarHBondContact O-CB 3.48Å; S119-S123 PolarHBondContact O-N 3.23Å; S119-S123 PolarHBondContact O-OG 2.87Å; I120-S123 PolarHBondContact O-N 2.88Å; L121-S123 PolarHBondContact O-N 3.36Å; S123-M126 PolarHBondContact O-N 3.19Å; S123-V127 VanDerWaalsContact O-CG2 3.28Å; S123-V127 WeakPolarHBondContact O-CG2 3.41Å; S123-V127 PolarHBondContact O-N 2.88Å |
| 124 | T | 92.1 | Very high | 86 | Confident | 70 Ų | 70 | 51.9 Ų | 51.9 | 43% | 0.429 | 27% | 0.266 | S | S | . | . | H | α-helix | trans | -63.1 | -47.4 | 176.4 | -54.9 | 0 | 0 | 0 | 0 | 111.5 | I120 L121 G122 M126 V127 I128 | I120-T124 WeakPolarHBondContact O-CB 3.36Å; I120-T124 PolarHBondContact O-N 2.76Å; I120-T124 PolarHBondContact O-OG1 3.1Å; L121-T124 PolarHBondContact O-N 3.08Å; G122-T124 PolarHBondContact O-N 3.14Å; T124-M126 VanDerWaalsContact C-N 3.3Å; T124-M126 PolarHBondContact O-N 3.21Å; T124-V127 PolarHBondContact O-N 3.31Å; T124-I128 HydrophobicContact CG2-CD1 3.82Å; T124-I128 HydrophobicContact CG2-CG1 4.48Å; T124-I128 VanDerWaalsContact O-CG1 3.29Å; T124-I128 WeakPolarHBondContact O-CG1 3.44Å; T124-I128 PolarHBondContact O-N 3.35Å |
| 125 | V | 93.2 | Very high | 84.6 | Confident | 45 Ų | 45 | 52 Ų | 52 | 27% | 0.273 | 27% | 0.265 | S | S | . | . | H | α-helix | trans | -59.8 | -43.3 | 177.4 | 172.3 | 0 | 0 | 0 | 0 | 110.7 | L121 G122 V127 I128 H129 G281 | L121-V125 WeakPolarHBondContact O-CG2 3.45Å; L121-V125 PolarHBondContact O-N 3.17Å; G122-V125 PolarHBondContact O-N 2.93Å; V125-V127 PolarHBondContact O-N 3.46Å; V125-I128 PolarHBondContact O-N 2.87Å; V125-H129 PolarHBondContact O-N 3.31Å; V125-H129 VanDerWaalsContact O-N 3.15Å; V125-H129 PolarHBondContact O-ND1 2.86Å; V125-G281 VanDerWaalsContact CG1-O 3.27Å; V125-G281 WeakPolarHBondContact CG1-O 3.48Å |
| 126 | M | 90.4 | Very high | 83.5 | Confident | 5 Ų | 5 | 53.1 Ų | 53.1 | 3% | 0.025 | 27% | 0.271 | C | S | . | . | H | α-helix | trans | -61.3 | -40.8 | 175.7 | -89.8 | -151.2 | 56.2 | 0 | 0 | 113.6 | T83 P87 G122 S123 T124 A130 T282 F286 I289 | T83-M126 WeakPolarHBondContact O-CE 3.4Å; P87-M126 HydrophobicContact CB-CE 3.88Å; P87-M126 HydrophobicContact CB-SD 3.6Å; P87-M126 HydrophobicContact CG-CE 3.46Å; P87-M126 VanDerWaalsContact CG-CE 3.46Å; P87-M126 HydrophobicContact CG-SD 3.72Å; G122-M126 WeakPolarHBondContact O-CB 3.38Å; G122-M126 PolarHBondContact O-N 3.06Å; S123-M126 PolarHBondContact O-N 3.19Å; T124-M126 VanDerWaalsContact C-N 3.3Å; T124-M126 PolarHBondContact O-N 3.21Å; M126-A130 WeakPolarHBondContact O-CA 3.19Å; M126-A130 WeakPolarHBondContact O-CB 3.33Å; M126-A130 PolarHBondContact O-N 3.28Å; M126-A130 VanDerWaalsContact O-N 3.07Å; M126-T282 HydrophobicContact CE-CG2 4.4Å; M126-F286 HydrophobicContact SD-CB 3.99Å; M126-I289 HydrophobicContact CG-CD1 4.21Å; M126-I289 HydrophobicContact SD-CD1 3.77Å |
| 127 | V | 89.6 | Confident | 82.6 | Confident | 31 Ų | 31 | 56.9 Ų | 56.9 | 19% | 0.188 | 29% | 0.287 | C | S | . | . | H | α-helix | trans | -68.5 | -39.6 | 178.3 | 170.1 | 0 | 0 | 0 | 0 | 111.4 | L14 L84 L88 S123 T124 V125 A130 | L14-V127 HydrophobicContact CD1-CG1 4.12Å; L14-V127 HydrophobicContact CD1-CG2 4Å; L14-V127 HydrophobicContact CD2-CG1 3.98Å; L84-V127 HydrophobicContact CD1-CB 4.24Å; L84-V127 HydrophobicContact CD1-CG1 4.15Å; L84-V127 HydrophobicContact CD1-CG2 3.89Å; L84-V127 HydrophobicContact CG-CG2 4.21Å; L88-V127 HydrophobicContact CD1-CG2 4.31Å; L88-V127 HydrophobicContact CD2-CG2 4.2Å; S123-V127 VanDerWaalsContact O-CG2 3.28Å; S123-V127 WeakPolarHBondContact O-CG2 3.41Å; S123-V127 PolarHBondContact O-N 2.88Å; T124-V127 PolarHBondContact O-N 3.31Å; V125-V127 PolarHBondContact O-N 3.46Å; V127-A130 PolarHBondContact O-N 3.41Å |
| 128 | I | 90.2 | Very high | 82.3 | Confident | 117 Ų | 117 | 53.5 Ų | 53.5 | 60% | 0.6 | 27% | 0.271 | S | S | * | . | H | α-helix | trans | -64.5 | -42.8 | -179.2 | -69.8 | 166.3 | 0 | 0 | 0 | 111.2 | T124 V125 | T124-I128 HydrophobicContact CG2-CD1 3.82Å; T124-I128 HydrophobicContact CG2-CG1 4.48Å; T124-I128 VanDerWaalsContact O-CG1 3.29Å; T124-I128 WeakPolarHBondContact O-CG1 3.44Å; T124-I128 PolarHBondContact O-N 3.35Å; V125-I128 PolarHBondContact O-N 2.87Å |
| 129 | H | 89.3 | Confident | 82 | Confident | 48 Ų | 48 | 51.4 Ų | 51.4 | 22% | 0.222 | 26% | 0.26 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -98 | 14.9 | -177 | -56 | 86.9 | 0 | 0 | 0 | 112.2 | V125 M274 D278 T282 | V125-H129 PolarHBondContact O-N 3.31Å; V125-H129 VanDerWaalsContact O-N 3.15Å; V125-H129 PolarHBondContact O-ND1 2.86Å; H129-M274 WeakPolarHBondContact O-CE 3.28Å; H129-D278 HydrophobicContact CB-CB 4.32Å; H129-D278 WeakPolarHBondContact CB-O 3.29Å; H129-D278 IonicContact CD2-OD1 2.71Å; H129-D278 PolarHBondContact CD2-OD1 3.02Å; H129-D278 VanDerWaalsContact CD2-OD1 3.31Å; H129-D278 IonicContact CG-OD1 2.57Å; H129-T282 PolarHBondContact O-OG1 3.3Å |
| 130 | A | 83.4 | Confident | 81.7 | Confident | 13 Ų | 13 | 56 Ų | 56 | 11% | 0.107 | 28% | 0.284 | C | S | . | . | trans | -63.1 | 138.9 | -178 | 0 | 0 | 0 | 0 | 0 | 110.7 | F10 L84 M126 V127 K132 | F10-A130 HydrophobicContact CE2-CB 4.42Å; F10-A130 HydrophobicContact CZ-CB 4.46Å; L84-A130 HydrophobicContact CB-CB 4.36Å; L84-A130 HydrophobicContact CD1-CB 3.78Å; M126-A130 WeakPolarHBondContact O-CA 3.19Å; M126-A130 WeakPolarHBondContact O-CB 3.33Å; M126-A130 PolarHBondContact O-N 3.28Å; M126-A130 VanDerWaalsContact O-N 3.07Å; V127-A130 PolarHBondContact O-N 3.41Å; A130-K132 PolarHBondContact O-N 3.41Å | ||
| 131 | P | 75.3 | Confident | 81.5 | Confident | 4 Ų | 4 | 56.6 Ų | 56.6 | 3% | 0.026 | 29% | 0.286 | C | S | . | . | trans | -61.9 | 137.1 | 178 | 26.6 | -32.4 | 0 | 0 | 0 | 109.5 | T83 E133 E270 M274 | T83-P131 HydrophobicContact CG2-CG 3.9Å; P131-E133 PolarHBondContact O-N 2.92Å; P131-E133 VanDerWaalsContact O-N 3.16Å; P131-E270 HydrophobicContact CB-CB 3.92Å; P131-E270 HydrophobicContact CB-CG 4.35Å; P131-E270 HydrophobicContact CG-CB 4.09Å; P131-E270 HydrophobicContact CG-CG 4.34Å; P131-E270 WeakPolarHBondContact CG-OE2 3.38Å; P131-M274 HydrophobicContact CB-CE 4.05Å; P131-M274 HydrophobicContact CB-SD 4.08Å; P131-M274 HydrophobicContact CG-CE 4.45Å | ||
| 132 | K | 67.9 | Low | 81.3 | Confident | 198 Ų | 198 | 52.2 Ų | 52.2 | 86% | 0.861 | 26% | 0.263 | S | S | * | . | trans | -77.3 | 100.6 | 168.3 | -66.4 | 172.6 | -172.8 | 155.7 | 0 | 106.2 | A130 E134 | A130-K132 PolarHBondContact O-N 3.41Å; K132-E134 PolarHBondContact O-N 3.38Å | ||
| 133 | E | 62.9 | Low | 81.1 | Confident | 43 Ų | 43 | 55 Ų | 55 | 20% | 0.201 | 28% | 0.282 | C | S | . | . | trans | -55.8 | 138.4 | 176.8 | -68.1 | -170.3 | 155.5 | 0 | 0 | 110.6 | P81 P131 E135 K197 E270 | P81-E133 WeakPolarHBondContact CA-OE1 3.28Å; P81-E133 VanDerWaalsContact CB-CD 3.43Å; P81-E133 HydrophobicContact CB-CG 3.7Å; P81-E133 WeakPolarHBondContact CB-OE1 3.35Å; P81-E133 HydrophobicContact CG-CG 4.07Å; P131-E133 PolarHBondContact O-N 2.92Å; P131-E133 VanDerWaalsContact O-N 3.16Å; E133-E135 PolarHBondContact O-N 3.4Å; E133-K197 IonicContact OE1-NZ 3.2Å; E133-K197 PolarHBondContact OE1-NZ 3.02Å; E133-K197 WeakPolarHBondContact OE2-CE 3.47Å; E133-K197 IonicContact OE2-NZ 2.68Å; E133-K197 PolarHBondContact OE2-NZ 3.49Å; E133-E270 HydrophobicContact CG-CG 3.98Å | ||
| 134 | E | 60.5 | Low | 81.1 | Confident | 108 Ų | 108 | 61.3 Ų | 61.3 | 51% | 0.505 | 31% | 0.31 | S | S | . | . | trans | -53.5 | 129.5 | 159.4 | -71.5 | -175.5 | 146.4 | 0 | 0 | 107.6 | K132 I136 K145 | K132-E134 PolarHBondContact O-N 3.38Å; E134-I136 WeakPolarHBondContact O-CG1 3.25Å; E134-I136 PolarHBondContact O-N 3.26Å; E134-K145 IonicContact OE2-NZ 3.43Å; E134-K145 PolarHBondContact OE2-NZ 3.13Å | ||
| 135 | E | 60.6 | Low | 81 | Confident | 75 Ų | 75 | 59.2 Ų | 59.2 | 35% | 0.35 | 30% | 0.295 | S | S | . | . | trans | -64.2 | 83.3 | -179.1 | -68.8 | 177.2 | 168.7 | 0 | 0 | 109.3 | S2 G6 E133 E137 | S2-E135 PolarHBondContact OG-OE2 3.4Å; G6-E135 WeakPolarHBondContact CA-OE1 3.49Å; G6-E135 PolarHBondContact N-OE1 2.81Å; G6-E135 VanDerWaalsContact N-OE1 3.08Å; E133-E135 PolarHBondContact O-N 3.4Å; E135-E137 VanDerWaalsContact C-N 3.3Å; E135-E137 HydrophobicContact CB-CG 4.1Å; E135-E137 PolarHBondContact O-N 2.97Å | ||
| 136 | I | 65.9 | Low | 80.8 | Confident | 23 Ų | 23 | 59.1 Ų | 59.1 | 12% | 0.118 | 29% | 0.293 | C | S | . | . | trans | -76.1 | 90.7 | 171 | -54.5 | -161.3 | 0 | 0 | 0 | 107 | E134 E141 M142 K145 I201 F268 | E134-I136 WeakPolarHBondContact O-CG1 3.25Å; E134-I136 PolarHBondContact O-N 3.26Å; I136-E141 HydrophobicContact CG2-CB 3.8Å; I136-M142 HydrophobicContact CG2-CB 4.32Å; I136-K145 HydrophobicContact CD1-CD 4.37Å; I136-K145 HydrophobicContact CD1-CG 3.77Å; I136-I201 HydrophobicContact CB-CD1 4.31Å; I136-I201 HydrophobicContact CG2-CD1 3.9Å; I136-I201 WeakPolarHBondContact O-CD1 3.5Å; I136-F268 HydrophobicContact CD1-CD1 3.45Å; I136-F268 VanDerWaalsContact CD1-CD1 3.45Å; I136-F268 HydrophobicContact CD1-CE1 3.74Å; I136-F268 HydrophobicContact CG1-CD1 4.38Å | ||
| 137 | E | 70.3 | Confident | 80.9 | Confident | 90 Ų | 90 | 61.4 Ų | 61.4 | 42% | 0.421 | 32% | 0.318 | S | S | . | . | trans | -91.1 | -12.9 | -177.3 | -62.8 | -160.7 | 154.8 | 0 | 0 | 112.3 | E135 E141 | E135-E137 VanDerWaalsContact C-N 3.3Å; E135-E137 HydrophobicContact CB-CG 4.1Å; E135-E137 PolarHBondContact O-N 2.97Å; E137-E141 PolarHBondContact N-OE2 3.33Å | ||
| 138 | T | 83.4 | Confident | 81 | Confident | 32 Ų | 32 | 61.3 Ų | 61.3 | 20% | 0.196 | 32% | 0.316 | C | S | . | . | S | Bend | trans | -126.5 | 148.4 | -171.8 | 70 | 0 | 0 | 0 | 0 | 114.5 | N140 E141 M142 | T138-N140 PolarHBondContact O-N 3.36Å; T138-E141 PolarHBondContact N-OE2 3.48Å; T138-E141 PolarHBondContact O-N 3.32Å; T138-E141 VanDerWaalsContact OG1-CD 3.23Å; T138-E141 VanDerWaalsContact OG1-CG 3.28Å; T138-E141 WeakPolarHBondContact OG1-CG 3.35Å; T138-E141 PolarHBondContact OG1-N 2.99Å; T138-E141 PolarHBondContact OG1-OE2 2.97Å; T138-M142 PolarHBondContact O-N 3.26Å; T138-M142 VanDerWaalsContact O-N 3.15Å |
| 139 | L | 85.8 | Confident | 81.1 | Confident | 1 Ų | 1 | 60.3 Ų | 60.3 | 1% | 0.005 | 32% | 0.317 | C | S | . | . | H | α-helix | trans | -63.4 | -24.8 | 173.7 | -79.2 | 171 | 0 | 0 | 0 | 113.6 | S143 A202 E205 V212 H215 L217 | L139-S143 WeakPolarHBondContact O-CB 3.46Å; L139-S143 PolarHBondContact O-N 3.25Å; L139-A202 HydrophobicContact CD1-CB 3.75Å; L139-A202 HydrophobicContact CD2-CB 3.83Å; L139-A202 HydrophobicContact CG-CB 4.14Å; L139-E205 PolarHBondContact N-OE2 2.78Å; L139-V212 HydrophobicContact CD1-CB 4.44Å; L139-V212 HydrophobicContact CD1-CG1 3.53Å; L139-V212 HydrophobicContact CD1-CG2 4.36Å; L139-H215 HydrophobicContact CD1-CB 4.4Å; L139-L217 HydrophobicContact CD2-CD2 3.65Å |
| 140 | N | 86.4 | Confident | 81.2 | Confident | 99 Ų | 99 | 59.9 Ų | 59.9 | 53% | 0.529 | 33% | 0.326 | S | S | . | . | H | α-helix | trans | -71.2 | -41.9 | 177.1 | -75.3 | -26.3 | 0 | 0 | 0 | 111.8 | T138 M142 S143 H144 H215 | T138-N140 PolarHBondContact O-N 3.36Å; N140-M142 VanDerWaalsContact C-N 3.33Å; N140-S143 VanDerWaalsContact O-CB 3.28Å; N140-S143 WeakPolarHBondContact O-CB 3.31Å; N140-S143 PolarHBondContact O-N 3.04Å; N140-H144 PolarHBondContact O-N 3.37Å; N140-H215 PolarHBondContact OD1-CE1 2.98Å |
| 141 | E | 86.6 | Confident | 81.7 | Confident | 89 Ų | 89 | 59.9 Ų | 59.9 | 42% | 0.416 | 32% | 0.324 | S | S | . | . | H | α-helix | trans | -64.6 | -40.7 | 173.4 | -72.4 | 161.7 | 166.4 | 0 | 0 | 111 | I136 E137 T138 S143 H144 K145 | I136-E141 HydrophobicContact CG2-CB 3.8Å; E137-E141 PolarHBondContact N-OE2 3.33Å; T138-E141 PolarHBondContact N-OE2 3.48Å; T138-E141 PolarHBondContact O-N 3.32Å; T138-E141 VanDerWaalsContact OG1-CD 3.23Å; T138-E141 VanDerWaalsContact OG1-CG 3.28Å; T138-E141 WeakPolarHBondContact OG1-CG 3.35Å; T138-E141 PolarHBondContact OG1-N 2.99Å; T138-E141 PolarHBondContact OG1-OE2 2.97Å; E141-S143 VanDerWaalsContact C-N 3.3Å; E141-S143 PolarHBondContact O-N 3.37Å; E141-H144 WeakPolarHBondContact O-CB 3.2Å; E141-H144 PolarHBondContact O-N 3.02Å; E141-H144 VanDerWaalsContact O-N 3.15Å; E141-K145 WeakPolarHBondContact O-CG 3.38Å; E141-K145 PolarHBondContact O-N 3.33Å |
| 142 | M | 89.1 | Confident | 82.6 | Confident | 0 Ų | 0 | 62.8 Ų | 62.8 | 0% | 0 | 34% | 0.341 | C | S | . | . | H | α-helix | trans | -58.8 | -42.7 | 171.7 | -172.7 | 67.8 | -177.2 | 0 | 0 | 111.5 | I136 T138 N140 H144 K145 L146 L267 F268 | I136-M142 HydrophobicContact CG2-CB 4.32Å; T138-M142 PolarHBondContact O-N 3.26Å; T138-M142 VanDerWaalsContact O-N 3.15Å; N140-M142 VanDerWaalsContact C-N 3.33Å; M142-H144 VanDerWaalsContact C-N 3.31Å; M142-H144 PolarHBondContact O-N 3.45Å; M142-K145 PolarHBondContact O-N 3.39Å; M142-L146 HydrophobicContact CE-CD1 4.18Å; M142-L146 HydrophobicContact CE-CD2 4.34Å; M142-L146 HydrophobicContact CE-CG 4.24Å; M142-L146 HydrophobicContact CG-CD1 4.14Å; M142-L146 WeakPolarHBondContact O-CB 3.5Å; M142-L146 VanDerWaalsContact O-CG 3.3Å; M142-L146 WeakPolarHBondContact O-CG 3.49Å; M142-L146 PolarHBondContact O-N 2.68Å; M142-L267 HydrophobicContact CE-CD2 3.99Å; M142-F268 HydrophobicContact CE-CZ 4.38Å; M142-F268 HydrophobicContact SD-CE1 4.04Å; M142-F268 HydrophobicContact SD-CZ 4.28Å |
| 143 | S | 89.7 | Confident | 83.9 | Confident | 57 Ų | 57 | 57.4 Ų | 57.4 | 40% | 0.399 | 33% | 0.325 | S | S | . | . | H | α-helix | trans | -60 | -42 | 174.6 | -164.5 | 0 | 0 | 0 | 0 | 112.2 | L139 N140 E141 L146 G147 L217 | L139-S143 WeakPolarHBondContact O-CB 3.46Å; L139-S143 PolarHBondContact O-N 3.25Å; N140-S143 VanDerWaalsContact O-CB 3.28Å; N140-S143 WeakPolarHBondContact O-CB 3.31Å; N140-S143 PolarHBondContact O-N 3.04Å; E141-S143 VanDerWaalsContact C-N 3.3Å; E141-S143 PolarHBondContact O-N 3.37Å; S143-L146 PolarHBondContact O-N 3.24Å; S143-G147 PolarHBondContact O-N 2.79Å; S143-L217 VanDerWaalsContact CA-CD1 3.44Å; S143-L217 WeakPolarHBondContact OG-CD1 3.43Å |
| 144 | H | 89.8 | Confident | 85.5 | Confident | 139 Ų | 139 | 57.4 Ų | 57.4 | 64% | 0.644 | 32% | 0.324 | S | S | * | . | H | α-helix | trans | -66.2 | -43.3 | -179.9 | -175.1 | -87 | 0 | 0 | 0 | 111.2 | N140 E141 M142 G147 D148 | N140-H144 PolarHBondContact O-N 3.37Å; E141-H144 WeakPolarHBondContact O-CB 3.2Å; E141-H144 PolarHBondContact O-N 3.02Å; E141-H144 VanDerWaalsContact O-N 3.15Å; M142-H144 VanDerWaalsContact C-N 3.31Å; M142-H144 PolarHBondContact O-N 3.45Å; H144-G147 CarbonylContact O-C 3.58Å; H144-G147 PolarHBondContact O-N 3.04Å; H144-D148 PolarHBondContact O-N 3.14Å |
| 145 | K | 89.9 | Confident | 87.1 | Confident | 26 Ų | 26 | 53.1 Ų | 53.1 | 11% | 0.113 | 31% | 0.307 | C | S | . | . | H | α-helix | trans | -64.7 | -39.6 | 175.5 | -67.6 | -78.1 | -172.5 | 164.4 | 0 | 112.2 | E134 I136 E141 M142 G147 D148 L267 F268 | E134-K145 IonicContact OE2-NZ 3.43Å; E134-K145 PolarHBondContact OE2-NZ 3.13Å; I136-K145 HydrophobicContact CD1-CD 4.37Å; I136-K145 HydrophobicContact CD1-CG 3.77Å; E141-K145 WeakPolarHBondContact O-CG 3.38Å; E141-K145 PolarHBondContact O-N 3.33Å; M142-K145 PolarHBondContact O-N 3.39Å; K145-G147 VanDerWaalsContact C-N 3.31Å; K145-G147 PolarHBondContact O-N 3.4Å; K145-D148 WeakPolarHBondContact O-CB 3.37Å; K145-D148 PolarHBondContact O-N 3.19Å; K145-L267 HydrophobicContact CB-CD1 4.13Å; K145-L267 WeakPolarHBondContact CD-O 3.2Å; K145-F268 PolarHBondContact NZ-O 2.89Å |
| 146 | L | 90.8 | Very high | 88.8 | Confident | 43 Ų | 43 | 52.9 Ų | 52.9 | 23% | 0.225 | 31% | 0.311 | C | S | . | . | H | α-helix | trans | -67.1 | -30.4 | 174.3 | -73 | 169.5 | 0 | 0 | 0 | 113.1 | M142 S143 F151 V152 L217 L221 L267 | M142-L146 HydrophobicContact CE-CD1 4.18Å; M142-L146 HydrophobicContact CE-CD2 4.34Å; M142-L146 HydrophobicContact CE-CG 4.24Å; M142-L146 HydrophobicContact CG-CD1 4.14Å; M142-L146 WeakPolarHBondContact O-CB 3.5Å; M142-L146 VanDerWaalsContact O-CG 3.3Å; M142-L146 WeakPolarHBondContact O-CG 3.49Å; M142-L146 PolarHBondContact O-N 2.68Å; S143-L146 PolarHBondContact O-N 3.24Å; L146-F151 HydrophobicContact CD2-CD1 4.09Å; L146-F151 HydrophobicContact CD2-CE1 3.42Å; L146-F151 VanDerWaalsContact CD2-CE1 3.42Å; L146-F151 HydrophobicContact CD2-CZ 3.97Å; L146-V152 WeakPolarHBondContact O-CG2 3.36Å; L146-L217 HydrophobicContact CD1-CD1 4.22Å; L146-L221 HydrophobicContact CD1-CD2 4.12Å; L146-L267 HydrophobicContact CD2-CD1 3.77Å; L146-L267 HydrophobicContact CD2-CD2 4.48Å; L146-L267 HydrophobicContact CG-CD1 4.19Å |
| 147 | G | 90.7 | Very high | 90.2 | Very high | 53 Ų | 53 | 56.6 Ų | 56.6 | 55% | 0.546 | 33% | 0.33 | S | S | . | . | H | α-helix | trans | -85.3 | -5.8 | 176.8 | 0 | 0 | 0 | 0 | 0 | 114.3 | S143 H144 K145 | S143-G147 PolarHBondContact O-N 2.79Å; H144-G147 CarbonylContact O-C 3.58Å; H144-G147 PolarHBondContact O-N 3.04Å; K145-G147 VanDerWaalsContact C-N 3.31Å; K145-G147 PolarHBondContact O-N 3.4Å |
| 148 | D | 92.1 | Very high | 91.4 | Very high | 29 Ų | 29 | 53.4 Ų | 53.4 | 16% | 0.155 | 32% | 0.317 | C | S | . | . | trans | -62.4 | 132.5 | 179.4 | -173.3 | 93.1 | 0 | 0 | 0 | 110.3 | H144 K145 G150 F151 V152 K269 | H144-D148 PolarHBondContact O-N 3.14Å; K145-D148 WeakPolarHBondContact O-CB 3.37Å; K145-D148 PolarHBondContact O-N 3.19Å; D148-G150 PolarHBondContact O-N 3.2Å; D148-G150 VanDerWaalsContact O-N 3.13Å; D148-G150 PolarHBondContact OD2-N 3.49Å; D148-F151 PolarHBondContact O-N 2.95Å; D148-V152 WeakPolarHBondContact O-CG2 3.29Å; D148-V152 PolarHBondContact O-N 2.83Å; D148-K269 VanDerWaalsContact CG-NZ 3.29Å; D148-K269 IonicContact OD1-NZ 3.93Å; D148-K269 PolarHBondContact OD1-NZ 3.04Å; D148-K269 IonicContact OD2-NZ 3.31Å; D148-K269 PolarHBondContact OD2-NZ 2.74Å | ||
| 149 | P | 92.1 | Very high | 92 | Very high | 96 Ų | 96 | 54.9 Ų | 54.9 | 62% | 0.623 | 33% | 0.326 | S | S | * | . | H | α-helix | trans | -58.3 | -32 | -175 | 22.2 | -33.8 | 0 | 0 | 0 | 112.7 | V153 | P149-V153 VanDerWaalsContact O-CG2 3.29Å; P149-V153 WeakPolarHBondContact O-CG2 3.37Å; P149-V153 PolarHBondContact O-N 2.98Å |
| 150 | G | 92 | Very high | 92.4 | Very high | 39 Ų | 39 | 59.1 Ų | 59.1 | 40% | 0.402 | 35% | 0.347 | S | S | . | . | H | α-helix | trans | -64.4 | -46.2 | 176.7 | 0 | 0 | 0 | 0 | 0 | 112.1 | D148 F154 | D148-G150 PolarHBondContact O-N 3.2Å; D148-G150 VanDerWaalsContact O-N 3.13Å; D148-G150 PolarHBondContact OD2-N 3.49Å; G150-F154 WeakPolarHBondContact O-CB 3.4Å; G150-F154 PolarHBondContact O-N 3.01Å; G150-F154 VanDerWaalsContact O-N 3.12Å |
| 151 | F | 93.4 | Very high | 92.8 | Very high | 14 Ų | 14 | 57.9 Ų | 57.9 | 6% | 0.061 | 34% | 0.343 | C | S | . | . | H | α-helix | trans | -69.5 | -40.1 | 177.7 | -178.1 | -100.7 | 0 | 0 | 0 | 112.2 | L146 D148 V153 F154 A155 F191 I266 L267 | L146-F151 HydrophobicContact CD2-CD1 4.09Å; L146-F151 HydrophobicContact CD2-CE1 3.42Å; L146-F151 VanDerWaalsContact CD2-CE1 3.42Å; L146-F151 HydrophobicContact CD2-CZ 3.97Å; D148-F151 PolarHBondContact O-N 2.95Å; F151-V153 PolarHBondContact O-N 3.48Å; F151-F154 HydrophobicContact CD2-CD1 4.27Å; F151-F154 HydrophobicContact CE2-CD1 4.27Å; F151-F154 PolarHBondContact O-N 3.46Å; F151-A155 HydrophobicContact CD1-CB 4.45Å; F151-A155 HydrophobicContact CE1-CB 4.07Å; F151-A155 HydrophobicContact CZ-CB 4.21Å; F151-A155 VanDerWaalsContact O-CB 3.24Å; F151-A155 WeakPolarHBondContact O-CB 3.4Å; F151-A155 PolarHBondContact O-N 2.9Å; F151-F191 HydrophobicContact CZ-CE1 4.34Å; F151-I266 HydrophobicContact CB-CG2 4.41Å; F151-I266 HydrophobicContact CD2-CG2 4.3Å; F151-L267 HydrophobicContact CD1-CD1 3.92Å; F151-L267 HydrophobicContact CD2-CB 3.66Å; F151-L267 HydrophobicContact CD2-CD1 3.7Å; F151-L267 HydrophobicContact CD2-CG 4.22Å; F151-L267 HydrophobicContact CE1-CD1 4.02Å; F151-L267 HydrophobicContact CE2-CB 3.71Å; F151-L267 HydrophobicContact CE2-CD1 3.8Å; F151-L267 HydrophobicContact CE2-CD2 4.24Å; F151-L267 HydrophobicContact CE2-CG 4.12Å; F151-L267 HydrophobicContact CG-CB 4.49Å; F151-L267 HydrophobicContact CG-CD1 3.75Å; F151-L267 HydrophobicContact CZ-CD1 3.95Å; F151-L267 HydrophobicContact CZ-CD2 4.38Å |
| 152 | V | 95 | Very high | 93.2 | Very high | 65 Ų | 65 | 53.7 Ų | 53.7 | 39% | 0.394 | 32% | 0.324 | S | S | . | . | H | α-helix | trans | -62.2 | -44.3 | 178.8 | 174.8 | 0 | 0 | 0 | 0 | 111.4 | L146 D148 A155 T156 | L146-V152 WeakPolarHBondContact O-CG2 3.36Å; D148-V152 WeakPolarHBondContact O-CG2 3.29Å; D148-V152 PolarHBondContact O-N 2.83Å; V152-A155 PolarHBondContact O-N 3.26Å; V152-T156 HydrophobicContact CG1-CG2 4.35Å; V152-T156 WeakPolarHBondContact O-CB 3.38Å; V152-T156 VanDerWaalsContact O-CG2 3.24Å; V152-T156 WeakPolarHBondContact O-CG2 3.07Å; V152-T156 PolarHBondContact O-N 3.47Å; V152-T156 PolarHBondContact O-OG1 2.89Å |
| 153 | V | 95.9 | Very high | 93.5 | Very high | 85 Ų | 85 | 57.6 Ų | 57.6 | 52% | 0.515 | 35% | 0.345 | S | S | . | . | H | α-helix | trans | -63.6 | -45.6 | 176.2 | 171.6 | 0 | 0 | 0 | 0 | 110.8 | P149 F151 T156 L157 | P149-V153 VanDerWaalsContact O-CG2 3.29Å; P149-V153 WeakPolarHBondContact O-CG2 3.37Å; P149-V153 PolarHBondContact O-N 2.98Å; F151-V153 PolarHBondContact O-N 3.48Å; V153-T156 WeakPolarHBondContact CA-OG1 3.32Å; V153-T156 PolarHBondContact O-OG1 2.93Å; V153-L157 HydrophobicContact CG1-CD1 3.95Å; V153-L157 HydrophobicContact CG1-CG 4.49Å; V153-L157 WeakPolarHBondContact O-CB 3.48Å; V153-L157 VanDerWaalsContact O-CG 3.26Å; V153-L157 WeakPolarHBondContact O-CG 3.31Å; V153-L157 PolarHBondContact O-N 3.25Å |
| 154 | F | 95.1 | Very high | 93.8 | Very high | 42 Ų | 42 | 59.3 Ų | 59.3 | 18% | 0.184 | 35% | 0.348 | C | S | . | . | H | α-helix | trans | -59.1 | -49.7 | 175.7 | 169.6 | -102.9 | 0 | 0 | 0 | 112 | G150 F151 T156 L157 V158 F191 T262 C263 I266 | G150-F154 WeakPolarHBondContact O-CB 3.4Å; G150-F154 PolarHBondContact O-N 3.01Å; G150-F154 VanDerWaalsContact O-N 3.12Å; F151-F154 HydrophobicContact CD2-CD1 4.27Å; F151-F154 HydrophobicContact CE2-CD1 4.27Å; F151-F154 PolarHBondContact O-N 3.46Å; F154-T156 PolarHBondContact O-N 3.19Å; F154-L157 PolarHBondContact O-N 2.87Å; F154-V158 HydrophobicContact CD2-CG2 4.08Å; F154-V158 HydrophobicContact CE1-CG2 4.17Å; F154-V158 HydrophobicContact CE2-CG2 3.67Å; F154-V158 HydrophobicContact CZ-CG2 3.72Å; F154-V158 WeakPolarHBondContact O-CG2 3.47Å; F154-V158 PolarHBondContact O-N 2.93Å; F154-F191 HydrophobicContact CE1-CE1 4.41Å; F154-T262 HydrophobicContact CE2-CG2 3.93Å; F154-T262 HydrophobicContact CZ-CG2 4.13Å; F154-C263 HydrophobicContact CE1-CB 4.09Å; F154-C263 HydrophobicContact CZ-CB 4.39Å; F154-I266 HydrophobicContact CB-CD1 4.17Å; F154-I266 HydrophobicContact CB-CG2 4.13Å; F154-I266 HydrophobicContact CD1-CD1 4.11Å; F154-I266 HydrophobicContact CD1-CG2 4.4Å; F154-I266 HydrophobicContact CD2-CD1 3.36Å; F154-I266 HydrophobicContact CE1-CD1 4.36Å; F154-I266 HydrophobicContact CE2-CD1 3.65Å; F154-I266 HydrophobicContact CG-CD1 3.6Å; F154-I266 HydrophobicContact CG-CG2 4.3Å; F154-I266 HydrophobicContact CZ-CD1 4.14Å |
| 155 | A | 95.2 | Very high | 94 | Very high | 18 Ų | 18 | 54 Ų | 54 | 15% | 0.149 | 33% | 0.325 | C | S | . | . | H | α-helix | trans | -63.3 | -44.2 | -177 | 0 | 0 | 0 | 0 | 0 | 111.7 | F151 V152 V158 V159 F191 | F151-A155 HydrophobicContact CD1-CB 4.45Å; F151-A155 HydrophobicContact CE1-CB 4.07Å; F151-A155 HydrophobicContact CZ-CB 4.21Å; F151-A155 VanDerWaalsContact O-CB 3.24Å; F151-A155 WeakPolarHBondContact O-CB 3.4Å; F151-A155 PolarHBondContact O-N 2.9Å; V152-A155 PolarHBondContact O-N 3.26Å; A155-V158 PolarHBondContact O-N 3.14Å; A155-V159 WeakPolarHBondContact O-CB 3.37Å; A155-V159 VanDerWaalsContact O-CG2 3.27Å; A155-V159 WeakPolarHBondContact O-CG2 3.36Å; A155-V159 PolarHBondContact O-N 3.41Å; A155-F191 HydrophobicContact CB-CE1 4.11Å; A155-F191 HydrophobicContact CB-CZ 4.1Å |
| 156 | T | 95.3 | Very high | 94.2 | Very high | 70 Ų | 70 | 54.3 Ų | 54.3 | 43% | 0.429 | 33% | 0.327 | S | S | . | . | H | α-helix | trans | -63.1 | -43.6 | 176.8 | 51 | 0 | 0 | 0 | 0 | 112 | V152 V153 F154 V159 I160 | V152-T156 HydrophobicContact CG1-CG2 4.35Å; V152-T156 WeakPolarHBondContact O-CB 3.38Å; V152-T156 VanDerWaalsContact O-CG2 3.24Å; V152-T156 WeakPolarHBondContact O-CG2 3.07Å; V152-T156 PolarHBondContact O-N 3.47Å; V152-T156 PolarHBondContact O-OG1 2.89Å; V153-T156 WeakPolarHBondContact CA-OG1 3.32Å; V153-T156 PolarHBondContact O-OG1 2.93Å; F154-T156 PolarHBondContact O-N 3.19Å; T156-V159 PolarHBondContact O-N 3.36Å; T156-I160 WeakPolarHBondContact O-CB 3.16Å; T156-I160 VanDerWaalsContact O-CG1 3.24Å; T156-I160 WeakPolarHBondContact O-CG1 3.32Å; T156-I160 PolarHBondContact O-N 3.34Å |
| 157 | L | 95.8 | Very high | 94.4 | Very high | 101 Ų | 101 | 59.7 Ų | 59.7 | 53% | 0.529 | 35% | 0.349 | S | S | . | . | H | α-helix | trans | -60.7 | -46.6 | 175.1 | -74.3 | 172.4 | 0 | 0 | 0 | 112 | V153 F154 V159 I160 V161 | V153-L157 HydrophobicContact CG1-CD1 3.95Å; V153-L157 HydrophobicContact CG1-CG 4.49Å; V153-L157 WeakPolarHBondContact O-CB 3.48Å; V153-L157 VanDerWaalsContact O-CG 3.26Å; V153-L157 WeakPolarHBondContact O-CG 3.31Å; V153-L157 PolarHBondContact O-N 3.25Å; F154-L157 PolarHBondContact O-N 2.87Å; L157-V159 VanDerWaalsContact C-N 3.34Å; L157-V159 PolarHBondContact O-N 3.45Å; L157-I160 PolarHBondContact O-N 2.97Å; L157-V161 WeakPolarHBondContact O-CG2 3.26Å; L157-V161 PolarHBondContact O-N 2.7Å |
| 158 | V | 95.4 | Very high | 94.5 | Very high | 23 Ų | 23 | 59.5 Ų | 59.5 | 14% | 0.139 | 34% | 0.342 | C | S | . | . | H | α-helix | trans | -62.6 | -42 | 178.4 | 171.1 | 0 | 0 | 0 | 0 | 111.2 | F154 A155 V161 A162 V187 F191 | F154-V158 HydrophobicContact CD2-CG2 4.08Å; F154-V158 HydrophobicContact CE1-CG2 4.17Å; F154-V158 HydrophobicContact CE2-CG2 3.67Å; F154-V158 HydrophobicContact CZ-CG2 3.72Å; F154-V158 WeakPolarHBondContact O-CG2 3.47Å; F154-V158 PolarHBondContact O-N 2.93Å; A155-V158 PolarHBondContact O-N 3.14Å; V158-V161 PolarHBondContact O-N 3.2Å; V158-A162 VanDerWaalsContact O-CB 3.29Å; V158-A162 WeakPolarHBondContact O-CB 3.14Å; V158-A162 PolarHBondContact O-N 3.4Å; V158-V187 HydrophobicContact CG1-CB 3.71Å; V158-V187 HydrophobicContact CG1-CG1 4.44Å; V158-V187 HydrophobicContact CG1-CG2 4.07Å; V158-F191 HydrophobicContact CB-CE2 4.11Å; V158-F191 HydrophobicContact CB-CZ 3.79Å; V158-F191 HydrophobicContact CG1-CE2 3.53Å; V158-F191 HydrophobicContact CG1-CZ 3.62Å |
| 159 | V | 95.1 | Very high | 94.5 | Very high | 63 Ų | 63 | 60 Ų | 60 | 38% | 0.382 | 35% | 0.346 | S | S | . | . | H | α-helix | trans | -63 | -44.6 | 175.4 | 169.8 | 0 | 0 | 0 | 0 | 110.8 | A155 T156 L157 V161 A162 L163 F191 | A155-V159 WeakPolarHBondContact O-CB 3.37Å; A155-V159 VanDerWaalsContact O-CG2 3.27Å; A155-V159 WeakPolarHBondContact O-CG2 3.36Å; A155-V159 PolarHBondContact O-N 3.41Å; T156-V159 PolarHBondContact O-N 3.36Å; L157-V159 VanDerWaalsContact C-N 3.34Å; L157-V159 PolarHBondContact O-N 3.45Å; V159-V161 PolarHBondContact O-N 3.5Å; V159-A162 PolarHBondContact O-N 2.94Å; V159-L163 HydrophobicContact CG1-CD1 3.81Å; V159-L163 HydrophobicContact CG1-CG 4.23Å; V159-L163 WeakPolarHBondContact O-CB 3.37Å; V159-L163 WeakPolarHBondContact O-CG 3.18Å; V159-L163 PolarHBondContact O-N 3.41Å; V159-F191 HydrophobicContact CG2-CE2 3.98Å |
| 160 | I | 96.1 | Very high | 94.4 | Very high | 90 Ų | 90 | 55.6 Ų | 55.6 | 46% | 0.462 | 32% | 0.318 | S | S | . | . | H | α-helix | trans | -59.5 | -48.3 | 176.6 | -70.7 | 164.7 | 0 | 0 | 0 | 110.6 | T156 L157 A162 L163 I164 | T156-I160 WeakPolarHBondContact O-CB 3.16Å; T156-I160 VanDerWaalsContact O-CG1 3.24Å; T156-I160 WeakPolarHBondContact O-CG1 3.32Å; T156-I160 PolarHBondContact O-N 3.34Å; L157-I160 PolarHBondContact O-N 2.97Å; I160-A162 VanDerWaalsContact C-N 3.34Å; I160-A162 PolarHBondContact O-N 2.97Å; I160-L163 PolarHBondContact O-N 3.49Å; I160-I164 HydrophobicContact CG2-CD1 3.8Å; I160-I164 HydrophobicContact CG2-CG1 4.49Å; I160-I164 VanDerWaalsContact O-CG1 3.31Å; I160-I164 WeakPolarHBondContact O-CG1 3.29Å; I160-I164 PolarHBondContact O-N 3.16Å |
| 161 | V | 94.7 | Very high | 94.2 | Very high | 73 Ų | 73 | 58.4 Ų | 58.4 | 44% | 0.442 | 33% | 0.329 | S | S | . | . | H | α-helix | trans | -60.3 | -45 | 177.3 | 170.9 | 0 | 0 | 0 | 0 | 110.7 | L157 V158 V159 L163 I164 L165 | L157-V161 WeakPolarHBondContact O-CG2 3.26Å; L157-V161 PolarHBondContact O-N 2.7Å; V158-V161 PolarHBondContact O-N 3.2Å; V159-V161 PolarHBondContact O-N 3.5Å; V161-L163 PolarHBondContact O-N 3.26Å; V161-I164 PolarHBondContact O-N 3.47Å; V161-L165 HydrophobicContact CG1-CD1 4.06Å; V161-L165 HydrophobicContact CG1-CG 4.38Å; V161-L165 WeakPolarHBondContact O-CB 3.37Å; V161-L165 VanDerWaalsContact O-CG 3.3Å; V161-L165 WeakPolarHBondContact O-CG 3.42Å; V161-L165 PolarHBondContact O-N 3.43Å |
| 162 | A | 94.5 | Very high | 94.1 | Very high | 2 Ų | 2 | 67.3 Ų | 67.3 | 2% | 0.017 | 36% | 0.363 | C | S | . | . | H | α-helix | trans | -61 | -43.4 | 177.1 | 0 | 0 | 0 | 0 | 0 | 111.7 | V158 V159 I160 L165 I166 V187 I188 | V158-A162 VanDerWaalsContact O-CB 3.29Å; V158-A162 WeakPolarHBondContact O-CB 3.14Å; V158-A162 PolarHBondContact O-N 3.4Å; V159-A162 PolarHBondContact O-N 2.94Å; I160-A162 VanDerWaalsContact C-N 3.34Å; I160-A162 PolarHBondContact O-N 2.97Å; A162-L165 PolarHBondContact O-N 3.47Å; A162-I166 WeakPolarHBondContact O-CB 3.26Å; A162-I166 WeakPolarHBondContact O-CD1 3.07Å; A162-I166 WeakPolarHBondContact O-CG1 3.38Å; A162-I166 PolarHBondContact O-N 2.93Å; A162-V187 HydrophobicContact CB-CG2 4.03Å; A162-I188 HydrophobicContact CB-CD1 3.86Å; A162-I188 HydrophobicContact CB-CG1 4.27Å |
| 163 | L | 95.1 | Very high | 93.8 | Very high | 81 Ų | 81 | 69 Ų | 69 | 42% | 0.424 | 37% | 0.366 | S | S | . | . | H | α-helix | trans | -64.8 | -41.6 | 177.4 | -68 | 170.3 | 0 | 0 | 0 | 111.9 | V159 I160 V161 L165 I166 F167 | V159-L163 HydrophobicContact CG1-CD1 3.81Å; V159-L163 HydrophobicContact CG1-CG 4.23Å; V159-L163 WeakPolarHBondContact O-CB 3.37Å; V159-L163 WeakPolarHBondContact O-CG 3.18Å; V159-L163 PolarHBondContact O-N 3.41Å; I160-L163 PolarHBondContact O-N 3.49Å; V161-L163 PolarHBondContact O-N 3.26Å; L163-L165 VanDerWaalsContact C-N 3.34Å; L163-I166 PolarHBondContact O-N 2.93Å; L163-F167 HydrophobicContact CB-CD2 4.35Å; L163-F167 HydrophobicContact CD2-CD2 4.31Å; L163-F167 HydrophobicContact CD2-CE2 3.76Å; L163-F167 WeakPolarHBondContact O-CB 3.48Å; L163-F167 VanDerWaalsContact O-CD2 3.31Å; L163-F167 WeakPolarHBondContact O-CD2 3.39Å; L163-F167 PolarHBondContact O-N 2.92Å |
| 164 | I | 95.4 | Very high | 93.2 | Very high | 93 Ų | 93 | 65 Ų | 65 | 48% | 0.477 | 34% | 0.341 | S | S | . | . | H | α-helix | trans | -61.5 | -45.1 | 174.2 | -68.8 | 166.7 | 0 | 0 | 0 | 110.3 | I160 V161 I166 A168 V169 | I160-I164 HydrophobicContact CG2-CD1 3.8Å; I160-I164 HydrophobicContact CG2-CG1 4.49Å; I160-I164 VanDerWaalsContact O-CG1 3.31Å; I160-I164 WeakPolarHBondContact O-CG1 3.29Å; I160-I164 PolarHBondContact O-N 3.16Å; V161-I164 PolarHBondContact O-N 3.47Å; I164-I166 VanDerWaalsContact C-N 3.32Å; I164-I166 PolarHBondContact O-N 3.12Å; I164-A168 HydrophobicContact CG2-CB 4.44Å; I164-A168 WeakPolarHBondContact O-CA 3.41Å; I164-A168 WeakPolarHBondContact O-CB 3.47Å; I164-A168 PolarHBondContact O-N 3.38Å; I164-V169 HydrophobicContact CG2-CG2 4.44Å; I164-V169 PolarHBondContact O-N 3.01Å |
| 165 | L | 94.1 | Very high | 92.7 | Very high | 29 Ų | 29 | 68 Ų | 68 | 15% | 0.152 | 36% | 0.356 | C | S | . | . | I | π-helix | trans | -63.9 | -37.5 | 176.6 | -70.4 | 176.8 | 0 | 0 | 0 | 111.9 | V161 A162 L163 V169 G170 T183 I184 | V161-L165 HydrophobicContact CG1-CD1 4.06Å; V161-L165 HydrophobicContact CG1-CG 4.38Å; V161-L165 WeakPolarHBondContact O-CB 3.37Å; V161-L165 VanDerWaalsContact O-CG 3.3Å; V161-L165 WeakPolarHBondContact O-CG 3.42Å; V161-L165 PolarHBondContact O-N 3.43Å; A162-L165 PolarHBondContact O-N 3.47Å; L163-L165 VanDerWaalsContact C-N 3.34Å; L165-V169 HydrophobicContact CD2-CB 4.03Å; L165-V169 HydrophobicContact CD2-CG1 4.27Å; L165-V169 HydrophobicContact CD2-CG2 4.04Å; L165-G170 VanDerWaalsContact O-CA 3.28Å; L165-G170 WeakPolarHBondContact O-CA 3.23Å; L165-G170 PolarHBondContact O-N 3.29Å; L165-T183 HydrophobicContact CD1-CG2 3.79Å; L165-I184 HydrophobicContact CB-CD1 3.81Å; L165-I184 HydrophobicContact CB-CG1 3.5Å; L165-I184 VanDerWaalsContact CB-CG1 3.5Å; L165-I184 HydrophobicContact CD1-CG1 4.09Å; L165-I184 HydrophobicContact CG-CG1 4.45Å |
| 166 | I | 93.9 | Very high | 92.4 | Very high | 31 Ų | 31 | 72.2 Ų | 72.2 | 16% | 0.159 | 38% | 0.38 | C | S | . | . | I | π-helix | trans | -70.7 | -48.7 | 179.4 | -73.8 | 165.9 | 0 | 0 | 0 | 111.8 | A162 L163 I164 P171 I184 Y235 | A162-I166 WeakPolarHBondContact O-CB 3.26Å; A162-I166 WeakPolarHBondContact O-CD1 3.07Å; A162-I166 WeakPolarHBondContact O-CG1 3.38Å; A162-I166 PolarHBondContact O-N 2.93Å; L163-I166 PolarHBondContact O-N 2.93Å; I164-I166 VanDerWaalsContact C-N 3.32Å; I164-I166 PolarHBondContact O-N 3.12Å; I166-P171 WeakPolarHBondContact O-CD 3.49Å; I166-I184 HydrophobicContact CD1-CG2 3.96Å; I166-I184 HydrophobicContact CG1-CD1 4Å; I166-I184 HydrophobicContact CG1-CG1 4.25Å; I166-I184 HydrophobicContact CG1-CG2 3.74Å; I166-Y235 HydrophobicContact CD1-CE2 4.25Å; I166-Y235 HydrophobicContact CG1-CE2 3.96Å; I166-Y235 WeakPolarHBondContact CG2-OH 3.32Å |
| 167 | F | 94.6 | Very high | 92.1 | Very high | 157 Ų | 157 | 72.3 Ų | 72.3 | 69% | 0.689 | 38% | 0.378 | S | S | * | . | I | π-helix | trans | -93.1 | -33.6 | -169.8 | -69.6 | -64.5 | 0 | 0 | 0 | 114.1 | L163 P171 | L163-F167 HydrophobicContact CB-CD2 4.35Å; L163-F167 HydrophobicContact CD2-CD2 4.31Å; L163-F167 HydrophobicContact CD2-CE2 3.76Å; L163-F167 WeakPolarHBondContact O-CB 3.48Å; L163-F167 VanDerWaalsContact O-CD2 3.31Å; L163-F167 WeakPolarHBondContact O-CD2 3.39Å; L163-F167 PolarHBondContact O-N 2.92Å; F167-P171 WeakPolarHBondContact O-CG 3.42Å |
| 168 | A | 92.9 | Very high | 91.9 | Very high | 48 Ų | 48 | 68.6 Ų | 68.6 | 40% | 0.397 | 36% | 0.358 | S | S | . | . | I | π-helix | trans | -101.5 | -49.1 | -176 | 0 | 0 | 0 | 0 | 0 | 112.6 | I164 | I164-A168 HydrophobicContact CG2-CB 4.44Å; I164-A168 WeakPolarHBondContact O-CA 3.41Å; I164-A168 WeakPolarHBondContact O-CB 3.47Å; I164-A168 PolarHBondContact O-N 3.38Å |
| 169 | V | 92.7 | Very high | 91.9 | Very high | 41 Ų | 41 | 70.8 Ų | 70.8 | 25% | 0.248 | 37% | 0.369 | C | S | . | . | I | π-helix | trans | -87.2 | -40.8 | -171.8 | -172.3 | 0 | 0 | 0 | 0 | 111.8 | I164 L165 R172 H173 V180 | I164-V169 HydrophobicContact CG2-CG2 4.44Å; I164-V169 PolarHBondContact O-N 3.01Å; L165-V169 HydrophobicContact CD2-CB 4.03Å; L165-V169 HydrophobicContact CD2-CG1 4.27Å; L165-V169 HydrophobicContact CD2-CG2 4.04Å; V169-R172 PolarHBondContact O-N 3.17Å; V169-R172 VanDerWaalsContact O-N 3.14Å; V169-H173 HydrophobicContact CG1-CB 4.06Å; V169-H173 PolarHBondContact O-N 3.19Å; V169-V180 HydrophobicContact CB-CG1 4.33Å; V169-V180 HydrophobicContact CG1-CG1 3.94Å; V169-V180 HydrophobicContact CG1-CG2 3.73Å |
| 170 | G | 89.6 | Confident | 91.8 | Very high | 3 Ų | 3 | 68.3 Ų | 68.3 | 3% | 0.031 | 35% | 0.354 | C | S | . | . | H | α-helix | trans | -56.2 | -46.9 | -176.8 | 0 | 0 | 0 | 0 | 0 | 113.9 | L165 R172 G174 | L165-G170 VanDerWaalsContact O-CA 3.28Å; L165-G170 WeakPolarHBondContact O-CA 3.23Å; L165-G170 PolarHBondContact O-N 3.29Å; G170-R172 VanDerWaalsContact C-N 3.33Å; G170-R172 PolarHBondContact O-N 2.99Å; G170-G174 WeakPolarHBondContact O-CA 3.36Å; G170-G174 PolarHBondContact O-N 3.49Å |
| 171 | P | 89.3 | Confident | 91.7 | Very high | 98 Ų | 98 | 64.2 Ų | 64.2 | 64% | 0.636 | 33% | 0.333 | S | S | * | . | H | α-helix | trans | -68.1 | -30 | 177.8 | -22.7 | 35.2 | 0 | 0 | 0 | 113.5 | I166 F167 | I166-P171 WeakPolarHBondContact O-CD 3.49Å; F167-P171 WeakPolarHBondContact O-CG 3.42Å |
| 172 | R | 89.6 | Confident | 91.7 | Very high | 201 Ų | 201 | 60.7 Ų | 60.7 | 76% | 0.758 | 31% | 0.312 | S | S | * | . | H | α-helix | trans | -92.4 | -39.6 | -174.6 | -68.5 | -175.6 | 177.2 | 156.5 | 0.3 | 113.7 | V169 G170 | V169-R172 PolarHBondContact O-N 3.17Å; V169-R172 VanDerWaalsContact O-N 3.14Å; G170-R172 VanDerWaalsContact C-N 3.33Å; G170-R172 PolarHBondContact O-N 2.99Å |
| 173 | H | 88.8 | Confident | 91.8 | Very high | 100 Ų | 100 | 62.1 Ų | 62.1 | 46% | 0.463 | 32% | 0.32 | S | S | . | . | H | α-helix | trans | -126.2 | -4.9 | -169.5 | -60.3 | 95 | 0 | 0 | 0 | 113.7 | V169 Q175 T176 N177 V180 | V169-H173 HydrophobicContact CG1-CB 4.06Å; V169-H173 PolarHBondContact O-N 3.19Å; H173-Q175 VanDerWaalsContact C-N 3.25Å; H173-Q175 PolarHBondContact O-N 3.44Å; H173-T176 PolarHBondContact O-N 3.32Å; H173-T176 PolarHBondContact O-OG1 3.1Å; H173-N177 PolarHBondContact O-N 2.69Å; H173-V180 HydrophobicContact CB-CG2 4.38Å |
| 174 | G | 83.6 | Confident | 91.8 | Very high | 0 Ų | 0 | 58.3 Ų | 58.3 | 0% | 0 | 30% | 0.3 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -63.3 | -31.7 | -178.1 | 0 | 0 | 0 | 0 | 0 | 113.6 | G170 Y181 | G170-G174 WeakPolarHBondContact O-CA 3.36Å; G170-G174 PolarHBondContact O-N 3.49Å; G174-Y181 VanDerWaalsContact C-CZ 3.49Å; G174-Y181 VanDerWaalsContact CA-CZ 3.46Å; G174-Y181 WeakPolarHBondContact O-CD2 3.47Å; G174-Y181 WeakPolarHBondContact O-CE2 3.24Å |
| 175 | Q | 86.2 | Confident | 91.8 | Very high | 105 Ų | 105 | 53.9 Ų | 53.9 | 49% | 0.491 | 28% | 0.277 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -77 | -24.7 | 178.3 | -62 | -67.8 | -42.5 | 0 | 0 | 113.1 | H173 Y181 I242 F243 | H173-Q175 VanDerWaalsContact C-N 3.25Å; H173-Q175 PolarHBondContact O-N 3.44Å; Q175-Y181 PolarHBondContact NE2-OH 3.48Å; Q175-Y181 VanDerWaalsContact NE2-OH 3.17Å; Q175-I242 VanDerWaalsContact CD-CD1 3.44Å; Q175-F243 WeakPolarHBondContact O-CZ 3.46Å |
| 176 | T | 87.3 | Confident | 91.9 | Very high | 107 Ų | 107 | 52.5 Ų | 52.5 | 66% | 0.656 | 27% | 0.27 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -101.2 | -26.8 | -176.1 | 53.9 | 0 | 0 | 0 | 0 | 112.6 | H173 | H173-T176 PolarHBondContact O-N 3.32Å; H173-T176 PolarHBondContact O-OG1 3.1Å |
| 177 | N | 90.2 | Very high | 92 | Very high | 73 Ų | 73 | 52 Ų | 52 | 39% | 0.39 | 27% | 0.269 | S | S | . | . | trans | -125.9 | 106.3 | -176.7 | -166.2 | -23.1 | 0 | 0 | 0 | 111.2 | H173 L179 V180 | H173-N177 PolarHBondContact O-N 2.69Å; N177-L179 PolarHBondContact O-N 3Å; N177-L179 VanDerWaalsContact O-N 3.13Å; N177-L179 WeakPolarHBondContact OD1-CB 3.36Å; N177-L179 PolarHBondContact OD1-N 2.97Å; N177-L179 VanDerWaalsContact OD1-N 3.1Å; N177-V180 HydrophobicContact CB-CG2 4.18Å; N177-V180 PolarHBondContact O-N 3.39Å; N177-V180 VanDerWaalsContact O-N 3.13Å | ||
| 178 | I | 91.9 | Very high | 92.1 | Very high | 22 Ų | 22 | 45.5 Ų | 45.5 | 11% | 0.113 | 24% | 0.241 | C | C | . | . | H | α-helix | trans | -52.6 | -33.6 | 178 | -171.8 | 172.5 | 0 | 0 | 0 | 113.3 | V180 Y181 I182 F243 I247 V248 I251 | I178-V180 PolarHBondContact O-N 2.93Å; I178-Y181 PolarHBondContact O-N 3.46Å; I178-I182 HydrophobicContact CG1-CG1 3.97Å; I178-I182 WeakPolarHBondContact O-CG1 3.28Å; I178-I182 PolarHBondContact O-N 3.48Å; I178-I182 VanDerWaalsContact O-N 3.14Å; I178-F243 VanDerWaalsContact CA-CE2 3.48Å; I178-F243 HydrophobicContact CB-CD1 4.01Å; I178-F243 HydrophobicContact CB-CD2 3.8Å; I178-F243 HydrophobicContact CB-CE1 4.03Å; I178-F243 HydrophobicContact CB-CE2 3.84Å; I178-F243 HydrophobicContact CB-CG 3.9Å; I178-F243 HydrophobicContact CB-CZ 3.95Å; I178-F243 HydrophobicContact CD1-CB 3.78Å; I178-F243 HydrophobicContact CD1-CD2 4.17Å; I178-F243 HydrophobicContact CD1-CG 3.93Å; I178-F243 HydrophobicContact CG1-CB 4.26Å; I178-F243 HydrophobicContact CG1-CD1 4.48Å; I178-F243 HydrophobicContact CG1-CD2 3.68Å; I178-F243 HydrophobicContact CG1-CE2 4.14Å; I178-F243 HydrophobicContact CG1-CG 3.89Å; I178-I247 HydrophobicContact CD1-CG2 4.07Å; I178-V248 HydrophobicContact CD1-CB 4.27Å; I178-V248 HydrophobicContact CD1-CG2 3.61Å; I178-I251 HydrophobicContact CD1-CD1 4.37Å; I178-I251 HydrophobicContact CG2-CD1 4.35Å |
| 179 | L | 93.6 | Very high | 92.1 | Very high | 70 Ų | 70 | 43.2 Ų | 43.2 | 37% | 0.366 | 22% | 0.222 | S | C | . | . | H | α-helix | trans | -62.5 | -27.5 | -176.5 | -62.2 | 179.9 | 0 | 0 | 0 | 112 | N177 T183 I251 F255 | N177-L179 PolarHBondContact O-N 3Å; N177-L179 VanDerWaalsContact O-N 3.13Å; N177-L179 WeakPolarHBondContact OD1-CB 3.36Å; N177-L179 PolarHBondContact OD1-N 2.97Å; N177-L179 VanDerWaalsContact OD1-N 3.1Å; L179-T183 WeakPolarHBondContact O-CB 3.35Å; L179-T183 PolarHBondContact O-N 3.22Å; L179-T183 PolarHBondContact O-OG1 3.34Å; L179-I251 HydrophobicContact CD2-CG2 3.86Å; L179-F255 HydrophobicContact CD2-CE2 3.92Å; L179-F255 HydrophobicContact CD2-CZ 3.87Å |
| 180 | V | 94.1 | Very high | 92.2 | Very high | 10 Ų | 10 | 41.5 Ų | 41.5 | 6% | 0.061 | 21% | 0.212 | C | C | . | . | H | α-helix | trans | -64.7 | -54.4 | -179.5 | 179.5 | 0 | 0 | 0 | 0 | 110.5 | V169 H173 N177 I178 T183 I184 | V169-V180 HydrophobicContact CB-CG1 4.33Å; V169-V180 HydrophobicContact CG1-CG1 3.94Å; V169-V180 HydrophobicContact CG1-CG2 3.73Å; H173-V180 HydrophobicContact CB-CG2 4.38Å; N177-V180 HydrophobicContact CB-CG2 4.18Å; N177-V180 PolarHBondContact O-N 3.39Å; N177-V180 VanDerWaalsContact O-N 3.13Å; I178-V180 PolarHBondContact O-N 2.93Å; V180-T183 PolarHBondContact O-N 3.5Å; V180-I184 HydrophobicContact CG1-CD1 4.14Å; V180-I184 WeakPolarHBondContact O-CD1 3.24Å; V180-I184 VanDerWaalsContact O-CG1 3.24Å; V180-I184 WeakPolarHBondContact O-CG1 3.35Å; V180-I184 PolarHBondContact O-N 2.94Å |
| 181 | Y | 93.3 | Very high | 92.5 | Very high | 4 Ų | 4 | 42.4 Ų | 42.4 | 2% | 0.016 | 22% | 0.215 | C | C | . | . | H | α-helix | trans | -68.1 | -38.7 | -179.9 | -66.2 | -30.4 | 0 | 0 | 0 | 112.4 | G174 Q175 I178 I184 C185 Y235 R238 I242 F243 | G174-Y181 VanDerWaalsContact C-CZ 3.49Å; G174-Y181 VanDerWaalsContact CA-CZ 3.46Å; G174-Y181 WeakPolarHBondContact O-CD2 3.47Å; G174-Y181 WeakPolarHBondContact O-CE2 3.24Å; Q175-Y181 PolarHBondContact NE2-OH 3.48Å; Q175-Y181 VanDerWaalsContact NE2-OH 3.17Å; I178-Y181 PolarHBondContact O-N 3.46Å; Y181-I184 HydrophobicContact CD1-CD1 4.5Å; Y181-I184 PolarHBondContact O-N 3.37Å; Y181-C185 PolarHBondContact O-N 3.08Å; Y181-C185 PolarHBondContact O-SG 3.5Å; Y181-C185 VanDerWaalsContact O-SG 3.41Å; Y181-Y235 AromaticContact CD1-CD1 3.51Å; Y181-Y235 HydrophobicContact CD1-CD1 3.51Å; Y181-Y235 AromaticContact CD1-CE1 3.84Å; Y181-Y235 HydrophobicContact CD1-CE1 3.84Å; Y181-Y235 HydrophobicContact CE1-CD1 4.05Å; Y181-Y235 AromaticContact CE1-CE1 3.98Å; Y181-Y235 HydrophobicContact CE1-CE1 3.98Å; Y181-Y235 HydrophobicContact CG-CD1 4.24Å; Y181-R238 HydrophobicContact CD2-CB 4.24Å; Y181-R238 HydrophobicContact CE2-CB 4.27Å; Y181-I242 HydrophobicContact CD2-CD1 4.26Å; Y181-I242 HydrophobicContact CE2-CD1 3.55Å; Y181-F243 HydrophobicContact CD2-CE2 4.35Å |
| 182 | I | 95.4 | Very high | 92.7 | Very high | 0 Ų | 0 | 38.1 Ų | 38.1 | 0% | 0 | 19% | 0.187 | C | C | . | . | H | α-helix | trans | -63.8 | -46.4 | 176.7 | -67.7 | -56.4 | 0 | 0 | 0 | 111.5 | I178 I184 C185 S186 L236 A239 V248 I251 Y252 F255 | I178-I182 HydrophobicContact CG1-CG1 3.97Å; I178-I182 WeakPolarHBondContact O-CG1 3.28Å; I178-I182 PolarHBondContact O-N 3.48Å; I178-I182 VanDerWaalsContact O-N 3.14Å; I182-I184 VanDerWaalsContact C-N 3.32Å; I182-I184 PolarHBondContact O-N 3.45Å; I182-C185 PolarHBondContact O-N 3.34Å; I182-C185 PolarHBondContact O-SG 3.33Å; I182-S186 WeakPolarHBondContact O-CB 3.01Å; I182-S186 PolarHBondContact O-N 3.32Å; I182-S186 PolarHBondContact O-OG 3.39Å; I182-L236 HydrophobicContact CD1-CD1 4.42Å; I182-A239 HydrophobicContact CD1-CB 4.02Å; I182-V248 HydrophobicContact CD1-CG1 3.86Å; I182-I251 HydrophobicContact CG1-CG2 4.47Å; I182-I251 HydrophobicContact CG2-CG2 4.05Å; I182-Y252 HydrophobicContact CD1-CD2 4.17Å; I182-Y252 HydrophobicContact CD1-CG 4.38Å; I182-F255 HydrophobicContact CG2-CB 3.74Å; I182-F255 HydrophobicContact CG2-CD2 4.27Å; I182-F255 HydrophobicContact CG2-CG 3.97Å |
| 183 | T | 96 | Very high | 92.9 | Very high | 32 Ų | 32 | 28.9 Ų | 28.9 | 20% | 0.196 | 15% | 0.153 | C | C | . | . | H | α-helix | trans | -61.2 | -42.9 | 179.7 | -54.9 | 0 | 0 | 0 | 0 | 110.9 | L165 L179 V180 S186 V187 F255 | L165-T183 HydrophobicContact CD1-CG2 3.79Å; L179-T183 WeakPolarHBondContact O-CB 3.35Å; L179-T183 PolarHBondContact O-N 3.22Å; L179-T183 PolarHBondContact O-OG1 3.34Å; V180-T183 PolarHBondContact O-N 3.5Å; T183-S186 PolarHBondContact O-N 3.5Å; T183-V187 HydrophobicContact CG2-CG1 4.28Å; T183-V187 WeakPolarHBondContact O-CG1 3.29Å; T183-V187 VanDerWaalsContact O-CG2 3.31Å; T183-V187 WeakPolarHBondContact O-CG2 3.28Å; T183-V187 PolarHBondContact O-N 2.89Å; T183-F255 WeakPolarHBondContact OG1-CE1 3.02Å |
| 184 | I | 95.3 | Very high | 93 | Very high | 0 Ų | 0 | 24.4 Ų | 24.4 | 0% | 0 | 13% | 0.133 | C | C | . | . | H | α-helix | trans | -58.9 | -53.4 | 177.1 | -65.3 | 162.5 | 0 | 0 | 0 | 111.1 | L165 I166 V180 Y181 I182 S186 I188 Y235 | L165-I184 HydrophobicContact CB-CD1 3.81Å; L165-I184 HydrophobicContact CB-CG1 3.5Å; L165-I184 VanDerWaalsContact CB-CG1 3.5Å; L165-I184 HydrophobicContact CD1-CG1 4.09Å; L165-I184 HydrophobicContact CG-CG1 4.45Å; I166-I184 HydrophobicContact CD1-CG2 3.96Å; I166-I184 HydrophobicContact CG1-CD1 4Å; I166-I184 HydrophobicContact CG1-CG1 4.25Å; I166-I184 HydrophobicContact CG1-CG2 3.74Å; V180-I184 HydrophobicContact CG1-CD1 4.14Å; V180-I184 WeakPolarHBondContact O-CD1 3.24Å; V180-I184 VanDerWaalsContact O-CG1 3.24Å; V180-I184 WeakPolarHBondContact O-CG1 3.35Å; V180-I184 PolarHBondContact O-N 2.94Å; Y181-I184 HydrophobicContact CD1-CD1 4.5Å; Y181-I184 PolarHBondContact O-N 3.37Å; I182-I184 VanDerWaalsContact C-N 3.32Å; I182-I184 PolarHBondContact O-N 3.45Å; I184-S186 VanDerWaalsContact C-N 3.29Å; I184-S186 PolarHBondContact O-N 3.46Å; I184-I188 WeakPolarHBondContact O-CB 3.25Å; I184-I188 VanDerWaalsContact O-CG1 3.29Å; I184-I188 WeakPolarHBondContact O-CG1 3.32Å; I184-I188 PolarHBondContact O-N 2.99Å; I184-Y235 HydrophobicContact CB-CG 4.37Å; I184-Y235 HydrophobicContact CD1-CD1 4.13Å; I184-Y235 HydrophobicContact CD1-CE1 3.91Å; I184-Y235 HydrophobicContact CG2-CD1 4.31Å; I184-Y235 HydrophobicContact CG2-CD2 3.57Å; I184-Y235 HydrophobicContact CG2-CE2 3.82Å; I184-Y235 HydrophobicContact CG2-CG 3.84Å |
| 185 | C | 95.2 | Very high | 93.5 | Very high | 0 Ų | 0 | 24.8 Ų | 24.8 | 0% | 0 | 14% | 0.136 | C | C | . | . | H | α-helix | trans | -69 | -30.6 | -176.3 | 70.6 | 0 | 0 | 0 | 0 | 112.1 | Y181 I182 G189 Q232 L236 Y252 | Y181-C185 PolarHBondContact O-N 3.08Å; Y181-C185 PolarHBondContact O-SG 3.5Å; Y181-C185 VanDerWaalsContact O-SG 3.41Å; I182-C185 PolarHBondContact O-N 3.34Å; I182-C185 PolarHBondContact O-SG 3.33Å; C185-G189 WeakPolarHBondContact O-CA 3.38Å; C185-G189 PolarHBondContact O-N 2.83Å; C185-Q232 HydrophobicContact CB-CG 4.27Å; C185-L236 HydrophobicContact CB-CB 4.46Å; C185-Y252 VanDerWaalsContact SG-CE2 3.55Å |
| 186 | S | 96.4 | Very high | 93.8 | Very high | 0 Ų | 0 | 20.8 Ų | 20.8 | 0% | 0 | 12% | 0.118 | C | C | . | . | H | α-helix | trans | -69.8 | -47.5 | 177.7 | -69 | 0 | 0 | 0 | 0 | 113.1 | I182 T183 I184 G189 A190 F255 F256 | I182-S186 WeakPolarHBondContact O-CB 3.01Å; I182-S186 PolarHBondContact O-N 3.32Å; I182-S186 PolarHBondContact O-OG 3.39Å; T183-S186 PolarHBondContact O-N 3.5Å; I184-S186 VanDerWaalsContact C-N 3.29Å; I184-S186 PolarHBondContact O-N 3.46Å; S186-G189 PolarHBondContact O-N 3.44Å; S186-A190 PolarHBondContact O-N 3.3Å; S186-F255 VanDerWaalsContact OG-CB 3.31Å; S186-F255 WeakPolarHBondContact OG-CB 3.48Å; S186-F256 WeakPolarHBondContact OG-CA 3.37Å; S186-F256 PolarHBondContact OG-N 2.89Å |
| 187 | V | 96.3 | Very high | 93.9 | Very high | 22 Ų | 22 | 16.1 Ų | 16.1 | 13% | 0.133 | 9% | 0.089 | C | C | . | . | H | α-helix | trans | -71.6 | -38.9 | -178.6 | -60 | 0 | 0 | 0 | 0 | 112.2 | V158 A162 T183 G189 A190 | V158-V187 HydrophobicContact CG1-CB 3.71Å; V158-V187 HydrophobicContact CG1-CG1 4.44Å; V158-V187 HydrophobicContact CG1-CG2 4.07Å; A162-V187 HydrophobicContact CB-CG2 4.03Å; T183-V187 HydrophobicContact CG2-CG1 4.28Å; T183-V187 WeakPolarHBondContact O-CG1 3.29Å; T183-V187 VanDerWaalsContact O-CG2 3.31Å; T183-V187 WeakPolarHBondContact O-CG2 3.28Å; T183-V187 PolarHBondContact O-N 2.89Å; V187-G189 VanDerWaalsContact C-N 3.33Å; V187-A190 WeakPolarHBondContact O-CB 3.37Å; V187-A190 PolarHBondContact O-N 3.18Å |
| 188 | I | 95.9 | Very high | 93.9 | Very high | 20 Ų | 20 | 12.7 Ų | 12.7 | 10% | 0.103 | 7% | 0.071 | C | C | . | . | H | α-helix | trans | -68.4 | -36.8 | 173.3 | -63.1 | -62.2 | 0 | 0 | 0 | 110.8 | A162 I184 A190 F191 S192 C228 T231 | A162-I188 HydrophobicContact CB-CD1 3.86Å; A162-I188 HydrophobicContact CB-CG1 4.27Å; I184-I188 WeakPolarHBondContact O-CB 3.25Å; I184-I188 VanDerWaalsContact O-CG1 3.29Å; I184-I188 WeakPolarHBondContact O-CG1 3.32Å; I184-I188 PolarHBondContact O-N 2.99Å; I188-A190 VanDerWaalsContact C-N 3.29Å; I188-A190 PolarHBondContact O-N 3.47Å; I188-F191 PolarHBondContact O-N 3.18Å; I188-S192 PolarHBondContact O-N 2.98Å; I188-C228 HydrophobicContact CG2-CB 3.8Å; I188-C228 WeakPolarHBondContact CG2-O 3.25Å; I188-T231 HydrophobicContact CG1-CG2 4.47Å; I188-T231 HydrophobicContact CG2-CG2 4.29Å |
| 189 | G | 93.9 | Very high | 93.9 | Very high | 0 Ų | 0 | 12.8 Ų | 12.8 | 0% | 0 | 7% | 0.071 | C | C | . | . | H | α-helix | trans | -64.3 | -30.4 | 174 | 0 | 0 | 0 | 0 | 0 | 113.5 | C185 S186 V187 F191 S192 V193 Q232 | C185-G189 WeakPolarHBondContact O-CA 3.38Å; C185-G189 PolarHBondContact O-N 2.83Å; S186-G189 PolarHBondContact O-N 3.44Å; V187-G189 VanDerWaalsContact C-N 3.33Å; G189-F191 VanDerWaalsContact C-N 3.3Å; G189-F191 PolarHBondContact O-N 2.86Å; G189-S192 WeakPolarHBondContact CA-OG 3.44Å; G189-S192 PolarHBondContact O-N 3.1Å; G189-S192 PolarHBondContact O-OG 2.94Å; G189-V193 PolarHBondContact O-N 3.16Å; G189-V193 VanDerWaalsContact O-N 3.17Å; G189-Q232 VanDerWaalsContact CA-CD 3.48Å |
| 190 | A | 95.1 | Very high | 93.7 | Very high | 4 Ų | 4 | 9.6 Ų | 9.6 | 3% | 0.033 | 6% | 0.055 | C | C | . | . | H | α-helix | trans | -62.5 | -39.3 | 174 | 0 | 0 | 0 | 0 | 0 | 112 | S186 V187 I188 V193 S194 S259 V260 C263 | S186-A190 PolarHBondContact O-N 3.3Å; V187-A190 WeakPolarHBondContact O-CB 3.37Å; V187-A190 PolarHBondContact O-N 3.18Å; I188-A190 VanDerWaalsContact C-N 3.29Å; I188-A190 PolarHBondContact O-N 3.47Å; A190-V193 PolarHBondContact O-N 3.44Å; A190-S194 PolarHBondContact O-N 3.3Å; A190-S194 PolarHBondContact O-OG 3.24Å; A190-S259 WeakPolarHBondContact CB-O 3.15Å; A190-V260 HydrophobicContact CB-CG2 4.14Å; A190-C263 HydrophobicContact CB-CB 3.93Å |
| 191 | F | 95 | Very high | 93.4 | Very high | 23 Ų | 23 | 9.5 Ų | 9.5 | 10% | 0.101 | 5% | 0.054 | C | C | . | . | H | α-helix | trans | -69.2 | -32 | 174 | -63.3 | -45.5 | 0 | 0 | 0 | 113.3 | F151 F154 A155 V158 V159 I188 G189 V193 S194 C195 | F151-F191 HydrophobicContact CZ-CE1 4.34Å; F154-F191 HydrophobicContact CE1-CE1 4.41Å; A155-F191 HydrophobicContact CB-CE1 4.11Å; A155-F191 HydrophobicContact CB-CZ 4.1Å; V158-F191 HydrophobicContact CB-CE2 4.11Å; V158-F191 HydrophobicContact CB-CZ 3.79Å; V158-F191 HydrophobicContact CG1-CE2 3.53Å; V158-F191 HydrophobicContact CG1-CZ 3.62Å; V159-F191 HydrophobicContact CG2-CE2 3.98Å; I188-F191 PolarHBondContact O-N 3.18Å; G189-F191 VanDerWaalsContact C-N 3.3Å; G189-F191 PolarHBondContact O-N 2.86Å; F191-V193 VanDerWaalsContact C-N 3.32Å; F191-V193 PolarHBondContact O-N 3.47Å; F191-S194 PolarHBondContact O-N 3.4Å; F191-C195 PolarHBondContact O-N 3.41Å; F191-C195 PolarHBondContact O-SG 2.85Å |
| 192 | S | 94.1 | Very high | 93.2 | Very high | 8 Ų | 8 | 9.6 Ų | 9.6 | 6% | 0.056 | 6% | 0.056 | C | C | . | . | H | α-helix | trans | -63.5 | -40.5 | 175.2 | 73.4 | 0 | 0 | 0 | 0 | 111.1 | I188 G189 C195 V196 L225 Q232 | I188-S192 PolarHBondContact O-N 2.98Å; G189-S192 WeakPolarHBondContact CA-OG 3.44Å; G189-S192 PolarHBondContact O-N 3.1Å; G189-S192 PolarHBondContact O-OG 2.94Å; S192-C195 PolarHBondContact O-N 3.45Å; S192-V196 WeakPolarHBondContact O-CG2 3.36Å; S192-V196 PolarHBondContact O-N 3.48Å; S192-L225 WeakPolarHBondContact O-CD1 3.39Å; S192-Q232 PolarHBondContact OG-OE1 3.32Å; S192-Q232 VanDerWaalsContact OG-OE1 3.08Å |
| 193 | V | 92.6 | Very high | 92.9 | Very high | 6 Ų | 6 | 13 Ų | 13 | 4% | 0.036 | 7% | 0.073 | C | C | . | . | H | α-helix | trans | -61.5 | -45.1 | 174 | 176.1 | 0 | 0 | 0 | 0 | 111.6 | Y77 A82 G189 A190 F191 C195 V196 K197 F256 V260 | Y77-V193 HydrophobicContact CD1-CG1 3.84Å; Y77-V193 HydrophobicContact CE1-CG1 3.45Å; Y77-V193 VanDerWaalsContact CE1-CG1 3.45Å; A82-V193 HydrophobicContact CB-CG1 3.63Å; G189-V193 PolarHBondContact O-N 3.16Å; G189-V193 VanDerWaalsContact O-N 3.17Å; A190-V193 PolarHBondContact O-N 3.44Å; F191-V193 VanDerWaalsContact C-N 3.32Å; F191-V193 PolarHBondContact O-N 3.47Å; V193-C195 VanDerWaalsContact C-N 3.33Å; V193-C195 PolarHBondContact O-N 3.23Å; V193-V196 PolarHBondContact O-N 2.96Å; V193-K197 PolarHBondContact O-N 2.97Å; V193-F256 HydrophobicContact CG2-CE2 4.4Å; V193-F256 HydrophobicContact CG2-CZ 3.84Å; V193-V260 HydrophobicContact CB-CG1 4.42Å; V193-V260 HydrophobicContact CB-CG2 4.34Å; V193-V260 HydrophobicContact CG1-CG1 4.03Å; V193-V260 HydrophobicContact CG2-CG2 3.89Å |
| 194 | S | 92.1 | Very high | 92.4 | Very high | 7 Ų | 7 | 14.5 Ų | 14.5 | 5% | 0.049 | 8% | 0.077 | C | C | . | . | H | α-helix | trans | -61.5 | -39.8 | 175.5 | -55.5 | 0 | 0 | 0 | 0 | 112.5 | A190 F191 K197 G198 C263 | A190-S194 PolarHBondContact O-N 3.3Å; A190-S194 PolarHBondContact O-OG 3.24Å; F191-S194 PolarHBondContact O-N 3.4Å; S194-K197 PolarHBondContact O-N 3.14Å; S194-G198 PolarHBondContact O-N 2.96Å; S194-C263 PolarHBondContact OG-SG 2.95Å |
| 195 | C | 93.6 | Very high | 92 | Very high | 7 Ų | 7 | 15.2 Ų | 15.2 | 5% | 0.047 | 8% | 0.081 | C | C | . | . | H | α-helix | trans | -67 | -42.6 | 176.5 | -64.9 | 0 | 0 | 0 | 0 | 111.9 | F191 S192 V193 K197 G198 L199 L225 | F191-C195 PolarHBondContact O-N 3.41Å; F191-C195 PolarHBondContact O-SG 2.85Å; S192-C195 PolarHBondContact O-N 3.45Å; V193-C195 VanDerWaalsContact C-N 3.33Å; V193-C195 PolarHBondContact O-N 3.23Å; C195-K197 VanDerWaalsContact C-N 3.32Å; C195-K197 PolarHBondContact O-N 2.9Å; C195-G198 PolarHBondContact O-N 2.95Å; C195-L199 WeakPolarHBondContact O-CB 3.3Å; C195-L199 VanDerWaalsContact O-CG 3.29Å; C195-L199 WeakPolarHBondContact O-CG 3.32Å; C195-L199 PolarHBondContact O-N 3.13Å; C195-L225 HydrophobicContact CB-CB 3.9Å; C195-L225 HydrophobicContact CB-CD1 4.21Å |
| 196 | V | 92.1 | Very high | 91.7 | Very high | 21 Ų | 21 | 18.5 Ų | 18.5 | 13% | 0.127 | 10% | 0.098 | C | C | . | . | H | α-helix | trans | -57 | -47.1 | 174.1 | 162.1 | 0 | 0 | 0 | 0 | 110.5 | F74 Y77 S192 V193 L199 G200 L225 | F74-V196 HydrophobicContact CD2-CB 4.36Å; F74-V196 HydrophobicContact CD2-CG1 3.46Å; F74-V196 VanDerWaalsContact CD2-CG1 3.46Å; F74-V196 HydrophobicContact CD2-CG2 4.12Å; F74-V196 HydrophobicContact CE2-CB 4.12Å; F74-V196 HydrophobicContact CE2-CG1 3.51Å; F74-V196 HydrophobicContact CE2-CG2 3.96Å; F74-V196 HydrophobicContact CG-CG1 4.3Å; F74-V196 HydrophobicContact CZ-CG1 4.36Å; Y77-V196 HydrophobicContact CD2-CG1 4.08Å; Y77-V196 HydrophobicContact CG-CG1 4.19Å; S192-V196 WeakPolarHBondContact O-CG2 3.36Å; S192-V196 PolarHBondContact O-N 3.48Å; V193-V196 PolarHBondContact O-N 2.96Å; V196-L199 CarbonylContact O-C 3.45Å; V196-L199 PolarHBondContact O-N 3.26Å; V196-G200 PolarHBondContact O-N 3.46Å; V196-L225 HydrophobicContact CG2-CD1 3.71Å; V196-L225 HydrophobicContact CG2-CD2 4.01Å |
| 197 | K | 89.6 | Confident | 91.2 | Very high | 10 Ų | 10 | 26.5 Ų | 26.5 | 4% | 0.043 | 13% | 0.133 | C | C | . | . | H | α-helix | trans | -61.8 | -47.2 | 178.8 | -176.9 | 162.7 | 176.3 | -153.9 | 0 | 112.1 | Y77 E133 V193 S194 C195 L199 G200 I201 F268 | Y77-K197 WeakPolarHBondContact O-CG 3.25Å; E133-K197 IonicContact OE1-NZ 3.2Å; E133-K197 PolarHBondContact OE1-NZ 3.02Å; E133-K197 WeakPolarHBondContact OE2-CE 3.47Å; E133-K197 IonicContact OE2-NZ 2.68Å; E133-K197 PolarHBondContact OE2-NZ 3.49Å; V193-K197 PolarHBondContact O-N 2.97Å; S194-K197 PolarHBondContact O-N 3.14Å; C195-K197 VanDerWaalsContact C-N 3.32Å; C195-K197 PolarHBondContact O-N 2.9Å; K197-L199 VanDerWaalsContact C-N 3.33Å; K197-L199 PolarHBondContact O-N 2.9Å; K197-G200 WeakPolarHBondContact O-CA 3.19Å; K197-G200 PolarHBondContact O-N 3.26Å; K197-G200 VanDerWaalsContact O-N 3.11Å; K197-I201 WeakPolarHBondContact O-CG1 3.42Å; K197-I201 PolarHBondContact O-N 2.89Å; K197-F268 HydrophobicContact CD-CE1 4.24Å; K197-F268 HydrophobicContact CD-CE2 3.74Å; K197-F268 HydrophobicContact CD-CZ 3.44Å; K197-F268 VanDerWaalsContact CD-CZ 3.44Å; K197-F268 HydrophobicContact CG-CZ 4.08Å; K197-F268 VanDerWaalsContact NZ-CE1 3.34Å; K197-F268 VanDerWaalsContact NZ-CE2 3.25Å |
| 198 | G | 90.9 | Very high | 90.7 | Very high | 0 Ų | 0 | 29 Ų | 29 | 0% | 0 | 16% | 0.157 | C | C | . | . | H | α-helix | trans | -61.3 | -38.8 | 175.4 | 0 | 0 | 0 | 0 | 0 | 113.3 | S194 C195 I201 A202 | S194-G198 PolarHBondContact O-N 2.96Å; C195-G198 PolarHBondContact O-N 2.95Å; G198-I201 PolarHBondContact O-N 2.88Å; G198-A202 PolarHBondContact O-N 3.34Å |
| 199 | L | 91.6 | Very high | 90.1 | Very high | 25 Ų | 25 | 31.3 Ų | 31.3 | 13% | 0.131 | 19% | 0.185 | C | C | . | . | H | α-helix | trans | -69.6 | -31.9 | 173.2 | -71.6 | 167.7 | 0 | 0 | 0 | 112.7 | C195 V196 K197 A202 L203 A218 L221 L222 L225 | C195-L199 WeakPolarHBondContact O-CB 3.3Å; C195-L199 VanDerWaalsContact O-CG 3.29Å; C195-L199 WeakPolarHBondContact O-CG 3.32Å; C195-L199 PolarHBondContact O-N 3.13Å; V196-L199 CarbonylContact O-C 3.45Å; V196-L199 PolarHBondContact O-N 3.26Å; K197-L199 VanDerWaalsContact C-N 3.33Å; K197-L199 PolarHBondContact O-N 2.9Å; L199-A202 WeakPolarHBondContact O-CB 3.2Å; L199-A202 PolarHBondContact O-N 3.31Å; L199-L203 WeakPolarHBondContact O-CB 3.34Å; L199-L203 PolarHBondContact O-N 3.4Å; L199-A218 WeakPolarHBondContact CD2-O 3.45Å; L199-L221 HydrophobicContact CD2-CB 4.06Å; L199-L221 HydrophobicContact CG-CB 4Å; L199-L222 HydrophobicContact CD1-CD1 4.23Å; L199-L222 HydrophobicContact CD2-CB 4.2Å; L199-L225 HydrophobicContact CD1-CB 4.29Å; L199-L225 HydrophobicContact CD1-CD2 3.57Å |
| 200 | G | 89 | Confident | 89.7 | Confident | 2 Ų | 2 | 35.8 Ų | 35.8 | 2% | 0.021 | 20% | 0.204 | C | C | . | . | H | α-helix | trans | -61.4 | -44.1 | 171.7 | 0 | 0 | 0 | 0 | 0 | 111.6 | V196 K197 L203 K204 | V196-G200 PolarHBondContact O-N 3.46Å; K197-G200 WeakPolarHBondContact O-CA 3.19Å; K197-G200 PolarHBondContact O-N 3.26Å; K197-G200 VanDerWaalsContact O-N 3.11Å; G200-L203 PolarHBondContact O-N 2.94Å; G200-K204 WeakPolarHBondContact O-CG 3.38Å; G200-K204 PolarHBondContact O-N 3.49Å |
| 201 | I | 87.8 | Confident | 89.1 | Confident | 8 Ų | 8 | 40 Ų | 40 | 4% | 0.041 | 23% | 0.231 | C | C | . | . | H | α-helix | trans | -62.9 | -46 | 172.8 | -62.9 | 164.1 | 0 | 0 | 0 | 110.3 | I136 K197 G198 L203 K204 E205 | I136-I201 HydrophobicContact CB-CD1 4.31Å; I136-I201 HydrophobicContact CG2-CD1 3.9Å; I136-I201 WeakPolarHBondContact O-CD1 3.5Å; K197-I201 WeakPolarHBondContact O-CG1 3.42Å; K197-I201 PolarHBondContact O-N 2.89Å; G198-I201 PolarHBondContact O-N 2.88Å; I201-L203 VanDerWaalsContact C-N 3.27Å; I201-L203 PolarHBondContact O-N 3.31Å; I201-K204 WeakPolarHBondContact O-CB 3.45Å; I201-K204 PolarHBondContact O-N 2.81Å; I201-E205 PolarHBondContact O-N 3.4Å |
| 202 | A | 89.6 | Confident | 88.5 | Confident | 7 Ų | 7 | 39.2 Ų | 39.2 | 6% | 0.058 | 23% | 0.228 | C | C | . | . | H | α-helix | trans | -54.6 | -44 | 175.3 | 0 | 0 | 0 | 0 | 0 | 111.9 | L139 G198 L199 E205 L206 V212 A218 | L139-A202 HydrophobicContact CD1-CB 3.75Å; L139-A202 HydrophobicContact CD2-CB 3.83Å; L139-A202 HydrophobicContact CG-CB 4.14Å; G198-A202 PolarHBondContact O-N 3.34Å; L199-A202 WeakPolarHBondContact O-CB 3.2Å; L199-A202 PolarHBondContact O-N 3.31Å; A202-E205 PolarHBondContact O-N 2.71Å; A202-L206 WeakPolarHBondContact O-CB 3.44Å; A202-L206 PolarHBondContact O-N 3.03Å; A202-V212 HydrophobicContact CB-CG1 3.78Å; A202-A218 HydrophobicContact CB-CB 4.48Å |
| 203 | L | 88.8 | Confident | 87.8 | Confident | 70 Ų | 70 | 44.2 Ų | 44.2 | 37% | 0.366 | 25% | 0.254 | S | S | . | . | H | α-helix | trans | -69.1 | -39.4 | -179.6 | -173.2 | 61.9 | 0 | 0 | 0 | 111.9 | L199 G200 I201 L206 F207 | L199-L203 WeakPolarHBondContact O-CB 3.34Å; L199-L203 PolarHBondContact O-N 3.4Å; G200-L203 PolarHBondContact O-N 2.94Å; I201-L203 VanDerWaalsContact C-N 3.27Å; I201-L203 PolarHBondContact O-N 3.31Å; L203-L206 HydrophobicContact CD1-CD2 4.25Å; L203-L206 WeakPolarHBondContact O-CB 3.23Å; L203-L206 PolarHBondContact O-N 3.45Å; L203-F207 HydrophobicContact CD1-CD2 4.29Å; L203-F207 HydrophobicContact CD1-CE2 3.72Å; L203-F207 HydrophobicContact CD1-CZ 3.98Å; L203-F207 HydrophobicContact CD2-CE2 4.04Å; L203-F207 HydrophobicContact CG-CD2 4.02Å; L203-F207 HydrophobicContact CG-CE2 3.57Å; L203-F207 HydrophobicContact CG-CZ 4.3Å; L203-F207 VanDerWaalsContact O-CD2 3.26Å; L203-F207 WeakPolarHBondContact O-CD2 3.31Å; L203-F207 PolarHBondContact O-N 3.43Å |
| 204 | K | 84.7 | Confident | 87.3 | Confident | 64 Ų | 64 | 54.6 Ų | 54.6 | 28% | 0.278 | 29% | 0.292 | S | S | . | . | H | α-helix | trans | -59.2 | -46.6 | 172.2 | -77 | -179.8 | 168.2 | -171.6 | 0 | 111.4 | D9 A78 F79 G200 I201 L206 F207 A208 | D9-K204 IonicContact OD2-NZ 2.68Å; D9-K204 PolarHBondContact OD2-NZ 3.12Å; A78-K204 WeakPolarHBondContact O-CE 3.4Å; A78-K204 PolarHBondContact O-NZ 3.26Å; F79-K204 VanDerWaalsContact CD1-CE 3.44Å; F79-K204 VanDerWaalsContact CZ-CE 3.49Å; G200-K204 WeakPolarHBondContact O-CG 3.38Å; G200-K204 PolarHBondContact O-N 3.49Å; I201-K204 WeakPolarHBondContact O-CB 3.45Å; I201-K204 PolarHBondContact O-N 2.81Å; K204-L206 VanDerWaalsContact C-N 3.31Å; K204-L206 PolarHBondContact O-N 2.93Å; K204-F207 PolarHBondContact O-N 2.79Å; K204-A208 PolarHBondContact O-N 3.27Å |
| 205 | E | 87 | Confident | 87 | Confident | 16 Ų | 16 | 57.3 Ų | 57.3 | 8% | 0.075 | 30% | 0.304 | C | S | . | . | H | α-helix | trans | -65 | -34.7 | 176.8 | -73.8 | -158.9 | 125 | 0 | 0 | 112.4 | L139 I201 A202 A208 G209 K210 V212 | L139-E205 PolarHBondContact N-OE2 2.78Å; I201-E205 PolarHBondContact O-N 3.4Å; A202-E205 PolarHBondContact O-N 2.71Å; E205-A208 CarbonylContact O-C 3.58Å; E205-A208 PolarHBondContact O-N 3.32Å; E205-G209 PolarHBondContact O-N 3.22Å; E205-K210 HydrophobicContact CB-CB 4.31Å; E205-K210 HydrophobicContact CB-CD 3.97Å; E205-K210 HydrophobicContact CG-CD 3.91Å; E205-K210 WeakPolarHBondContact O-CB 3.47Å; E205-K210 PolarHBondContact O-N 3.45Å; E205-K210 VanDerWaalsContact OE1-CD 3.31Å; E205-K210 WeakPolarHBondContact OE1-CD 3.5Å; E205-K210 IonicContact OE1-NZ 2.72Å; E205-K210 PolarHBondContact OE1-NZ 2.95Å; E205-V212 HydrophobicContact CB-CG2 3.38Å |
| 206 | L | 88.9 | Confident | 86.7 | Confident | 69 Ų | 69 | 61.4 Ų | 61.4 | 36% | 0.361 | 33% | 0.331 | S | S | . | . | H | α-helix | trans | -65 | -45.1 | 176.1 | -176.5 | 65.9 | 0 | 0 | 0 | 111.2 | A202 L203 K204 A208 G209 V212 L213 | A202-L206 WeakPolarHBondContact O-CB 3.44Å; A202-L206 PolarHBondContact O-N 3.03Å; L203-L206 HydrophobicContact CD1-CD2 4.25Å; L203-L206 WeakPolarHBondContact O-CB 3.23Å; L203-L206 PolarHBondContact O-N 3.45Å; K204-L206 VanDerWaalsContact C-N 3.31Å; K204-L206 PolarHBondContact O-N 2.93Å; L206-A208 PolarHBondContact O-N 2.93Å; L206-G209 PolarHBondContact O-N 2.95Å; L206-V212 HydrophobicContact CB-CB 4.34Å; L206-V212 HydrophobicContact CB-CG2 4.31Å; L206-V212 HydrophobicContact CD1-CB 4.45Å; L206-L213 HydrophobicContact CD1-CG 4.33Å |
| 207 | F | 87.1 | Confident | 86.6 | Confident | 167 Ų | 167 | 61.6 Ų | 61.6 | 73% | 0.732 | 33% | 0.331 | S | S | * | . | H | α-helix | trans | -66.9 | -25.6 | 174.7 | -71.3 | -49.6 | 0 | 0 | 0 | 113.1 | L203 K204 G209 | L203-F207 HydrophobicContact CD1-CD2 4.29Å; L203-F207 HydrophobicContact CD1-CE2 3.72Å; L203-F207 HydrophobicContact CD1-CZ 3.98Å; L203-F207 HydrophobicContact CD2-CE2 4.04Å; L203-F207 HydrophobicContact CG-CD2 4.02Å; L203-F207 HydrophobicContact CG-CE2 3.57Å; L203-F207 HydrophobicContact CG-CZ 4.3Å; L203-F207 VanDerWaalsContact O-CD2 3.26Å; L203-F207 WeakPolarHBondContact O-CD2 3.31Å; L203-F207 PolarHBondContact O-N 3.43Å; K204-F207 PolarHBondContact O-N 2.79Å; F207-G209 PolarHBondContact O-N 2.94Å |
| 208 | A | 85.9 | Confident | 86.7 | Confident | 76 Ų | 76 | 61.7 Ų | 61.7 | 63% | 0.628 | 33% | 0.333 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -76.9 | 0.5 | 171 | 0 | 0 | 0 | 0 | 0 | 113.7 | K204 E205 L206 | K204-A208 PolarHBondContact O-N 3.27Å; E205-A208 CarbonylContact O-C 3.58Å; E205-A208 PolarHBondContact O-N 3.32Å; L206-A208 PolarHBondContact O-N 2.93Å |
| 209 | G | 83.7 | Confident | 86.8 | Confident | 68 Ų | 68 | 68.5 Ų | 68.5 | 70% | 0.701 | 36% | 0.359 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 82.8 | 10.4 | 177 | 0 | 0 | 0 | 0 | 0 | 115.1 | E205 L206 F207 | E205-G209 PolarHBondContact O-N 3.22Å; L206-G209 PolarHBondContact O-N 2.95Å; F207-G209 PolarHBondContact O-N 2.94Å |
| 210 | K | 84.4 | Confident | 86.9 | Confident | 93 Ų | 93 | 71.9 Ų | 71.9 | 40% | 0.404 | 38% | 0.381 | S | S | . | . | trans | -75.8 | 147.8 | 175.6 | -66.9 | 174.2 | 172.5 | 175.2 | 0 | 110.6 | E205 V212 | E205-K210 HydrophobicContact CB-CB 4.31Å; E205-K210 HydrophobicContact CB-CD 3.97Å; E205-K210 HydrophobicContact CG-CD 3.91Å; E205-K210 WeakPolarHBondContact O-CB 3.47Å; E205-K210 PolarHBondContact O-N 3.45Å; E205-K210 VanDerWaalsContact OE1-CD 3.31Å; E205-K210 WeakPolarHBondContact OE1-CD 3.5Å; E205-K210 IonicContact OE1-NZ 2.72Å; E205-K210 PolarHBondContact OE1-NZ 2.95Å; K210-V212 HydrophobicContact CB-CG2 4.25Å; K210-V212 PolarHBondContact O-N 3.26Å | ||
| 211 | P | 83 | Confident | 87.1 | Confident | 93 Ų | 93 | 72.3 Ų | 72.3 | 60% | 0.604 | 38% | 0.382 | S | S | * | . | trans | -76.4 | 59.2 | -178 | 32.8 | -36.8 | 0 | 0 | 0 | 113 | L213 R214 | P211-L213 VanDerWaalsContact C-N 3.31Å; P211-L213 PolarHBondContact O-N 3.48Å; P211-R214 PolarHBondContact O-N 2.9Å | ||
| 212 | V | 81.9 | Confident | 87.4 | Confident | 6 Ų | 6 | 75.2 Ų | 75.2 | 4% | 0.036 | 40% | 0.398 | C | S | . | . | G | 310 helix | trans | -62.7 | -33.9 | -175.2 | 173 | 0 | 0 | 0 | 0 | 113.1 | L139 A202 E205 L206 K210 R214 H215 A218 | L139-V212 HydrophobicContact CD1-CB 4.44Å; L139-V212 HydrophobicContact CD1-CG1 3.53Å; L139-V212 HydrophobicContact CD1-CG2 4.36Å; A202-V212 HydrophobicContact CB-CG1 3.78Å; E205-V212 HydrophobicContact CB-CG2 3.38Å; L206-V212 HydrophobicContact CB-CB 4.34Å; L206-V212 HydrophobicContact CB-CG2 4.31Å; L206-V212 HydrophobicContact CD1-CB 4.45Å; K210-V212 HydrophobicContact CB-CG2 4.25Å; K210-V212 PolarHBondContact O-N 3.26Å; V212-R214 PolarHBondContact O-N 2.97Å; V212-R214 VanDerWaalsContact O-N 3.12Å; V212-H215 WeakPolarHBondContact O-CB 3.22Å; V212-H215 PolarHBondContact O-N 3.37Å; V212-A218 HydrophobicContact CG1-CB 4.3Å |
| 213 | L | 80.6 | Confident | 87.7 | Confident | 113 Ų | 113 | 80.3 Ų | 80.3 | 59% | 0.592 | 42% | 0.424 | S | S | * | . | G | 310 helix | trans | -63.8 | -19.1 | 179.9 | -64.5 | 175.3 | 0 | 0 | 0 | 113.4 | L206 P211 W219 | L206-L213 HydrophobicContact CD1-CG 4.33Å; P211-L213 VanDerWaalsContact C-N 3.31Å; P211-L213 PolarHBondContact O-N 3.48Å; L213-W219 HydrophobicContact CD2-CZ2 4.41Å; L213-W219 PolarHBondContact O-NE1 2.99Å |
| 214 | R | 81.4 | Confident | 87.9 | Confident | 224 Ų | 224 | 79.1 Ų | 79.1 | 85% | 0.845 | 42% | 0.421 | S | S | * | . | G | 310 helix | trans | -83.8 | -15.7 | 173.2 | -74.1 | -163.8 | 170.8 | 127 | -0.4 | 113.4 | P211 V212 P216 | P211-R214 PolarHBondContact O-N 2.9Å; V212-R214 PolarHBondContact O-N 2.97Å; V212-R214 VanDerWaalsContact O-N 3.12Å; R214-P216 WeakPolarHBondContact O-CD 3.41Å |
| 215 | H | 84.8 | Confident | 88.4 | Confident | 64 Ų | 64 | 77.2 Ų | 77.2 | 30% | 0.296 | 41% | 0.414 | S | S | . | . | trans | -74.2 | 120.6 | 177.3 | -102.4 | -79.6 | 0 | 0 | 0 | 110.2 | L139 N140 V212 L217 A218 | L139-H215 HydrophobicContact CD1-CB 4.4Å; N140-H215 PolarHBondContact OD1-CE1 2.98Å; V212-H215 WeakPolarHBondContact O-CB 3.22Å; V212-H215 PolarHBondContact O-N 3.37Å; H215-L217 PolarHBondContact O-N 3.24Å; H215-A218 PolarHBondContact O-N 2.98Å | ||
| 216 | P | 88.5 | Confident | 88.8 | Confident | 94 Ų | 94 | 81 Ų | 81 | 61% | 0.61 | 43% | 0.433 | S | S | * | . | H | α-helix | trans | -63.5 | -28.8 | -178.6 | 25.2 | -33.8 | 0 | 0 | 0 | 112.2 | R214 A218 W219 V220 | R214-P216 WeakPolarHBondContact O-CD 3.41Å; P216-A218 VanDerWaalsContact C-N 3.32Å; P216-A218 PolarHBondContact O-N 2.87Å; P216-W219 PolarHBondContact O-N 3.33Å; P216-V220 WeakPolarHBondContact O-CG2 3.25Å; P216-V220 PolarHBondContact O-N 3.48Å; P216-V220 VanDerWaalsContact O-N 3.11Å |
| 217 | L | 89.9 | Confident | 89.2 | Confident | 25 Ų | 25 | 81.6 Ų | 81.6 | 13% | 0.131 | 44% | 0.44 | C | S | . | . | H | α-helix | trans | -60.2 | -38.1 | -179.9 | -174.3 | 149.2 | 0 | 0 | 0 | 112.7 | L139 S143 L146 H215 W219 V220 L221 | L139-L217 HydrophobicContact CD2-CD2 3.65Å; S143-L217 VanDerWaalsContact CA-CD1 3.44Å; S143-L217 WeakPolarHBondContact OG-CD1 3.43Å; L146-L217 HydrophobicContact CD1-CD1 4.22Å; H215-L217 PolarHBondContact O-N 3.24Å; L217-W219 VanDerWaalsContact C-N 3.29Å; L217-W219 PolarHBondContact O-N 3.19Å; L217-V220 PolarHBondContact O-N 2.93Å; L217-L221 HydrophobicContact CD2-CD1 3.41Å; L217-L221 VanDerWaalsContact CD2-CD1 3.41Å; L217-L221 HydrophobicContact CD2-CG 3.76Å; L217-L221 HydrophobicContact CG-CD1 4.49Å; L217-L221 HydrophobicContact CG-CG 4.38Å; L217-L221 WeakPolarHBondContact O-CG 3.18Å; L217-L221 PolarHBondContact O-N 3.46Å |
| 218 | A | 90.9 | Very high | 89.6 | Confident | 11 Ų | 11 | 74.1 Ų | 74.1 | 9% | 0.091 | 41% | 0.408 | C | S | . | . | H | α-helix | trans | -61.2 | -40.1 | 179.1 | 0 | 0 | 0 | 0 | 0 | 111.7 | L199 A202 V212 H215 P216 L222 | L199-A218 WeakPolarHBondContact CD2-O 3.45Å; A202-A218 HydrophobicContact CB-CB 4.48Å; V212-A218 HydrophobicContact CG1-CB 4.3Å; H215-A218 PolarHBondContact O-N 2.98Å; P216-A218 VanDerWaalsContact C-N 3.32Å; P216-A218 PolarHBondContact O-N 2.87Å; A218-L222 WeakPolarHBondContact O-CB 3.42Å; A218-L222 PolarHBondContact O-N 3.12Å |
| 219 | W | 92.4 | Very high | 89.9 | Confident | 144 Ų | 144 | 72.9 Ų | 72.9 | 55% | 0.545 | 39% | 0.393 | S | S | . | . | H | α-helix | trans | -71.5 | -38.1 | 177.1 | -65.3 | 102.8 | 0 | 0 | 0 | 112.6 | L213 P216 L217 L222 L223 | L213-W219 HydrophobicContact CD2-CZ2 4.41Å; L213-W219 PolarHBondContact O-NE1 2.99Å; P216-W219 PolarHBondContact O-N 3.33Å; L217-W219 VanDerWaalsContact C-N 3.29Å; L217-W219 PolarHBondContact O-N 3.19Å; W219-L222 HydrophobicContact CE3-CD2 4.14Å; W219-L222 HydrophobicContact CZ3-CD2 4.15Å; W219-L222 PolarHBondContact O-N 2.92Å; W219-L223 WeakPolarHBondContact O-CB 3.41Å; W219-L223 PolarHBondContact O-N 3.03Å |
| 220 | V | 93.9 | Very high | 90.4 | Very high | 96 Ų | 96 | 73 Ų | 73 | 58% | 0.582 | 38% | 0.383 | S | S | * | . | H | α-helix | trans | -63.5 | -45.2 | 174.6 | 173.9 | 0 | 0 | 0 | 0 | 110.8 | P216 L217 L222 L223 S224 | P216-V220 WeakPolarHBondContact O-CG2 3.25Å; P216-V220 PolarHBondContact O-N 3.48Å; P216-V220 VanDerWaalsContact O-N 3.11Å; L217-V220 PolarHBondContact O-N 2.93Å; V220-L222 VanDerWaalsContact C-N 3.33Å; V220-L222 PolarHBondContact O-N 3.02Å; V220-L223 PolarHBondContact O-N 3.45Å; V220-S224 WeakPolarHBondContact O-CB 3.38Å; V220-S224 PolarHBondContact O-N 3.08Å |
| 221 | L | 93.5 | Very high | 90.8 | Very high | 10 Ų | 10 | 70.3 Ų | 70.3 | 5% | 0.052 | 37% | 0.374 | C | S | . | . | H | α-helix | trans | -62.3 | -40.4 | 175.6 | -70.3 | -175.8 | 0 | 0 | 0 | 111.9 | L146 L199 L217 L225 | L146-L221 HydrophobicContact CD1-CD2 4.12Å; L199-L221 HydrophobicContact CD2-CB 4.06Å; L199-L221 HydrophobicContact CG-CB 4Å; L217-L221 HydrophobicContact CD2-CD1 3.41Å; L217-L221 VanDerWaalsContact CD2-CD1 3.41Å; L217-L221 HydrophobicContact CD2-CG 3.76Å; L217-L221 HydrophobicContact CG-CD1 4.49Å; L217-L221 HydrophobicContact CG-CG 4.38Å; L217-L221 WeakPolarHBondContact O-CG 3.18Å; L217-L221 PolarHBondContact O-N 3.46Å; L221-L225 VanDerWaalsContact O-CB 3.25Å; L221-L225 WeakPolarHBondContact O-CB 3.28Å; L221-L225 PolarHBondContact O-N 3.45Å |
| 222 | L | 94 | Very high | 91.3 | Very high | 69 Ų | 69 | 66.9 Ų | 66.9 | 36% | 0.361 | 35% | 0.35 | S | S | . | . | H | α-helix | trans | -64.1 | -48.2 | 177.3 | -175.8 | 66.4 | 0 | 0 | 0 | 111.9 | L199 A218 W219 V220 L225 I226 | L199-L222 HydrophobicContact CD1-CD1 4.23Å; L199-L222 HydrophobicContact CD2-CB 4.2Å; A218-L222 WeakPolarHBondContact O-CB 3.42Å; A218-L222 PolarHBondContact O-N 3.12Å; W219-L222 HydrophobicContact CE3-CD2 4.14Å; W219-L222 HydrophobicContact CZ3-CD2 4.15Å; W219-L222 PolarHBondContact O-N 2.92Å; V220-L222 VanDerWaalsContact C-N 3.33Å; V220-L222 PolarHBondContact O-N 3.02Å; L222-L225 WeakPolarHBondContact O-CB 3.37Å; L222-L225 PolarHBondContact O-N 2.65Å; L222-I226 HydrophobicContact CG-CD1 4.4Å; L222-I226 WeakPolarHBondContact O-CG1 3.38Å; L222-I226 PolarHBondContact O-N 3.09Å; L222-I226 VanDerWaalsContact O-N 3.09Å |
| 223 | L | 95.6 | Very high | 91.7 | Very high | 115 Ų | 115 | 70.6 Ų | 70.6 | 60% | 0.602 | 37% | 0.369 | S | S | * | . | H | α-helix | trans | -63.3 | -45.5 | 178.1 | -177.6 | 66.6 | 0 | 0 | 0 | 111.1 | W219 V220 L225 I226 V227 | W219-L223 WeakPolarHBondContact O-CB 3.41Å; W219-L223 PolarHBondContact O-N 3.03Å; V220-L223 PolarHBondContact O-N 3.45Å; L223-L225 VanDerWaalsContact C-N 3.31Å; L223-L225 PolarHBondContact O-N 3.27Å; L223-I226 PolarHBondContact O-N 2.79Å; L223-V227 WeakPolarHBondContact O-CG2 3.38Å; L223-V227 PolarHBondContact O-N 2.83Å; L223-V227 VanDerWaalsContact O-N 3.1Å |
| 224 | S | 94.5 | Very high | 92.3 | Very high | 44 Ų | 44 | 69.3 Ų | 69.3 | 31% | 0.308 | 36% | 0.363 | S | S | . | . | H | α-helix | trans | -58.6 | -43.6 | 176.2 | -176.3 | 0 | 0 | 0 | 0 | 111.4 | V220 I226 V227 C228 | V220-S224 WeakPolarHBondContact O-CB 3.38Å; V220-S224 PolarHBondContact O-N 3.08Å; S224-I226 PolarHBondContact O-N 3.28Å; S224-V227 PolarHBondContact O-N 3.23Å; S224-C228 WeakPolarHBondContact O-CB 3.4Å; S224-C228 PolarHBondContact O-N 2.98Å; S224-C228 PolarHBondContact O-SG 3.48Å |
| 225 | L | 95.2 | Very high | 92.9 | Very high | 25 Ų | 25 | 59.7 Ų | 59.7 | 13% | 0.131 | 33% | 0.327 | C | S | . | . | H | α-helix | trans | -58.5 | -47.7 | 176.6 | 178.8 | 62.1 | 0 | 0 | 0 | 111.7 | S192 C195 V196 L199 L221 L222 L223 V227 C228 V229 | S192-L225 WeakPolarHBondContact O-CD1 3.39Å; C195-L225 HydrophobicContact CB-CB 3.9Å; C195-L225 HydrophobicContact CB-CD1 4.21Å; V196-L225 HydrophobicContact CG2-CD1 3.71Å; V196-L225 HydrophobicContact CG2-CD2 4.01Å; L199-L225 HydrophobicContact CD1-CB 4.29Å; L199-L225 HydrophobicContact CD1-CD2 3.57Å; L221-L225 VanDerWaalsContact O-CB 3.25Å; L221-L225 WeakPolarHBondContact O-CB 3.28Å; L221-L225 PolarHBondContact O-N 3.45Å; L222-L225 WeakPolarHBondContact O-CB 3.37Å; L222-L225 PolarHBondContact O-N 2.65Å; L223-L225 VanDerWaalsContact C-N 3.31Å; L223-L225 PolarHBondContact O-N 3.27Å; L225-V227 VanDerWaalsContact C-N 3.34Å; L225-V227 PolarHBondContact O-N 2.97Å; L225-C228 PolarHBondContact O-N 3.4Å; L225-V229 HydrophobicContact CD1-CG2 3.62Å; L225-V229 HydrophobicContact CG-CG2 4.21Å; L225-V229 WeakPolarHBondContact O-CB 3.45Å; L225-V229 VanDerWaalsContact O-CG2 3.28Å; L225-V229 WeakPolarHBondContact O-CG2 3.42Å; L225-V229 PolarHBondContact O-N 3.41Å |
| 226 | I | 95.8 | Very high | 93.2 | Very high | 94 Ų | 94 | 58.3 Ų | 58.3 | 48% | 0.482 | 32% | 0.321 | S | S | . | . | H | α-helix | trans | -59.9 | -45.9 | -179.9 | -67.6 | 165.8 | 0 | 0 | 0 | 110.6 | L222 L223 S224 S230 | L222-I226 HydrophobicContact CG-CD1 4.4Å; L222-I226 WeakPolarHBondContact O-CG1 3.38Å; L222-I226 PolarHBondContact O-N 3.09Å; L222-I226 VanDerWaalsContact O-N 3.09Å; L223-I226 PolarHBondContact O-N 2.79Å; S224-I226 PolarHBondContact O-N 3.28Å; I226-S230 VanDerWaalsContact O-CB 3.24Å; I226-S230 WeakPolarHBondContact O-CB 3.3Å; I226-S230 PolarHBondContact O-N 3.01Å; I226-S230 PolarHBondContact O-OG 3.23Å |
| 227 | V | 95.5 | Very high | 93.4 | Very high | 82 Ų | 82 | 58.2 Ų | 58.2 | 50% | 0.497 | 32% | 0.316 | S | S | . | . | H | α-helix | trans | -65 | -46 | 179 | 174 | 0 | 0 | 0 | 0 | 111.1 | L223 S224 L225 T231 | L223-V227 WeakPolarHBondContact O-CG2 3.38Å; L223-V227 PolarHBondContact O-N 2.83Å; L223-V227 VanDerWaalsContact O-N 3.1Å; S224-V227 PolarHBondContact O-N 3.23Å; L225-V227 VanDerWaalsContact C-N 3.34Å; L225-V227 PolarHBondContact O-N 2.97Å; V227-T231 WeakPolarHBondContact O-CB 3.42Å; V227-T231 PolarHBondContact O-N 3.35Å; V227-T231 PolarHBondContact O-OG1 3.31Å |
| 228 | C | 95.7 | Very high | 93.4 | Very high | 11 Ų | 11 | 62.3 Ų | 62.3 | 7% | 0.074 | 33% | 0.329 | C | S | . | . | H | α-helix | trans | -63.7 | -48.9 | -179.5 | -68.4 | 0 | 0 | 0 | 0 | 111.4 | I188 S224 L225 S230 T231 Q232 | I188-C228 HydrophobicContact CG2-CB 3.8Å; I188-C228 WeakPolarHBondContact CG2-O 3.25Å; S224-C228 WeakPolarHBondContact O-CB 3.4Å; S224-C228 PolarHBondContact O-N 2.98Å; S224-C228 PolarHBondContact O-SG 3.48Å; L225-C228 PolarHBondContact O-N 3.4Å; C228-S230 PolarHBondContact O-N 3.21Å; C228-T231 PolarHBondContact O-N 3.23Å; C228-Q232 WeakPolarHBondContact O-CB 3.36Å; C228-Q232 PolarHBondContact O-N 3.01Å |
| 229 | V | 93.5 | Very high | 93.4 | Very high | 50 Ų | 50 | 61.8 Ų | 61.8 | 30% | 0.303 | 33% | 0.325 | S | S | . | . | H | α-helix | trans | -63.7 | -43.1 | 179.8 | 170.6 | 0 | 0 | 0 | 0 | 111.1 | L225 T231 Q232 I233 | L225-V229 HydrophobicContact CD1-CG2 3.62Å; L225-V229 HydrophobicContact CG-CG2 4.21Å; L225-V229 WeakPolarHBondContact O-CB 3.45Å; L225-V229 VanDerWaalsContact O-CG2 3.28Å; L225-V229 WeakPolarHBondContact O-CG2 3.42Å; L225-V229 PolarHBondContact O-N 3.41Å; V229-T231 VanDerWaalsContact C-N 3.34Å; V229-T231 PolarHBondContact O-N 2.81Å; V229-Q232 PolarHBondContact O-N 2.97Å; V229-I233 HydrophobicContact CG1-CD1 3.62Å; V229-I233 HydrophobicContact CG1-CG1 4.27Å; V229-I233 WeakPolarHBondContact O-CB 3.49Å; V229-I233 VanDerWaalsContact O-CG1 3.32Å; V229-I233 WeakPolarHBondContact O-CG1 3.28Å; V229-I233 PolarHBondContact O-N 3.24Å |
| 230 | S | 93.9 | Very high | 93.3 | Very high | 70 Ų | 70 | 57.8 Ų | 57.8 | 49% | 0.49 | 31% | 0.314 | S | S | . | . | H | α-helix | trans | -60.5 | -45.2 | 177.4 | -59.6 | 0 | 0 | 0 | 0 | 111.5 | I226 C228 N234 | I226-S230 VanDerWaalsContact O-CB 3.24Å; I226-S230 WeakPolarHBondContact O-CB 3.3Å; I226-S230 PolarHBondContact O-N 3.01Å; I226-S230 PolarHBondContact O-OG 3.23Å; C228-S230 PolarHBondContact O-N 3.21Å; S230-N234 WeakPolarHBondContact O-CB 3.36Å; S230-N234 PolarHBondContact O-N 3.09Å; S230-N234 VanDerWaalsContact O-N 3.1Å |
| 231 | T | 92.9 | Very high | 93.1 | Very high | 37 Ų | 37 | 60.1 Ų | 60.1 | 23% | 0.227 | 32% | 0.323 | C | S | . | . | H | α-helix | trans | -65.5 | -46.5 | 177.4 | -56.3 | 0 | 0 | 0 | 0 | 111.2 | I188 V227 C228 V229 I233 N234 Y235 | I188-T231 HydrophobicContact CG1-CG2 4.47Å; I188-T231 HydrophobicContact CG2-CG2 4.29Å; V227-T231 WeakPolarHBondContact O-CB 3.42Å; V227-T231 PolarHBondContact O-N 3.35Å; V227-T231 PolarHBondContact O-OG1 3.31Å; C228-T231 PolarHBondContact O-N 3.23Å; V229-T231 VanDerWaalsContact C-N 3.34Å; V229-T231 PolarHBondContact O-N 2.81Å; T231-I233 PolarHBondContact O-N 3.04Å; T231-N234 PolarHBondContact O-N 3.38Å; T231-Y235 HydrophobicContact CG2-CD2 3.79Å; T231-Y235 HydrophobicContact CG2-CE2 3.87Å; T231-Y235 WeakPolarHBondContact O-CD2 3.41Å; T231-Y235 PolarHBondContact O-N 2.97Å; T231-Y235 VanDerWaalsContact O-N 3.08Å |
| 232 | Q | 93.8 | Very high | 92.9 | Very high | 20 Ų | 20 | 62.3 Ų | 62.3 | 9% | 0.093 | 33% | 0.334 | C | S | . | . | H | α-helix | trans | -57.1 | -51.1 | 178.6 | 179.8 | 179 | 10.9 | 0 | 0 | 111.5 | C185 G189 S192 C228 V229 N234 Y235 L236 Y252 | C185-Q232 HydrophobicContact CB-CG 4.27Å; G189-Q232 VanDerWaalsContact CA-CD 3.48Å; S192-Q232 PolarHBondContact OG-OE1 3.32Å; S192-Q232 VanDerWaalsContact OG-OE1 3.08Å; C228-Q232 WeakPolarHBondContact O-CB 3.36Å; C228-Q232 PolarHBondContact O-N 3.01Å; V229-Q232 PolarHBondContact O-N 2.97Å; Q232-N234 PolarHBondContact O-N 2.88Å; Q232-Y235 PolarHBondContact O-N 2.87Å; Q232-L236 VanDerWaalsContact O-CB 3.25Å; Q232-L236 WeakPolarHBondContact O-CB 3.45Å; Q232-L236 PolarHBondContact O-N 2.92Å; Q232-Y252 PolarHBondContact NE2-OH 3.11Å |
| 233 | I | 89.6 | Confident | 92.7 | Very high | 85 Ų | 85 | 61 Ų | 61 | 44% | 0.436 | 33% | 0.326 | S | S | . | . | H | α-helix | trans | -63.3 | -42.2 | 179.9 | -68.9 | 172.8 | 0 | 0 | 0 | 110.8 | V229 T231 Y235 L236 N237 | V229-I233 HydrophobicContact CG1-CD1 3.62Å; V229-I233 HydrophobicContact CG1-CG1 4.27Å; V229-I233 WeakPolarHBondContact O-CB 3.49Å; V229-I233 VanDerWaalsContact O-CG1 3.32Å; V229-I233 WeakPolarHBondContact O-CG1 3.28Å; V229-I233 PolarHBondContact O-N 3.24Å; T231-I233 PolarHBondContact O-N 3.04Å; I233-Y235 PolarHBondContact O-N 2.8Å; I233-L236 PolarHBondContact O-N 3.19Å; I233-N237 WeakPolarHBondContact CG2-ND2 3.41Å; I233-N237 VanDerWaalsContact O-CB 3.25Å; I233-N237 WeakPolarHBondContact O-CB 3.1Å; I233-N237 PolarHBondContact O-N 3.45Å; I233-N237 PolarHBondContact O-ND2 3.44Å |
| 234 | N | 92.8 | Very high | 92.3 | Very high | 86 Ų | 86 | 60.1 Ų | 60.1 | 46% | 0.46 | 32% | 0.322 | S | S | . | . | H | α-helix | trans | -59.9 | -49.2 | 179.3 | -175.9 | 25.2 | 0 | 0 | 0 | 112.1 | S230 T231 Q232 N237 R238 | S230-N234 WeakPolarHBondContact O-CB 3.36Å; S230-N234 PolarHBondContact O-N 3.09Å; S230-N234 VanDerWaalsContact O-N 3.1Å; T231-N234 PolarHBondContact O-N 3.38Å; Q232-N234 PolarHBondContact O-N 2.88Å; N234-N237 PolarHBondContact O-N 2.93Å; N234-R238 PolarHBondContact O-N 3.1Å |
| 235 | Y | 94 | Very high | 91.8 | Very high | 22 Ų | 22 | 61.5 Ų | 61.5 | 9% | 0.086 | 33% | 0.328 | C | S | . | . | H | α-helix | trans | -72.9 | -35.7 | -179.3 | -80.2 | -73.6 | 0 | 0 | 0 | 113.3 | I166 Y181 I184 T231 Q232 I233 R238 A239 | I166-Y235 HydrophobicContact CD1-CE2 4.25Å; I166-Y235 HydrophobicContact CG1-CE2 3.96Å; I166-Y235 WeakPolarHBondContact CG2-OH 3.32Å; Y181-Y235 AromaticContact CD1-CD1 3.51Å; Y181-Y235 HydrophobicContact CD1-CD1 3.51Å; Y181-Y235 AromaticContact CD1-CE1 3.84Å; Y181-Y235 HydrophobicContact CD1-CE1 3.84Å; Y181-Y235 HydrophobicContact CE1-CD1 4.05Å; Y181-Y235 AromaticContact CE1-CE1 3.98Å; Y181-Y235 HydrophobicContact CE1-CE1 3.98Å; Y181-Y235 HydrophobicContact CG-CD1 4.24Å; I184-Y235 HydrophobicContact CB-CG 4.37Å; I184-Y235 HydrophobicContact CD1-CD1 4.13Å; I184-Y235 HydrophobicContact CD1-CE1 3.91Å; I184-Y235 HydrophobicContact CG2-CD1 4.31Å; I184-Y235 HydrophobicContact CG2-CD2 3.57Å; I184-Y235 HydrophobicContact CG2-CE2 3.82Å; I184-Y235 HydrophobicContact CG2-CG 3.84Å; T231-Y235 HydrophobicContact CG2-CD2 3.79Å; T231-Y235 HydrophobicContact CG2-CE2 3.87Å; T231-Y235 WeakPolarHBondContact O-CD2 3.41Å; T231-Y235 PolarHBondContact O-N 2.97Å; T231-Y235 VanDerWaalsContact O-N 3.08Å; Q232-Y235 PolarHBondContact O-N 2.87Å; I233-Y235 PolarHBondContact O-N 2.8Å; Y235-R238 PolarHBondContact O-N 3.41Å; Y235-A239 PolarHBondContact O-N 3.48Å |
| 236 | L | 92.3 | Very high | 91.2 | Very high | 35 Ų | 35 | 61.6 Ų | 61.6 | 18% | 0.183 | 33% | 0.331 | C | S | . | . | H | α-helix | trans | -63 | -44.9 | 173.4 | -178.2 | 61.2 | 0 | 0 | 0 | 111 | I182 C185 Q232 I233 R238 A239 L240 Y252 | I182-L236 HydrophobicContact CD1-CD1 4.42Å; C185-L236 HydrophobicContact CB-CB 4.46Å; Q232-L236 VanDerWaalsContact O-CB 3.25Å; Q232-L236 WeakPolarHBondContact O-CB 3.45Å; Q232-L236 PolarHBondContact O-N 2.92Å; I233-L236 PolarHBondContact O-N 3.19Å; L236-R238 PolarHBondContact O-N 2.95Å; L236-A239 PolarHBondContact O-N 3.04Å; L236-L240 HydrophobicContact CD1-CD1 4.43Å; L236-L240 HydrophobicContact CG-CD1 4.14Å; L236-L240 WeakPolarHBondContact O-CG 3.38Å; L236-L240 PolarHBondContact O-N 2.9Å; L236-Y252 HydrophobicContact CD1-CD1 4.26Å; L236-Y252 HydrophobicContact CD1-CD2 3.9Å; L236-Y252 HydrophobicContact CD1-CE2 4.17Å; L236-Y252 HydrophobicContact CD1-CG 3.93Å; L236-Y252 HydrophobicContact CD2-CE1 4.33Å |
| 237 | N | 91.4 | Very high | 90.8 | Very high | 92 Ų | 92 | 61.6 Ų | 61.6 | 49% | 0.492 | 33% | 0.331 | S | S | . | . | H | α-helix | trans | -63.9 | -40.4 | 177 | -72.3 | -12.8 | 0 | 0 | 0 | 111.7 | I233 N234 A239 L240 D241 | I233-N237 WeakPolarHBondContact CG2-ND2 3.41Å; I233-N237 VanDerWaalsContact O-CB 3.25Å; I233-N237 WeakPolarHBondContact O-CB 3.1Å; I233-N237 PolarHBondContact O-N 3.45Å; I233-N237 PolarHBondContact O-ND2 3.44Å; N234-N237 PolarHBondContact O-N 2.93Å; N237-A239 PolarHBondContact O-N 3.36Å; N237-L240 PolarHBondContact O-N 3.05Å; N237-D241 WeakPolarHBondContact O-CB 3.42Å; N237-D241 PolarHBondContact O-N 2.95Å |
| 238 | R | 90.9 | Very high | 90.5 | Very high | 110 Ų | 110 | 57.7 Ų | 57.7 | 42% | 0.415 | 31% | 0.308 | S | S | . | . | H | α-helix | trans | -58.3 | -45.6 | 172.1 | -84.4 | -179.1 | 146.4 | -171.2 | -5.9 | 112.3 | Y181 N234 Y235 L236 L240 D241 I242 | Y181-R238 HydrophobicContact CD2-CB 4.24Å; Y181-R238 HydrophobicContact CE2-CB 4.27Å; N234-R238 PolarHBondContact O-N 3.1Å; Y235-R238 PolarHBondContact O-N 3.41Å; L236-R238 PolarHBondContact O-N 2.95Å; R238-L240 VanDerWaalsContact C-N 3.32Å; R238-L240 PolarHBondContact O-N 3.41Å; R238-D241 PolarHBondContact O-N 3.35Å; R238-I242 VanDerWaalsContact O-CD1 3.28Å; R238-I242 WeakPolarHBondContact O-CD1 3.33Å; R238-I242 WeakPolarHBondContact O-CG1 3.44Å; R238-I242 PolarHBondContact O-N 3.06Å |
| 239 | A | 90.8 | Very high | 90.1 | Very high | 0 Ų | 0 | 59.1 Ų | 59.1 | 0% | 0 | 32% | 0.316 | C | S | . | . | H | α-helix | trans | -62.1 | -40.9 | 177.3 | 0 | 0 | 0 | 0 | 0 | 111.9 | I182 Y235 L236 N237 D241 F243 V248 | I182-A239 HydrophobicContact CD1-CB 4.02Å; Y235-A239 PolarHBondContact O-N 3.48Å; L236-A239 PolarHBondContact O-N 3.04Å; N237-A239 PolarHBondContact O-N 3.36Å; A239-D241 VanDerWaalsContact C-N 3.33Å; A239-F243 WeakPolarHBondContact O-CB 3.35Å; A239-F243 WeakPolarHBondContact O-CD2 3.34Å; A239-F243 PolarHBondContact O-N 3.23Å; A239-V248 HydrophobicContact CB-CG1 4.18Å |
| 240 | L | 88.9 | Confident | 89.9 | Confident | 61 Ų | 61 | 56.9 Ų | 56.9 | 32% | 0.319 | 30% | 0.302 | S | S | . | . | H | α-helix | trans | -70.5 | -26.2 | 178.5 | -71.7 | 169.8 | 0 | 0 | 0 | 114 | L236 N237 R238 T245 V248 | L236-L240 HydrophobicContact CD1-CD1 4.43Å; L236-L240 HydrophobicContact CG-CD1 4.14Å; L236-L240 WeakPolarHBondContact O-CG 3.38Å; L236-L240 PolarHBondContact O-N 2.9Å; N237-L240 PolarHBondContact O-N 3.05Å; R238-L240 VanDerWaalsContact C-N 3.32Å; R238-L240 PolarHBondContact O-N 3.41Å; L240-T245 HydrophobicContact CD2-CG2 3.87Å; L240-V248 HydrophobicContact CD2-CB 3.85Å; L240-V248 HydrophobicContact CD2-CG1 3.56Å; L240-V248 HydrophobicContact CD2-CG2 4.31Å; L240-V248 HydrophobicContact CG-CG1 3.97Å |
| 241 | D | 90.3 | Very high | 89.8 | Confident | 144 Ų | 144 | 54.8 Ų | 54.8 | 77% | 0.77 | 29% | 0.285 | S | S | * | . | H | α-helix | trans | -75 | -36.3 | 177.6 | -171.6 | 53.9 | 0 | 0 | 0 | 111.9 | N237 R238 A239 | N237-D241 WeakPolarHBondContact O-CB 3.42Å; N237-D241 PolarHBondContact O-N 2.95Å; R238-D241 PolarHBondContact O-N 3.35Å; A239-D241 VanDerWaalsContact C-N 3.33Å |
| 242 | I | 88.8 | Confident | 89.8 | Confident | 56 Ų | 56 | 55 Ų | 55 | 29% | 0.287 | 28% | 0.282 | S | S | . | . | H | α-helix | trans | -94.2 | -37.9 | -174 | -59.4 | 155.2 | 0 | 0 | 0 | 111.8 | Q175 Y181 R238 | Q175-I242 VanDerWaalsContact CD-CD1 3.44Å; Y181-I242 HydrophobicContact CD2-CD1 4.26Å; Y181-I242 HydrophobicContact CE2-CD1 3.55Å; R238-I242 VanDerWaalsContact O-CD1 3.28Å; R238-I242 WeakPolarHBondContact O-CD1 3.33Å; R238-I242 WeakPolarHBondContact O-CG1 3.44Å; R238-I242 PolarHBondContact O-N 3.06Å |
| 243 | F | 90.4 | Very high | 89.6 | Confident | 42 Ų | 42 | 55.1 Ų | 55.1 | 18% | 0.184 | 28% | 0.282 | C | S | . | . | S | Bend | trans | -112.7 | 151.3 | -171.7 | -54.9 | -76.3 | 0 | 0 | 0 | 111.8 | Q175 I178 Y181 A239 T245 V248 | Q175-F243 WeakPolarHBondContact O-CZ 3.46Å; I178-F243 VanDerWaalsContact CA-CE2 3.48Å; I178-F243 HydrophobicContact CB-CD1 4.01Å; I178-F243 HydrophobicContact CB-CD2 3.8Å; I178-F243 HydrophobicContact CB-CE1 4.03Å; I178-F243 HydrophobicContact CB-CE2 3.84Å; I178-F243 HydrophobicContact CB-CG 3.9Å; I178-F243 HydrophobicContact CB-CZ 3.95Å; I178-F243 HydrophobicContact CD1-CB 3.78Å; I178-F243 HydrophobicContact CD1-CD2 4.17Å; I178-F243 HydrophobicContact CD1-CG 3.93Å; I178-F243 HydrophobicContact CG1-CB 4.26Å; I178-F243 HydrophobicContact CG1-CD1 4.48Å; I178-F243 HydrophobicContact CG1-CD2 3.68Å; I178-F243 HydrophobicContact CG1-CE2 4.14Å; I178-F243 HydrophobicContact CG1-CG 3.89Å; Y181-F243 HydrophobicContact CD2-CE2 4.35Å; A239-F243 WeakPolarHBondContact O-CB 3.35Å; A239-F243 WeakPolarHBondContact O-CD2 3.34Å; A239-F243 PolarHBondContact O-N 3.23Å; F243-T245 PolarHBondContact O-N 3.5Å; F243-V248 HydrophobicContact CB-CG2 3.58Å |
| 244 | N | 87.1 | Confident | 89.8 | Confident | 97 Ų | 97 | 52.4 Ų | 52.4 | 52% | 0.519 | 27% | 0.27 | S | S | . | . | trans | -60.9 | 125.5 | 179.1 | -173 | -27 | 0 | 0 | 0 | 110.9 | S246 I247 V248 | N244-S246 PolarHBondContact O-N 3.19Å; N244-S246 VanDerWaalsContact O-N 3.12Å; N244-S246 WeakPolarHBondContact OD1-CB 3.17Å; N244-S246 PolarHBondContact OD1-N 2.89Å; N244-I247 WeakPolarHBondContact O-CA 3.48Å; N244-I247 PolarHBondContact O-N 3.47Å; N244-V248 WeakPolarHBondContact O-CG2 3.33Å; N244-V248 PolarHBondContact O-N 2.92Å | ||
| 245 | T | 84.1 | Confident | 89.9 | Confident | 72 Ų | 72 | 51.7 Ų | 51.7 | 44% | 0.442 | 26% | 0.262 | S | S | . | . | H | α-helix | trans | -52.9 | -33.8 | 178 | -50.7 | 0 | 0 | 0 | 0 | 113.1 | L240 F243 I247 V248 T249 | L240-T245 HydrophobicContact CD2-CG2 3.87Å; F243-T245 PolarHBondContact O-N 3.5Å; T245-I247 PolarHBondContact O-N 3.15Å; T245-V248 PolarHBondContact O-N 2.99Å; T245-T249 WeakPolarHBondContact O-CB 3.43Å; T245-T249 PolarHBondContact O-N 3.44Å; T245-T249 PolarHBondContact O-OG1 3.23Å |
| 246 | S | 82.6 | Confident | 89.9 | Confident | 28 Ų | 28 | 51.9 Ų | 51.9 | 20% | 0.196 | 26% | 0.264 | C | S | . | . | H | α-helix | trans | -62.4 | -21.7 | 176.4 | -63.2 | 0 | 0 | 0 | 0 | 113.4 | N244 P250 | N244-S246 PolarHBondContact O-N 3.19Å; N244-S246 VanDerWaalsContact O-N 3.12Å; N244-S246 WeakPolarHBondContact OD1-CB 3.17Å; N244-S246 PolarHBondContact OD1-N 2.89Å; S246-P250 VanDerWaalsContact O-CD 3.28Å; S246-P250 WeakPolarHBondContact O-CD 3.44Å; S246-P250 VanDerWaalsContact O-CG 3.3Å; S246-P250 WeakPolarHBondContact O-CG 3.31Å |
| 247 | I | 86.6 | Confident | 89.9 | Confident | 94 Ų | 94 | 50.3 Ų | 50.3 | 48% | 0.482 | 26% | 0.255 | S | S | . | . | H | α-helix | trans | -98 | -42.3 | 174.5 | -60.5 | 174.8 | 0 | 0 | 0 | 110.4 | I178 N244 T245 T249 P250 I251 | I178-I247 HydrophobicContact CD1-CG2 4.07Å; N244-I247 WeakPolarHBondContact O-CA 3.48Å; N244-I247 PolarHBondContact O-N 3.47Å; T245-I247 PolarHBondContact O-N 3.15Å; I247-T249 PolarHBondContact O-N 3.4Å; I247-P250 VanDerWaalsContact O-CD 3.32Å; I247-P250 WeakPolarHBondContact O-CD 3.4Å; I247-P250 WeakPolarHBondContact O-CG 3.44Å; I247-I251 HydrophobicContact CG2-CD1 3.56Å; I247-I251 HydrophobicContact CG2-CG1 4.43Å; I247-I251 VanDerWaalsContact O-CG1 3.3Å; I247-I251 WeakPolarHBondContact O-CG1 3.47Å; I247-I251 PolarHBondContact O-N 2.82Å |
| 248 | V | 89.6 | Confident | 90.1 | Very high | 0 Ų | 0 | 48.6 Ų | 48.6 | 0% | 0 | 25% | 0.249 | C | C | . | . | H | α-helix | trans | -60 | -47.4 | -178.1 | -179.8 | 0 | 0 | 0 | 0 | 111.6 | I178 I182 A239 L240 F243 N244 T245 I251 Y252 | I178-V248 HydrophobicContact CD1-CB 4.27Å; I178-V248 HydrophobicContact CD1-CG2 3.61Å; I182-V248 HydrophobicContact CD1-CG1 3.86Å; A239-V248 HydrophobicContact CB-CG1 4.18Å; L240-V248 HydrophobicContact CD2-CB 3.85Å; L240-V248 HydrophobicContact CD2-CG1 3.56Å; L240-V248 HydrophobicContact CD2-CG2 4.31Å; L240-V248 HydrophobicContact CG-CG1 3.97Å; F243-V248 HydrophobicContact CB-CG2 3.58Å; N244-V248 WeakPolarHBondContact O-CG2 3.33Å; N244-V248 PolarHBondContact O-N 2.92Å; T245-V248 PolarHBondContact O-N 2.99Å; V248-I251 PolarHBondContact O-N 3.15Å; V248-Y252 WeakPolarHBondContact O-CB 3.41Å; V248-Y252 PolarHBondContact O-N 3.1Å |
| 249 | T | 87.8 | Confident | 90.3 | Very high | 40 Ų | 40 | 44.4 Ų | 44.4 | 25% | 0.245 | 24% | 0.236 | C | C | . | . | H | α-helix | trans | -59.9 | -53.1 | -175.3 | -58.7 | 0 | 0 | 0 | 0 | 113.9 | T245 I247 Y253 | T245-T249 WeakPolarHBondContact O-CB 3.43Å; T245-T249 PolarHBondContact O-N 3.44Å; T245-T249 PolarHBondContact O-OG1 3.23Å; I247-T249 PolarHBondContact O-N 3.4Å; T249-Y253 WeakPolarHBondContact O-CB 3.26Å; T249-Y253 PolarHBondContact O-N 2.9Å |
| 250 | P | 88.7 | Confident | 90.4 | Very high | 3 Ų | 3 | 44.5 Ų | 44.5 | 2% | 0.019 | 24% | 0.236 | C | C | . | . | H | α-helix | trans | -64 | -41.5 | 178.7 | 21.4 | -31.4 | 0 | 0 | 0 | 112.5 | S246 I247 Y253 V254 I293 F294 H297 | S246-P250 VanDerWaalsContact O-CD 3.28Å; S246-P250 WeakPolarHBondContact O-CD 3.44Å; S246-P250 VanDerWaalsContact O-CG 3.3Å; S246-P250 WeakPolarHBondContact O-CG 3.31Å; I247-P250 VanDerWaalsContact O-CD 3.32Å; I247-P250 WeakPolarHBondContact O-CD 3.4Å; I247-P250 WeakPolarHBondContact O-CG 3.44Å; P250-Y253 PolarHBondContact O-N 3.48Å; P250-V254 VanDerWaalsContact O-CG2 3.31Å; P250-V254 WeakPolarHBondContact O-CG2 3.49Å; P250-V254 PolarHBondContact O-N 3.33Å; P250-V254 VanDerWaalsContact O-N 3.13Å; P250-I293 HydrophobicContact CB-CG2 4.03Å; P250-F294 HydrophobicContact CB-CD1 4Å; P250-F294 HydrophobicContact CB-CD2 4.31Å; P250-F294 HydrophobicContact CB-CE1 3.98Å; P250-F294 HydrophobicContact CB-CE2 4.3Å; P250-F294 HydrophobicContact CB-CG 4.17Å; P250-F294 HydrophobicContact CB-CZ 4.13Å; P250-F294 HydrophobicContact CG-CD1 4.42Å; P250-F294 HydrophobicContact CG-CE1 4.32Å; P250-H297 HydrophobicContact CG-CB 4.01Å |
| 251 | I | 92.2 | Very high | 90.5 | Very high | 27 Ų | 27 | 42.2 Ų | 42.2 | 14% | 0.138 | 23% | 0.225 | C | C | . | . | H | α-helix | trans | -66 | -46 | 179.8 | -61.7 | 178.1 | 0 | 0 | 0 | 110.6 | I178 L179 I182 I247 V248 Y253 V254 F255 F294 | I178-I251 HydrophobicContact CD1-CD1 4.37Å; I178-I251 HydrophobicContact CG2-CD1 4.35Å; L179-I251 HydrophobicContact CD2-CG2 3.86Å; I182-I251 HydrophobicContact CG1-CG2 4.47Å; I182-I251 HydrophobicContact CG2-CG2 4.05Å; I247-I251 HydrophobicContact CG2-CD1 3.56Å; I247-I251 HydrophobicContact CG2-CG1 4.43Å; I247-I251 VanDerWaalsContact O-CG1 3.3Å; I247-I251 WeakPolarHBondContact O-CG1 3.47Å; I247-I251 PolarHBondContact O-N 2.82Å; V248-I251 PolarHBondContact O-N 3.15Å; I251-Y253 VanDerWaalsContact C-N 3.3Å; I251-Y253 PolarHBondContact O-N 3.29Å; I251-V254 PolarHBondContact O-N 3.28Å; I251-F255 HydrophobicContact CG2-CD2 3.81Å; I251-F255 HydrophobicContact CG2-CE2 3.92Å; I251-F255 WeakPolarHBondContact O-CD2 3.36Å; I251-F255 PolarHBondContact O-N 2.93Å; I251-F294 HydrophobicContact CG1-CZ 4.37Å |
| 252 | Y | 92.8 | Very high | 90.6 | Very high | 40 Ų | 40 | 38.2 Ų | 38.2 | 16% | 0.157 | 21% | 0.206 | C | C | . | . | H | α-helix | trans | -56.5 | -46.4 | 175 | 174.3 | -111.7 | 0 | 0 | 0 | 111.2 | I182 C185 Q232 L236 V248 V254 F255 F256 | I182-Y252 HydrophobicContact CD1-CD2 4.17Å; I182-Y252 HydrophobicContact CD1-CG 4.38Å; C185-Y252 VanDerWaalsContact SG-CE2 3.55Å; Q232-Y252 PolarHBondContact NE2-OH 3.11Å; L236-Y252 HydrophobicContact CD1-CD1 4.26Å; L236-Y252 HydrophobicContact CD1-CD2 3.9Å; L236-Y252 HydrophobicContact CD1-CE2 4.17Å; L236-Y252 HydrophobicContact CD1-CG 3.93Å; L236-Y252 HydrophobicContact CD2-CE1 4.33Å; V248-Y252 WeakPolarHBondContact O-CB 3.41Å; V248-Y252 PolarHBondContact O-N 3.1Å; Y252-V254 VanDerWaalsContact C-N 3.32Å; Y252-V254 PolarHBondContact O-N 3.23Å; Y252-F255 PolarHBondContact O-N 3.49Å; Y252-F256 HydrophobicContact CD2-CB 4.23Å; Y252-F256 HydrophobicContact CE1-CB 4.33Å; Y252-F256 HydrophobicContact CE1-CG 4.4Å; Y252-F256 HydrophobicContact CE2-CB 3.88Å; Y252-F256 HydrophobicContact CE2-CD2 4.28Å; Y252-F256 HydrophobicContact CE2-CG 4.21Å; Y252-F256 AromaticContact CZ-CG 3.89Å; Y252-F256 WeakPolarHBondContact O-CB 3.38Å; Y252-F256 PolarHBondContact O-N 3.12Å |
| 253 | Y | 90.6 | Very high | 90.9 | Very high | 24 Ų | 24 | 35.6 Ų | 35.6 | 9% | 0.094 | 19% | 0.192 | C | C | . | . | H | α-helix | trans | -56.8 | -46.8 | 179.4 | 179.9 | -90.8 | 0 | 0 | 0 | 111.8 | P87 A90 T249 P250 I251 T257 F286 I289 I293 | P87-Y253 VanDerWaalsContact CA-OH 3.23Å; P87-Y253 WeakPolarHBondContact CA-OH 3.44Å; P87-Y253 PolarHBondContact O-OH 3.37Å; A90-Y253 HydrophobicContact CB-CD2 4.43Å; A90-Y253 HydrophobicContact CB-CE2 3.56Å; A90-Y253 WeakPolarHBondContact CB-OH 3.33Å; T249-Y253 WeakPolarHBondContact O-CB 3.26Å; T249-Y253 PolarHBondContact O-N 2.9Å; P250-Y253 PolarHBondContact O-N 3.48Å; I251-Y253 VanDerWaalsContact C-N 3.3Å; I251-Y253 PolarHBondContact O-N 3.29Å; Y253-T257 WeakPolarHBondContact O-CB 3.47Å; Y253-T257 PolarHBondContact O-N 3.16Å; Y253-T257 PolarHBondContact O-OG1 3.02Å; Y253-F286 HydrophobicContact CE1-CE2 4.43Å; Y253-I289 HydrophobicContact CE1-CG2 3.82Å; Y253-I289 VanDerWaalsContact OH-CG2 3.23Å; Y253-I289 WeakPolarHBondContact OH-CG2 3.28Å; Y253-I293 HydrophobicContact CD1-CD1 3.21Å; Y253-I293 HydrophobicContact CD2-CD1 3.82Å; Y253-I293 HydrophobicContact CE1-CD1 3.18Å; Y253-I293 HydrophobicContact CE2-CD1 3.8Å; Y253-I293 HydrophobicContact CG-CD1 3.52Å; Y253-I293 VanDerWaalsContact CZ-CD1 3.46Å |
| 254 | V | 92.7 | Very high | 90.8 | Very high | 28 Ų | 28 | 33.6 Ų | 33.6 | 17% | 0.17 | 18% | 0.184 | C | C | . | . | H | α-helix | trans | -61.9 | -57.1 | 178.4 | -179.7 | 0 | 0 | 0 | 0 | 110.8 | P250 I251 Y252 F256 T257 T258 I290 F294 | P250-V254 VanDerWaalsContact O-CG2 3.31Å; P250-V254 WeakPolarHBondContact O-CG2 3.49Å; P250-V254 PolarHBondContact O-N 3.33Å; P250-V254 VanDerWaalsContact O-N 3.13Å; I251-V254 PolarHBondContact O-N 3.28Å; Y252-V254 VanDerWaalsContact C-N 3.32Å; Y252-V254 PolarHBondContact O-N 3.23Å; V254-F256 VanDerWaalsContact C-N 3.34Å; V254-F256 PolarHBondContact O-N 2.93Å; V254-T257 PolarHBondContact O-N 3.29Å; V254-T258 WeakPolarHBondContact O-CB 3.41Å; V254-T258 PolarHBondContact O-N 3.12Å; V254-T258 PolarHBondContact O-OG1 2.91Å; V254-I290 HydrophobicContact CB-CD1 4.49Å; V254-I290 HydrophobicContact CG1-CD1 3.85Å; V254-I290 HydrophobicContact CG1-CG1 4.46Å; V254-I290 HydrophobicContact CG2-CB 4.32Å; V254-I290 HydrophobicContact CG2-CD1 4.07Å; V254-I290 HydrophobicContact CG2-CG1 3.79Å; V254-I290 HydrophobicContact CG2-CG2 3.74Å; V254-F294 HydrophobicContact CG2-CE2 3.73Å |
| 255 | F | 95.3 | Very high | 90.9 | Very high | 70 Ų | 70 | 29.8 Ų | 29.8 | 31% | 0.307 | 17% | 0.166 | S | C | . | . | H | α-helix | trans | -62.4 | -40.7 | -175.5 | -84.7 | -105.2 | 0 | 0 | 0 | 112.4 | L179 I182 T183 S186 I251 Y252 S259 | L179-F255 HydrophobicContact CD2-CE2 3.92Å; L179-F255 HydrophobicContact CD2-CZ 3.87Å; I182-F255 HydrophobicContact CG2-CB 3.74Å; I182-F255 HydrophobicContact CG2-CD2 4.27Å; I182-F255 HydrophobicContact CG2-CG 3.97Å; T183-F255 WeakPolarHBondContact OG1-CE1 3.02Å; S186-F255 VanDerWaalsContact OG-CB 3.31Å; S186-F255 WeakPolarHBondContact OG-CB 3.48Å; I251-F255 HydrophobicContact CG2-CD2 3.81Å; I251-F255 HydrophobicContact CG2-CE2 3.92Å; I251-F255 WeakPolarHBondContact O-CD2 3.36Å; I251-F255 PolarHBondContact O-N 2.93Å; Y252-F255 PolarHBondContact O-N 3.49Å; F255-S259 VanDerWaalsContact O-CB 3.29Å; F255-S259 WeakPolarHBondContact O-CB 3.19Å; F255-S259 PolarHBondContact O-N 3.4Å; F255-S259 PolarHBondContact O-OG 2.99Å |
| 256 | F | 94.4 | Very high | 91.3 | Very high | 26 Ų | 26 | 29 Ų | 29 | 11% | 0.114 | 16% | 0.158 | C | C | . | . | H | α-helix | trans | -65.5 | -50.3 | 178.7 | 176.8 | -109.7 | 0 | 0 | 0 | 110.4 | T86 S186 V193 Y252 V254 T258 S259 V260 | T86-F256 HydrophobicContact CG2-CD1 3.9Å; T86-F256 HydrophobicContact CG2-CE1 3.57Å; S186-F256 WeakPolarHBondContact OG-CA 3.37Å; S186-F256 PolarHBondContact OG-N 2.89Å; V193-F256 HydrophobicContact CG2-CE2 4.4Å; V193-F256 HydrophobicContact CG2-CZ 3.84Å; Y252-F256 HydrophobicContact CD2-CB 4.23Å; Y252-F256 HydrophobicContact CE1-CB 4.33Å; Y252-F256 HydrophobicContact CE1-CG 4.4Å; Y252-F256 HydrophobicContact CE2-CB 3.88Å; Y252-F256 HydrophobicContact CE2-CD2 4.28Å; Y252-F256 HydrophobicContact CE2-CG 4.21Å; Y252-F256 AromaticContact CZ-CG 3.89Å; Y252-F256 WeakPolarHBondContact O-CB 3.38Å; Y252-F256 PolarHBondContact O-N 3.12Å; V254-F256 VanDerWaalsContact C-N 3.34Å; V254-F256 PolarHBondContact O-N 2.93Å; F256-T258 PolarHBondContact O-N 2.94Å; F256-S259 PolarHBondContact O-N 2.93Å; F256-V260 HydrophobicContact CD1-CG2 4.44Å; F256-V260 HydrophobicContact CD2-CG2 4.23Å; F256-V260 HydrophobicContact CE1-CG2 4.12Å; F256-V260 HydrophobicContact CE2-CG2 3.87Å; F256-V260 HydrophobicContact CZ-CG2 3.82Å; F256-V260 VanDerWaalsContact O-CG2 3.32Å; F256-V260 WeakPolarHBondContact O-CG2 3.45Å; F256-V260 PolarHBondContact O-N 2.93Å |
| 257 | T | 92.7 | Very high | 91.6 | Very high | 2 Ų | 2 | 27.8 Ų | 27.8 | 1% | 0.012 | 15% | 0.149 | C | C | . | . | H | α-helix | trans | -65.7 | -41.8 | -178.1 | -54 | 0 | 0 | 0 | 0 | 111.7 | T86 P87 Y253 V254 S259 V260 L261 F286 | T86-T257 HydrophobicContact CG2-CG2 4.25Å; P87-T257 HydrophobicContact CB-CG2 4.36Å; P87-T257 HydrophobicContact CG-CG2 3.65Å; Y253-T257 WeakPolarHBondContact O-CB 3.47Å; Y253-T257 PolarHBondContact O-N 3.16Å; Y253-T257 PolarHBondContact O-OG1 3.02Å; V254-T257 PolarHBondContact O-N 3.29Å; T257-S259 VanDerWaalsContact C-N 3.34Å; T257-S259 PolarHBondContact O-N 3.1Å; T257-V260 PolarHBondContact O-N 3.1Å; T257-L261 VanDerWaalsContact O-CB 3.26Å; T257-L261 WeakPolarHBondContact O-CB 3.14Å; T257-L261 PolarHBondContact O-N 3.1Å; T257-F286 HydrophobicContact CG2-CD2 3.79Å; T257-F286 HydrophobicContact CG2-CE2 3.23Å; T257-F286 HydrophobicContact CG2-CZ 3.97Å |
| 258 | T | 94.1 | Very high | 91.6 | Very high | 57 Ų | 57 | 23.6 Ų | 23.6 | 35% | 0.35 | 13% | 0.128 | S | C | . | . | H | α-helix | trans | -61.2 | -42.7 | 174 | -57.8 | 0 | 0 | 0 | 0 | 111.7 | V254 F256 L261 T262 F286 | V254-T258 WeakPolarHBondContact O-CB 3.41Å; V254-T258 PolarHBondContact O-N 3.12Å; V254-T258 PolarHBondContact O-OG1 2.91Å; F256-T258 PolarHBondContact O-N 2.94Å; T258-L261 PolarHBondContact O-N 3.36Å; T258-T262 WeakPolarHBondContact O-CB 3.49Å; T258-T262 PolarHBondContact O-N 3.47Å; T258-T262 PolarHBondContact O-OG1 3.43Å; T258-F286 WeakPolarHBondContact OG1-CE1 3.35Å; T258-F286 VanDerWaalsContact OG1-CZ 3.28Å; T258-F286 WeakPolarHBondContact OG1-CZ 3.45Å |
| 259 | S | 95.2 | Very high | 91.4 | Very high | 22 Ų | 22 | 26.6 Ų | 26.6 | 15% | 0.154 | 14% | 0.14 | C | C | . | . | H | α-helix | trans | -64.4 | -43.5 | 177.5 | -58.8 | 0 | 0 | 0 | 0 | 111.4 | A190 F255 F256 T257 T262 C263 | A190-S259 WeakPolarHBondContact CB-O 3.15Å; F255-S259 VanDerWaalsContact O-CB 3.29Å; F255-S259 WeakPolarHBondContact O-CB 3.19Å; F255-S259 PolarHBondContact O-N 3.4Å; F255-S259 PolarHBondContact O-OG 2.99Å; F256-S259 PolarHBondContact O-N 2.93Å; T257-S259 VanDerWaalsContact C-N 3.34Å; T257-S259 PolarHBondContact O-N 3.1Å; S259-T262 PolarHBondContact O-N 2.69Å; S259-C263 WeakPolarHBondContact O-CB 3.4Å; S259-C263 PolarHBondContact O-N 3.41Å |
| 260 | V | 93.3 | Very high | 90.8 | Very high | 1 Ų | 1 | 25.3 Ų | 25.3 | 1% | 0.006 | 13% | 0.132 | C | C | . | . | H | α-helix | trans | -64.1 | -44.7 | 177 | 172.7 | 0 | 0 | 0 | 0 | 111.2 | A82 T86 A190 V193 F256 T257 C263 S264 | A82-V260 HydrophobicContact CB-CG1 4.1Å; T86-V260 HydrophobicContact CG2-CB 4.21Å; T86-V260 HydrophobicContact CG2-CG1 4.25Å; T86-V260 HydrophobicContact CG2-CG2 4.2Å; T86-V260 WeakPolarHBondContact OG1-CG1 3.32Å; A190-V260 HydrophobicContact CB-CG2 4.14Å; V193-V260 HydrophobicContact CB-CG1 4.42Å; V193-V260 HydrophobicContact CB-CG2 4.34Å; V193-V260 HydrophobicContact CG1-CG1 4.03Å; V193-V260 HydrophobicContact CG2-CG2 3.89Å; F256-V260 HydrophobicContact CD1-CG2 4.44Å; F256-V260 HydrophobicContact CD2-CG2 4.23Å; F256-V260 HydrophobicContact CE1-CG2 4.12Å; F256-V260 HydrophobicContact CE2-CG2 3.87Å; F256-V260 HydrophobicContact CZ-CG2 3.82Å; F256-V260 VanDerWaalsContact O-CG2 3.32Å; F256-V260 WeakPolarHBondContact O-CG2 3.45Å; F256-V260 PolarHBondContact O-N 2.93Å; T257-V260 PolarHBondContact O-N 3.1Å; V260-C263 PolarHBondContact O-N 3.25Å; V260-S264 VanDerWaalsContact O-CB 3.29Å; V260-S264 WeakPolarHBondContact O-CB 3.44Å; V260-S264 PolarHBondContact O-N 2.86Å; V260-S264 PolarHBondContact O-OG 3.34Å |
| 261 | L | 91.8 | Very high | 90.3 | Very high | 13 Ų | 13 | 28.6 Ų | 28.6 | 7% | 0.068 | 14% | 0.144 | C | C | . | . | H | α-helix | trans | -62.3 | -45.1 | 179.4 | -170.6 | 63.5 | 0 | 0 | 0 | 110.9 | T83 T257 T258 S264 A265 W271 | T83-L261 HydrophobicContact CG2-CD1 3.25Å; T257-L261 VanDerWaalsContact O-CB 3.26Å; T257-L261 WeakPolarHBondContact O-CB 3.14Å; T257-L261 PolarHBondContact O-N 3.1Å; T258-L261 PolarHBondContact O-N 3.36Å; L261-S264 PolarHBondContact O-N 3.26Å; L261-A265 WeakPolarHBondContact O-CB 3.48Å; L261-A265 PolarHBondContact O-N 3.28Å; L261-W271 HydrophobicContact CD1-CZ2 4.06Å; L261-W271 HydrophobicContact CD2-CH2 4.36Å; L261-W271 HydrophobicContact CD2-CZ2 3.97Å; L261-W271 HydrophobicContact CG-CZ2 3.9Å |
| 262 | T | 92.6 | Very high | 89.6 | Confident | 61 Ų | 61 | 34.1 Ų | 34.1 | 37% | 0.374 | 17% | 0.169 | S | C | . | . | H | α-helix | trans | -65 | -46.7 | 177.3 | -53.3 | 0 | 0 | 0 | 0 | 111.4 | F154 T258 S259 S264 A265 I266 | F154-T262 HydrophobicContact CE2-CG2 3.93Å; F154-T262 HydrophobicContact CZ-CG2 4.13Å; T258-T262 WeakPolarHBondContact O-CB 3.49Å; T258-T262 PolarHBondContact O-N 3.47Å; T258-T262 PolarHBondContact O-OG1 3.43Å; S259-T262 PolarHBondContact O-N 2.69Å; T262-S264 VanDerWaalsContact C-N 3.35Å; T262-S264 PolarHBondContact O-N 3.05Å; T262-A265 PolarHBondContact O-N 2.62Å; T262-I266 HydrophobicContact CG2-CD1 3.9Å; T262-I266 WeakPolarHBondContact O-CG1 3.4Å; T262-I266 PolarHBondContact O-N 2.99Å |
| 263 | C | 93.8 | Very high | 88.7 | Confident | 1 Ų | 1 | 38.4 Ų | 38.4 | 1% | 0.007 | 20% | 0.195 | C | C | . | . | H | α-helix | trans | -60.3 | -45.3 | 178.2 | -173.6 | 0 | 0 | 0 | 0 | 111.2 | F154 A190 S194 S259 V260 I266 L267 | F154-C263 HydrophobicContact CE1-CB 4.09Å; F154-C263 HydrophobicContact CZ-CB 4.39Å; A190-C263 HydrophobicContact CB-CB 3.93Å; S194-C263 PolarHBondContact OG-SG 2.95Å; S259-C263 WeakPolarHBondContact O-CB 3.4Å; S259-C263 PolarHBondContact O-N 3.41Å; V260-C263 PolarHBondContact O-N 3.25Å; C263-I266 PolarHBondContact O-N 3.04Å; C263-L267 WeakPolarHBondContact O-CB 3.46Å; C263-L267 PolarHBondContact O-N 3.43Å |
| 264 | S | 89.9 | Confident | 88.1 | Confident | 0 Ų | 0 | 38.3 Ų | 38.3 | 0% | 0 | 20% | 0.195 | C | C | . | . | H | α-helix | trans | -67.5 | -44.9 | 179.8 | -53 | 0 | 0 | 0 | 0 | 111.4 | A82 V260 L261 T262 I266 L267 F268 | A82-S264 WeakPolarHBondContact CB-OG 3.37Å; V260-S264 VanDerWaalsContact O-CB 3.29Å; V260-S264 WeakPolarHBondContact O-CB 3.44Å; V260-S264 PolarHBondContact O-N 2.86Å; V260-S264 PolarHBondContact O-OG 3.34Å; L261-S264 PolarHBondContact O-N 3.26Å; T262-S264 VanDerWaalsContact C-N 3.35Å; T262-S264 PolarHBondContact O-N 3.05Å; S264-I266 VanDerWaalsContact C-N 3.3Å; S264-I266 PolarHBondContact O-N 2.95Å; S264-L267 PolarHBondContact O-N 3Å; S264-F268 WeakPolarHBondContact O-CB 3.43Å; S264-F268 WeakPolarHBondContact O-CD2 3.29Å; S264-F268 PolarHBondContact O-N 2.87Å |
| 265 | A | 89.2 | Confident | 87.8 | Confident | 17 Ų | 17 | 40 Ų | 40 | 14% | 0.14 | 21% | 0.207 | C | C | . | . | H | α-helix | trans | -57.9 | -41.5 | 177.3 | 0 | 0 | 0 | 0 | 0 | 112.4 | L261 T262 K269 W271 | L261-A265 WeakPolarHBondContact O-CB 3.48Å; L261-A265 PolarHBondContact O-N 3.28Å; T262-A265 PolarHBondContact O-N 2.62Å; A265-K269 WeakPolarHBondContact O-CA 3.2Å; A265-K269 PolarHBondContact O-N 3.03Å; A265-K269 VanDerWaalsContact O-N 3.1Å; A265-W271 HydrophobicContact CB-CD2 4.12Å; A265-W271 HydrophobicContact CB-CG 3.89Å |
| 266 | I | 91 | Very high | 87.5 | Confident | 56 Ų | 56 | 39 Ų | 39 | 29% | 0.287 | 22% | 0.216 | S | C | . | . | H | α-helix | trans | -76 | -45.4 | 178.6 | -64 | 169.6 | 0 | 0 | 0 | 111.2 | F151 F154 T262 C263 S264 | F151-I266 HydrophobicContact CB-CG2 4.41Å; F151-I266 HydrophobicContact CD2-CG2 4.3Å; F154-I266 HydrophobicContact CB-CD1 4.17Å; F154-I266 HydrophobicContact CB-CG2 4.13Å; F154-I266 HydrophobicContact CD1-CD1 4.11Å; F154-I266 HydrophobicContact CD1-CG2 4.4Å; F154-I266 HydrophobicContact CD2-CD1 3.36Å; F154-I266 HydrophobicContact CE1-CD1 4.36Å; F154-I266 HydrophobicContact CE2-CD1 3.65Å; F154-I266 HydrophobicContact CG-CD1 3.6Å; F154-I266 HydrophobicContact CG-CG2 4.3Å; F154-I266 HydrophobicContact CZ-CD1 4.14Å; T262-I266 HydrophobicContact CG2-CD1 3.9Å; T262-I266 WeakPolarHBondContact O-CG1 3.4Å; T262-I266 PolarHBondContact O-N 2.99Å; C263-I266 PolarHBondContact O-N 3.04Å; S264-I266 VanDerWaalsContact C-N 3.3Å; S264-I266 PolarHBondContact O-N 2.95Å |
| 267 | L | 90.4 | Very high | 87.2 | Confident | 2 Ų | 2 | 42.6 Ų | 42.6 | 1% | 0.01 | 24% | 0.237 | C | C | . | . | H | α-helix | trans | -65.8 | -47.8 | -176.1 | 178.2 | 57.4 | 0 | 0 | 0 | 112 | M142 K145 L146 F151 C263 S264 | M142-L267 HydrophobicContact CE-CD2 3.99Å; K145-L267 HydrophobicContact CB-CD1 4.13Å; K145-L267 WeakPolarHBondContact CD-O 3.2Å; L146-L267 HydrophobicContact CD2-CD1 3.77Å; L146-L267 HydrophobicContact CD2-CD2 4.48Å; L146-L267 HydrophobicContact CG-CD1 4.19Å; F151-L267 HydrophobicContact CD1-CD1 3.92Å; F151-L267 HydrophobicContact CD2-CB 3.66Å; F151-L267 HydrophobicContact CD2-CD1 3.7Å; F151-L267 HydrophobicContact CD2-CG 4.22Å; F151-L267 HydrophobicContact CE1-CD1 4.02Å; F151-L267 HydrophobicContact CE2-CB 3.71Å; F151-L267 HydrophobicContact CE2-CD1 3.8Å; F151-L267 HydrophobicContact CE2-CD2 4.24Å; F151-L267 HydrophobicContact CE2-CG 4.12Å; F151-L267 HydrophobicContact CG-CB 4.49Å; F151-L267 HydrophobicContact CG-CD1 3.75Å; F151-L267 HydrophobicContact CZ-CD1 3.95Å; F151-L267 HydrophobicContact CZ-CD2 4.38Å; C263-L267 WeakPolarHBondContact O-CB 3.46Å; C263-L267 PolarHBondContact O-N 3.43Å; S264-L267 PolarHBondContact O-N 3Å |
| 268 | F | 86.4 | Confident | 87.1 | Confident | 6 Ų | 6 | 44.5 Ų | 44.5 | 3% | 0.026 | 25% | 0.247 | C | C | . | . | H | α-helix | trans | -92.1 | -12.4 | -175.5 | -64.6 | -68.8 | 0 | 0 | 0 | 112.7 | I136 M142 K145 K197 S264 E270 | I136-F268 HydrophobicContact CD1-CD1 3.45Å; I136-F268 VanDerWaalsContact CD1-CD1 3.45Å; I136-F268 HydrophobicContact CD1-CE1 3.74Å; I136-F268 HydrophobicContact CG1-CD1 4.38Å; M142-F268 HydrophobicContact CE-CZ 4.38Å; M142-F268 HydrophobicContact SD-CE1 4.04Å; M142-F268 HydrophobicContact SD-CZ 4.28Å; K145-F268 PolarHBondContact NZ-O 2.89Å; K197-F268 HydrophobicContact CD-CE1 4.24Å; K197-F268 HydrophobicContact CD-CE2 3.74Å; K197-F268 HydrophobicContact CD-CZ 3.44Å; K197-F268 VanDerWaalsContact CD-CZ 3.44Å; K197-F268 HydrophobicContact CG-CZ 4.08Å; K197-F268 VanDerWaalsContact NZ-CE1 3.34Å; K197-F268 VanDerWaalsContact NZ-CE2 3.25Å; S264-F268 WeakPolarHBondContact O-CB 3.43Å; S264-F268 WeakPolarHBondContact O-CD2 3.29Å; S264-F268 PolarHBondContact O-N 2.87Å; F268-E270 HydrophobicContact CB-CG 3.63Å; F268-E270 WeakPolarHBondContact CB-OE1 3.42Å; F268-E270 WeakPolarHBondContact CD2-OE1 3.46Å; F268-E270 WeakPolarHBondContact CG-OE1 3.49Å; F268-E270 PolarHBondContact O-N 3.14Å |
| 269 | K | 84.2 | Confident | 86.9 | Confident | 62 Ų | 62 | 43.2 Ų | 43.2 | 27% | 0.27 | 24% | 0.239 | S | C | . | . | trans | 58.7 | 25.3 | -173.3 | -60.8 | -178.5 | 178.2 | 174.7 | 0 | 113.1 | D148 A265 W271 Q272 | D148-K269 VanDerWaalsContact CG-NZ 3.29Å; D148-K269 IonicContact OD1-NZ 3.93Å; D148-K269 PolarHBondContact OD1-NZ 3.04Å; D148-K269 IonicContact OD2-NZ 3.31Å; D148-K269 PolarHBondContact OD2-NZ 2.74Å; A265-K269 WeakPolarHBondContact O-CA 3.2Å; A265-K269 PolarHBondContact O-N 3.03Å; A265-K269 VanDerWaalsContact O-N 3.1Å; K269-W271 PolarHBondContact O-N 2.79Å; K269-Q272 HydrophobicContact CB-CG 4.26Å; K269-Q272 PolarHBondContact O-N 3.41Å; K269-Q272 VanDerWaalsContact O-N 3.1Å | ||
| 270 | E | 76.2 | Confident | 86.7 | Confident | 13 Ų | 13 | 47.9 Ų | 47.9 | 6% | 0.061 | 26% | 0.261 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -53.2 | -26.9 | -177.4 | -78.6 | 163.8 | -142 | 0 | 0 | 114.3 | T83 P131 E133 F268 | T83-E270 PolarHBondContact OG1-OE2 3.39Å; P131-E270 HydrophobicContact CB-CB 3.92Å; P131-E270 HydrophobicContact CB-CG 4.35Å; P131-E270 HydrophobicContact CG-CB 4.09Å; P131-E270 HydrophobicContact CG-CG 4.34Å; P131-E270 WeakPolarHBondContact CG-OE2 3.38Å; E133-E270 HydrophobicContact CG-CG 3.98Å; F268-E270 HydrophobicContact CB-CG 3.63Å; F268-E270 WeakPolarHBondContact CB-OE1 3.42Å; F268-E270 WeakPolarHBondContact CD2-OE1 3.46Å; F268-E270 WeakPolarHBondContact CG-OE1 3.49Å; F268-E270 PolarHBondContact O-N 3.14Å |
| 271 | W | 78.1 | Confident | 86.6 | Confident | 73 Ų | 73 | 48 Ų | 48 | 28% | 0.277 | 26% | 0.263 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -94.4 | -8.5 | -173.5 | -71.3 | 33.9 | 0 | 0 | 0 | 113.3 | L261 A265 K269 V279 T282 L283 | L261-W271 HydrophobicContact CD1-CZ2 4.06Å; L261-W271 HydrophobicContact CD2-CH2 4.36Å; L261-W271 HydrophobicContact CD2-CZ2 3.97Å; L261-W271 HydrophobicContact CG-CZ2 3.9Å; A265-W271 HydrophobicContact CB-CD2 4.12Å; A265-W271 HydrophobicContact CB-CG 3.89Å; K269-W271 PolarHBondContact O-N 2.79Å; W271-V279 HydrophobicContact CE3-CG1 4.03Å; W271-V279 HydrophobicContact CH2-CG1 4.49Å; W271-V279 HydrophobicContact CZ3-CG1 3.81Å; W271-T282 HydrophobicContact CZ2-CG2 4.42Å; W271-L283 HydrophobicContact CH2-CD2 3.83Å; W271-L283 HydrophobicContact CH2-CG 4.1Å |
| 272 | Q | 77.8 | Confident | 86.5 | Confident | 142 Ų | 142 | 47.4 Ų | 47.4 | 66% | 0.664 | 26% | 0.259 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -71.7 | -35.3 | -179.2 | -68.2 | -167.8 | -32.8 | 0 | 0 | 112.1 | K269 | K269-Q272 HydrophobicContact CB-CG 4.26Å; K269-Q272 PolarHBondContact O-N 3.41Å; K269-Q272 VanDerWaalsContact O-N 3.1Å |
| 273 | D | 72.9 | Confident | 86.5 | Confident | 131 Ų | 131 | 47.5 Ų | 47.5 | 70% | 0.701 | 26% | 0.257 | S | S | * | . | S | Bend | trans | -102.6 | 5.9 | -178.4 | -58.8 | -55.1 | 0 | 0 | 0 | 113.1 | ||
| 274 | M | 78.9 | Confident | 86.5 | Confident | 21 Ų | 21 | 50 Ų | 50 | 10% | 0.103 | 27% | 0.274 | C | S | . | . | S | Bend | trans | -83.7 | 128.6 | -177.3 | -165.9 | 173 | -161.9 | 0 | 0 | 110.2 | H129 P131 D278 V279 T282 | H129-M274 WeakPolarHBondContact O-CE 3.28Å; P131-M274 HydrophobicContact CB-CE 4.05Å; P131-M274 HydrophobicContact CB-SD 4.08Å; P131-M274 HydrophobicContact CG-CE 4.45Å; M274-D278 HydrophobicContact CE-CB 3.6Å; M274-D278 HydrophobicContact CG-CB 3.67Å; M274-D278 HydrophobicContact SD-CB 4.39Å; M274-V279 HydrophobicContact CB-CG2 4.02Å; M274-V279 HydrophobicContact CG-CG2 3.81Å; M274-V279 HydrophobicContact SD-CG2 3.78Å; M274-T282 VanDerWaalsContact CE-OG1 3.32Å; M274-T282 WeakPolarHBondContact CE-OG1 3.45Å |
| 275 | P | 86.6 | Confident | 86.7 | Confident | 65 Ų | 65 | 50 Ų | 50 | 42% | 0.422 | 27% | 0.274 | S | S | . | . | trans | -68.7 | 150.6 | 178 | 34.9 | -38.2 | 0 | 0 | 0 | 109.9 | D277 D278 V279 | P275-D277 WeakPolarHBondContact CB-OD1 3.46Å; P275-D277 WeakPolarHBondContact CG-OD1 3.43Å; P275-D277 PolarHBondContact O-N 2.91Å; P275-D278 WeakPolarHBondContact CD-OD2 3.25Å; P275-D278 HydrophobicContact CG-CB 3.9Å; P275-D278 WeakPolarHBondContact CG-OD2 3.29Å; P275-D278 WeakPolarHBondContact O-CB 3.37Å; P275-D278 PolarHBondContact O-N 3.45Å; P275-V279 PolarHBondContact O-N 3.34Å | ||
| 276 | G | 87.4 | Confident | 86.9 | Confident | 48 Ų | 48 | 49.6 Ų | 49.6 | 50% | 0.495 | 27% | 0.27 | S | S | . | . | H | α-helix | trans | -63 | -28.9 | -168.4 | 0 | 0 | 0 | 0 | 0 | 114.2 | V279 I280 | G276-V279 PolarHBondContact O-N 2.89Å; G276-I280 WeakPolarHBondContact O-CD1 3.34Å; G276-I280 VanDerWaalsContact O-CG1 3.24Å; G276-I280 WeakPolarHBondContact O-CG1 3.49Å; G276-I280 PolarHBondContact O-N 3.49Å |
| 277 | D | 89.4 | Confident | 87 | Confident | 102 Ų | 102 | 53.1 Ų | 53.1 | 55% | 0.545 | 28% | 0.283 | S | S | . | . | H | α-helix | trans | -63.7 | -42.3 | 171.7 | 56.2 | -39.2 | 0 | 0 | 0 | 112.1 | P275 V279 I280 G281 | P275-D277 WeakPolarHBondContact CB-OD1 3.46Å; P275-D277 WeakPolarHBondContact CG-OD1 3.43Å; P275-D277 PolarHBondContact O-N 2.91Å; D277-V279 PolarHBondContact O-N 3.43Å; D277-I280 PolarHBondContact O-N 3.16Å; D277-G281 PolarHBondContact O-N 3.49Å |
| 278 | D | 89.2 | Confident | 87.2 | Confident | 42 Ų | 42 | 55 Ų | 55 | 23% | 0.225 | 30% | 0.295 | C | S | . | . | H | α-helix | trans | -66.4 | -37.3 | 176.2 | -76.1 | -22 | 0 | 0 | 0 | 111.8 | H129 M274 P275 G281 T282 | H129-D278 HydrophobicContact CB-CB 4.32Å; H129-D278 WeakPolarHBondContact CB-O 3.29Å; H129-D278 IonicContact CD2-OD1 2.71Å; H129-D278 PolarHBondContact CD2-OD1 3.02Å; H129-D278 VanDerWaalsContact CD2-OD1 3.31Å; H129-D278 IonicContact CG-OD1 2.57Å; M274-D278 HydrophobicContact CE-CB 3.6Å; M274-D278 HydrophobicContact CG-CB 3.67Å; M274-D278 HydrophobicContact SD-CB 4.39Å; P275-D278 WeakPolarHBondContact CD-OD2 3.25Å; P275-D278 HydrophobicContact CG-CB 3.9Å; P275-D278 WeakPolarHBondContact CG-OD2 3.29Å; P275-D278 WeakPolarHBondContact O-CB 3.37Å; P275-D278 PolarHBondContact O-N 3.45Å; D278-G281 PolarHBondContact O-N 3.45Å; D278-T282 WeakPolarHBondContact O-CB 3.27Å; D278-T282 PolarHBondContact O-N 3.39Å; D278-T282 PolarHBondContact O-OG1 3.36Å |
| 279 | V | 89.8 | Confident | 87.5 | Confident | 29 Ų | 29 | 54.7 Ų | 54.7 | 18% | 0.176 | 29% | 0.293 | C | S | . | . | H | α-helix | trans | -63.5 | -47.3 | 174.8 | 178.1 | 0 | 0 | 0 | 0 | 110.8 | W271 M274 P275 G276 D277 G281 T282 L283 | W271-V279 HydrophobicContact CE3-CG1 4.03Å; W271-V279 HydrophobicContact CH2-CG1 4.49Å; W271-V279 HydrophobicContact CZ3-CG1 3.81Å; M274-V279 HydrophobicContact CB-CG2 4.02Å; M274-V279 HydrophobicContact CG-CG2 3.81Å; M274-V279 HydrophobicContact SD-CG2 3.78Å; P275-V279 PolarHBondContact O-N 3.34Å; G276-V279 PolarHBondContact O-N 2.89Å; D277-V279 PolarHBondContact O-N 3.43Å; V279-G281 VanDerWaalsContact C-N 3.32Å; V279-G281 PolarHBondContact O-N 2.87Å; V279-T282 PolarHBondContact O-N 2.96Å; V279-L283 HydrophobicContact CG1-CD1 4.19Å; V279-L283 WeakPolarHBondContact O-CG 3.47Å; V279-L283 PolarHBondContact O-N 3.1Å |
| 280 | I | 91.4 | Very high | 87.8 | Confident | 120 Ų | 120 | 52.7 Ų | 52.7 | 62% | 0.615 | 29% | 0.286 | S | S | * | . | H | α-helix | trans | -63.8 | -40.7 | 177.4 | -66.7 | 164.4 | 0 | 0 | 0 | 110.4 | G276 D277 L283 S284 | G276-I280 WeakPolarHBondContact O-CD1 3.34Å; G276-I280 VanDerWaalsContact O-CG1 3.24Å; G276-I280 WeakPolarHBondContact O-CG1 3.49Å; G276-I280 PolarHBondContact O-N 3.49Å; D277-I280 PolarHBondContact O-N 3.16Å; I280-L283 PolarHBondContact O-N 3.45Å; I280-S284 WeakPolarHBondContact O-CB 3.21Å; I280-S284 PolarHBondContact O-N 3Å; I280-S284 PolarHBondContact O-OG 3.29Å |
| 281 | G | 92.1 | Very high | 88.5 | Confident | 5 Ų | 5 | 55.7 Ų | 55.7 | 5% | 0.052 | 30% | 0.304 | C | S | . | . | H | α-helix | trans | -58.9 | -49.5 | 174.3 | 0 | 0 | 0 | 0 | 0 | 112 | V125 D277 D278 V279 L283 S284 G285 | V125-G281 VanDerWaalsContact CG1-O 3.27Å; V125-G281 WeakPolarHBondContact CG1-O 3.48Å; D277-G281 PolarHBondContact O-N 3.49Å; D278-G281 PolarHBondContact O-N 3.45Å; V279-G281 VanDerWaalsContact C-N 3.32Å; V279-G281 PolarHBondContact O-N 2.87Å; G281-L283 PolarHBondContact O-N 3.12Å; G281-S284 WeakPolarHBondContact CA-OG 3.46Å; G281-S284 PolarHBondContact O-N 3.09Å; G281-S284 PolarHBondContact O-OG 3.12Å; G281-G285 PolarHBondContact O-N 3.36Å |
| 282 | T | 89.4 | Confident | 89.1 | Confident | 0 Ų | 0 | 52.2 Ų | 52.2 | 0% | 0 | 29% | 0.291 | C | S | . | . | H | α-helix | trans | -60.8 | -47.7 | 178.5 | -63.1 | 0 | 0 | 0 | 0 | 111.9 | T83 M126 H129 W271 M274 D278 V279 F286 | T83-T282 HydrophobicContact CG2-CG2 4.34Å; M126-T282 HydrophobicContact CE-CG2 4.4Å; H129-T282 PolarHBondContact O-OG1 3.3Å; W271-T282 HydrophobicContact CZ2-CG2 4.42Å; M274-T282 VanDerWaalsContact CE-OG1 3.32Å; M274-T282 WeakPolarHBondContact CE-OG1 3.45Å; D278-T282 WeakPolarHBondContact O-CB 3.27Å; D278-T282 PolarHBondContact O-N 3.39Å; D278-T282 PolarHBondContact O-OG1 3.36Å; V279-T282 PolarHBondContact O-N 2.96Å; T282-F286 WeakPolarHBondContact O-CB 3.43Å; T282-F286 PolarHBondContact O-N 3.28Å |
| 283 | L | 92 | Very high | 89.6 | Confident | 63 Ų | 63 | 45.9 Ų | 45.9 | 33% | 0.33 | 26% | 0.262 | S | S | . | . | H | α-helix | trans | -64.9 | -45.5 | 178.6 | -72.6 | 176.2 | 0 | 0 | 0 | 112.1 | W271 V279 I280 G281 F286 F287 | W271-L283 HydrophobicContact CH2-CD2 3.83Å; W271-L283 HydrophobicContact CH2-CG 4.1Å; V279-L283 HydrophobicContact CG1-CD1 4.19Å; V279-L283 WeakPolarHBondContact O-CG 3.47Å; V279-L283 PolarHBondContact O-N 3.1Å; I280-L283 PolarHBondContact O-N 3.45Å; G281-L283 PolarHBondContact O-N 3.12Å; L283-F286 PolarHBondContact O-N 3.45Å; L283-F287 WeakPolarHBondContact O-CD2 3.27Å; L283-F287 PolarHBondContact O-N 3.41Å |
| 284 | S | 94.4 | Very high | 90.3 | Very high | 52 Ų | 52 | 43.4 Ų | 43.4 | 36% | 0.364 | 25% | 0.245 | S | C | . | . | H | α-helix | trans | -64.5 | -40.2 | 178.8 | 63.9 | 0 | 0 | 0 | 0 | 112.1 | I280 G281 F287 T288 | I280-S284 WeakPolarHBondContact O-CB 3.21Å; I280-S284 PolarHBondContact O-N 3Å; I280-S284 PolarHBondContact O-OG 3.29Å; G281-S284 WeakPolarHBondContact CA-OG 3.46Å; G281-S284 PolarHBondContact O-N 3.09Å; G281-S284 PolarHBondContact O-OG 3.12Å; S284-F287 PolarHBondContact O-N 3.21Å; S284-T288 WeakPolarHBondContact O-CB 3.47Å; S284-T288 PolarHBondContact O-N 3.47Å; S284-T288 PolarHBondContact O-OG1 3.18Å |
| 285 | G | 93.3 | Very high | 90.7 | Very high | 0 Ų | 0 | 43.8 Ų | 43.8 | 0% | 0 | 25% | 0.247 | C | C | . | . | H | α-helix | trans | -58.7 | -49.2 | 171.7 | 0 | 0 | 0 | 0 | 0 | 111.3 | G122 G281 F287 T288 I289 | G122-G285 WeakPolarHBondContact CA-O 3.25Å; G281-G285 PolarHBondContact O-N 3.36Å; G285-F287 PolarHBondContact O-N 3.43Å; G285-T288 WeakPolarHBondContact O-CB 3.45Å; G285-T288 PolarHBondContact O-N 3.46Å; G285-T288 VanDerWaalsContact O-N 3.14Å; G285-I289 WeakPolarHBondContact O-CG1 3.49Å; G285-I289 PolarHBondContact O-N 3.16Å |
| 286 | F | 93.1 | Very high | 90.5 | Very high | 10 Ų | 10 | 41.5 Ų | 41.5 | 4% | 0.044 | 23% | 0.232 | C | C | . | . | H | α-helix | trans | -58.5 | -48.7 | 177.4 | 178.2 | -124.6 | 0 | 0 | 0 | 112.6 | M126 Y253 T257 T258 T282 L283 T288 I289 I290 | M126-F286 HydrophobicContact SD-CB 3.99Å; Y253-F286 HydrophobicContact CE1-CE2 4.43Å; T257-F286 HydrophobicContact CG2-CD2 3.79Å; T257-F286 HydrophobicContact CG2-CE2 3.23Å; T257-F286 HydrophobicContact CG2-CZ 3.97Å; T258-F286 WeakPolarHBondContact OG1-CE1 3.35Å; T258-F286 VanDerWaalsContact OG1-CZ 3.28Å; T258-F286 WeakPolarHBondContact OG1-CZ 3.45Å; T282-F286 WeakPolarHBondContact O-CB 3.43Å; T282-F286 PolarHBondContact O-N 3.28Å; L283-F286 PolarHBondContact O-N 3.45Å; F286-T288 VanDerWaalsContact C-N 3.29Å; F286-T288 PolarHBondContact O-N 3.06Å; F286-I289 PolarHBondContact O-N 3.01Å; F286-I290 HydrophobicContact CD1-CD1 4Å; F286-I290 HydrophobicContact CD2-CD1 4.42Å; F286-I290 HydrophobicContact CD2-CG1 4.42Å; F286-I290 HydrophobicContact CE1-CD1 3.58Å; F286-I290 HydrophobicContact CE1-CG1 4.49Å; F286-I290 HydrophobicContact CE2-CD1 3.99Å; F286-I290 HydrophobicContact CE2-CG1 4.04Å; F286-I290 HydrophobicContact CG-CD1 4.42Å; F286-I290 HydrophobicContact CZ-CD1 3.59Å; F286-I290 HydrophobicContact CZ-CG1 4.12Å; F286-I290 WeakPolarHBondContact O-CG1 3.32Å; F286-I290 PolarHBondContact O-N 3.35Å |
| 287 | F | 93.6 | Very high | 90.1 | Very high | 130 Ų | 130 | 40.6 Ų | 40.6 | 57% | 0.57 | 21% | 0.214 | S | C | * | . | H | α-helix | trans | -59.3 | -39.3 | 174.9 | -82.9 | -68.7 | 0 | 0 | 0 | 112.5 | L283 S284 G285 I289 I290 V291 | L283-F287 WeakPolarHBondContact O-CD2 3.27Å; L283-F287 PolarHBondContact O-N 3.41Å; S284-F287 PolarHBondContact O-N 3.21Å; G285-F287 PolarHBondContact O-N 3.43Å; F287-I289 VanDerWaalsContact C-N 3.35Å; F287-I289 PolarHBondContact O-N 2.98Å; F287-I290 HydrophobicContact CD1-CD1 4.36Å; F287-I290 WeakPolarHBondContact O-CB 3.4Å; F287-I290 PolarHBondContact O-N 2.91Å; F287-V291 WeakPolarHBondContact O-CG2 3.23Å; F287-V291 PolarHBondContact O-N 3.39Å |
| 288 | T | 94.6 | Very high | 89.4 | Confident | 41 Ų | 41 | 38.4 Ų | 38.4 | 25% | 0.252 | 21% | 0.211 | S | C | . | . | H | α-helix | trans | -63.6 | -41.1 | 177.4 | -55.7 | 0 | 0 | 0 | 0 | 111.4 | L118 S284 G285 F286 V291 G292 | L118-T288 HydrophobicContact CB-CG2 4.3Å; L118-T288 HydrophobicContact CD2-CG2 3.66Å; L118-T288 WeakPolarHBondContact O-CG2 3.35Å; S284-T288 WeakPolarHBondContact O-CB 3.47Å; S284-T288 PolarHBondContact O-N 3.47Å; S284-T288 PolarHBondContact O-OG1 3.18Å; G285-T288 WeakPolarHBondContact O-CB 3.45Å; G285-T288 PolarHBondContact O-N 3.46Å; G285-T288 VanDerWaalsContact O-N 3.14Å; F286-T288 VanDerWaalsContact C-N 3.29Å; F286-T288 PolarHBondContact O-N 3.06Å; T288-V291 PolarHBondContact O-N 3.45Å; T288-G292 PolarHBondContact O-N 3.43Å |
| 289 | I | 92.3 | Very high | 88.4 | Confident | 0 Ų | 0 | 40 Ų | 40 | 0% | 0 | 22% | 0.215 | C | C | . | . | H | α-helix | trans | -64.7 | -42.1 | 175.1 | -59.8 | 170 | 0 | 0 | 0 | 110.9 | P87 A90 G122 M126 Y253 G285 F286 F287 V291 G292 I293 | P87-I289 HydrophobicContact CB-CD1 4.01Å; A90-I289 HydrophobicContact CB-CG2 4.09Å; G122-I289 VanDerWaalsContact C-CG1 3.47Å; M126-I289 HydrophobicContact CG-CD1 4.21Å; M126-I289 HydrophobicContact SD-CD1 3.77Å; Y253-I289 HydrophobicContact CE1-CG2 3.82Å; Y253-I289 VanDerWaalsContact OH-CG2 3.23Å; Y253-I289 WeakPolarHBondContact OH-CG2 3.28Å; G285-I289 WeakPolarHBondContact O-CG1 3.49Å; G285-I289 PolarHBondContact O-N 3.16Å; F286-I289 PolarHBondContact O-N 3.01Å; F287-I289 VanDerWaalsContact C-N 3.35Å; F287-I289 PolarHBondContact O-N 2.98Å; I289-V291 PolarHBondContact O-N 3.27Å; I289-G292 WeakPolarHBondContact O-CA 3.22Å; I289-G292 PolarHBondContact O-N 3.07Å; I289-G292 VanDerWaalsContact O-N 3.14Å; I289-I293 HydrophobicContact CG2-CD1 3.64Å; I289-I293 HydrophobicContact CG2-CG1 4.19Å; I289-I293 WeakPolarHBondContact O-CG1 3.48Å; I289-I293 PolarHBondContact O-N 3.37Å |
| 290 | I | 90.9 | Very high | 87.3 | Confident | 20 Ų | 20 | 44.7 Ų | 44.7 | 10% | 0.103 | 23% | 0.234 | C | C | . | . | H | α-helix | trans | -54.9 | -53.2 | 175.4 | -69.4 | 172.6 | 0 | 0 | 0 | 110.1 | V254 F286 F287 G292 I293 F294 | V254-I290 HydrophobicContact CB-CD1 4.49Å; V254-I290 HydrophobicContact CG1-CD1 3.85Å; V254-I290 HydrophobicContact CG1-CG1 4.46Å; V254-I290 HydrophobicContact CG2-CB 4.32Å; V254-I290 HydrophobicContact CG2-CD1 4.07Å; V254-I290 HydrophobicContact CG2-CG1 3.79Å; V254-I290 HydrophobicContact CG2-CG2 3.74Å; F286-I290 HydrophobicContact CD1-CD1 4Å; F286-I290 HydrophobicContact CD2-CD1 4.42Å; F286-I290 HydrophobicContact CD2-CG1 4.42Å; F286-I290 HydrophobicContact CE1-CD1 3.58Å; F286-I290 HydrophobicContact CE1-CG1 4.49Å; F286-I290 HydrophobicContact CE2-CD1 3.99Å; F286-I290 HydrophobicContact CE2-CG1 4.04Å; F286-I290 HydrophobicContact CG-CD1 4.42Å; F286-I290 HydrophobicContact CZ-CD1 3.59Å; F286-I290 HydrophobicContact CZ-CG1 4.12Å; F286-I290 WeakPolarHBondContact O-CG1 3.32Å; F286-I290 PolarHBondContact O-N 3.35Å; F287-I290 HydrophobicContact CD1-CD1 4.36Å; F287-I290 WeakPolarHBondContact O-CB 3.4Å; F287-I290 PolarHBondContact O-N 2.91Å; I290-G292 VanDerWaalsContact C-N 3.25Å; I290-G292 PolarHBondContact O-N 2.9Å; I290-I293 PolarHBondContact O-N 2.97Å; I290-F294 HydrophobicContact CG2-CD2 3.58Å; I290-F294 HydrophobicContact CG2-CE2 3.72Å; I290-F294 WeakPolarHBondContact O-CD2 3.36Å; I290-F294 PolarHBondContact O-N 3.22Å |
| 291 | V | 91.4 | Very high | 85.6 | Confident | 75 Ų | 75 | 45.2 Ų | 45.2 | 46% | 0.455 | 24% | 0.238 | S | C | . | . | H | α-helix | trans | -58.1 | -42.1 | 178.7 | 178 | 0 | 0 | 0 | 0 | 110.5 | L118 F287 T288 I289 F294 L295 | L118-V291 HydrophobicContact CD1-CG1 4.06Å; F287-V291 WeakPolarHBondContact O-CG2 3.23Å; F287-V291 PolarHBondContact O-N 3.39Å; T288-V291 PolarHBondContact O-N 3.45Å; I289-V291 PolarHBondContact O-N 3.27Å; V291-F294 PolarHBondContact O-N 3.05Å; V291-L295 HydrophobicContact CG1-CD1 3.98Å; V291-L295 HydrophobicContact CG1-CG 4.44Å; V291-L295 WeakPolarHBondContact O-CB 3.46Å; V291-L295 VanDerWaalsContact O-CG 3.31Å; V291-L295 WeakPolarHBondContact O-CG 3.21Å; V291-L295 PolarHBondContact O-N 2.9Å |
| 292 | G | 90.6 | Very high | 84 | Confident | 0 Ų | 0 | 47.7 Ų | 47.7 | 0% | 0 | 25% | 0.252 | C | S | . | . | H | α-helix | trans | -58.4 | -47.7 | 177 | 0 | 0 | 0 | 0 | 0 | 113.7 | G115 T288 I289 I290 L295 L296 | G115-G292 VanDerWaalsContact CA-O 3.31Å; G115-G292 WeakPolarHBondContact CA-O 3.5Å; G115-G292 WeakPolarHBondContact O-CA 3.41Å; T288-G292 PolarHBondContact O-N 3.43Å; I289-G292 WeakPolarHBondContact O-CA 3.22Å; I289-G292 PolarHBondContact O-N 3.07Å; I289-G292 VanDerWaalsContact O-N 3.14Å; I290-G292 VanDerWaalsContact C-N 3.25Å; I290-G292 PolarHBondContact O-N 2.9Å; G292-L295 PolarHBondContact O-N 2.88Å; G292-L296 WeakPolarHBondContact O-CB 3.07Å; G292-L296 PolarHBondContact O-N 3.11Å |
| 293 | I | 88.6 | Confident | 82 | Confident | 9 Ų | 9 | 52.3 Ų | 52.3 | 5% | 0.046 | 28% | 0.284 | C | S | . | . | H | α-helix | trans | -70.2 | -40.9 | -179.4 | -65.9 | 168.5 | 0 | 0 | 0 | 111.5 | A90 P250 Y253 I289 I290 L295 L296 H297 | A90-I293 HydrophobicContact CB-CD1 3.64Å; A90-I293 HydrophobicContact CB-CG1 4.37Å; P250-I293 HydrophobicContact CB-CG2 4.03Å; Y253-I293 HydrophobicContact CD1-CD1 3.21Å; Y253-I293 HydrophobicContact CD2-CD1 3.82Å; Y253-I293 HydrophobicContact CE1-CD1 3.18Å; Y253-I293 HydrophobicContact CE2-CD1 3.8Å; Y253-I293 HydrophobicContact CG-CD1 3.52Å; Y253-I293 VanDerWaalsContact CZ-CD1 3.46Å; I289-I293 HydrophobicContact CG2-CD1 3.64Å; I289-I293 HydrophobicContact CG2-CG1 4.19Å; I289-I293 WeakPolarHBondContact O-CG1 3.48Å; I289-I293 PolarHBondContact O-N 3.37Å; I290-I293 PolarHBondContact O-N 2.97Å; I293-L295 VanDerWaalsContact C-N 3.33Å; I293-L295 PolarHBondContact O-N 3.24Å; I293-L296 PolarHBondContact O-N 2.89Å; I293-H297 PolarHBondContact O-N 2.82Å |
| 294 | F | 86.8 | Confident | 80.1 | Confident | 79 Ų | 79 | 54.8 Ų | 54.8 | 35% | 0.346 | 29% | 0.292 | S | S | . | . | H | α-helix | trans | -60.1 | -44.4 | 174 | -92 | -79.6 | 0 | 0 | 0 | 111.1 | P250 I251 V254 I290 V291 L296 H297 A298 | P250-F294 HydrophobicContact CB-CD1 4Å; P250-F294 HydrophobicContact CB-CD2 4.31Å; P250-F294 HydrophobicContact CB-CE1 3.98Å; P250-F294 HydrophobicContact CB-CE2 4.3Å; P250-F294 HydrophobicContact CB-CG 4.17Å; P250-F294 HydrophobicContact CB-CZ 4.13Å; P250-F294 HydrophobicContact CG-CD1 4.42Å; P250-F294 HydrophobicContact CG-CE1 4.32Å; I251-F294 HydrophobicContact CG1-CZ 4.37Å; V254-F294 HydrophobicContact CG2-CE2 3.73Å; I290-F294 HydrophobicContact CG2-CD2 3.58Å; I290-F294 HydrophobicContact CG2-CE2 3.72Å; I290-F294 WeakPolarHBondContact O-CD2 3.36Å; I290-F294 PolarHBondContact O-N 3.22Å; V291-F294 PolarHBondContact O-N 3.05Å; F294-L296 VanDerWaalsContact C-N 3.29Å; F294-L296 PolarHBondContact O-N 2.62Å; F294-H297 PolarHBondContact O-N 3.22Å; F294-A298 WeakPolarHBondContact O-CB 3.45Å; F294-A298 PolarHBondContact O-N 3.19Å |
| 295 | L | 86.9 | Confident | 77.7 | Confident | 30 Ų | 30 | 56 Ų | 56 | 16% | 0.157 | 30% | 0.301 | C | S | . | . | H | α-helix | trans | -62.6 | -37.4 | 176 | -75 | 171.6 | 0 | 0 | 0 | 112.6 | I114 L118 V291 G292 I293 F299 | I114-L295 HydrophobicContact CG2-CD1 4.01Å; L118-L295 HydrophobicContact CD1-CD1 3.48Å; L118-L295 VanDerWaalsContact CD1-CD1 3.48Å; V291-L295 HydrophobicContact CG1-CD1 3.98Å; V291-L295 HydrophobicContact CG1-CG 4.44Å; V291-L295 WeakPolarHBondContact O-CB 3.46Å; V291-L295 VanDerWaalsContact O-CG 3.31Å; V291-L295 WeakPolarHBondContact O-CG 3.21Å; V291-L295 PolarHBondContact O-N 2.9Å; G292-L295 PolarHBondContact O-N 2.88Å; I293-L295 VanDerWaalsContact C-N 3.33Å; I293-L295 PolarHBondContact O-N 3.24Å; L295-F299 HydrophobicContact CD2-CD2 3.89Å; L295-F299 HydrophobicContact CD2-CE2 3.88Å |
| 296 | L | 82.8 | Confident | 75.6 | Confident | 17 Ų | 17 | 61.3 Ų | 61.3 | 9% | 0.089 | 33% | 0.329 | C | S | . | . | H | α-helix | trans | -68.8 | -36 | 179.5 | -168.4 | 66.2 | 0 | 0 | 0 | 112.8 | V93 A97 G292 I293 F294 | V93-L296 HydrophobicContact CG1-CD2 3.86Å; A97-L296 HydrophobicContact CB-CD1 4.28Å; A97-L296 HydrophobicContact CB-CD2 4.47Å; G292-L296 WeakPolarHBondContact O-CB 3.07Å; G292-L296 PolarHBondContact O-N 3.11Å; I293-L296 PolarHBondContact O-N 2.89Å; F294-L296 VanDerWaalsContact C-N 3.29Å; F294-L296 PolarHBondContact O-N 2.62Å |
| 297 | H | 79.9 | Confident | 73.8 | Confident | 28 Ų | 28 | 65.1 Ų | 65.1 | 13% | 0.13 | 36% | 0.362 | C | S | . | . | H | α-helix | trans | -98.7 | -40.8 | -174.8 | -84.5 | -86.3 | 0 | 0 | 0 | 114.5 | P250 I293 F294 | P250-H297 HydrophobicContact CG-CB 4.01Å; I293-H297 PolarHBondContact O-N 2.82Å; F294-H297 PolarHBondContact O-N 3.22Å |
| 298 | A | 74.4 | Confident | 71.5 | Confident | 57 Ų | 57 | 62.8 Ų | 62.8 | 47% | 0.471 | 36% | 0.362 | S | S | . | . | H | α-helix | trans | -71.7 | -31.1 | -176.3 | 0 | 0 | 0 | 0 | 0 | 113 | F294 | F294-A298 WeakPolarHBondContact O-CB 3.45Å; F294-A298 PolarHBondContact O-N 3.19Å |
| 299 | F | 68.9 | Low | 69.2 | Low | 74 Ų | 74 | 66.1 Ų | 66.1 | 33% | 0.325 | 38% | 0.377 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -108.1 | 15.7 | -178.5 | -62.1 | -77.4 | 0 | 0 | 0 | 113.6 | N109 H111 L295 D301 V302 | N109-F299 PolarHBondContact ND2-O 3.44Å; N109-F299 VanDerWaalsContact ND2-O 3.12Å; H111-F299 HydrophobicContact CB-CB 3.71Å; H111-F299 HydrophobicContact CB-CD2 4.34Å; H111-F299 HydrophobicContact CB-CG 4.19Å; L295-F299 HydrophobicContact CD2-CD2 3.89Å; L295-F299 HydrophobicContact CD2-CE2 3.88Å; F299-D301 PolarHBondContact O-N 2.82Å; F299-V302 HydrophobicContact CD1-CB 4.12Å; F299-V302 HydrophobicContact CD1-CG2 4.2Å; F299-V302 PolarHBondContact O-N 3.43Å |
| 300 | K | 66.2 | Low | 67.1 | Low | 129 Ų | 129 | 71.3 Ų | 71.3 | 56% | 0.561 | 41% | 0.411 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -57.7 | -34.7 | 178.7 | -172.8 | 173.7 | 175.5 | 177.1 | 0 | 112.1 | N109 | N109-K300 PolarHBondContact ND2-O 2.93Å; N109-K300 VanDerWaalsContact ND2-O 3.14Å |
| 301 | D | 56.4 | Low | 65.1 | Low | 131 Ų | 131 | 75.6 Ų | 75.6 | 70% | 0.701 | 44% | 0.438 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -101.3 | -0.9 | -177.5 | -55.7 | -41.2 | 0 | 0 | 0 | 113.6 | F299 | F299-D301 PolarHBondContact O-N 2.82Š|
| 302 | V | 58.2 | Low | 62.9 | Low | 57 Ų | 57 | 75.8 Ų | 75.8 | 35% | 0.345 | 44% | 0.442 | S | S | . | . | trans | -103.4 | 96.7 | -177.2 | -170.2 | 0 | 0 | 0 | 0 | 110.3 | N109 F299 F304 | N109-V302 PolarHBondContact ND2-O 2.73Å; F299-V302 HydrophobicContact CD1-CB 4.12Å; F299-V302 HydrophobicContact CD1-CG2 4.2Å; F299-V302 PolarHBondContact O-N 3.43Å; V302-F304 HydrophobicContact CG1-CD2 3.58Å; V302-F304 HydrophobicContact CG1-CE2 3.27Å; V302-F304 HydrophobicContact CG1-CZ 4.02Å; V302-F304 PolarHBondContact O-N 3.35Å; V302-F304 VanDerWaalsContact O-N 3.1Å | ||
| 303 | S | 46.6 | Very low | 60.7 | Low | 97 Ų | 97 | 84.7 Ų | 84.7 | 68% | 0.678 | 48% | 0.482 | S | S | * | . | trans | -80.6 | 85 | 179.1 | 61.3 | 0 | 0 | 0 | 0 | 111.7 | S305 | S303-S305 PolarHBondContact O-N 3Š| ||
| 304 | F | 52.2 | Low | 58.6 | Low | 115 Ų | 115 | 92.5 Ų | 92.5 | 50% | 0.504 | 51% | 0.511 | S | S | . | . | trans | -83.5 | 103.2 | 160.4 | -71.5 | -69.9 | 0 | 0 | 0 | 108.8 | H111 V302 | H111-F304 AromaticContact CE1-CD2 3.82Å; V302-F304 HydrophobicContact CG1-CD2 3.58Å; V302-F304 HydrophobicContact CG1-CE2 3.27Å; V302-F304 HydrophobicContact CG1-CZ 4.02Å; V302-F304 PolarHBondContact O-N 3.35Å; V302-F304 VanDerWaalsContact O-N 3.1Å | ||
| 305 | S | 43.6 | Very low | 56.5 | Low | 77 Ų | 77 | 96.6 Ų | 96.6 | 54% | 0.538 | 53% | 0.528 | S | S | . | . | trans | -75.6 | 136.7 | 168.3 | -176.7 | 0 | 0 | 0 | 0 | 108.4 | S303 A307 S308 | S303-S305 PolarHBondContact O-N 3Å; S305-A307 PolarHBondContact O-N 3.42Å; S305-A307 WeakPolarHBondContact OG-CB 3.37Å; S305-A307 PolarHBondContact OG-N 3.06Å; S305-S308 PolarHBondContact O-N 3.3Å; S305-S308 PolarHBondContact O-OG 3.3Å | ||
| 306 | L | 49 | Very low | 54.5 | Low | 112 Ų | 112 | 99.9 Ų | 99.9 | 59% | 0.586 | 55% | 0.546 | S | S | * | . | G | 310 helix | trans | -54.9 | -12.1 | 171 | -77.2 | 168.7 | 0 | 0 | 0 | 113.1 | L110 S308 L309 | L110-L306 HydrophobicContact CD2-CD2 3.85Å; L110-L306 HydrophobicContact CD2-CG 4.19Å; L306-S308 PolarHBondContact O-N 3.27Å; L306-L309 HydrophobicContact CD2-CD1 3.33Å; L306-L309 HydrophobicContact CD2-CG 4.45Å; L306-L309 PolarHBondContact O-N 3.3Å |
| 307 | A | 55.4 | Low | 52.7 | Low | 90 Ų | 90 | 105.9 Ų | 105.9 | 74% | 0.744 | 57% | 0.573 | S | S | * | * | G | 310 helix | trans | -65.6 | -13.7 | 169.1 | 0 | 0 | 0 | 0 | 0 | 114.6 | S305 | S305-A307 PolarHBondContact O-N 3.42Å; S305-A307 WeakPolarHBondContact OG-CB 3.37Å; S305-A307 PolarHBondContact OG-N 3.06Å |
| 308 | S | 46.3 | Very low | 51 | Low | 81 Ų | 81 | 112 Ų | 112 | 57% | 0.566 | 60% | 0.599 | S | S | * | * | G | 310 helix | trans | -102.6 | 5.7 | 176.6 | 64.7 | 0 | 0 | 0 | 0 | 114.2 | S305 L306 | S305-S308 PolarHBondContact O-N 3.3Å; S305-S308 PolarHBondContact O-OG 3.3Å; L306-S308 PolarHBondContact O-N 3.27Å |
| 309 | L | 46.7 | Very low | 49.8 | Very low | 110 Ų | 110 | 111.8 Ų | 111.8 | 58% | 0.576 | 60% | 0.598 | S | S | * | * | S | Bend | trans | -64.8 | 131.1 | 163.5 | -88.5 | 160 | 0 | 0 | 0 | 108 | L306 V311 | L306-L309 HydrophobicContact CD2-CD1 3.33Å; L306-L309 HydrophobicContact CD2-CG 4.45Å; L306-L309 PolarHBondContact O-N 3.3Å; L309-V311 PolarHBondContact O-N 3.42Å; L309-V311 VanDerWaalsContact O-N 3.1Å |
| 310 | P | 46.5 | Very low | 48.8 | Very low | 110 Ų | 110 | 113 Ų | 113 | 71% | 0.714 | 61% | 0.612 | S | S | * | * | trans | -56.3 | 125.9 | 170.7 | 23.9 | -30 | 0 | 0 | 0 | 107.2 | S312 | P310-S312 PolarHBondContact O-N 3.33Š| ||
| 311 | V | 49.4 | Very low | 47.9 | Very low | 109 Ų | 109 | 112 Ų | 112 | 66% | 0.661 | 61% | 0.612 | S | S | * | * | trans | -64.9 | 62.8 | 174.8 | -179 | 0 | 0 | 0 | 0 | 108.5 | L309 R314 | L309-V311 PolarHBondContact O-N 3.42Å; L309-V311 VanDerWaalsContact O-N 3.1Å; V311-R314 HydrophobicContact CG1-CB 3.36Å; V311-R314 HydrophobicContact CG1-CG 4.44Å | ||
| 312 | S | 44.8 | Very low | 47.7 | Very low | 79 Ų | 79 | 107.1 Ų | 107.1 | 55% | 0.552 | 59% | 0.593 | S | S | * | * | trans | -80.3 | -29.5 | 177.7 | -172.3 | 0 | 0 | 0 | 0 | 110.5 | P310 | P310-S312 PolarHBondContact O-N 3.33Š| ||
| 313 | F | 45.8 | Very low | 47.4 | Very low | 187 Ų | 187 | 110.1 Ų | 110.1 | 82% | 0.82 | 61% | 0.607 | S | S | * | * | H | α-helix | trans | -84.8 | -8.4 | -178.4 | -87.5 | -79.8 | 0 | 0 | 0 | 115.1 | ||
| 314 | R | 44.1 | Very low | 47.5 | Very low | 174 Ų | 174 | 110 Ų | 110 | 66% | 0.657 | 60% | 0.598 | S | S | * | * | H | α-helix | trans | -93.5 | -8.2 | 174.7 | -150.5 | 174.7 | -178.9 | 169.7 | 0.5 | 113.3 | V311 | V311-R314 HydrophobicContact CG1-CB 3.36Å; V311-R314 HydrophobicContact CG1-CG 4.44Å |
| 315 | K | 42.4 | Very low | 47.5 | Very low | 165 Ų | 165 | 107.5 Ų | 107.5 | 72% | 0.717 | 60% | 0.595 | S | S | * | * | H | α-helix | trans | -78.8 | -32.5 | 175.3 | -161.1 | 172.4 | -178.7 | 178.9 | 0 | 111.4 | A319 | K315-A319 VanDerWaalsContact O-CB 3.29Å; K315-A319 WeakPolarHBondContact O-CB 3.31Å; K315-A319 PolarHBondContact O-N 3.38Å |
| 316 | D | 45.5 | Very low | 47.9 | Very low | 99 Ų | 99 | 108.1 Ų | 108.1 | 53% | 0.529 | 59% | 0.592 | S | S | . | * | H | α-helix | trans | -73.1 | -37 | 178.7 | -68.5 | -36.3 | 0 | 0 | 0 | 112.7 | K318 A319 V320 | D316-K318 PolarHBondContact O-N 3.08Å; D316-A319 PolarHBondContact O-N 3.18Å; D316-V320 WeakPolarHBondContact O-CB 3.43Å; D316-V320 WeakPolarHBondContact O-CG2 3.48Å; D316-V320 PolarHBondContact O-N 3.16Å |
| 317 | E | 43.7 | Very low | 48 | Very low | 142 Ų | 142 | 108.2 Ų | 108.2 | 66% | 0.664 | 59% | 0.591 | S | S | * | * | H | α-helix | trans | -71.2 | -31.8 | 178.4 | -155.2 | 172.4 | 101.7 | 0 | 0 | 112.8 | N321 | E317-N321 WeakPolarHBondContact O-CB 3.3Å; E317-N321 PolarHBondContact O-N 3.32Å; E317-N321 VanDerWaalsContact O-N 3.1Å |
| 318 | K | 45.9 | Very low | 47.7 | Very low | 156 Ų | 156 | 112.1 Ų | 112.1 | 68% | 0.678 | 59% | 0.588 | S | S | * | * | H | α-helix | trans | -76.5 | -33.2 | 172.1 | -78.7 | -170 | 175.5 | -171.5 | 0 | 113 | D316 G322 | D316-K318 PolarHBondContact O-N 3.08Å; K318-G322 PolarHBondContact O-N 2.92Å |
| 319 | A | 49 | Very low | 48 | Very low | 54 Ų | 54 | 114.2 Ų | 114.2 | 45% | 0.446 | 59% | 0.589 | S | S | . | * | H | α-helix | trans | -69.1 | -37.4 | 174.7 | 0 | 0 | 0 | 0 | 0 | 111.6 | K315 D316 N323 | K315-A319 VanDerWaalsContact O-CB 3.29Å; K315-A319 WeakPolarHBondContact O-CB 3.31Å; K315-A319 PolarHBondContact O-N 3.38Å; D316-A319 PolarHBondContact O-N 3.18Å; A319-N323 WeakPolarHBondContact O-CB 3.49Å; A319-N323 PolarHBondContact O-N 3.43Å; A319-N323 VanDerWaalsContact O-N 3.1Å |
| 320 | V | 48.1 | Very low | 48.4 | Very low | 100 Ų | 100 | 113.3 Ų | 113.3 | 61% | 0.606 | 59% | 0.588 | S | S | * | * | H | α-helix | trans | -70.5 | -43 | 176 | 174.3 | 0 | 0 | 0 | 0 | 111.5 | D316 N323 L324 | D316-V320 WeakPolarHBondContact O-CB 3.43Å; D316-V320 WeakPolarHBondContact O-CG2 3.48Å; D316-V320 PolarHBondContact O-N 3.16Å; V320-N323 PolarHBondContact O-N 3.16Å; V320-L324 PolarHBondContact O-N 2.81Å; V320-L324 VanDerWaalsContact O-N 3.12Å |
| 321 | N | 46.2 | Very low | 48.7 | Very low | 106 Ų | 106 | 113.2 Ų | 113.2 | 57% | 0.567 | 58% | 0.581 | S | S | * | * | H | α-helix | trans | -69 | -33.8 | 175.6 | -90.5 | -4 | 0 | 0 | 0 | 113.6 | E317 L324 S325 | E317-N321 WeakPolarHBondContact O-CB 3.3Å; E317-N321 PolarHBondContact O-N 3.32Å; E317-N321 VanDerWaalsContact O-N 3.1Å; N321-L324 PolarHBondContact O-N 3.25Å; N321-S325 PolarHBondContact O-N 3.05Å; N321-S325 VanDerWaalsContact O-N 3.16Å; N321-S325 PolarHBondContact O-OG 3.35Å |
| 322 | G | 53.3 | Low | 48.6 | Very low | 29 Ų | 29 | 112.7 Ų | 112.7 | 30% | 0.299 | 57% | 0.574 | S | S | . | * | H | α-helix | trans | -70.6 | -32.3 | 175.6 | 0 | 0 | 0 | 0 | 0 | 113.5 | K318 S325 N326 | K318-G322 PolarHBondContact O-N 2.92Å; G322-S325 PolarHBondContact O-OG 3.06Å; G322-N326 VanDerWaalsContact O-CG 3.3Å; G322-N326 PolarHBondContact O-N 3.08Å; G322-N326 PolarHBondContact O-ND2 3.46Å |
| 323 | N | 50.5 | Low | 48.8 | Very low | 121 Ų | 121 | 113.6 Ų | 113.6 | 65% | 0.647 | 57% | 0.573 | S | S | * | * | H | α-helix | trans | -74.2 | -33.9 | 173.7 | -89.1 | 1.5 | 0 | 0 | 0 | 112.5 | A319 V320 M327 | A319-N323 WeakPolarHBondContact O-CB 3.49Å; A319-N323 PolarHBondContact O-N 3.43Å; A319-N323 VanDerWaalsContact O-N 3.1Å; V320-N323 PolarHBondContact O-N 3.16Å; N323-M327 WeakPolarHBondContact O-CB 3.39Å; N323-M327 PolarHBondContact O-N 2.94Å; N323-M327 VanDerWaalsContact O-N 3.09Å |
| 324 | L | 49.1 | Very low | 48.7 | Very low | 93 Ų | 93 | 110 Ų | 110 | 49% | 0.487 | 56% | 0.562 | S | S | . | * | H | α-helix | trans | -69.9 | -39.4 | 177.3 | -163.8 | 72.7 | 0 | 0 | 0 | 111.8 | V320 N321 M327 Y328 | V320-L324 PolarHBondContact O-N 2.81Å; V320-L324 VanDerWaalsContact O-N 3.12Å; N321-L324 PolarHBondContact O-N 3.25Å; L324-M327 PolarHBondContact O-N 3.26Å; L324-Y328 HydrophobicContact CG-CD2 4.34Å; L324-Y328 HydrophobicContact CG-CE2 4.39Å; L324-Y328 WeakPolarHBondContact O-CD2 3.46Å; L324-Y328 PolarHBondContact O-N 3.36Å; L324-Y328 VanDerWaalsContact O-N 3.12Å |
| 325 | S | 52.4 | Low | 48.7 | Very low | 63 Ų | 63 | 108.4 Ų | 108.4 | 44% | 0.441 | 56% | 0.562 | S | S | . | * | H | α-helix | trans | -65.5 | -41.4 | 175.8 | 56.6 | 0 | 0 | 0 | 0 | 112.6 | N321 G322 M327 Y328 E329 | N321-S325 PolarHBondContact O-N 3.05Å; N321-S325 VanDerWaalsContact O-N 3.16Å; N321-S325 PolarHBondContact O-OG 3.35Å; G322-S325 PolarHBondContact O-OG 3.06Å; S325-M327 VanDerWaalsContact C-N 3.31Å; S325-M327 PolarHBondContact O-N 3.42Å; S325-Y328 PolarHBondContact O-N 3.14Å; S325-E329 PolarHBondContact O-N 3.22Å |
| 326 | N | 52.8 | Low | 48.8 | Very low | 90 Ų | 90 | 106.5 Ų | 106.5 | 48% | 0.481 | 56% | 0.556 | S | S | . | * | H | α-helix | trans | -66.5 | -33.8 | 176.5 | -73.6 | -5.7 | 0 | 0 | 0 | 112 | G322 V330 | G322-N326 VanDerWaalsContact O-CG 3.3Å; G322-N326 PolarHBondContact O-N 3.08Å; G322-N326 PolarHBondContact O-ND2 3.46Å; N326-V330 WeakPolarHBondContact O-CB 3.49Å; N326-V330 VanDerWaalsContact O-CG2 3.25Å; N326-V330 WeakPolarHBondContact O-CG2 3.39Å; N326-V330 PolarHBondContact O-N 3.45Å |
| 327 | M | 49.7 | Very low | 48.6 | Very low | 115 Ų | 115 | 106.1 Ų | 106.1 | 57% | 0.567 | 56% | 0.561 | S | S | * | * | H | α-helix | trans | -70.1 | -34.7 | 176.8 | -147.6 | 178.4 | 83 | 0 | 0 | 112 | N323 L324 S325 L331 | N323-M327 WeakPolarHBondContact O-CB 3.39Å; N323-M327 PolarHBondContact O-N 2.94Å; N323-M327 VanDerWaalsContact O-N 3.09Å; L324-M327 PolarHBondContact O-N 3.26Å; S325-M327 VanDerWaalsContact C-N 3.31Å; S325-M327 PolarHBondContact O-N 3.42Å; M327-L331 PolarHBondContact O-N 3.29Å |
| 328 | Y | 49.2 | Very low | 48.3 | Very low | 171 Ų | 171 | 106.8 Ų | 106.8 | 67% | 0.671 | 57% | 0.568 | S | S | * | * | H | α-helix | trans | -70.7 | -39.7 | 173.3 | -93.6 | -87.4 | 0 | 0 | 0 | 112.8 | L324 S325 L331 N332 | L324-Y328 HydrophobicContact CG-CD2 4.34Å; L324-Y328 HydrophobicContact CG-CE2 4.39Å; L324-Y328 WeakPolarHBondContact O-CD2 3.46Å; L324-Y328 PolarHBondContact O-N 3.36Å; L324-Y328 VanDerWaalsContact O-N 3.12Å; S325-Y328 PolarHBondContact O-N 3.14Å; Y328-L331 PolarHBondContact O-N 3.28Å; Y328-N332 WeakPolarHBondContact O-CB 3.35Å; Y328-N332 PolarHBondContact O-N 3.2Å |
| 329 | E | 53.6 | Low | 48 | Very low | 126 Ų | 126 | 105 Ų | 105 | 59% | 0.589 | 57% | 0.57 | S | S | * | * | H | α-helix | trans | -66.7 | -36.5 | 175 | -85.2 | -173.6 | 160.8 | 0 | 0 | 113 | S325 N332 N333 | S325-E329 PolarHBondContact O-N 3.22Å; E329-N332 PolarHBondContact O-N 3.16Å; E329-N333 WeakPolarHBondContact O-CB 3.4Å; E329-N333 VanDerWaalsContact O-CG 3.31Å; E329-N333 PolarHBondContact O-N 3.42Å; E329-N333 PolarHBondContact O-ND2 2.96Å |
| 330 | V | 55.2 | Low | 47.3 | Very low | 90 Ų | 90 | 108.3 Ų | 108.3 | 55% | 0.545 | 59% | 0.589 | S | S | . | * | H | α-helix | trans | -70 | -34.5 | 176.8 | 170.9 | 0 | 0 | 0 | 0 | 112 | N326 N334 | N326-V330 WeakPolarHBondContact O-CB 3.49Å; N326-V330 VanDerWaalsContact O-CG2 3.25Å; N326-V330 WeakPolarHBondContact O-CG2 3.39Å; N326-V330 PolarHBondContact O-N 3.45Å; V330-N334 PolarHBondContact O-N 3Å |
| 331 | L | 51.1 | Low | 46.7 | Very low | 109 Ų | 109 | 107 Ų | 107 | 57% | 0.571 | 60% | 0.596 | S | S | * | * | H | α-helix | trans | -68.7 | -40 | 173.1 | -101.7 | 132.3 | 0 | 0 | 0 | 112 | M327 Y328 N334 E335 | M327-L331 PolarHBondContact O-N 3.29Å; Y328-L331 PolarHBondContact O-N 3.28Å; L331-N334 PolarHBondContact O-N 3.3Å; L331-E335 PolarHBondContact O-N 3.23Å |
| 332 | N | 48.1 | Very low | 46.4 | Very low | 97 Ų | 97 | 109.3 Ų | 109.3 | 52% | 0.519 | 61% | 0.606 | S | S | . | * | H | α-helix | trans | -71 | -38.8 | -179.3 | -133.4 | 39.2 | 0 | 0 | 0 | 112.7 | Y328 E329 N334 E335 E336 | Y328-N332 WeakPolarHBondContact O-CB 3.35Å; Y328-N332 PolarHBondContact O-N 3.2Å; E329-N332 PolarHBondContact O-N 3.16Å; N332-N334 VanDerWaalsContact C-N 3.28Å; N332-N334 PolarHBondContact O-N 3.01Å; N332-E335 PolarHBondContact O-N 3.47Å; N332-E336 PolarHBondContact O-N 3.15Å |
| 333 | N | 48.5 | Very low | 45.4 | Very low | 99 Ų | 99 | 117.2 Ų | 117.2 | 53% | 0.529 | 64% | 0.636 | S | S | . | * | H | α-helix | trans | -68.9 | -26.1 | 178 | -74.8 | -21.3 | 0 | 0 | 0 | 113 | E329 S337 | E329-N333 WeakPolarHBondContact O-CB 3.4Å; E329-N333 VanDerWaalsContact O-CG 3.31Å; E329-N333 PolarHBondContact O-N 3.42Å; E329-N333 PolarHBondContact O-ND2 2.96Å; N333-S337 PolarHBondContact O-N 3.47Å |
| 334 | N | 45.2 | Very low | 44.5 | Very low | 110 Ų | 110 | 120.6 Ų | 120.6 | 59% | 0.588 | 65% | 0.647 | S | S | * | * | H | α-helix | trans | -75.8 | -29.8 | 175.5 | -79.5 | -4.2 | 0 | 0 | 0 | 112.4 | V330 L331 N332 S337 | V330-N334 PolarHBondContact O-N 3Å; L331-N334 PolarHBondContact O-N 3.3Å; N332-N334 VanDerWaalsContact C-N 3.28Å; N332-N334 PolarHBondContact O-N 3.01Å; N334-S337 PolarHBondContact O-OG 2.96Å |
| 335 | E | 43.8 | Very low | 43.5 | Very low | 141 Ų | 141 | 124.6 Ų | 124.6 | 66% | 0.659 | 66% | 0.663 | S | S | * | * | H | α-helix | trans | -73.7 | -36.5 | 173.5 | -87.3 | -176.9 | 134.6 | 0 | 0 | 112.9 | L331 N332 L338 T339 | L331-E335 PolarHBondContact O-N 3.23Å; N332-E335 PolarHBondContact O-N 3.47Å; E335-L338 PolarHBondContact O-N 2.82Å; E335-T339 PolarHBondContact O-OG1 3.35Å; E335-T339 VanDerWaalsContact O-OG1 3.08Å |
| 336 | E | 44.2 | Very low | 42.4 | Very low | 126 Ų | 126 | 128.2 Ų | 128.2 | 59% | 0.589 | 68% | 0.683 | S | S | * | * | H | α-helix | trans | -71.5 | -28.9 | 177 | -75.4 | -170.5 | 165.1 | 0 | 0 | 113.1 | N332 L338 T339 | N332-E336 PolarHBondContact O-N 3.15Å; E336-L338 VanDerWaalsContact C-N 3.25Å; E336-L338 PolarHBondContact O-N 3.41Å; E336-T339 PolarHBondContact O-N 3.35Å; E336-T339 PolarHBondContact O-OG1 3.28Å |
| 337 | S | 40.4 | Very low | 41.3 | Very low | 91 Ų | 91 | 127.5 Ų | 127.5 | 64% | 0.636 | 70% | 0.697 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -71.4 | -15.8 | 177.1 | 70.5 | 0 | 0 | 0 | 0 | 114.4 | N333 N334 | N333-S337 PolarHBondContact O-N 3.47Å; N334-S337 PolarHBondContact O-OG 2.96Å |
| 338 | L | 38.9 | Very low | 40.5 | Very low | 155 Ų | 155 | 130.2 Ų | 130.2 | 81% | 0.812 | 71% | 0.708 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -91.8 | -10.2 | 176.2 | -130.8 | 176.2 | 0 | 0 | 0 | 112.8 | E335 E336 | E335-L338 PolarHBondContact O-N 2.82Å; E336-L338 VanDerWaalsContact C-N 3.25Å; E336-L338 PolarHBondContact O-N 3.41Å |
| 339 | T | 39.7 | Very low | 39.5 | Very low | 118 Ų | 118 | 128.3 Ų | 128.3 | 72% | 0.724 | 71% | 0.709 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -110.7 | -6.5 | -174.4 | 27.6 | 0 | 0 | 0 | 0 | 115.1 | E335 E336 | E335-T339 PolarHBondContact O-OG1 3.35Å; E335-T339 VanDerWaalsContact O-OG1 3.08Å; E336-T339 PolarHBondContact O-N 3.35Å; E336-T339 PolarHBondContact O-OG1 3.28Å |
| 340 | C | 34.3 | Very low | 38.6 | Very low | 124 Ų | 124 | 128.6 Ų | 128.6 | 84% | 0.838 | 72% | 0.72 | S | S | * | * | trans | -107.9 | 53.3 | 179.4 | -153 | 0 | 0 | 0 | 0 | 113 | ||||
| 341 | G | 35.2 | Very low | 37.6 | Very low | 73 Ų | 73 | 129.4 Ų | 129.4 | 75% | 0.753 | 73% | 0.729 | S | S | * | * | trans | -113.2 | 1.7 | 177 | 0 | 0 | 0 | 0 | 0 | 115.1 | ||||
| 342 | I | 39.8 | Very low | 36.9 | Very low | 154 Ų | 154 | 134.9 Ų | 134.9 | 79% | 0.79 | 74% | 0.742 | S | S | * | * | S | Bend | trans | -138.8 | 101.7 | -175.1 | -52.5 | -179.5 | 0 | 0 | 0 | 108.6 | ||
| 343 | E | 32.3 | Very low | 36.3 | Very low | 196 Ų | 196 | 139.6 Ų | 139.6 | 92% | 0.916 | 75% | 0.753 | S | S | * | * | trans | 144.2 | 95.4 | 149.4 | -80.1 | -168.6 | 112.5 | 0 | 0 | 111.3 | ||||
| 344 | Q | 30.7 | Very low | 35.8 | Very low | 191 Ų | 191 | 141.7 Ų | 141.7 | 89% | 0.893 | 76% | 0.764 | S | S | * | * | trans | -138.4 | 111.2 | 163.7 | -134 | -179.1 | 1.7 | 0 | 0 | 108.3 | ||||
| 345 | H | 28.8 | Very low | 35.3 | Very low | 178 Ų | 178 | 139.9 Ų | 139.9 | 82% | 0.824 | 77% | 0.771 | S | S | * | * | trans | -154.3 | 132.4 | 153.2 | -120.7 | -76.8 | 0 | 0 | 0 | 112.5 | ||||
| 346 | T | 28.7 | Very low | 34.9 | Very low | 139 Ų | 139 | 140.4 Ų | 140.4 | 85% | 0.853 | 78% | 0.778 | S | S | * | * | trans | 76.3 | 124.7 | 154.9 | 24.6 | 0 | 0 | 0 | 0 | 121 | ||||
| 347 | G | 29.5 | Very low | 34.7 | Very low | 75 Ų | 75 | 141 Ų | 141 | 77% | 0.773 | 79% | 0.785 | S | S | * | * | trans | 144.7 | 79.8 | 148.3 | 0 | 0 | 0 | 0 | 0 | 118.7 | ||||
| 348 | E | 32.5 | Very low | 34.6 | Very low | 171 Ų | 171 | 142.2 Ų | 142.2 | 80% | 0.799 | 79% | 0.789 | S | S | * | * | trans | 16.3 | 132.4 | 146.6 | -67.9 | -171.2 | 112.5 | 0 | 0 | 125.5 | ||||
| 349 | N | 30 | Very low | 34.7 | Very low | 131 Ų | 131 | 138.7 Ų | 138.7 | 70% | 0.701 | 78% | 0.782 | S | S | * | * | 68.4 | 139.6 | 123.5 | -62.7 | -31 | 0 | 0 | 0 | 125.3 | |||||
| 350 | V | 33.3 | Very low | 34.8 | Very low | 133 Ų | 133 | 146.3 Ų | 146.3 | 81% | 0.806 | 81% | 0.805 | S | S | * | * | trans | 116.5 | 93.9 | 139.6 | -167.7 | 0 | 0 | 0 | 0 | 119.6 | ||||
| 351 | S | 35 | Very low | 34.9 | Very low | 106 Ų | 106 | 147.4 Ų | 147.4 | 74% | 0.741 | 80% | 0.804 | S | S | * | * | 22.8 | 132.4 | 120.5 | -165.9 | 0 | 0 | 0 | 0 | 124.2 | |||||
| 352 | R | 36.2 | Very low | 34.9 | Very low | 225 Ų | 225 | 151.3 Ų | 151.3 | 85% | 0.849 | 81% | 0.806 | S | S | * | * | 150.1 | 156.9 | 126.3 | -91.8 | -175.9 | 166.3 | 168.3 | -3.2 | 110.6 | |||||
| 353 | R | 36.3 | Very low | 34.6 | Very low | 195 Ų | 195 | 151.2 Ų | 151.2 | 74% | 0.736 | 81% | 0.807 | S | S | * | * | cis | 173.7 | 134.6 | -27.7 | -179 | 179.3 | -176.9 | 179.4 | 4.4 | 105.4 | ||||
| 354 | N | 37.1 | Very low | 34.7 | Very low | 144 Ų | 144 | 148.5 Ų | 148.5 | 77% | 0.77 | 80% | 0.801 | S | S | * | * | trans | 63.5 | 138.1 | 154.4 | -78.9 | 6.3 | 0 | 0 | 0 | 123.2 | ||||
| 355 | G | 35.5 | Very low | 35 | Very low | 71 Ų | 71 | 145.9 Ų | 145.9 | 73% | 0.732 | 80% | 0.795 | S | S | * | * | 143.8 | 89.3 | 114 | 0 | 0 | 0 | 0 | 0 | 118.6 | |||||
| 356 | N | 34.1 | Very low | 35.4 | Very low | 152 Ų | 152 | 143.7 Ų | 143.7 | 81% | 0.813 | 79% | 0.793 | S | S | * | * | trans | 7.5 | 139.7 | 137.5 | -80 | 1.3 | 0 | 0 | 0 | 120.4 | ||||
| 357 | L | 40 | Very low | 35.8 | Very low | 139 Ų | 139 | 144.1 Ų | 144.1 | 73% | 0.728 | 79% | 0.789 | S | S | * | * | 157.4 | 124.7 | 84.4 | -145.1 | 79.9 | 0 | 0 | 0 | 112.8 | |||||
| 358 | T | 38.9 | Very low | 36.3 | Very low | 116 Ų | 116 | 149.4 Ų | 149.4 | 71% | 0.712 | 79% | 0.79 | S | S | * | * | trans | 49.8 | 136.7 | 137.5 | 58.7 | 0 | 0 | 0 | 0 | 126.3 | ||||
| 359 | A | 40.1 | Very low | 36.7 | Very low | 81 Ų | 81 | 147.6 Ų | 147.6 | 67% | 0.669 | 79% | 0.79 | S | S | * | * | trans | 74.3 | 140.8 | 130.9 | 0 | 0 | 0 | 0 | 0 | 118.5 | ||||
| 360 | F | 43.3 | Very low | 37.3 | Very low | 278 Ų | 278 | 149.1 Ų | 149.1 | 100% | 1.219 | 80% | 0.798 | S | S | * | * | cis | -135.8 | 0 | 11.4 | -101.2 | -85.6 | 0 | 0 | 0 | 110.1 |
Retrieved 360 of 360 residues in 400.7 ms
(Link to these results)