| 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 | 59.2 | Low | 82.2 | Confident | 87 Ų | 87 | 78.8 Ų | 78.8 | 43% | 0.429 | 41% | 0.41 | S | S | . | . | 0 | -63.9 | 0 | -148.6 | 175.6 | 88.7 | 0 | 0 | 111.8 | V3 Q4 V5 Y54 F58 | M1-V3 VanDerWaalsContact C-N 3.33Å; M1-V3 PolarHBondContact O-N 3.29Å; M1-Q4 PolarHBondContact O-N 3.23Å; M1-V5 PolarHBondContact O-N 3.43Å; M1-Y54 WeakPolarHBondContact CE-OH 3.31Å; M1-F58 HydrophobicContact CE-CD2 3.77Å; M1-F58 HydrophobicContact CE-CE2 3.16Å; M1-F58 HydrophobicContact CE-CZ 3.72Å | |||
| 2 | F | 71.1 | Confident | 83.1 | Confident | 95 Ų | 95 | 78.8 Ų | 78.8 | 42% | 0.417 | 41% | 0.41 | S | S | . | . | H | α-helix | trans | -62.8 | -32.3 | -178.6 | -62.8 | -71.8 | 0 | 0 | 0 | 114.9 | V5 K6 Y54 F55 F58 F69 | F2-V5 PolarHBondContact O-N 3.36Å; F2-K6 WeakPolarHBondContact O-CB 3.26Å; F2-K6 PolarHBondContact O-N 3.23Å; F2-Y54 HydrophobicContact CD1-CE1 4.23Å; F2-Y54 HydrophobicContact CE1-CE1 4.06Å; F2-F55 HydrophobicContact CE1-CE1 4.16Å; F2-F55 HydrophobicContact CE1-CZ 4.41Å; F2-F58 HydrophobicContact CZ-CE1 4.21Å; F2-F58 HydrophobicContact CZ-CZ 4.38Å; F2-F69 HydrophobicContact CE2-CE2 4.43Å; F2-F69 AromaticContact CZ-CE2 3.91Å; F2-F69 HydrophobicContact CZ-CE2 3.91Å; F2-F69 HydrophobicContact CZ-CZ 4.22Å |
| 3 | V | 77.6 | Confident | 83.9 | Confident | 112 Ų | 112 | 72.7 Ų | 72.7 | 68% | 0.679 | 38% | 0.378 | S | S | * | . | H | α-helix | trans | -64.5 | -40.6 | 175.3 | -179 | 0 | 0 | 0 | 0 | 112 | M1 K6 V7 | M1-V3 VanDerWaalsContact C-N 3.33Å; M1-V3 PolarHBondContact O-N 3.29Å; V3-K6 PolarHBondContact O-N 3.3Å; V3-V7 VanDerWaalsContact O-CG2 3.3Å; V3-V7 WeakPolarHBondContact O-CG2 3.5Å; V3-V7 PolarHBondContact O-N 3.44Å |
| 4 | Q | 79.8 | Confident | 84.5 | Confident | 137 Ų | 137 | 73.3 Ų | 73.3 | 64% | 0.64 | 38% | 0.38 | S | S | * | . | H | α-helix | trans | -66.5 | -40.7 | 178.2 | -73.5 | 172 | -33.1 | 0 | 0 | 111.4 | M1 V7 I8 | M1-Q4 PolarHBondContact O-N 3.23Å; Q4-V7 PolarHBondContact O-N 3.06Å; Q4-I8 VanDerWaalsContact O-CG1 3.29Å; Q4-I8 WeakPolarHBondContact O-CG1 3.23Å; Q4-I8 PolarHBondContact O-N 3.14Å |
| 5 | V | 84.2 | Confident | 85.2 | Confident | 27 Ų | 27 | 75.4 Ų | 75.4 | 16% | 0.164 | 39% | 0.39 | C | S | . | . | H | α-helix | trans | -63.6 | -44.4 | 176.5 | 175.9 | 0 | 0 | 0 | 0 | 110.8 | M1 F2 V7 I8 A9 Y54 | M1-V5 PolarHBondContact O-N 3.43Å; F2-V5 PolarHBondContact O-N 3.36Å; V5-V7 PolarHBondContact O-N 3.31Å; V5-I8 PolarHBondContact O-N 2.8Å; V5-A9 VanDerWaalsContact O-CB 3.3Å; V5-A9 WeakPolarHBondContact O-CB 3.17Å; V5-A9 PolarHBondContact O-N 3.19Å; V5-Y54 HydrophobicContact CB-CD2 4.48Å; V5-Y54 HydrophobicContact CB-CE2 4.28Å; V5-Y54 HydrophobicContact CG1-CD1 3.98Å; V5-Y54 HydrophobicContact CG1-CD2 3.71Å; V5-Y54 HydrophobicContact CG1-CE1 4.23Å; V5-Y54 HydrophobicContact CG1-CE2 3.97Å; V5-Y54 HydrophobicContact CG1-CG 3.71Å; V5-Y54 HydrophobicContact CG2-CD2 3.89Å; V5-Y54 HydrophobicContact CG2-CE1 4.34Å; V5-Y54 HydrophobicContact CG2-CE2 3.33Å |
| 6 | K | 85.6 | Confident | 85.7 | Confident | 100 Ų | 100 | 72 Ų | 72 | 44% | 0.435 | 38% | 0.377 | S | S | . | . | H | α-helix | trans | -55.2 | -51.5 | 174.2 | 174.2 | 177.9 | -179.6 | -173.6 | 0 | 111.1 | F2 V3 I8 A9 E10 Y51 | F2-K6 WeakPolarHBondContact O-CB 3.26Å; F2-K6 PolarHBondContact O-N 3.23Å; V3-K6 PolarHBondContact O-N 3.3Å; K6-I8 VanDerWaalsContact C-N 3.35Å; K6-I8 PolarHBondContact O-N 3.27Å; K6-A9 PolarHBondContact O-N 2.99Å; K6-E10 VanDerWaalsContact CE-CD 3.49Å; K6-E10 WeakPolarHBondContact CE-OE1 3.17Å; K6-E10 HydrophobicContact CG-CG 4.33Å; K6-E10 IonicContact NZ-OE1 2.71Å; K6-E10 WeakPolarHBondContact O-CB 3.09Å; K6-E10 WeakPolarHBondContact O-CG 3.29Å; K6-E10 PolarHBondContact O-N 3.35Å; K6-Y51 WeakPolarHBondContact CA-OH 3.25Å; K6-Y51 WeakPolarHBondContact CB-OH 3.3Å; K6-Y51 WeakPolarHBondContact CG-OH 3.42Å |
| 7 | V | 87.2 | Confident | 86.3 | Confident | 76 Ų | 76 | 70.9 Ų | 70.9 | 46% | 0.461 | 37% | 0.369 | S | S | . | . | H | α-helix | trans | -59.8 | -44.6 | -179.4 | 171.9 | 0 | 0 | 0 | 0 | 111.3 | V3 Q4 V5 S11 | V3-V7 VanDerWaalsContact O-CG2 3.3Å; V3-V7 WeakPolarHBondContact O-CG2 3.5Å; V3-V7 PolarHBondContact O-N 3.44Å; Q4-V7 PolarHBondContact O-N 3.06Å; V5-V7 PolarHBondContact O-N 3.31Å; V7-S11 VanDerWaalsContact O-CB 3.25Å; V7-S11 WeakPolarHBondContact O-CB 3.43Å; V7-S11 PolarHBondContact O-N 3.01Å; V7-S11 PolarHBondContact O-OG 2.99Å |
| 8 | I | 89.1 | Confident | 86.7 | Confident | 104 Ų | 104 | 70.7 Ų | 70.7 | 53% | 0.533 | 37% | 0.373 | S | S | . | . | H | α-helix | trans | -65.3 | -47.1 | 178.9 | -66.4 | 165.5 | 0 | 0 | 0 | 111.1 | Q4 V5 K6 S11 L12 | Q4-I8 VanDerWaalsContact O-CG1 3.29Å; Q4-I8 WeakPolarHBondContact O-CG1 3.23Å; Q4-I8 PolarHBondContact O-N 3.14Å; V5-I8 PolarHBondContact O-N 2.8Å; K6-I8 VanDerWaalsContact C-N 3.35Å; K6-I8 PolarHBondContact O-N 3.27Å; I8-S11 PolarHBondContact O-N 3.4Å; I8-L12 HydrophobicContact CG2-CD1 3.92Å; I8-L12 HydrophobicContact CG2-CG 4.42Å; I8-L12 WeakPolarHBondContact O-CG 3.42Å; I8-L12 PolarHBondContact O-N 2.88Å |
| 9 | A | 90.4 | Very high | 87 | Confident | 4 Ų | 4 | 70.3 Ų | 70.3 | 3% | 0.033 | 38% | 0.377 | C | S | . | . | H | α-helix | trans | -63.8 | -45.4 | -179 | 0 | 0 | 0 | 0 | 0 | 111.9 | V5 K6 L12 A13 L47 C50 | V5-A9 VanDerWaalsContact O-CB 3.3Å; V5-A9 WeakPolarHBondContact O-CB 3.17Å; V5-A9 PolarHBondContact O-N 3.19Å; K6-A9 PolarHBondContact O-N 2.99Å; A9-L12 PolarHBondContact O-N 3.34Å; A9-A13 VanDerWaalsContact O-CB 3.29Å; A9-A13 WeakPolarHBondContact O-CB 3.32Å; A9-A13 PolarHBondContact O-N 3.11Å; A9-L47 HydrophobicContact CB-CD1 4.14Å; A9-C50 HydrophobicContact CB-CB 3.75Å |
| 10 | E | 90.6 | Very high | 87.4 | Confident | 66 Ų | 66 | 69.3 Ų | 69.3 | 31% | 0.308 | 37% | 0.373 | S | S | . | . | H | α-helix | trans | -62.8 | -41.9 | 175.4 | -74.1 | 178.7 | 170.6 | 0 | 0 | 111.4 | K6 A13 M14 L47 | K6-E10 VanDerWaalsContact CE-CD 3.49Å; K6-E10 WeakPolarHBondContact CE-OE1 3.17Å; K6-E10 HydrophobicContact CG-CG 4.33Å; K6-E10 IonicContact NZ-OE1 2.71Å; K6-E10 WeakPolarHBondContact O-CB 3.09Å; K6-E10 WeakPolarHBondContact O-CG 3.29Å; K6-E10 PolarHBondContact O-N 3.35Å; E10-A13 PolarHBondContact O-N 3.41Å; E10-M14 WeakPolarHBondContact O-CB 3.43Å; E10-M14 VanDerWaalsContact O-CG 3.32Å; E10-M14 WeakPolarHBondContact O-CG 3.35Å; E10-M14 PolarHBondContact O-N 3.48Å; E10-L47 HydrophobicContact CG-CD1 3.96Å |
| 11 | S | 89.8 | Confident | 87.7 | Confident | 59 Ų | 59 | 67 Ų | 67 | 41% | 0.413 | 36% | 0.361 | S | S | . | . | H | α-helix | trans | -62.9 | -47.2 | 178 | -60 | 0 | 0 | 0 | 0 | 111.8 | V7 I8 M14 I15 | V7-S11 VanDerWaalsContact O-CB 3.25Å; V7-S11 WeakPolarHBondContact O-CB 3.43Å; V7-S11 PolarHBondContact O-N 3.01Å; V7-S11 PolarHBondContact O-OG 2.99Å; I8-S11 PolarHBondContact O-N 3.4Å; S11-M14 PolarHBondContact O-N 3.42Å; S11-I15 VanDerWaalsContact O-CG1 3.27Å; S11-I15 WeakPolarHBondContact O-CG1 3.37Å; S11-I15 PolarHBondContact O-N 3.3Å |
| 12 | L | 92.4 | Very high | 89.3 | Confident | 78 Ų | 78 | 67.2 Ų | 67.2 | 41% | 0.408 | 37% | 0.368 | S | S | . | . | H | α-helix | trans | -65 | -42.7 | 178.6 | -69.3 | 171.2 | 0 | 0 | 0 | 111.9 | I8 A9 M14 I15 A16 F46 | I8-L12 HydrophobicContact CG2-CD1 3.92Å; I8-L12 HydrophobicContact CG2-CG 4.42Å; I8-L12 WeakPolarHBondContact O-CG 3.42Å; I8-L12 PolarHBondContact O-N 2.88Å; A9-L12 PolarHBondContact O-N 3.34Å; L12-M14 VanDerWaalsContact C-N 3.33Å; L12-M14 PolarHBondContact O-N 3.18Å; L12-I15 PolarHBondContact O-N 2.86Å; L12-A16 WeakPolarHBondContact O-CB 3.34Å; L12-A16 PolarHBondContact O-N 3.29Å; L12-F46 HydrophobicContact CB-CD1 4.23Å; L12-F46 HydrophobicContact CB-CE1 3.6Å; L12-F46 HydrophobicContact CB-CZ 4.48Å; L12-F46 HydrophobicContact CD1-CE1 4.47Å |
| 13 | A | 93.7 | Very high | 90.4 | Very high | 0 Ų | 0 | 66.4 Ų | 66.4 | 0% | 0 | 37% | 0.37 | C | S | . | . | H | α-helix | trans | -62.6 | -40.5 | 176.3 | 0 | 0 | 0 | 0 | 0 | 111.7 | A9 E10 A16 K17 Y43 F46 L47 | A9-A13 VanDerWaalsContact O-CB 3.29Å; A9-A13 WeakPolarHBondContact O-CB 3.32Å; A9-A13 PolarHBondContact O-N 3.11Å; E10-A13 PolarHBondContact O-N 3.41Å; A13-A16 PolarHBondContact O-N 3.48Å; A13-K17 WeakPolarHBondContact O-CB 3.3Å; A13-K17 PolarHBondContact O-N 2.83Å; A13-Y43 HydrophobicContact CB-CD2 3.61Å; A13-Y43 HydrophobicContact CB-CE2 3.64Å; A13-Y43 HydrophobicContact CB-CG 4.41Å; A13-F46 HydrophobicContact CB-CB 4.23Å; A13-F46 HydrophobicContact CB-CD1 4.19Å; A13-L47 HydrophobicContact CB-CB 4.14Å; A13-L47 HydrophobicContact CB-CD1 4.35Å |
| 14 | M | 92.6 | Very high | 91.1 | Very high | 81 Ų | 81 | 63 Ų | 63 | 40% | 0.399 | 35% | 0.348 | S | S | . | . | H | α-helix | trans | -64.3 | -44.2 | 174.6 | -79.2 | -56.3 | -65.9 | 0 | 0 | 112.2 | E10 S11 L12 A16 K17 C18 Y43 | E10-M14 WeakPolarHBondContact O-CB 3.43Å; E10-M14 VanDerWaalsContact O-CG 3.32Å; E10-M14 WeakPolarHBondContact O-CG 3.35Å; E10-M14 PolarHBondContact O-N 3.48Å; S11-M14 PolarHBondContact O-N 3.42Å; L12-M14 VanDerWaalsContact C-N 3.33Å; L12-M14 PolarHBondContact O-N 3.18Å; M14-A16 VanDerWaalsContact C-N 3.32Å; M14-A16 PolarHBondContact O-N 3.22Å; M14-K17 PolarHBondContact O-N 2.9Å; M14-K17 HydrophobicContact SD-CD 4.41Å; M14-C18 WeakPolarHBondContact O-CB 3.3Å; M14-C18 PolarHBondContact O-N 3.41Å; M14-C18 PolarHBondContact O-SG 3.31Å; M14-C18 VanDerWaalsContact O-SG 3.35Å; M14-Y43 HydrophobicContact CG-CD2 4.31Å; M14-Y43 HydrophobicContact CG-CE2 3.77Å; M14-Y43 HydrophobicContact SD-CD2 3.8Å; M14-Y43 HydrophobicContact SD-CE2 3.55Å; M14-Y43 VanDerWaalsContact SD-CE2 3.55Å |
| 15 | I | 94.8 | Very high | 91.7 | Very high | 105 Ų | 105 | 59.7 Ų | 59.7 | 54% | 0.538 | 34% | 0.337 | S | S | . | . | H | α-helix | trans | -59.9 | -45.1 | 176.3 | -69.6 | 164.3 | 0 | 0 | 0 | 110.3 | S11 L12 C18 S19 | S11-I15 VanDerWaalsContact O-CG1 3.27Å; S11-I15 WeakPolarHBondContact O-CG1 3.37Å; S11-I15 PolarHBondContact O-N 3.3Å; L12-I15 PolarHBondContact O-N 2.86Å; I15-C18 PolarHBondContact O-N 3.37Å; I15-S19 WeakPolarHBondContact O-CB 3.43Å; I15-S19 PolarHBondContact O-N 3.19Å; I15-S19 PolarHBondContact O-OG 3.39Å |
| 16 | A | 93.6 | Very high | 92.1 | Very high | 21 Ų | 21 | 63.1 Ų | 63.1 | 17% | 0.174 | 36% | 0.358 | C | S | . | . | H | α-helix | trans | -61.5 | -47.4 | 177.9 | 0 | 0 | 0 | 0 | 0 | 111.7 | L12 A13 M14 S19 V20 V42 F46 | L12-A16 WeakPolarHBondContact O-CB 3.34Å; L12-A16 PolarHBondContact O-N 3.29Å; A13-A16 PolarHBondContact O-N 3.48Å; M14-A16 VanDerWaalsContact C-N 3.32Å; M14-A16 PolarHBondContact O-N 3.22Å; A16-S19 PolarHBondContact O-N 3.28Å; A16-V20 WeakPolarHBondContact O-CG2 3.35Å; A16-V20 PolarHBondContact O-N 2.95Å; A16-V42 HydrophobicContact CB-CG1 4.02Å; A16-F46 HydrophobicContact CB-CD2 4.28Å; A16-F46 HydrophobicContact CB-CG 4.36Å |
| 17 | K | 95.3 | Very high | 92.4 | Very high | 54 Ų | 54 | 66.3 Ų | 66.3 | 24% | 0.235 | 37% | 0.372 | C | S | . | . | H | α-helix | trans | -54.8 | -55.8 | 174.2 | 173 | 176.2 | 172.8 | 175.3 | 0 | 111.6 | A13 M14 S19 V20 T21 G39 Y43 | A13-K17 WeakPolarHBondContact O-CB 3.3Å; A13-K17 PolarHBondContact O-N 2.83Å; M14-K17 PolarHBondContact O-N 2.9Å; M14-K17 HydrophobicContact SD-CD 4.41Å; K17-S19 VanDerWaalsContact C-N 3.31Å; K17-S19 PolarHBondContact O-N 3.49Å; K17-V20 PolarHBondContact O-N 3.46Å; K17-T21 WeakPolarHBondContact O-CB 3.45Å; K17-T21 PolarHBondContact O-N 3.33Å; K17-T21 PolarHBondContact O-OG1 2.87Å; K17-G39 WeakPolarHBondContact CG-O 3.3Å; K17-Y43 HydrophobicContact CB-CD2 4.43Å; K17-Y43 HydrophobicContact CD-CD2 4.37Å; K17-Y43 HydrophobicContact CD-CG 4.32Å |
| 18 | C | 93.2 | Very high | 92.6 | Very high | 66 Ų | 66 | 63.7 Ų | 63.7 | 45% | 0.446 | 36% | 0.358 | S | S | . | . | H | α-helix | trans | -60 | -42.9 | -177.4 | -71.5 | 0 | 0 | 0 | 0 | 111.5 | M14 I15 T21 V22 | M14-C18 WeakPolarHBondContact O-CB 3.3Å; M14-C18 PolarHBondContact O-N 3.41Å; M14-C18 PolarHBondContact O-SG 3.31Å; M14-C18 VanDerWaalsContact O-SG 3.35Å; I15-C18 PolarHBondContact O-N 3.37Å; C18-T21 PolarHBondContact O-N 2.99Å; C18-V22 WeakPolarHBondContact O-CB 3.46Å; C18-V22 VanDerWaalsContact O-CG2 3.26Å; C18-V22 WeakPolarHBondContact O-CG2 3.22Å; C18-V22 PolarHBondContact O-N 3.41Å |
| 19 | S | 93.8 | Very high | 92.4 | Very high | 64 Ų | 64 | 62.7 Ų | 62.7 | 45% | 0.448 | 36% | 0.359 | S | S | . | . | H | α-helix | trans | -61.6 | -48.4 | 178.9 | -55.9 | 0 | 0 | 0 | 0 | 111.4 | I15 A16 K17 V22 V23 | I15-S19 WeakPolarHBondContact O-CB 3.43Å; I15-S19 PolarHBondContact O-N 3.19Å; I15-S19 PolarHBondContact O-OG 3.39Å; A16-S19 PolarHBondContact O-N 3.28Å; K17-S19 VanDerWaalsContact C-N 3.31Å; K17-S19 PolarHBondContact O-N 3.49Å; S19-V22 PolarHBondContact O-N 3.22Å; S19-V23 WeakPolarHBondContact O-CB 3.44Å; S19-V23 VanDerWaalsContact O-CG2 3.26Å; S19-V23 WeakPolarHBondContact O-CG2 3.34Å; S19-V23 PolarHBondContact O-N 3.47Å |
| 20 | V | 94 | Very high | 92.3 | Very high | 50 Ų | 50 | 69.8 Ų | 69.8 | 30% | 0.303 | 40% | 0.396 | S | S | . | . | H | α-helix | trans | -64.6 | -43.8 | 178.2 | 171.4 | 0 | 0 | 0 | 0 | 111.3 | A16 K17 V22 V23 L24 V42 | A16-V20 WeakPolarHBondContact O-CG2 3.35Å; A16-V20 PolarHBondContact O-N 2.95Å; K17-V20 PolarHBondContact O-N 3.46Å; V20-V22 PolarHBondContact O-N 3.33Å; V20-V23 PolarHBondContact O-N 3.02Å; V20-L24 HydrophobicContact CG1-CD1 3.67Å; V20-L24 HydrophobicContact CG1-CG 4.17Å; V20-L24 WeakPolarHBondContact O-CB 3.48Å; V20-L24 VanDerWaalsContact O-CG 3.3Å; V20-L24 WeakPolarHBondContact O-CG 3.45Å; V20-L24 PolarHBondContact O-N 2.95Å; V20-V42 HydrophobicContact CG1-CG2 4.28Å; V20-V42 HydrophobicContact CG2-CG1 4.19Å; V20-V42 HydrophobicContact CG2-CG2 4.32Å |
| 21 | T | 93 | Very high | 92.1 | Very high | 21 Ų | 21 | 74 Ų | 74 | 13% | 0.129 | 41% | 0.409 | C | S | . | . | H | α-helix | trans | -59.8 | -46.4 | 177 | -63.4 | 0 | 0 | 0 | 0 | 111.2 | K17 C18 L24 V25 I35 | K17-T21 WeakPolarHBondContact O-CB 3.45Å; K17-T21 PolarHBondContact O-N 3.33Å; K17-T21 PolarHBondContact O-OG1 2.87Å; C18-T21 PolarHBondContact O-N 2.99Å; T21-L24 PolarHBondContact O-N 3.33Å; T21-V25 HydrophobicContact CG2-CG2 4.32Å; T21-V25 WeakPolarHBondContact O-CB 3.49Å; T21-V25 VanDerWaalsContact O-CG2 3.23Å; T21-V25 WeakPolarHBondContact O-CG2 3.36Å; T21-V25 PolarHBondContact O-N 3.4Å; T21-I35 HydrophobicContact CG2-CG2 4.21Å |
| 22 | V | 93.2 | Very high | 91.8 | Very high | 92 Ų | 92 | 72.9 Ų | 72.9 | 56% | 0.558 | 41% | 0.407 | S | S | * | . | H | α-helix | trans | -62.3 | -47.1 | 178.6 | 169.4 | 0 | 0 | 0 | 0 | 111.2 | C18 S19 V20 L24 V25 V26 | C18-V22 WeakPolarHBondContact O-CB 3.46Å; C18-V22 VanDerWaalsContact O-CG2 3.26Å; C18-V22 WeakPolarHBondContact O-CG2 3.22Å; C18-V22 PolarHBondContact O-N 3.41Å; S19-V22 PolarHBondContact O-N 3.22Å; V20-V22 PolarHBondContact O-N 3.33Å; V22-L24 PolarHBondContact O-N 2.95Å; V22-V25 PolarHBondContact O-N 2.96Å; V22-V26 VanDerWaalsContact O-CG2 3.31Å; V22-V26 WeakPolarHBondContact O-CG2 3.49Å; V22-V26 PolarHBondContact O-N 2.88Å |
| 23 | V | 93.9 | Very high | 91.4 | Very high | 77 Ų | 77 | 76 Ų | 76 | 47% | 0.467 | 42% | 0.423 | S | S | . | . | H | α-helix | trans | -58.6 | -49.8 | 178 | 169.6 | 0 | 0 | 0 | 0 | 110.4 | S19 V20 V25 V26 F27 | S19-V23 WeakPolarHBondContact O-CB 3.44Å; S19-V23 VanDerWaalsContact O-CG2 3.26Å; S19-V23 WeakPolarHBondContact O-CG2 3.34Å; S19-V23 PolarHBondContact O-N 3.47Å; V20-V23 PolarHBondContact O-N 3.02Å; V23-V25 PolarHBondContact O-N 3.19Å; V23-V26 PolarHBondContact O-N 3.4Å; V23-F27 HydrophobicContact CG1-CD2 3.71Å; V23-F27 HydrophobicContact CG1-CE2 4.06Å; V23-F27 WeakPolarHBondContact O-CD2 3.35Å; V23-F27 PolarHBondContact O-N 3.48Å |
| 24 | L | 93.3 | Very high | 91.3 | Very high | 41 Ų | 41 | 84.3 Ų | 84.3 | 22% | 0.215 | 46% | 0.456 | C | S | . | . | H | α-helix | trans | -65.6 | -36.8 | -179.1 | -71.8 | 177 | 0 | 0 | 0 | 112.9 | V20 T21 V22 V26 A28 I35 A38 | V20-L24 HydrophobicContact CG1-CD1 3.67Å; V20-L24 HydrophobicContact CG1-CG 4.17Å; V20-L24 WeakPolarHBondContact O-CB 3.48Å; V20-L24 VanDerWaalsContact O-CG 3.3Å; V20-L24 WeakPolarHBondContact O-CG 3.45Å; V20-L24 PolarHBondContact O-N 2.95Å; T21-L24 PolarHBondContact O-N 3.33Å; V22-L24 PolarHBondContact O-N 2.95Å; L24-V26 VanDerWaalsContact C-N 3.33Å; L24-A28 CarbonylContact O-C 3.33Å; L24-A28 WeakPolarHBondContact O-CA 3.24Å; L24-A28 PolarHBondContact O-N 2.89Å; L24-I35 HydrophobicContact CB-CB 4.27Å; L24-I35 HydrophobicContact CB-CG1 4.09Å; L24-I35 HydrophobicContact CB-CG2 3.44Å; L24-I35 VanDerWaalsContact CB-CG2 3.44Å; L24-I35 HydrophobicContact CD1-CG2 4.12Å; L24-I35 HydrophobicContact CG-CG2 4.45Å; L24-A38 HydrophobicContact CD1-CB 3.94Å |
| 25 | V | 92.3 | Very high | 91.2 | Very high | 68 Ų | 68 | 80.7 Ų | 80.7 | 41% | 0.412 | 44% | 0.438 | S | S | . | . | H | α-helix | trans | -63.7 | -39.3 | 174.5 | 167.8 | 0 | 0 | 0 | 0 | 111.4 | T21 V22 V23 I35 | T21-V25 HydrophobicContact CG2-CG2 4.32Å; T21-V25 WeakPolarHBondContact O-CB 3.49Å; T21-V25 VanDerWaalsContact O-CG2 3.23Å; T21-V25 WeakPolarHBondContact O-CG2 3.36Å; T21-V25 PolarHBondContact O-N 3.4Å; V22-V25 PolarHBondContact O-N 2.96Å; V23-V25 PolarHBondContact O-N 3.19Å; V25-I35 HydrophobicContact CG2-CD1 4.11Å; V25-I35 HydrophobicContact CG2-CG2 3.91Å |
| 26 | V | 91.8 | Very high | 90.9 | Very high | 99 Ų | 99 | 82 Ų | 82 | 60% | 0.6 | 44% | 0.44 | S | S | * | . | H | α-helix | trans | -73.6 | -41.2 | -179.4 | 172 | 0 | 0 | 0 | 0 | 112 | V22 V23 L24 | V22-V26 VanDerWaalsContact O-CG2 3.31Å; V22-V26 WeakPolarHBondContact O-CG2 3.49Å; V22-V26 PolarHBondContact O-N 2.88Å; V23-V26 PolarHBondContact O-N 3.4Å; L24-V26 VanDerWaalsContact C-N 3.33Å |
| 27 | F | 92.4 | Very high | 90.8 | Very high | 167 Ų | 167 | 84 Ų | 84 | 73% | 0.732 | 45% | 0.453 | S | S | * | . | H | α-helix | trans | -95.9 | -23.6 | -172.3 | -69.8 | -70.7 | 0 | 0 | 0 | 114.9 | V23 | V23-F27 HydrophobicContact CG1-CD2 3.71Å; V23-F27 HydrophobicContact CG1-CE2 4.06Å; V23-F27 WeakPolarHBondContact O-CD2 3.35Å; V23-F27 PolarHBondContact O-N 3.48Å |
| 28 | A | 91.3 | Very high | 90.7 | Very high | 21 Ų | 21 | 83.1 Ų | 83.1 | 17% | 0.174 | 46% | 0.455 | C | S | . | . | trans | -138.8 | 58.9 | -177.8 | 0 | 0 | 0 | 0 | 0 | 111.3 | L24 D30 W31 I35 | L24-A28 CarbonylContact O-C 3.33Å; L24-A28 WeakPolarHBondContact O-CA 3.24Å; L24-A28 PolarHBondContact O-N 2.89Å; A28-D30 PolarHBondContact O-N 2.89Å; A28-D30 VanDerWaalsContact O-N 3.12Å; A28-W31 HydrophobicContact CB-CD2 4.26Å; A28-W31 HydrophobicContact CB-CG 4.1Å; A28-W31 WeakPolarHBondContact O-CB 3.35Å; A28-W31 PolarHBondContact O-N 3.28Å; A28-W31 VanDerWaalsContact O-N 3.08Å; A28-I35 WeakPolarHBondContact O-CD1 3.44Å | ||
| 29 | P | 84.3 | Confident | 90.8 | Very high | 83 Ų | 83 | 80 Ų | 80 | 54% | 0.539 | 43% | 0.434 | S | S | . | . | G | 310 helix | trans | -58.5 | -29.7 | -174.3 | 24.1 | -34.4 | 0 | 0 | 0 | 113.3 | W31 G32 | P29-W31 PolarHBondContact O-N 3.25Å; P29-W31 VanDerWaalsContact O-N 3.14Å; P29-G32 PolarHBondContact O-N 2.97Å |
| 30 | D | 88.9 | Confident | 90.8 | Very high | 153 Ų | 153 | 81 Ų | 81 | 82% | 0.818 | 43% | 0.432 | S | S | * | . | G | 310 helix | trans | -65.6 | -16.2 | -179.5 | -54.8 | -47.8 | 0 | 0 | 0 | 113.7 | A28 G32 | A28-D30 PolarHBondContact O-N 2.89Å; A28-D30 VanDerWaalsContact O-N 3.12Å; D30-G32 VanDerWaalsContact C-N 3.26Å; D30-G32 PolarHBondContact O-N 3.15Å |
| 31 | W | 86.5 | Confident | 90.8 | Very high | 154 Ų | 154 | 84.8 Ų | 84.8 | 58% | 0.583 | 45% | 0.45 | S | S | * | . | G | 310 helix | trans | -77.6 | -11.9 | -178.5 | -74 | 27.1 | 0 | 0 | 0 | 112.9 | A28 P29 L33 Y34 I35 | A28-W31 HydrophobicContact CB-CD2 4.26Å; A28-W31 HydrophobicContact CB-CG 4.1Å; A28-W31 WeakPolarHBondContact O-CB 3.35Å; A28-W31 PolarHBondContact O-N 3.28Å; A28-W31 VanDerWaalsContact O-N 3.08Å; P29-W31 PolarHBondContact O-N 3.25Å; P29-W31 VanDerWaalsContact O-N 3.14Å; W31-L33 PolarHBondContact O-N 3.45Å; W31-Y34 WeakPolarHBondContact O-CB 3.27Å; W31-Y34 WeakPolarHBondContact O-CD2 3.31Å; W31-Y34 PolarHBondContact O-N 3.39Å; W31-I35 HydrophobicContact CB-CD1 4.09Å; W31-I35 HydrophobicContact CB-CG1 3.68Å |
| 32 | G | 83.1 | Confident | 90.9 | Very high | 35 Ų | 35 | 86.2 Ų | 86.2 | 36% | 0.361 | 46% | 0.458 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 41.3 | -107.9 | 170.1 | 0 | 0 | 0 | 0 | 0 | 114.4 | P29 D30 Y34 I35 | P29-G32 PolarHBondContact O-N 2.97Å; D30-G32 VanDerWaalsContact C-N 3.26Å; D30-G32 PolarHBondContact O-N 3.15Å; G32-Y34 VanDerWaalsContact C-N 3.33Å; G32-Y34 PolarHBondContact O-N 3.34Å; G32-I35 WeakPolarHBondContact O-CB 3.4Å; G32-I35 PolarHBondContact O-N 3.36Å |
| 33 | L | 84.6 | Confident | 91.1 | Very high | 145 Ų | 145 | 83.8 Ų | 83.8 | 76% | 0.759 | 44% | 0.439 | S | S | * | . | H | α-helix | trans | -62.5 | -30 | -179.6 | -81.2 | 149.8 | 0 | 0 | 0 | 114.8 | W31 I35 F36 S37 | W31-L33 PolarHBondContact O-N 3.45Å; L33-I35 PolarHBondContact O-N 3.43Å; L33-F36 PolarHBondContact O-N 3.42Å; L33-S37 PolarHBondContact O-N 3.35Å; L33-S37 VanDerWaalsContact O-N 3.13Å; L33-S37 PolarHBondContact O-OG 3.4Å |
| 34 | Y | 90.7 | Very high | 91.1 | Very high | 174 Ų | 174 | 83.3 Ų | 83.3 | 68% | 0.682 | 44% | 0.437 | S | S | * | . | H | α-helix | trans | -66.2 | -30.7 | 179 | -64.6 | -71.4 | 0 | 0 | 0 | 111.7 | W31 G32 S37 A38 | W31-Y34 WeakPolarHBondContact O-CB 3.27Å; W31-Y34 WeakPolarHBondContact O-CD2 3.31Å; W31-Y34 PolarHBondContact O-N 3.39Å; G32-Y34 VanDerWaalsContact C-N 3.33Å; G32-Y34 PolarHBondContact O-N 3.34Å; Y34-S37 PolarHBondContact O-N 3.38Å; Y34-A38 WeakPolarHBondContact O-CB 3.38Å; Y34-A38 PolarHBondContact O-N 2.99Å |
| 35 | I | 91.9 | Very high | 91.2 | Very high | 4 Ų | 4 | 83.3 Ų | 83.3 | 2% | 0.021 | 45% | 0.447 | C | S | . | . | H | α-helix | trans | -64 | -44.7 | 177.6 | -56.5 | 168.1 | 0 | 0 | 0 | 110.8 | T21 L24 V25 A28 W31 G32 L33 A38 G39 | T21-I35 HydrophobicContact CG2-CG2 4.21Å; L24-I35 HydrophobicContact CB-CB 4.27Å; L24-I35 HydrophobicContact CB-CG1 4.09Å; L24-I35 HydrophobicContact CB-CG2 3.44Å; L24-I35 VanDerWaalsContact CB-CG2 3.44Å; L24-I35 HydrophobicContact CD1-CG2 4.12Å; L24-I35 HydrophobicContact CG-CG2 4.45Å; V25-I35 HydrophobicContact CG2-CD1 4.11Å; V25-I35 HydrophobicContact CG2-CG2 3.91Å; A28-I35 WeakPolarHBondContact O-CD1 3.44Å; W31-I35 HydrophobicContact CB-CD1 4.09Å; W31-I35 HydrophobicContact CB-CG1 3.68Å; G32-I35 WeakPolarHBondContact O-CB 3.4Å; G32-I35 PolarHBondContact O-N 3.36Å; L33-I35 PolarHBondContact O-N 3.43Å; I35-A38 PolarHBondContact O-N 3.26Å; I35-G39 PolarHBondContact O-N 3.42Å |
| 36 | F | 87.4 | Confident | 91.2 | Very high | 132 Ų | 132 | 83.7 Ų | 83.7 | 58% | 0.579 | 44% | 0.443 | S | S | * | . | H | α-helix | trans | -65.9 | -41.7 | 177.2 | -73.4 | -81.3 | 0 | 0 | 0 | 111.6 | L33 G39 Q40 | L33-F36 PolarHBondContact O-N 3.42Å; F36-G39 PolarHBondContact O-N 3.15Å; F36-Q40 PolarHBondContact O-N 2.88Å |
| 37 | S | 92.3 | Very high | 91.2 | Very high | 65 Ų | 65 | 80.5 Ų | 80.5 | 46% | 0.455 | 42% | 0.422 | S | S | . | . | H | α-helix | trans | -59.7 | -47.1 | 174.9 | -60.6 | 0 | 0 | 0 | 0 | 111.7 | L33 Y34 G39 Q40 L41 | L33-S37 PolarHBondContact O-N 3.35Å; L33-S37 VanDerWaalsContact O-N 3.13Å; L33-S37 PolarHBondContact O-OG 3.4Å; Y34-S37 PolarHBondContact O-N 3.38Å; S37-G39 PolarHBondContact O-N 3.16Å; S37-Q40 PolarHBondContact O-N 3.15Å; S37-L41 WeakPolarHBondContact O-CG 3.45Å; S37-L41 PolarHBondContact O-N 3.36Å |
| 38 | A | 93.6 | Very high | 91.2 | Very high | 34 Ų | 34 | 76.6 Ų | 76.6 | 28% | 0.281 | 41% | 0.412 | S | S | . | . | H | α-helix | trans | -61.2 | -44.7 | 176.8 | 0 | 0 | 0 | 0 | 0 | 111.8 | L24 Y34 I35 Q40 L41 V42 | L24-A38 HydrophobicContact CD1-CB 3.94Å; Y34-A38 WeakPolarHBondContact O-CB 3.38Å; Y34-A38 PolarHBondContact O-N 2.99Å; I35-A38 PolarHBondContact O-N 3.26Å; A38-Q40 VanDerWaalsContact C-N 3.3Å; A38-Q40 PolarHBondContact O-N 3.27Å; A38-L41 PolarHBondContact O-N 3.49Å; A38-V42 WeakPolarHBondContact O-CG2 3.26Å; A38-V42 PolarHBondContact O-N 3.12Å |
| 39 | G | 93.8 | Very high | 91.2 | Very high | 0 Ų | 0 | 80.3 Ų | 80.3 | 0% | 0 | 43% | 0.429 | C | S | . | . | H | α-helix | trans | -58.9 | -39.9 | 175 | 0 | 0 | 0 | 0 | 0 | 112.8 | K17 I35 F36 S37 V42 Y43 | K17-G39 WeakPolarHBondContact CG-O 3.3Å; I35-G39 PolarHBondContact O-N 3.42Å; F36-G39 PolarHBondContact O-N 3.15Å; S37-G39 PolarHBondContact O-N 3.16Å; G39-V42 PolarHBondContact O-N 3.05Å; G39-Y43 PolarHBondContact O-N 3.26Å |
| 40 | Q | 93.8 | Very high | 91.5 | Very high | 85 Ų | 85 | 77.7 Ų | 77.7 | 40% | 0.397 | 41% | 0.412 | S | S | . | . | H | α-helix | trans | -70.5 | -35.1 | 177.9 | -166.4 | 63.1 | 20.6 | 0 | 0 | 112.9 | F36 S37 A38 T44 | F36-Q40 PolarHBondContact O-N 2.88Å; S37-Q40 PolarHBondContact O-N 3.15Å; A38-Q40 VanDerWaalsContact C-N 3.3Å; A38-Q40 PolarHBondContact O-N 3.27Å; Q40-T44 WeakPolarHBondContact O-CB 3.28Å; Q40-T44 PolarHBondContact O-N 3.29Å; Q40-T44 PolarHBondContact O-OG1 3.22Å |
| 41 | L | 95.5 | Very high | 91.4 | Very high | 131 Ų | 131 | 73.5 Ų | 73.5 | 69% | 0.686 | 39% | 0.385 | S | S | * | . | H | α-helix | trans | -65.7 | -43.1 | 172.6 | -71.8 | 174 | 0 | 0 | 0 | 111.2 | S37 A38 T44 G45 | S37-L41 WeakPolarHBondContact O-CG 3.45Å; S37-L41 PolarHBondContact O-N 3.36Å; A38-L41 PolarHBondContact O-N 3.49Å; L41-T44 PolarHBondContact O-N 3.2Å; L41-G45 PolarHBondContact O-N 3.06Å |
| 42 | V | 95.3 | Very high | 91.4 | Very high | 50 Ų | 50 | 69.3 Ų | 69.3 | 30% | 0.303 | 38% | 0.376 | S | S | . | . | H | α-helix | trans | -60.9 | -47.9 | 175.5 | 169.6 | 0 | 0 | 0 | 0 | 110.8 | A16 V20 A38 G39 T44 G45 F46 | A16-V42 HydrophobicContact CB-CG1 4.02Å; V20-V42 HydrophobicContact CG1-CG2 4.28Å; V20-V42 HydrophobicContact CG2-CG1 4.19Å; V20-V42 HydrophobicContact CG2-CG2 4.32Å; A38-V42 WeakPolarHBondContact O-CG2 3.26Å; A38-V42 PolarHBondContact O-N 3.12Å; G39-V42 PolarHBondContact O-N 3.05Å; V42-T44 PolarHBondContact O-N 3.37Å; V42-G45 PolarHBondContact O-N 2.87Å; V42-F46 VanDerWaalsContact O-CB 3.24Å; V42-F46 WeakPolarHBondContact O-CB 3.27Å; V42-F46 PolarHBondContact O-N 3.2Å |
| 43 | Y | 95.7 | Very high | 91.6 | Very high | 41 Ų | 41 | 70.5 Ų | 70.5 | 16% | 0.161 | 38% | 0.376 | C | S | . | . | H | α-helix | trans | -52.4 | -54.6 | 174.8 | 177.5 | -100 | 0 | 0 | 0 | 111.8 | A13 M14 K17 G39 F46 L47 | A13-Y43 HydrophobicContact CB-CD2 3.61Å; A13-Y43 HydrophobicContact CB-CE2 3.64Å; A13-Y43 HydrophobicContact CB-CG 4.41Å; M14-Y43 HydrophobicContact CG-CD2 4.31Å; M14-Y43 HydrophobicContact CG-CE2 3.77Å; M14-Y43 HydrophobicContact SD-CD2 3.8Å; M14-Y43 HydrophobicContact SD-CE2 3.55Å; M14-Y43 VanDerWaalsContact SD-CE2 3.55Å; K17-Y43 HydrophobicContact CB-CD2 4.43Å; K17-Y43 HydrophobicContact CD-CD2 4.37Å; K17-Y43 HydrophobicContact CD-CG 4.32Å; G39-Y43 PolarHBondContact O-N 3.26Å; Y43-F46 PolarHBondContact O-N 2.65Å; Y43-L47 HydrophobicContact CE1-CD2 4.13Å; Y43-L47 VanDerWaalsContact O-CB 3.31Å; Y43-L47 WeakPolarHBondContact O-CB 3.25Å; Y43-L47 PolarHBondContact O-N 3.35Å |
| 44 | T | 94.6 | Very high | 91.7 | Very high | 67 Ų | 67 | 66 Ų | 66 | 41% | 0.411 | 35% | 0.35 | S | S | . | . | H | α-helix | trans | -65.4 | -44.7 | -174.5 | -52.4 | 0 | 0 | 0 | 0 | 110.9 | Q40 L41 V42 L47 V48 | Q40-T44 WeakPolarHBondContact O-CB 3.28Å; Q40-T44 PolarHBondContact O-N 3.29Å; Q40-T44 PolarHBondContact O-OG1 3.22Å; L41-T44 PolarHBondContact O-N 3.2Å; V42-T44 PolarHBondContact O-N 3.37Å; T44-L47 PolarHBondContact O-N 2.67Å; T44-V48 VanDerWaalsContact O-CG2 3.3Å; T44-V48 WeakPolarHBondContact O-CG2 3.27Å; T44-V48 PolarHBondContact O-N 2.95Å |
| 45 | G | 94.8 | Very high | 91.4 | Very high | 42 Ų | 42 | 59.6 Ų | 59.6 | 43% | 0.433 | 33% | 0.326 | S | S | . | . | H | α-helix | trans | -62.1 | -44.6 | 177.2 | 0 | 0 | 0 | 0 | 0 | 112.4 | L41 V42 V48 L49 | L41-G45 PolarHBondContact O-N 3.06Å; V42-G45 PolarHBondContact O-N 2.87Å; G45-V48 PolarHBondContact O-N 3.21Å; G45-L49 VanDerWaalsContact O-CB 3.28Å; G45-L49 WeakPolarHBondContact O-CB 2.84Å; G45-L49 PolarHBondContact O-N 3.47Å |
| 46 | F | 92.8 | Very high | 90.9 | Very high | 75 Ų | 75 | 63.2 Ų | 63.2 | 33% | 0.329 | 34% | 0.344 | S | S | . | . | H | α-helix | trans | -66.2 | -39.9 | 178.9 | -156.2 | -85.2 | 0 | 0 | 0 | 112 | L12 A13 A16 V42 Y43 L49 C50 | L12-F46 HydrophobicContact CB-CD1 4.23Å; L12-F46 HydrophobicContact CB-CE1 3.6Å; L12-F46 HydrophobicContact CB-CZ 4.48Å; L12-F46 HydrophobicContact CD1-CE1 4.47Å; A13-F46 HydrophobicContact CB-CB 4.23Å; A13-F46 HydrophobicContact CB-CD1 4.19Å; A16-F46 HydrophobicContact CB-CD2 4.28Å; A16-F46 HydrophobicContact CB-CG 4.36Å; V42-F46 VanDerWaalsContact O-CB 3.24Å; V42-F46 WeakPolarHBondContact O-CB 3.27Å; V42-F46 PolarHBondContact O-N 3.2Å; Y43-F46 PolarHBondContact O-N 2.65Å; F46-L49 PolarHBondContact O-N 3.25Å; F46-C50 VanDerWaalsContact CD1-SG 3.57Å; F46-C50 WeakPolarHBondContact CE1-SG 3.26Å; F46-C50 WeakPolarHBondContact O-CB 3.24Å; F46-C50 PolarHBondContact O-N 2.94Å; F46-C50 PolarHBondContact O-SG 2.9Å |
| 47 | L | 92.6 | Very high | 90.7 | Very high | 32 Ų | 32 | 66.2 Ų | 66.2 | 17% | 0.168 | 35% | 0.352 | C | S | . | . | H | α-helix | trans | -63.3 | -48.8 | 176.7 | -170.6 | 70 | 0 | 0 | 0 | 111.3 | A9 E10 A13 Y43 T44 L49 C50 Y51 | A9-L47 HydrophobicContact CB-CD1 4.14Å; E10-L47 HydrophobicContact CG-CD1 3.96Å; A13-L47 HydrophobicContact CB-CB 4.14Å; A13-L47 HydrophobicContact CB-CD1 4.35Å; Y43-L47 HydrophobicContact CE1-CD2 4.13Å; Y43-L47 VanDerWaalsContact O-CB 3.31Å; Y43-L47 WeakPolarHBondContact O-CB 3.25Å; Y43-L47 PolarHBondContact O-N 3.35Å; T44-L47 PolarHBondContact O-N 2.67Å; L47-L49 VanDerWaalsContact C-N 3.34Å; L47-L49 PolarHBondContact O-N 2.96Å; L47-C50 PolarHBondContact O-N 3.45Å; L47-Y51 HydrophobicContact CD1-CD2 4.28Å; L47-Y51 HydrophobicContact CD1-CE2 3.72Å; L47-Y51 HydrophobicContact CD2-CE2 4.45Å; L47-Y51 HydrophobicContact CG-CD2 4.06Å; L47-Y51 HydrophobicContact CG-CE2 3.82Å; L47-Y51 VanDerWaalsContact O-CD2 3.26Å; L47-Y51 WeakPolarHBondContact O-CD2 3.31Å; L47-Y51 PolarHBondContact O-N 3.48Å; L47-Y51 VanDerWaalsContact O-N 3.08Å |
| 48 | V | 91.1 | Very high | 90.2 | Very high | 85 Ų | 85 | 63.8 Ų | 63.8 | 52% | 0.515 | 33% | 0.333 | S | S | . | . | H | α-helix | trans | -59.5 | -46.4 | 176.1 | 171 | 0 | 0 | 0 | 0 | 110.3 | T44 G45 C50 Y51 V52 | T44-V48 VanDerWaalsContact O-CG2 3.3Å; T44-V48 WeakPolarHBondContact O-CG2 3.27Å; T44-V48 PolarHBondContact O-N 2.95Å; G45-V48 PolarHBondContact O-N 3.21Å; V48-C50 VanDerWaalsContact C-N 3.35Å; V48-C50 PolarHBondContact O-N 3.4Å; V48-Y51 PolarHBondContact O-N 3.41Å; V48-V52 HydrophobicContact CG1-CG2 4.13Å; V48-V52 WeakPolarHBondContact O-CB 3.29Å; V48-V52 VanDerWaalsContact O-CG2 3.27Å; V48-V52 WeakPolarHBondContact O-CG2 3.47Å; V48-V52 PolarHBondContact O-N 3.08Å |
| 49 | L | 91.1 | Very high | 89.4 | Confident | 100 Ų | 100 | 63.7 Ų | 63.7 | 52% | 0.524 | 33% | 0.327 | S | S | . | . | H | α-helix | trans | -58.5 | -45.3 | 177.8 | -177 | 66.6 | 0 | 0 | 0 | 111.8 | G45 F46 L47 Y51 V52 V53 | G45-L49 VanDerWaalsContact O-CB 3.28Å; G45-L49 WeakPolarHBondContact O-CB 2.84Å; G45-L49 PolarHBondContact O-N 3.47Å; F46-L49 PolarHBondContact O-N 3.25Å; L47-L49 VanDerWaalsContact C-N 3.34Å; L47-L49 PolarHBondContact O-N 2.96Å; L49-Y51 PolarHBondContact O-N 2.89Å; L49-V52 PolarHBondContact O-N 2.92Å; L49-V53 HydrophobicContact CD1-CG2 4.09Å; L49-V53 HydrophobicContact CG-CG2 4.33Å; L49-V53 WeakPolarHBondContact O-CB 3.28Å; L49-V53 WeakPolarHBondContact O-CG2 3.43Å; L49-V53 PolarHBondContact O-N 3.29Å |
| 50 | C | 90.4 | Very high | 88.2 | Confident | 28 Ų | 28 | 67.1 Ų | 67.1 | 19% | 0.189 | 36% | 0.363 | C | S | . | . | H | α-helix | trans | -59.4 | -46.8 | 177.7 | -73.6 | 0 | 0 | 0 | 0 | 112.1 | A9 F46 L47 V48 Y54 | A9-C50 HydrophobicContact CB-CB 3.75Å; F46-C50 VanDerWaalsContact CD1-SG 3.57Å; F46-C50 WeakPolarHBondContact CE1-SG 3.26Å; F46-C50 WeakPolarHBondContact O-CB 3.24Å; F46-C50 PolarHBondContact O-N 2.94Å; F46-C50 PolarHBondContact O-SG 2.9Å; L47-C50 PolarHBondContact O-N 3.45Å; V48-C50 VanDerWaalsContact C-N 3.35Å; V48-C50 PolarHBondContact O-N 3.4Å; C50-Y54 VanDerWaalsContact O-CB 3.23Å; C50-Y54 WeakPolarHBondContact O-CB 3.27Å; C50-Y54 PolarHBondContact O-N 3.47Å |
| 51 | Y | 87.9 | Confident | 87.3 | Confident | 64 Ų | 64 | 65.2 Ų | 65.2 | 25% | 0.251 | 36% | 0.359 | S | S | . | . | H | α-helix | trans | -66.5 | -44.1 | 178.6 | -79.4 | -64 | 0 | 0 | 0 | 112.1 | K6 L47 V48 L49 Y54 F55 | K6-Y51 WeakPolarHBondContact CA-OH 3.25Å; K6-Y51 WeakPolarHBondContact CB-OH 3.3Å; K6-Y51 WeakPolarHBondContact CG-OH 3.42Å; L47-Y51 HydrophobicContact CD1-CD2 4.28Å; L47-Y51 HydrophobicContact CD1-CE2 3.72Å; L47-Y51 HydrophobicContact CD2-CE2 4.45Å; L47-Y51 HydrophobicContact CG-CD2 4.06Å; L47-Y51 HydrophobicContact CG-CE2 3.82Å; L47-Y51 VanDerWaalsContact O-CD2 3.26Å; L47-Y51 WeakPolarHBondContact O-CD2 3.31Å; L47-Y51 PolarHBondContact O-N 3.48Å; L47-Y51 VanDerWaalsContact O-N 3.08Å; V48-Y51 PolarHBondContact O-N 3.41Å; L49-Y51 PolarHBondContact O-N 2.89Å; Y51-Y54 PolarHBondContact O-N 3.41Å; Y51-F55 HydrophobicContact CD1-CE2 4.16Å; Y51-F55 WeakPolarHBondContact O-CB 3.32Å; Y51-F55 VanDerWaalsContact O-CD2 3.24Å; Y51-F55 WeakPolarHBondContact O-CD2 3.16Å; Y51-F55 PolarHBondContact O-N 2.97Å |
| 52 | V | 86.9 | Confident | 85.8 | Confident | 66 Ų | 66 | 67.8 Ų | 67.8 | 40% | 0.4 | 37% | 0.365 | S | S | . | . | H | α-helix | trans | -59.8 | -49.9 | 177.3 | 170.1 | 0 | 0 | 0 | 0 | 110.3 | V48 L49 Y54 F55 I56 | V48-V52 HydrophobicContact CG1-CG2 4.13Å; V48-V52 WeakPolarHBondContact O-CB 3.29Å; V48-V52 VanDerWaalsContact O-CG2 3.27Å; V48-V52 WeakPolarHBondContact O-CG2 3.47Å; V48-V52 PolarHBondContact O-N 3.08Å; L49-V52 PolarHBondContact O-N 2.92Å; V52-Y54 VanDerWaalsContact C-N 3.34Å; V52-Y54 PolarHBondContact O-N 2.9Å; V52-F55 PolarHBondContact O-N 3.29Å; V52-I56 HydrophobicContact CG1-CD1 3.64Å; V52-I56 HydrophobicContact CG1-CG1 4.39Å; V52-I56 WeakPolarHBondContact O-CB 3.41Å; V52-I56 WeakPolarHBondContact O-CD1 3.38Å; V52-I56 WeakPolarHBondContact O-CG1 3.27Å; V52-I56 PolarHBondContact O-N 3.26Å |
| 53 | V | 87.6 | Confident | 84.5 | Confident | 60 Ų | 60 | 69.8 Ų | 69.8 | 36% | 0.364 | 37% | 0.371 | S | S | . | . | H | α-helix | trans | -60.9 | -42.9 | 178 | 171 | 0 | 0 | 0 | 0 | 111.4 | L49 R57 | L49-V53 HydrophobicContact CD1-CG2 4.09Å; L49-V53 HydrophobicContact CG-CG2 4.33Å; L49-V53 WeakPolarHBondContact O-CB 3.28Å; L49-V53 WeakPolarHBondContact O-CG2 3.43Å; L49-V53 PolarHBondContact O-N 3.29Å; V53-R57 WeakPolarHBondContact O-CG 3.36Å; V53-R57 PolarHBondContact O-N 2.82Å; V53-R57 VanDerWaalsContact O-N 3.11Å |
| 54 | Y | 86.4 | Confident | 83 | Confident | 50 Ų | 50 | 68.3 Ų | 68.3 | 20% | 0.196 | 37% | 0.367 | C | S | . | . | H | α-helix | trans | -62.4 | -50.4 | 178 | 173.9 | -95 | 0 | 0 | 0 | 111.7 | M1 F2 V5 C50 Y51 V52 I56 R57 F58 | M1-Y54 WeakPolarHBondContact CE-OH 3.31Å; F2-Y54 HydrophobicContact CD1-CE1 4.23Å; F2-Y54 HydrophobicContact CE1-CE1 4.06Å; V5-Y54 HydrophobicContact CB-CD2 4.48Å; V5-Y54 HydrophobicContact CB-CE2 4.28Å; V5-Y54 HydrophobicContact CG1-CD1 3.98Å; V5-Y54 HydrophobicContact CG1-CD2 3.71Å; V5-Y54 HydrophobicContact CG1-CE1 4.23Å; V5-Y54 HydrophobicContact CG1-CE2 3.97Å; V5-Y54 HydrophobicContact CG1-CG 3.71Å; V5-Y54 HydrophobicContact CG2-CD2 3.89Å; V5-Y54 HydrophobicContact CG2-CE1 4.34Å; V5-Y54 HydrophobicContact CG2-CE2 3.33Å; C50-Y54 VanDerWaalsContact O-CB 3.23Å; C50-Y54 WeakPolarHBondContact O-CB 3.27Å; C50-Y54 PolarHBondContact O-N 3.47Å; Y51-Y54 PolarHBondContact O-N 3.41Å; V52-Y54 VanDerWaalsContact C-N 3.34Å; V52-Y54 PolarHBondContact O-N 2.9Å; Y54-I56 PolarHBondContact O-N 3.46Å; Y54-R57 PolarHBondContact O-N 3.09Å; Y54-F58 HydrophobicContact CE1-CB 4.14Å; Y54-F58 HydrophobicContact CE1-CG 4.33Å; Y54-F58 VanDerWaalsContact O-CB 3.26Å; Y54-F58 WeakPolarHBondContact O-CB 3.49Å; Y54-F58 PolarHBondContact O-N 2.7Å |
| 55 | F | 83.3 | Confident | 81.5 | Confident | 40 Ų | 40 | 69.2 Ų | 69.2 | 18% | 0.175 | 38% | 0.382 | C | S | . | . | H | α-helix | trans | -66.5 | -38.3 | -178.2 | -82.8 | -69.4 | 0 | 0 | 0 | 112 | F2 Y51 V52 R57 F58 L59 F69 L77 | F2-F55 HydrophobicContact CE1-CE1 4.16Å; F2-F55 HydrophobicContact CE1-CZ 4.41Å; Y51-F55 HydrophobicContact CD1-CE2 4.16Å; Y51-F55 WeakPolarHBondContact O-CB 3.32Å; Y51-F55 VanDerWaalsContact O-CD2 3.24Å; Y51-F55 WeakPolarHBondContact O-CD2 3.16Å; Y51-F55 PolarHBondContact O-N 2.97Å; V52-F55 PolarHBondContact O-N 3.29Å; F55-R57 VanDerWaalsContact C-N 3.32Å; F55-R57 PolarHBondContact O-N 3.33Å; F55-F58 PolarHBondContact O-N 3.43Å; F55-L59 HydrophobicContact CB-CD1 4.37Å; F55-L59 VanDerWaalsContact O-CB 3.3Å; F55-L59 WeakPolarHBondContact O-CB 3.48Å; F55-L59 WeakPolarHBondContact O-CD1 3.46Å; F55-L59 WeakPolarHBondContact O-CG 3.46Å; F55-L59 PolarHBondContact O-N 3Å; F55-F69 HydrophobicContact CE1-CZ 4.41Å; F55-L77 HydrophobicContact CB-CD1 4.02Å; F55-L77 HydrophobicContact CG-CD1 4.5Å; F55-L77 HydrophobicContact CG-CD2 4.39Å |
| 56 | I | 82.9 | Confident | 79.9 | Confident | 80 Ų | 80 | 75.9 Ų | 75.9 | 41% | 0.41 | 40% | 0.398 | S | S | . | . | H | α-helix | trans | -56.2 | -47.8 | 172.4 | -70 | 169.2 | 0 | 0 | 0 | 110.7 | V52 Y54 G60 I74 | V52-I56 HydrophobicContact CG1-CD1 3.64Å; V52-I56 HydrophobicContact CG1-CG1 4.39Å; V52-I56 WeakPolarHBondContact O-CB 3.41Å; V52-I56 WeakPolarHBondContact O-CD1 3.38Å; V52-I56 WeakPolarHBondContact O-CG1 3.27Å; V52-I56 PolarHBondContact O-N 3.26Å; Y54-I56 PolarHBondContact O-N 3.46Å; I56-G60 PolarHBondContact O-N 3.33Å; I56-I74 HydrophobicContact CB-CD1 4.46Å; I56-I74 HydrophobicContact CG1-CD1 3.74Å; I56-I74 HydrophobicContact CG1-CG1 4.12Å; I56-I74 HydrophobicContact CG2-CD1 4.43Å |
| 57 | R | 82.6 | Confident | 78.5 | Confident | 195 Ų | 195 | 78.3 Ų | 78.3 | 74% | 0.736 | 41% | 0.409 | S | S | * | . | H | α-helix | trans | -70 | -36.3 | 179.4 | -71.9 | -175.8 | 178.5 | -176.4 | 1.2 | 112.8 | V53 Y54 F55 S61 | V53-R57 WeakPolarHBondContact O-CG 3.36Å; V53-R57 PolarHBondContact O-N 2.82Å; V53-R57 VanDerWaalsContact O-N 3.11Å; Y54-R57 PolarHBondContact O-N 3.09Å; F55-R57 VanDerWaalsContact C-N 3.32Å; F55-R57 PolarHBondContact O-N 3.33Å; R57-S61 PolarHBondContact O-N 2.93Å |
| 58 | F | 81.4 | Confident | 77 | Confident | 14 Ų | 14 | 82.9 Ų | 82.9 | 6% | 0.061 | 44% | 0.439 | C | S | . | . | H | α-helix | trans | -71 | -45.3 | -178.4 | -178.7 | -107.3 | 0 | 0 | 0 | 112 | M1 F2 Y54 F55 G60 S61 A64 F69 | M1-F58 HydrophobicContact CE-CD2 3.77Å; M1-F58 HydrophobicContact CE-CE2 3.16Å; M1-F58 HydrophobicContact CE-CZ 3.72Å; F2-F58 HydrophobicContact CZ-CE1 4.21Å; F2-F58 HydrophobicContact CZ-CZ 4.38Å; Y54-F58 HydrophobicContact CE1-CB 4.14Å; Y54-F58 HydrophobicContact CE1-CG 4.33Å; Y54-F58 VanDerWaalsContact O-CB 3.26Å; Y54-F58 WeakPolarHBondContact O-CB 3.49Å; Y54-F58 PolarHBondContact O-N 2.7Å; F55-F58 PolarHBondContact O-N 3.43Å; F58-G60 PolarHBondContact O-N 3.37Å; F58-S61 VanDerWaalsContact O-CB 3.31Å; F58-S61 WeakPolarHBondContact O-CB 3.28Å; F58-S61 PolarHBondContact O-N 2.97Å; F58-A64 HydrophobicContact CD1-CB 4.35Å; F58-A64 HydrophobicContact CE1-CB 4.01Å; F58-A64 HydrophobicContact CZ-CB 4.1Å; F58-A64 VanDerWaalsContact O-CB 3.25Å; F58-A64 WeakPolarHBondContact O-CB 3.38Å; F58-F69 HydrophobicContact CE1-CD1 4.24Å; F58-F69 HydrophobicContact CE1-CD2 4.46Å; F58-F69 HydrophobicContact CE1-CE1 4.39Å; F58-F69 HydrophobicContact CE1-CG 4.28Å |
| 59 | L | 76.6 | Confident | 75.9 | Confident | 32 Ų | 32 | 81.1 Ų | 81.1 | 17% | 0.168 | 42% | 0.424 | C | S | . | . | H | α-helix | trans | -61.8 | -29.9 | 176.2 | -79 | 152.3 | 0 | 0 | 0 | 112.3 | F55 S61 L71 I74 | F55-L59 HydrophobicContact CB-CD1 4.37Å; F55-L59 VanDerWaalsContact O-CB 3.3Å; F55-L59 WeakPolarHBondContact O-CB 3.48Å; F55-L59 WeakPolarHBondContact O-CD1 3.46Å; F55-L59 WeakPolarHBondContact O-CG 3.46Å; F55-L59 PolarHBondContact O-N 3Å; L59-S61 VanDerWaalsContact C-N 3.34Å; L59-L71 HydrophobicContact CD2-CB 4.39Å; L59-L71 WeakPolarHBondContact CD2-O 3.49Å; L59-I74 HydrophobicContact CD1-CG1 4.29Å |
| 60 | G | 69.8 | Low | 74.9 | Confident | 72 Ų | 72 | 81.7 Ų | 81.7 | 74% | 0.742 | 43% | 0.434 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -81.3 | -3 | 173.3 | 0 | 0 | 0 | 0 | 0 | 115.5 | I56 F58 | I56-G60 PolarHBondContact O-N 3.33Å; F58-G60 PolarHBondContact O-N 3.37Å |
| 61 | S | 74.2 | Confident | 73.8 | Confident | 46 Ų | 46 | 82.7 Ų | 82.7 | 32% | 0.322 | 44% | 0.437 | S | S | . | . | S | Bend | trans | -90.1 | 146.4 | -175.6 | 177.1 | 0 | 0 | 0 | 0 | 112.9 | R57 F58 L59 E63 A64 | R57-S61 PolarHBondContact O-N 2.93Å; F58-S61 VanDerWaalsContact O-CB 3.31Å; F58-S61 WeakPolarHBondContact O-CB 3.28Å; F58-S61 PolarHBondContact O-N 2.97Å; L59-S61 VanDerWaalsContact C-N 3.34Å; S61-E63 PolarHBondContact O-N 3.23Å; S61-E63 PolarHBondContact OG-N 2.93Å; S61-A64 PolarHBondContact O-N 3.32Å; S61-A64 VanDerWaalsContact O-N 3.14Å |
| 62 | K | 63.7 | Low | 72.9 | Confident | 185 Ų | 185 | 86.5 Ų | 86.5 | 80% | 0.804 | 46% | 0.457 | S | S | * | . | H | α-helix | trans | -57.4 | -21.1 | 171.5 | -65.6 | -175.1 | 178.5 | -178.8 | 0 | 113 | K66 | K62-K66 PolarHBondContact O-N 3.41Å |
| 63 | E | 67.4 | Low | 72.1 | Confident | 91 Ų | 91 | 89.1 Ų | 89.1 | 43% | 0.425 | 47% | 0.465 | S | S | . | . | H | α-helix | trans | -74.7 | -34.2 | 179.6 | -135.9 | -175.8 | 157 | 0 | 0 | 113 | S61 K66 K67 | S61-E63 PolarHBondContact O-N 3.23Å; S61-E63 PolarHBondContact OG-N 2.93Å; E63-K66 PolarHBondContact O-N 3.23Å; E63-K67 PolarHBondContact O-N 2.93Å; E63-K67 IonicContact OE1-NZ 3.75Å |
| 64 | A | 64.6 | Low | 71.3 | Confident | 10 Ų | 10 | 90.6 Ų | 90.6 | 8% | 0.083 | 47% | 0.47 | C | S | . | . | H | α-helix | trans | -69.4 | -39.9 | 174.1 | 0 | 0 | 0 | 0 | 0 | 111.2 | F58 S61 K66 K67 | F58-A64 HydrophobicContact CD1-CB 4.35Å; F58-A64 HydrophobicContact CE1-CB 4.01Å; F58-A64 HydrophobicContact CZ-CB 4.1Å; F58-A64 VanDerWaalsContact O-CB 3.25Å; F58-A64 WeakPolarHBondContact O-CB 3.38Å; S61-A64 PolarHBondContact O-N 3.32Å; S61-A64 VanDerWaalsContact O-N 3.14Å; A64-K66 VanDerWaalsContact C-N 3.27Å; A64-K66 PolarHBondContact O-N 2.99Å; A64-K67 PolarHBondContact O-N 3.42Å |
| 65 | A | 62.4 | Low | 70.6 | Confident | 87 Ų | 87 | 98.3 Ų | 98.3 | 72% | 0.719 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -63.2 | -29.6 | 175.1 | 0 | 0 | 0 | 0 | 0 | 113.3 | ||
| 66 | K | 61.8 | Low | 70.2 | Confident | 181 Ų | 181 | 99.2 Ų | 99.2 | 79% | 0.787 | 51% | 0.505 | S | S | * | . | H | α-helix | trans | -80.4 | -25.2 | 177.5 | -85.1 | -173.3 | 175.9 | -175.4 | 0 | 114.5 | K62 E63 A64 | K62-K66 PolarHBondContact O-N 3.41Å; E63-K66 PolarHBondContact O-N 3.23Å; A64-K66 VanDerWaalsContact C-N 3.27Å; A64-K66 PolarHBondContact O-N 2.99Å |
| 67 | K | 62.8 | Low | 69.6 | Low | 126 Ų | 126 | 98.8 Ų | 98.8 | 55% | 0.548 | 50% | 0.503 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -98.2 | 7.3 | -172.4 | -76.9 | -175.4 | 178.6 | 166.3 | 0 | 114.2 | E63 A64 F69 | E63-K67 PolarHBondContact O-N 2.93Å; E63-K67 IonicContact OE1-NZ 3.75Å; A64-K67 PolarHBondContact O-N 3.42Å; K67-F69 PolarHBondContact O-N 3.45Å |
| 68 | T | 62.6 | Low | 69.3 | Low | 129 Ų | 129 | 95.3 Ų | 95.3 | 79% | 0.791 | 50% | 0.498 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 48 | 47.9 | -178 | -31.9 | 0 | 0 | 0 | 0 | 111.3 | ||
| 69 | F | 68.4 | Low | 68.8 | Low | 47 Ų | 47 | 101.2 Ų | 101.2 | 21% | 0.206 | 54% | 0.538 | C | S | . | . | trans | -66.2 | 134.3 | -177 | -166.3 | -113.3 | 0 | 0 | 0 | 109.7 | F2 F55 F58 K67 L71 | F2-F69 HydrophobicContact CE2-CE2 4.43Å; F2-F69 AromaticContact CZ-CE2 3.91Å; F2-F69 HydrophobicContact CZ-CE2 3.91Å; F2-F69 HydrophobicContact CZ-CZ 4.22Å; F55-F69 HydrophobicContact CE1-CZ 4.41Å; F58-F69 HydrophobicContact CE1-CD1 4.24Å; F58-F69 HydrophobicContact CE1-CD2 4.46Å; F58-F69 HydrophobicContact CE1-CE1 4.39Å; F58-F69 HydrophobicContact CE1-CG 4.28Å; K67-F69 PolarHBondContact O-N 3.45Å; F69-L71 HydrophobicContact CD1-CB 3.92Å; F69-L71 HydrophobicContact CE1-CB 3.77Å; F69-L71 HydrophobicContact CE1-CD1 3.78Å; F69-L71 HydrophobicContact CE1-CG 4.07Å; F69-L71 HydrophobicContact CZ-CD1 4.23Å; F69-L71 PolarHBondContact O-N 3.35Å | ||
| 70 | P | 68.3 | Low | 68.6 | Low | 113 Ų | 113 | 104 Ų | 104 | 73% | 0.734 | 56% | 0.561 | S | S | * | * | S | Bend | trans | -68.1 | -16.6 | -171.3 | 23.8 | -33.7 | 0 | 0 | 0 | 114.4 | ||
| 71 | L | 68.8 | Low | 68.5 | Low | 49 Ų | 49 | 108.6 Ų | 108.6 | 26% | 0.257 | 56% | 0.556 | S | S | . | * | trans | -99.7 | 123.9 | 174.8 | -58.7 | 167.6 | 0 | 0 | 0 | 108.4 | L59 F69 D76 L77 | L59-L71 HydrophobicContact CD2-CB 4.39Å; L59-L71 WeakPolarHBondContact CD2-O 3.49Å; F69-L71 HydrophobicContact CD1-CB 3.92Å; F69-L71 HydrophobicContact CE1-CB 3.77Å; F69-L71 HydrophobicContact CE1-CD1 3.78Å; F69-L71 HydrophobicContact CE1-CG 4.07Å; F69-L71 HydrophobicContact CZ-CD1 4.23Å; F69-L71 PolarHBondContact O-N 3.35Å; L71-D76 HydrophobicContact CB-CB 4.44Å; L71-D76 HydrophobicContact CD2-CB 3.57Å; L71-D76 WeakPolarHBondContact CD2-O 3.27Å; L71-L77 HydrophobicContact CD1-CD2 3.79Å | ||
| 72 | Q | 67.4 | Low | 68.3 | Low | 144 Ų | 144 | 109.3 Ų | 109.3 | 67% | 0.673 | 56% | 0.564 | S | S | * | * | trans | -110.2 | -25 | -178.1 | -63.2 | -164.8 | -6.8 | 0 | 0 | 112.1 | D76 | Q72-D76 PolarHBondContact N-OD2 2.93Š| ||
| 73 | H | 70.4 | Confident | 68.7 | Low | 121 Ų | 121 | 108.4 Ų | 108.4 | 56% | 0.56 | 57% | 0.568 | S | S | * | * | S | Bend | trans | -129.3 | 154.5 | -180 | -61.2 | -60.6 | 0 | 0 | 0 | 112 | R75 D76 | H73-R75 PolarHBondContact O-N 3.37Å; H73-D76 PolarHBondContact N-OD2 2.86Å; H73-D76 VanDerWaalsContact O-CB 3.3Å; H73-D76 WeakPolarHBondContact O-CB 3.38Å; H73-D76 PolarHBondContact O-N 2.89Å |
| 74 | I | 71.2 | Confident | 69.1 | Low | 91 Ų | 91 | 108 Ų | 108 | 47% | 0.467 | 59% | 0.588 | S | S | . | * | G | 310 helix | trans | -60.5 | -27.5 | 176.4 | -65 | 157.9 | 0 | 0 | 0 | 111.2 | I56 L59 D76 L77 | I56-I74 HydrophobicContact CB-CD1 4.46Å; I56-I74 HydrophobicContact CG1-CD1 3.74Å; I56-I74 HydrophobicContact CG1-CG1 4.12Å; I56-I74 HydrophobicContact CG2-CD1 4.43Å; L59-I74 HydrophobicContact CD1-CG1 4.29Å; I74-D76 PolarHBondContact O-N 2.97Å; I74-L77 HydrophobicContact CG2-CD1 4.41Å; I74-L77 WeakPolarHBondContact O-CB 3.47Å; I74-L77 PolarHBondContact O-N 3.37Å |
| 75 | R | 72.3 | Confident | 69.6 | Low | 212 Ų | 212 | 113.2 Ų | 113.2 | 80% | 0.8 | 61% | 0.611 | S | S | * | * | G | 310 helix | trans | -67 | -25 | 176.1 | -67.5 | -175.6 | 177.4 | -177.3 | -0.8 | 112.6 | H73 L77 L78 | H73-R75 PolarHBondContact O-N 3.37Å; R75-L77 PolarHBondContact O-N 2.87Å; R75-L78 WeakPolarHBondContact O-CB 3.42Å; R75-L78 PolarHBondContact O-N 3.44Å; R75-L78 VanDerWaalsContact O-N 3.15Å |
| 76 | D | 73.6 | Confident | 70.5 | Confident | 58 Ų | 58 | 112.6 Ų | 112.6 | 31% | 0.31 | 60% | 0.599 | S | S | . | * | G | 310 helix | trans | -75 | -12.8 | 178.9 | -47.9 | -19.3 | 0 | 0 | 0 | 111.8 | L71 Q72 H73 I74 | L71-D76 HydrophobicContact CB-CB 4.44Å; L71-D76 HydrophobicContact CD2-CB 3.57Å; L71-D76 WeakPolarHBondContact CD2-O 3.27Å; Q72-D76 PolarHBondContact N-OD2 2.93Å; H73-D76 PolarHBondContact N-OD2 2.86Å; H73-D76 VanDerWaalsContact O-CB 3.3Å; H73-D76 WeakPolarHBondContact O-CB 3.38Å; H73-D76 PolarHBondContact O-N 2.89Å; I74-D76 PolarHBondContact O-N 2.97Å |
| 77 | L | 71.5 | Confident | 71.2 | Confident | 71 Ų | 71 | 110.7 Ų | 110.7 | 37% | 0.372 | 60% | 0.597 | S | S | . | * | G | 310 helix | trans | -73.8 | -19.1 | 170.9 | -66.4 | 167.6 | 0 | 0 | 0 | 112.3 | F55 L71 I74 R75 | F55-L77 HydrophobicContact CB-CD1 4.02Å; F55-L77 HydrophobicContact CG-CD1 4.5Å; F55-L77 HydrophobicContact CG-CD2 4.39Å; L71-L77 HydrophobicContact CD1-CD2 3.79Å; I74-L77 HydrophobicContact CG2-CD1 4.41Å; I74-L77 WeakPolarHBondContact O-CB 3.47Å; I74-L77 PolarHBondContact O-N 3.37Å; R75-L77 PolarHBondContact O-N 2.87Å |
| 78 | L | 75.9 | Confident | 72.2 | Confident | 122 Ų | 122 | 108 Ų | 108 | 64% | 0.639 | 59% | 0.591 | S | S | * | * | S | Bend | trans | -86.6 | 146.5 | 173.8 | -64.6 | 174.9 | 0 | 0 | 0 | 109.1 | R75 S80 | R75-L78 WeakPolarHBondContact O-CB 3.42Å; R75-L78 PolarHBondContact O-N 3.44Å; R75-L78 VanDerWaalsContact O-N 3.15Å; L78-S80 PolarHBondContact O-N 3.02Å |
| 79 | P | 71.6 | Confident | 73.3 | Confident | 138 Ų | 138 | 105.7 Ų | 105.7 | 90% | 0.896 | 57% | 0.574 | S | S | * | * | trans | -59.5 | 111.6 | 177.2 | 22.6 | -30.9 | 0 | 0 | 0 | 109.9 | ||||
| 80 | S | 71.4 | Confident | 74.3 | Confident | 92 Ų | 92 | 113 Ų | 113 | 64% | 0.643 | 60% | 0.6 | S | S | * | * | trans | -117.9 | 147.5 | 175.5 | 62.3 | 0 | 0 | 0 | 0 | 110.3 | L78 A82 | L78-S80 PolarHBondContact O-N 3.02Å; S80-A82 PolarHBondContact O-N 3.14Å | ||
| 81 | R | 68.7 | Low | 75.3 | Confident | 168 Ų | 168 | 112.9 Ų | 112.9 | 63% | 0.634 | 60% | 0.598 | S | S | * | * | P | Polyproline II helix | trans | -69.8 | 128.2 | 172.4 | -174.7 | 178.7 | 179 | -175.3 | -2.6 | 108.9 | ||
| 82 | A | 70.1 | Confident | 76.3 | Confident | 60 Ų | 60 | 114.3 Ų | 114.3 | 50% | 0.496 | 61% | 0.608 | S | S | . | * | P | Polyproline II helix | trans | -74.7 | 134.7 | 168.7 | 0 | 0 | 0 | 0 | 0 | 109.5 | S80 G84 E85 | S80-A82 PolarHBondContact O-N 3.14Å; A82-G84 PolarHBondContact O-N 3.46Å; A82-E85 HydrophobicContact CB-CB 4.25Å; A82-E85 HydrophobicContact CB-CG 4.38Å; A82-E85 PolarHBondContact O-N 3.4Å |
| 83 | D | 72.1 | Confident | 77.3 | Confident | 166 Ų | 166 | 108.9 Ų | 108.9 | 89% | 0.888 | 59% | 0.588 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -63.8 | 128.1 | -178.8 | -71 | -39.8 | 0 | 0 | 0 | 110.9 | E85 | D83-E85 VanDerWaalsContact C-N 3.32Å; D83-E85 PolarHBondContact O-N 3.11Å |
| 84 | G | 74.4 | Confident | 78.4 | Confident | 82 Ų | 82 | 112.5 Ų | 112.5 | 85% | 0.845 | 60% | 0.597 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 85.8 | -12.2 | 178.8 | 0 | 0 | 0 | 0 | 0 | 115.9 | A82 | A82-G84 PolarHBondContact O-N 3.46Š|
| 85 | E | 76.9 | Confident | 79.4 | Confident | 120 Ų | 120 | 112.5 Ų | 112.5 | 56% | 0.561 | 60% | 0.597 | S | S | * | * | S | Bend | trans | -95.1 | 151.7 | 179.1 | -69.3 | -64.1 | 150.2 | 0 | 0 | 112.2 | A82 D83 | A82-E85 HydrophobicContact CB-CB 4.25Å; A82-E85 HydrophobicContact CB-CG 4.38Å; A82-E85 PolarHBondContact O-N 3.4Å; D83-E85 VanDerWaalsContact C-N 3.32Å; D83-E85 PolarHBondContact O-N 3.11Å |
| 86 | P | 79.3 | Confident | 80.3 | Confident | 74 Ų | 74 | 106.3 Ų | 106.3 | 48% | 0.481 | 58% | 0.583 | S | S | . | * | trans | -62.9 | 147.1 | 170.8 | 28.5 | -32.3 | 0 | 0 | 0 | 109.8 | V88 | P86-V88 PolarHBondContact O-N 3.22Å; P86-V88 VanDerWaalsContact O-N 3.09Å | ||
| 87 | L | 78.6 | Confident | 81.2 | Confident | 141 Ų | 141 | 110.3 Ų | 110.3 | 74% | 0.738 | 59% | 0.594 | S | S | * | * | S | Bend | trans | -61 | -24.1 | -177.4 | -145.9 | 139.2 | 0 | 0 | 0 | 112.5 | ||
| 88 | V | 82.4 | Confident | 82.1 | Confident | 69 Ų | 69 | 109.3 Ų | 109.3 | 42% | 0.418 | 59% | 0.593 | S | S | . | * | S | Bend | trans | -134.5 | 122.9 | 173.4 | 178.7 | 0 | 0 | 0 | 0 | 108 | P86 W90 A93 | P86-V88 PolarHBondContact O-N 3.22Å; P86-V88 VanDerWaalsContact O-N 3.09Å; V88-W90 PolarHBondContact O-N 3.28Å; V88-A93 HydrophobicContact CG1-CB 3.74Å |
| 89 | D | 86.7 | Confident | 82.7 | Confident | 82 Ų | 82 | 108.9 Ų | 108.9 | 44% | 0.439 | 59% | 0.586 | S | S | . | * | trans | -71.4 | 108 | 166.1 | -179.4 | -19.9 | 0 | 0 | 0 | 108.6 | T91 V92 A93 | D89-T91 PolarHBondContact O-N 2.79Å; D89-T91 WeakPolarHBondContact OD1-CA 3.2Å; D89-T91 WeakPolarHBondContact OD1-CB 3.21Å; D89-T91 PolarHBondContact OD1-N 2.73Å; D89-T91 PolarHBondContact OD1-OG1 3.1Å; D89-V92 HydrophobicContact CB-CB 4.12Å; D89-V92 HydrophobicContact CB-CG2 4.15Å; D89-V92 PolarHBondContact O-N 3.46Å; D89-V92 PolarHBondContact OD1-N 3.45Å; D89-V92 WeakPolarHBondContact OD2-CG2 3.5Å; D89-A93 VanDerWaalsContact O-CB 3.32Å; D89-A93 WeakPolarHBondContact O-CB 3.02Å; D89-A93 PolarHBondContact O-N 2.93Å | ||
| 90 | W | 87.8 | Confident | 83.7 | Confident | 200 Ų | 200 | 107.7 Ų | 107.7 | 76% | 0.758 | 57% | 0.567 | S | S | * | * | H | α-helix | trans | -64.1 | -24.8 | -178.3 | -68.5 | 107.3 | 0 | 0 | 0 | 113.8 | V88 R94 | V88-W90 PolarHBondContact O-N 3.28Å; W90-R94 VanDerWaalsContact O-CB 3.32Å; W90-R94 WeakPolarHBondContact O-CB 3.21Å; W90-R94 PolarHBondContact O-N 3.26Å |
| 91 | T | 90.8 | Very high | 84.3 | Confident | 111 Ų | 111 | 109 Ų | 109 | 68% | 0.681 | 56% | 0.561 | S | S | * | * | H | α-helix | trans | -69.4 | -50.3 | 175.5 | -48.7 | 0 | 0 | 0 | 0 | 109.7 | D89 A93 R94 L95 | D89-T91 PolarHBondContact O-N 2.79Å; D89-T91 WeakPolarHBondContact OD1-CA 3.2Å; D89-T91 WeakPolarHBondContact OD1-CB 3.21Å; D89-T91 PolarHBondContact OD1-N 2.73Å; D89-T91 PolarHBondContact OD1-OG1 3.1Å; T91-A93 VanDerWaalsContact C-N 3.34Å; T91-R94 PolarHBondContact O-N 3.47Å; T91-L95 PolarHBondContact O-N 2.85Å |
| 92 | V | 88.9 | Confident | 84.7 | Confident | 78 Ų | 78 | 107 Ų | 107 | 47% | 0.473 | 56% | 0.559 | S | S | . | * | H | α-helix | trans | -67.8 | -36.3 | 177.1 | 178.9 | 0 | 0 | 0 | 0 | 110.8 | D89 L95 T96 | D89-V92 HydrophobicContact CB-CB 4.12Å; D89-V92 HydrophobicContact CB-CG2 4.15Å; D89-V92 PolarHBondContact O-N 3.46Å; D89-V92 PolarHBondContact OD1-N 3.45Å; D89-V92 WeakPolarHBondContact OD2-CG2 3.5Å; V92-L95 PolarHBondContact O-N 2.96Å; V92-T96 VanDerWaalsContact O-CB 3.27Å; V92-T96 WeakPolarHBondContact O-CB 3.44Å; V92-T96 PolarHBondContact O-N 3.35Å; V92-T96 PolarHBondContact O-OG1 3.12Å |
| 93 | A | 89.8 | Confident | 85.4 | Confident | 31 Ų | 31 | 107.6 Ų | 107.6 | 26% | 0.256 | 56% | 0.56 | S | S | . | * | H | α-helix | trans | -63.8 | -42.1 | 175.7 | 0 | 0 | 0 | 0 | 0 | 111.9 | V88 D89 T91 T96 W97 | V88-A93 HydrophobicContact CG1-CB 3.74Å; D89-A93 VanDerWaalsContact O-CB 3.32Å; D89-A93 WeakPolarHBondContact O-CB 3.02Å; D89-A93 PolarHBondContact O-N 2.93Å; T91-A93 VanDerWaalsContact C-N 3.34Å; A93-T96 PolarHBondContact O-N 3.45Å; A93-W97 VanDerWaalsContact O-CB 3.3Å; A93-W97 WeakPolarHBondContact O-CB 3.4Å; A93-W97 PolarHBondContact O-N 2.72Å |
| 94 | R | 92.8 | Very high | 85.9 | Confident | 197 Ų | 197 | 105.3 Ų | 105.3 | 74% | 0.743 | 54% | 0.542 | S | S | * | . | H | α-helix | trans | -65.3 | -39.7 | 175.6 | -174.1 | 177.6 | 179.8 | 176.9 | 0.9 | 112.2 | W90 T91 S98 | W90-R94 VanDerWaalsContact O-CB 3.32Å; W90-R94 WeakPolarHBondContact O-CB 3.21Å; W90-R94 PolarHBondContact O-N 3.26Å; T91-R94 PolarHBondContact O-N 3.47Å; R94-S98 PolarHBondContact O-N 3.39Å; R94-S98 VanDerWaalsContact O-N 3.09Å; R94-S98 PolarHBondContact O-OG 3.44Å |
| 95 | L | 91 | Very high | 86 | Confident | 91 Ų | 91 | 105.7 Ų | 105.7 | 48% | 0.476 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -65.2 | -46.8 | 174 | -178.9 | 60.7 | 0 | 0 | 0 | 111.3 | T91 V92 W97 S98 F99 | T91-L95 PolarHBondContact O-N 2.85Å; V92-L95 PolarHBondContact O-N 2.96Å; L95-W97 VanDerWaalsContact C-N 3.3Å; L95-W97 PolarHBondContact O-N 3.42Å; L95-S98 WeakPolarHBondContact O-CA 3.28Å; L95-S98 WeakPolarHBondContact O-CB 3.32Å; L95-S98 PolarHBondContact O-N 2.93Å; L95-F99 HydrophobicContact CD1-CD2 4.36Å; L95-F99 HydrophobicContact CD1-CE1 4.38Å; L95-F99 HydrophobicContact CD1-CE2 3.78Å; L95-F99 HydrophobicContact CD1-CZ 3.79Å; L95-F99 HydrophobicContact CD2-CE2 4.07Å; L95-F99 HydrophobicContact CG-CD2 4.12Å; L95-F99 HydrophobicContact CG-CE2 3.67Å; L95-F99 HydrophobicContact CG-CZ 4.2Å; L95-F99 PolarHBondContact O-N 3.43Å |
| 96 | T | 92.3 | Very high | 86 | Confident | 82 Ų | 82 | 107 Ų | 107 | 50% | 0.503 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -59.5 | -41.6 | 176.8 | -58.1 | 0 | 0 | 0 | 0 | 111.1 | V92 A93 S98 F99 F100 | V92-T96 VanDerWaalsContact O-CB 3.27Å; V92-T96 WeakPolarHBondContact O-CB 3.44Å; V92-T96 PolarHBondContact O-N 3.35Å; V92-T96 PolarHBondContact O-OG1 3.12Å; A93-T96 PolarHBondContact O-N 3.45Å; T96-S98 VanDerWaalsContact C-N 3.29Å; T96-S98 PolarHBondContact O-N 3.36Å; T96-F99 PolarHBondContact O-N 2.76Å; T96-F100 VanDerWaalsContact O-CB 3.31Å; T96-F100 WeakPolarHBondContact O-CB 3.4Å; T96-F100 PolarHBondContact O-N 3.35Å |
| 97 | W | 92.3 | Very high | 86.2 | Confident | 142 Ų | 142 | 107.6 Ų | 107.6 | 54% | 0.538 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -62.2 | -37.1 | 174.3 | -176.9 | -123 | 0 | 0 | 0 | 112.6 | A93 L95 F100 K101 | A93-W97 VanDerWaalsContact O-CB 3.3Å; A93-W97 WeakPolarHBondContact O-CB 3.4Å; A93-W97 PolarHBondContact O-N 2.72Å; L95-W97 VanDerWaalsContact C-N 3.3Å; L95-W97 PolarHBondContact O-N 3.42Å; W97-F100 AromaticContact CE3-CD1 3.9Å; W97-F100 HydrophobicContact CE3-CD1 3.9Å; W97-F100 HydrophobicContact CE3-CG 4.49Å; W97-F100 HydrophobicContact CH2-CD1 4.39Å; W97-F100 AromaticContact CZ3-CD1 3.65Å; W97-F100 HydrophobicContact CZ3-CD1 3.65Å; W97-F100 AromaticContact CZ3-CE1 3.96Å; W97-F100 HydrophobicContact CZ3-CE1 3.96Å; W97-F100 PolarHBondContact O-N 2.89Å; W97-K101 WeakPolarHBondContact O-CG 3.2Å; W97-K101 PolarHBondContact O-N 2.92Å |
| 98 | S | 90 | Very high | 85.9 | Confident | 50 Ų | 50 | 103.9 Ų | 103.9 | 35% | 0.35 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -67.1 | -45.2 | 175.9 | -55.7 | 0 | 0 | 0 | 0 | 111.2 | R94 L95 T96 F100 K101 Q102 | R94-S98 PolarHBondContact O-N 3.39Å; R94-S98 VanDerWaalsContact O-N 3.09Å; R94-S98 PolarHBondContact O-OG 3.44Å; L95-S98 WeakPolarHBondContact O-CA 3.28Å; L95-S98 WeakPolarHBondContact O-CB 3.32Å; L95-S98 PolarHBondContact O-N 2.93Å; T96-S98 VanDerWaalsContact C-N 3.29Å; T96-S98 PolarHBondContact O-N 3.36Å; S98-F100 VanDerWaalsContact C-N 3.33Å; S98-F100 PolarHBondContact O-N 3.33Å; S98-K101 PolarHBondContact O-N 3.41Å; S98-Q102 WeakPolarHBondContact O-CG 3.49Å; S98-Q102 PolarHBondContact O-N 3.45Å; S98-Q102 VanDerWaalsContact O-N 3.07Å |
| 99 | F | 90.1 | Very high | 85.3 | Confident | 112 Ų | 112 | 104 Ų | 104 | 49% | 0.491 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -65.8 | -34.6 | 173.8 | -68.7 | -36 | 0 | 0 | 0 | 113.1 | L95 T96 Q102 S103 | L95-F99 HydrophobicContact CD1-CD2 4.36Å; L95-F99 HydrophobicContact CD1-CE1 4.38Å; L95-F99 HydrophobicContact CD1-CE2 3.78Å; L95-F99 HydrophobicContact CD1-CZ 3.79Å; L95-F99 HydrophobicContact CD2-CE2 4.07Å; L95-F99 HydrophobicContact CG-CD2 4.12Å; L95-F99 HydrophobicContact CG-CE2 3.67Å; L95-F99 HydrophobicContact CG-CZ 4.2Å; L95-F99 PolarHBondContact O-N 3.43Å; T96-F99 PolarHBondContact O-N 2.76Å; F99-Q102 PolarHBondContact O-N 3.32Å; F99-S103 VanDerWaalsContact O-CB 3.3Å; F99-S103 WeakPolarHBondContact O-CB 3.33Å; F99-S103 PolarHBondContact O-N 2.94Å; F99-S103 PolarHBondContact O-OG 3.43Å |
| 100 | F | 91.6 | Very high | 84.4 | Confident | 114 Ų | 114 | 104.3 Ų | 104.3 | 50% | 0.5 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -62.3 | -48.1 | 174.3 | 178.6 | -98.7 | 0 | 0 | 0 | 110.8 | T96 W97 S98 Q102 S103 F104 | T96-F100 VanDerWaalsContact O-CB 3.31Å; T96-F100 WeakPolarHBondContact O-CB 3.4Å; T96-F100 PolarHBondContact O-N 3.35Å; W97-F100 AromaticContact CE3-CD1 3.9Å; W97-F100 HydrophobicContact CE3-CD1 3.9Å; W97-F100 HydrophobicContact CE3-CG 4.49Å; W97-F100 HydrophobicContact CH2-CD1 4.39Å; W97-F100 AromaticContact CZ3-CD1 3.65Å; W97-F100 HydrophobicContact CZ3-CD1 3.65Å; W97-F100 AromaticContact CZ3-CE1 3.96Å; W97-F100 HydrophobicContact CZ3-CE1 3.96Å; W97-F100 PolarHBondContact O-N 2.89Å; S98-F100 VanDerWaalsContact C-N 3.33Å; S98-F100 PolarHBondContact O-N 3.33Å; F100-Q102 VanDerWaalsContact C-N 3.34Å; F100-Q102 PolarHBondContact O-N 3.07Å; F100-S103 PolarHBondContact O-N 3.01Å; F100-F104 VanDerWaalsContact O-CB 3.28Å; F100-F104 WeakPolarHBondContact O-CB 3.43Å; F100-F104 PolarHBondContact O-N 3.38Å |
| 101 | K | 83.7 | Confident | 83.9 | Confident | 118 Ų | 118 | 97.1 Ų | 97.1 | 51% | 0.513 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -57.7 | -45.7 | 174.9 | -76.1 | 175.7 | 172.3 | 175.4 | 0 | 112.3 | W97 S98 F104 L105 | W97-K101 WeakPolarHBondContact O-CG 3.2Å; W97-K101 PolarHBondContact O-N 2.92Å; S98-K101 PolarHBondContact O-N 3.41Å; K101-F104 PolarHBondContact O-N 2.88Å; K101-L105 WeakPolarHBondContact O-CB 3.35Å; K101-L105 PolarHBondContact O-N 3.43Å |
| 102 | Q | 78.3 | Confident | 83 | Confident | 127 Ų | 127 | 92 Ų | 92 | 59% | 0.593 | 45% | 0.452 | S | S | * | . | H | α-helix | trans | -62.4 | -43.5 | 177.3 | -72.3 | 177 | -8.7 | 0 | 0 | 111.8 | S98 F99 F100 K106 | S98-Q102 WeakPolarHBondContact O-CG 3.49Å; S98-Q102 PolarHBondContact O-N 3.45Å; S98-Q102 VanDerWaalsContact O-N 3.07Å; F99-Q102 PolarHBondContact O-N 3.32Å; F100-Q102 VanDerWaalsContact C-N 3.34Å; F100-Q102 PolarHBondContact O-N 3.07Å; Q102-K106 VanDerWaalsContact O-CB 3.28Å; Q102-K106 WeakPolarHBondContact O-CB 3.32Å; Q102-K106 PolarHBondContact O-N 3.35Å |
| 103 | S | 83.3 | Confident | 82.3 | Confident | 73 Ų | 73 | 90.2 Ų | 90.2 | 51% | 0.51 | 44% | 0.439 | S | S | . | . | H | α-helix | trans | -68.9 | -39.5 | 179.7 | -58.1 | 0 | 0 | 0 | 0 | 111.9 | F99 F100 K106 Q107 | F99-S103 VanDerWaalsContact O-CB 3.3Å; F99-S103 WeakPolarHBondContact O-CB 3.33Å; F99-S103 PolarHBondContact O-N 2.94Å; F99-S103 PolarHBondContact O-OG 3.43Å; F100-S103 PolarHBondContact O-N 3.01Å; S103-K106 PolarHBondContact O-N 3.02Å; S103-Q107 VanDerWaalsContact O-CB 3.31Å; S103-Q107 WeakPolarHBondContact O-CB 3.4Å; S103-Q107 PolarHBondContact O-N 3.38Å |
| 104 | F | 83.7 | Confident | 81.6 | Confident | 117 Ų | 117 | 95.1 Ų | 95.1 | 51% | 0.513 | 45% | 0.451 | S | S | . | . | H | α-helix | trans | -64.4 | -46.1 | 175.8 | -178.9 | -100.3 | 0 | 0 | 0 | 111.5 | F100 K101 K106 Q107 I108 | F100-F104 VanDerWaalsContact O-CB 3.28Å; F100-F104 WeakPolarHBondContact O-CB 3.43Å; F100-F104 PolarHBondContact O-N 3.38Å; K101-F104 PolarHBondContact O-N 2.88Å; F104-K106 VanDerWaalsContact C-N 3.33Å; F104-K106 PolarHBondContact O-N 2.94Å; F104-Q107 WeakPolarHBondContact O-CB 3.43Å; F104-Q107 PolarHBondContact O-N 2.78Å; F104-I108 HydrophobicContact CD1-CD1 3.95Å; F104-I108 HydrophobicContact CE1-CD1 3.33Å; F104-I108 HydrophobicContact CE1-CG1 4.34Å; F104-I108 HydrophobicContact CE2-CD1 4.42Å; F104-I108 HydrophobicContact CZ-CD1 3.61Å; F104-I108 HydrophobicContact CZ-CG1 4.38Å; F104-I108 PolarHBondContact O-N 2.72Å |
| 105 | L | 76.6 | Confident | 80.9 | Confident | 90 Ų | 90 | 89.8 Ų | 89.8 | 47% | 0.471 | 43% | 0.431 | S | S | . | . | H | α-helix | trans | -60.7 | -45.7 | 174.5 | -179.1 | 62.7 | 0 | 0 | 0 | 110.9 | K101 Q107 I108 L109 | K101-L105 WeakPolarHBondContact O-CB 3.35Å; K101-L105 PolarHBondContact O-N 3.43Å; L105-Q107 VanDerWaalsContact C-N 3.29Å; L105-Q107 PolarHBondContact O-N 2.95Å; L105-I108 PolarHBondContact O-N 2.8Å; L105-L109 HydrophobicContact CD1-CD1 4.2Å; L105-L109 HydrophobicContact CD1-CG 4.43Å; L105-L109 HydrophobicContact CG-CD1 3.93Å; L105-L109 VanDerWaalsContact O-CG 3.31Å; L105-L109 WeakPolarHBondContact O-CG 3.46Å; L105-L109 PolarHBondContact O-N 3.34Å |
| 106 | K | 77.3 | Confident | 80.1 | Confident | 147 Ų | 147 | 86.3 Ų | 86.3 | 64% | 0.639 | 41% | 0.413 | S | S | * | . | H | α-helix | trans | -59.1 | -41.1 | 175.7 | -172.8 | 177.8 | -178.5 | -179.4 | 0 | 111.7 | Q102 S103 F104 L109 T110 | Q102-K106 VanDerWaalsContact O-CB 3.28Å; Q102-K106 WeakPolarHBondContact O-CB 3.32Å; Q102-K106 PolarHBondContact O-N 3.35Å; S103-K106 PolarHBondContact O-N 3.02Å; F104-K106 VanDerWaalsContact C-N 3.33Å; F104-K106 PolarHBondContact O-N 2.94Å; K106-L109 PolarHBondContact O-N 3.45Å; K106-T110 WeakPolarHBondContact O-CB 3.27Å; K106-T110 PolarHBondContact O-N 3.07Å; K106-T110 PolarHBondContact O-OG1 3.27Å |
| 107 | Q | 81.7 | Confident | 79.2 | Confident | 87 Ų | 87 | 82.8 Ų | 82.8 | 41% | 0.407 | 39% | 0.391 | S | S | . | . | H | α-helix | trans | -61.3 | -47 | 177.5 | -176.4 | 67.2 | 15.1 | 0 | 0 | 111.2 | S103 F104 L105 L109 T110 E111 Y115 | S103-Q107 VanDerWaalsContact O-CB 3.31Å; S103-Q107 WeakPolarHBondContact O-CB 3.4Å; S103-Q107 PolarHBondContact O-N 3.38Å; F104-Q107 WeakPolarHBondContact O-CB 3.43Å; F104-Q107 PolarHBondContact O-N 2.78Å; L105-Q107 VanDerWaalsContact C-N 3.29Å; L105-Q107 PolarHBondContact O-N 2.95Å; Q107-L109 VanDerWaalsContact C-N 3.32Å; Q107-L109 PolarHBondContact O-N 3.02Å; Q107-T110 PolarHBondContact O-N 3.37Å; Q107-E111 WeakPolarHBondContact O-CB 3.32Å; Q107-E111 PolarHBondContact O-N 3.21Å; Q107-Y115 HydrophobicContact CG-CE2 4.34Å; Q107-Y115 VanDerWaalsContact CG-OH 3.26Å; Q107-Y115 WeakPolarHBondContact CG-OH 3.3Å; Q107-Y115 PolarHBondContact NE2-OH 3.38Å; Q107-Y115 VanDerWaalsContact NE2-OH 3.14Å |
| 108 | I | 73.8 | Confident | 78.5 | Confident | 63 Ų | 63 | 79.5 Ų | 79.5 | 32% | 0.323 | 39% | 0.387 | S | S | . | . | H | α-helix | trans | -61.7 | -41.7 | 175.8 | -68.6 | 174.3 | 0 | 0 | 0 | 111.2 | F104 L105 T110 G112 | F104-I108 HydrophobicContact CD1-CD1 3.95Å; F104-I108 HydrophobicContact CE1-CD1 3.33Å; F104-I108 HydrophobicContact CE1-CG1 4.34Å; F104-I108 HydrophobicContact CE2-CD1 4.42Å; F104-I108 HydrophobicContact CZ-CD1 3.61Å; F104-I108 HydrophobicContact CZ-CG1 4.38Å; F104-I108 PolarHBondContact O-N 2.72Å; L105-I108 PolarHBondContact O-N 2.8Å; I108-T110 VanDerWaalsContact C-N 3.33Å; I108-T110 PolarHBondContact O-N 2.97Å; I108-G112 WeakPolarHBondContact O-CA 3.32Å; I108-G112 PolarHBondContact O-N 3Å |
| 109 | L | 68.4 | Low | 77.8 | Confident | 72 Ų | 72 | 83.8 Ų | 83.8 | 38% | 0.377 | 40% | 0.4 | S | S | . | . | H | α-helix | trans | -70.2 | -29.9 | -179.6 | -68.5 | 169.2 | 0 | 0 | 0 | 113.2 | L105 K106 Q107 L262 | L105-L109 HydrophobicContact CD1-CD1 4.2Å; L105-L109 HydrophobicContact CD1-CG 4.43Å; L105-L109 HydrophobicContact CG-CD1 3.93Å; L105-L109 VanDerWaalsContact O-CG 3.31Å; L105-L109 WeakPolarHBondContact O-CG 3.46Å; L105-L109 PolarHBondContact O-N 3.34Å; K106-L109 PolarHBondContact O-N 3.45Å; Q107-L109 VanDerWaalsContact C-N 3.32Å; Q107-L109 PolarHBondContact O-N 3.02Å; L109-L262 HydrophobicContact CD1-CD1 3.96Å; L109-L262 HydrophobicContact CD2-CD1 3.61Å; L109-L262 HydrophobicContact CG-CD1 4.38Å |
| 110 | T | 68.1 | Low | 76.8 | Confident | 89 Ų | 89 | 83.2 Ų | 83.2 | 55% | 0.546 | 40% | 0.4 | S | S | . | . | H | α-helix | trans | -92.2 | -39.4 | -175.7 | -44.4 | 0 | 0 | 0 | 0 | 111.9 | K106 Q107 I108 | K106-T110 WeakPolarHBondContact O-CB 3.27Å; K106-T110 PolarHBondContact O-N 3.07Å; K106-T110 PolarHBondContact O-OG1 3.27Å; Q107-T110 PolarHBondContact O-N 3.37Å; I108-T110 VanDerWaalsContact C-N 3.33Å; I108-T110 PolarHBondContact O-N 2.97Å |
| 111 | E | 77.3 | Confident | 75.6 | Confident | 48 Ų | 48 | 83.8 Ų | 83.8 | 22% | 0.224 | 41% | 0.408 | C | S | . | . | H | α-helix | trans | -110.7 | 7.5 | -174.4 | -63.2 | -70.6 | 160.2 | 0 | 0 | 112.2 | Q107 E113 R114 Y115 | Q107-E111 WeakPolarHBondContact O-CB 3.32Å; Q107-E111 PolarHBondContact O-N 3.21Å; E111-E113 PolarHBondContact O-N 2.94Å; E111-R114 VanDerWaalsContact CD-NH1 3.32Å; E111-R114 WeakPolarHBondContact O-CB 3.32Å; E111-R114 PolarHBondContact O-N 3.46Å; E111-R114 IonicContact OE1-NH1 2.68Å; E111-R114 PolarHBondContact OE1-NH1 3.36Å; E111-R114 WeakPolarHBondContact OE2-CD 3.34Å; E111-R114 WeakPolarHBondContact OE2-CG 3.45Å; E111-R114 IonicContact OE2-CZ 3.05Å; E111-R114 IonicContact OE2-NE 3.89Å; E111-R114 IonicContact OE2-NH1 3.66Å; E111-R114 PolarHBondContact OE2-NH1 3.5Å; E111-Y115 HydrophobicContact CB-CE2 4.14Å; E111-Y115 WeakPolarHBondContact O-CD2 3.46Å; E111-Y115 PolarHBondContact O-N 3.02Å |
| 112 | G | 73.3 | Confident | 75 | Confident | 5 Ų | 5 | 79.7 Ų | 79.7 | 5% | 0.052 | 39% | 0.393 | C | S | . | . | H | α-helix | trans | -55.2 | -37.4 | 178 | 0 | 0 | 0 | 0 | 0 | 112.8 | I108 R114 Y115 V116 | I108-G112 WeakPolarHBondContact O-CA 3.32Å; I108-G112 PolarHBondContact O-N 3Å; G112-R114 PolarHBondContact O-N 3.35Å; G112-Y115 PolarHBondContact O-N 3.34Å; G112-V116 WeakPolarHBondContact O-CG2 3.3Å; G112-V116 PolarHBondContact O-N 3.24Å |
| 113 | E | 72.6 | Confident | 74.9 | Confident | 40 Ų | 40 | 74.4 Ų | 74.4 | 19% | 0.187 | 37% | 0.369 | C | S | . | . | H | α-helix | trans | -53.9 | -50.5 | 170.6 | 153.2 | 160 | 171.1 | 0 | 0 | 112.2 | E111 Y115 V116 M117 Y131 F268 F284 N288 | E111-E113 PolarHBondContact O-N 2.94Å; E113-Y115 VanDerWaalsContact C-N 3.31Å; E113-Y115 PolarHBondContact O-N 3.27Å; E113-V116 PolarHBondContact O-N 3Å; E113-M117 HydrophobicContact CG-CE 3.28Å; E113-M117 PolarHBondContact O-N 3.38Å; E113-M117 WeakPolarHBondContact OE1-CE 3.5Å; E113-Y131 PolarHBondContact OE1-OH 2.96Å; E113-F268 HydrophobicContact CB-CE1 4.29Å; E113-F268 HydrophobicContact CB-CZ 4.45Å; E113-F284 HydrophobicContact CB-CE1 4.48Å; E113-F284 HydrophobicContact CB-CZ 3.74Å; E113-F284 HydrophobicContact CG-CE1 3.61Å; E113-F284 HydrophobicContact CG-CE2 4.27Å; E113-F284 HydrophobicContact CG-CZ 3.24Å; E113-F284 VanDerWaalsContact OE1-CE1 3.24Å; E113-F284 WeakPolarHBondContact OE1-CE1 3.41Å; E113-F284 WeakPolarHBondContact OE2-CE1 3.39Å; E113-N288 PolarHBondContact OE2-ND2 3.37Å |
| 114 | R | 75.8 | Confident | 74.9 | Confident | 134 Ų | 134 | 74 Ų | 74 | 51% | 0.506 | 37% | 0.366 | S | S | . | . | H | α-helix | trans | -67.1 | -34.3 | 178.4 | -65.9 | -156.7 | 179.7 | 130.7 | -8 | 112.2 | E111 G112 M117 T118 | E111-R114 VanDerWaalsContact CD-NH1 3.32Å; E111-R114 WeakPolarHBondContact O-CB 3.32Å; E111-R114 PolarHBondContact O-N 3.46Å; E111-R114 IonicContact OE1-NH1 2.68Å; E111-R114 PolarHBondContact OE1-NH1 3.36Å; E111-R114 WeakPolarHBondContact OE2-CD 3.34Å; E111-R114 WeakPolarHBondContact OE2-CG 3.45Å; E111-R114 IonicContact OE2-CZ 3.05Å; E111-R114 IonicContact OE2-NE 3.89Å; E111-R114 IonicContact OE2-NH1 3.66Å; E111-R114 PolarHBondContact OE2-NH1 3.5Å; G112-R114 PolarHBondContact O-N 3.35Å; R114-M117 PolarHBondContact O-N 2.9Å; R114-T118 WeakPolarHBondContact O-CB 3.19Å; R114-T118 PolarHBondContact O-N 2.88Å; R114-T118 PolarHBondContact O-OG1 2.92Å |
| 115 | Y | 78.9 | Confident | 74.8 | Confident | 84 Ų | 84 | 76.4 Ų | 76.4 | 33% | 0.329 | 38% | 0.376 | S | S | . | . | H | α-helix | trans | -65.1 | -41.3 | 174.5 | -64 | -35.3 | 0 | 0 | 0 | 112.1 | Q107 E111 G112 E113 T118 F119 | Q107-Y115 HydrophobicContact CG-CE2 4.34Å; Q107-Y115 VanDerWaalsContact CG-OH 3.26Å; Q107-Y115 WeakPolarHBondContact CG-OH 3.3Å; Q107-Y115 PolarHBondContact NE2-OH 3.38Å; Q107-Y115 VanDerWaalsContact NE2-OH 3.14Å; E111-Y115 HydrophobicContact CB-CE2 4.14Å; E111-Y115 WeakPolarHBondContact O-CD2 3.46Å; E111-Y115 PolarHBondContact O-N 3.02Å; G112-Y115 PolarHBondContact O-N 3.34Å; E113-Y115 VanDerWaalsContact C-N 3.31Å; E113-Y115 PolarHBondContact O-N 3.27Å; Y115-T118 PolarHBondContact O-N 3.47Å; Y115-F119 HydrophobicContact CD1-CD2 4.09Å; Y115-F119 AromaticContact CD1-CE2 3.55Å; Y115-F119 HydrophobicContact CD1-CE2 3.55Å; Y115-F119 HydrophobicContact CE1-CE2 4.23Å; Y115-F119 HydrophobicContact CG-CD2 4.36Å; Y115-F119 HydrophobicContact CG-CE2 4.17Å; Y115-F119 WeakPolarHBondContact O-CB 3.45Å; Y115-F119 WeakPolarHBondContact O-CD2 3.44Å; Y115-F119 PolarHBondContact O-N 3.34Å |
| 116 | V | 73.8 | Confident | 75 | Confident | 18 Ų | 18 | 74.4 Ų | 74.4 | 11% | 0.109 | 38% | 0.377 | C | S | . | . | H | α-helix | trans | -60.8 | -47 | 173.3 | 172.6 | 0 | 0 | 0 | 0 | 110.1 | G112 E113 T118 M120 L269 | G112-V116 WeakPolarHBondContact O-CG2 3.3Å; G112-V116 PolarHBondContact O-N 3.24Å; E113-V116 PolarHBondContact O-N 3Å; V116-T118 PolarHBondContact O-N 2.91Å; V116-M120 HydrophobicContact CG1-CG 4.39Å; V116-M120 VanDerWaalsContact O-CB 3.23Å; V116-M120 WeakPolarHBondContact O-CB 3.38Å; V116-M120 PolarHBondContact O-N 2.92Å; V116-L269 HydrophobicContact CG2-CD2 3.94Å |
| 117 | M | 73.3 | Confident | 75.3 | Confident | 8 Ų | 8 | 70.1 Ų | 70.1 | 4% | 0.039 | 36% | 0.362 | C | S | . | . | H | α-helix | trans | -60.8 | -44.5 | 178.2 | -70.3 | -170.1 | -115.6 | 0 | 0 | 112.9 | E113 R114 Q128 Y131 F284 | E113-M117 HydrophobicContact CG-CE 3.28Å; E113-M117 PolarHBondContact O-N 3.38Å; E113-M117 WeakPolarHBondContact OE1-CE 3.5Å; R114-M117 PolarHBondContact O-N 2.9Å; M117-Q128 PolarHBondContact O-NE2 3.15Å; M117-Y131 HydrophobicContact CE-CD1 4.01Å; M117-Y131 HydrophobicContact CE-CE1 3.55Å; M117-Y131 HydrophobicContact SD-CD1 3.79Å; M117-Y131 HydrophobicContact SD-CE1 3.94Å; M117-F284 HydrophobicContact CE-CE1 4.07Å; M117-F284 HydrophobicContact CE-CZ 4.15Å; M117-F284 HydrophobicContact CG-CE2 4.48Å |
| 118 | T | 76.6 | Confident | 75.5 | Confident | 74 Ų | 74 | 67.1 Ų | 67.1 | 45% | 0.454 | 35% | 0.348 | S | S | . | . | H | α-helix | trans | -78.8 | -45.9 | -172.9 | -53.1 | 0 | 0 | 0 | 0 | 112.6 | R114 Y115 V116 | R114-T118 WeakPolarHBondContact O-CB 3.19Å; R114-T118 PolarHBondContact O-N 2.88Å; R114-T118 PolarHBondContact O-OG1 2.92Å; Y115-T118 PolarHBondContact O-N 3.47Å; V116-T118 PolarHBondContact O-N 2.91Å |
| 119 | F | 76.3 | Confident | 76.2 | Confident | 139 Ų | 139 | 65.6 Ų | 65.6 | 61% | 0.61 | 35% | 0.348 | S | S | * | . | H | α-helix | trans | -91.1 | -25.5 | -170.1 | -67.2 | -64.5 | 0 | 0 | 0 | 113.7 | Y115 | Y115-F119 HydrophobicContact CD1-CD2 4.09Å; Y115-F119 AromaticContact CD1-CE2 3.55Å; Y115-F119 HydrophobicContact CD1-CE2 3.55Å; Y115-F119 HydrophobicContact CE1-CE2 4.23Å; Y115-F119 HydrophobicContact CG-CD2 4.36Å; Y115-F119 HydrophobicContact CG-CE2 4.17Å; Y115-F119 WeakPolarHBondContact O-CB 3.45Å; Y115-F119 WeakPolarHBondContact O-CD2 3.44Å; Y115-F119 PolarHBondContact O-N 3.34Å |
| 120 | M | 68.6 | Low | 77.2 | Confident | 100 Ų | 100 | 63.3 Ų | 63.3 | 49% | 0.493 | 34% | 0.336 | S | S | . | . | S | Bend | trans | -91.9 | 1.4 | -176 | -55 | -71.8 | 95.8 | 0 | 0 | 113 | V116 V122 Y273 | V116-M120 HydrophobicContact CG1-CG 4.39Å; V116-M120 VanDerWaalsContact O-CB 3.23Å; V116-M120 WeakPolarHBondContact O-CB 3.38Å; V116-M120 PolarHBondContact O-N 2.92Å; M120-V122 HydrophobicContact CB-CG2 3.49Å; M120-V122 VanDerWaalsContact CB-CG2 3.49Å; M120-V122 WeakPolarHBondContact O-CG2 3.41Å; M120-V122 PolarHBondContact O-N 2.74Å; M120-Y273 HydrophobicContact CB-CD2 4.2Å; M120-Y273 HydrophobicContact CB-CE2 4.18Å; M120-Y273 HydrophobicContact CG-CD2 4.18Å; M120-Y273 HydrophobicContact CG-CE2 4.38Å; M120-Y273 HydrophobicContact SD-CD2 4.46Å; M120-Y273 HydrophobicContact SD-CE2 4.31Å |
| 121 | N | 67.6 | Low | 78.2 | Confident | 126 Ų | 126 | 59.2 Ų | 59.2 | 67% | 0.674 | 31% | 0.31 | S | S | * | . | trans | 48 | 30.3 | 178 | -71.9 | -30.9 | 0 | 0 | 0 | 114.3 | L123 | N121-L123 VanDerWaalsContact C-N 3.27Å; N121-L123 PolarHBondContact O-N 3.49Å | ||
| 122 | V | 70.3 | Confident | 78.8 | Confident | 33 Ų | 33 | 59.9 Ų | 59.9 | 20% | 0.2 | 32% | 0.315 | C | S | . | . | trans | -77.5 | -18.7 | -173.2 | -153 | 0 | 0 | 0 | 0 | 112.1 | M120 Y273 T276 W277 | M120-V122 HydrophobicContact CB-CG2 3.49Å; M120-V122 VanDerWaalsContact CB-CG2 3.49Å; M120-V122 WeakPolarHBondContact O-CG2 3.41Å; M120-V122 PolarHBondContact O-N 2.74Å; V122-Y273 HydrophobicContact CG2-CD2 4.38Å; V122-T276 HydrophobicContact CB-CG2 3.69Å; V122-T276 VanDerWaalsContact CG1-C 3.46Å; V122-T276 HydrophobicContact CG1-CG2 3.46Å; V122-T276 VanDerWaalsContact CG1-CG2 3.46Å; V122-W277 HydrophobicContact CG1-CB 4.28Å | ||
| 123 | L | 76.6 | Confident | 79.6 | Confident | 16 Ų | 16 | 62.5 Ų | 62.5 | 8% | 0.084 | 33% | 0.327 | C | S | . | . | S | Bend | trans | -129.1 | 142.6 | 179.7 | -84.9 | 143.1 | 0 | 0 | 0 | 109.9 | N121 D127 Q128 T276 | N121-L123 VanDerWaalsContact C-N 3.27Å; N121-L123 PolarHBondContact O-N 3.49Å; L123-D127 HydrophobicContact CD2-CB 3.45Å; L123-D127 VanDerWaalsContact CD2-CB 3.45Å; L123-Q128 HydrophobicContact CB-CG 3.7Å; L123-Q128 PolarHBondContact O-NE2 3.28Å; L123-T276 HydrophobicContact CD1-CG2 3.62Å; L123-T276 HydrophobicContact CG-CG2 4.09Å |
| 124 | S | 82.1 | Confident | 80.5 | Confident | 64 Ų | 64 | 60.6 Ų | 60.6 | 45% | 0.448 | 32% | 0.319 | S | S | . | . | trans | -63.6 | 153.6 | 170.6 | 79.8 | 0 | 0 | 0 | 0 | 110.6 | G126 D127 Q128 | S124-G126 PolarHBondContact O-N 3.36Å; S124-D127 PolarHBondContact O-N 2.85Å; S124-D127 VanDerWaalsContact O-N 3.09Å; S124-D127 VanDerWaalsContact OG-CG 3.27Å; S124-D127 PolarHBondContact OG-N 3.21Å; S124-D127 VanDerWaalsContact OG-N 3.11Å; S124-D127 PolarHBondContact OG-OD2 2.79Å; S124-Q128 WeakPolarHBondContact O-CG 3.28Å; S124-Q128 PolarHBondContact O-N 3.35Å | ||
| 125 | F | 82.1 | Confident | 81.2 | Confident | 167 Ų | 167 | 55.8 Ų | 55.8 | 73% | 0.732 | 30% | 0.303 | S | S | * | . | H | α-helix | trans | -56.7 | -33.8 | 176.6 | -73.1 | -66.4 | 0 | 0 | 0 | 113 | G129 | F125-G129 PolarHBondContact O-N 2.8Å; F125-G129 VanDerWaalsContact O-N 3.1Å |
| 126 | G | 81.7 | Confident | 81.8 | Confident | 48 Ų | 48 | 55.2 Ų | 55.2 | 50% | 0.495 | 31% | 0.306 | S | S | . | . | H | α-helix | trans | -65.2 | -47.5 | 174.8 | 0 | 0 | 0 | 0 | 0 | 112.1 | S124 Q128 G129 I130 | S124-G126 PolarHBondContact O-N 3.36Å; G126-Q128 VanDerWaalsContact C-N 3.33Å; G126-Q128 PolarHBondContact O-N 2.87Å; G126-G129 PolarHBondContact O-N 3.48Å; G126-I130 WeakPolarHBondContact O-CG1 3.27Å; G126-I130 PolarHBondContact O-N 3.11Å |
| 127 | D | 83.3 | Confident | 82.6 | Confident | 57 Ų | 57 | 56.1 Ų | 56.1 | 31% | 0.305 | 31% | 0.31 | S | S | . | . | H | α-helix | trans | -67.5 | -33 | 178.4 | -66.1 | -55 | 0 | 0 | 0 | 112.6 | L123 S124 G129 I130 Y131 S220 | L123-D127 HydrophobicContact CD2-CB 3.45Å; L123-D127 VanDerWaalsContact CD2-CB 3.45Å; S124-D127 PolarHBondContact O-N 2.85Å; S124-D127 VanDerWaalsContact O-N 3.09Å; S124-D127 VanDerWaalsContact OG-CG 3.27Å; S124-D127 PolarHBondContact OG-N 3.21Å; S124-D127 VanDerWaalsContact OG-N 3.11Å; S124-D127 PolarHBondContact OG-OD2 2.79Å; D127-G129 VanDerWaalsContact C-N 3.34Å; D127-I130 PolarHBondContact O-N 3.13Å; D127-Y131 WeakPolarHBondContact O-CB 3.44Å; D127-Y131 PolarHBondContact O-N 3.36Å; D127-S220 PolarHBondContact OD1-OG 3.21Å |
| 128 | Q | 86.1 | Confident | 83.4 | Confident | 24 Ų | 24 | 56.1 Ų | 56.1 | 11% | 0.112 | 31% | 0.312 | C | S | . | . | H | α-helix | trans | -61.5 | -43.5 | 171.3 | -69 | 177.4 | 34.5 | 0 | 0 | 110.9 | M117 L123 S124 G126 Y131 D132 | M117-Q128 PolarHBondContact O-NE2 3.15Å; L123-Q128 HydrophobicContact CB-CG 3.7Å; L123-Q128 PolarHBondContact O-NE2 3.28Å; S124-Q128 WeakPolarHBondContact O-CG 3.28Å; S124-Q128 PolarHBondContact O-N 3.35Å; G126-Q128 VanDerWaalsContact C-N 3.33Å; G126-Q128 PolarHBondContact O-N 2.87Å; Q128-Y131 PolarHBondContact O-N 3.13Å; Q128-D132 WeakPolarHBondContact O-CB 3.46Å; Q128-D132 PolarHBondContact O-N 2.82Å |
| 129 | G | 87.3 | Confident | 84 | Confident | 32 Ų | 32 | 53 Ų | 53 | 33% | 0.33 | 29% | 0.293 | S | S | . | . | H | α-helix | trans | -62.3 | -44.7 | 175.5 | 0 | 0 | 0 | 0 | 0 | 113 | F125 G126 D127 D132 I133 | F125-G129 PolarHBondContact O-N 2.8Å; F125-G129 VanDerWaalsContact O-N 3.1Å; G126-G129 PolarHBondContact O-N 3.48Å; D127-G129 VanDerWaalsContact C-N 3.34Å; G129-D132 PolarHBondContact O-N 3.29Å; G129-I133 VanDerWaalsContact O-CG1 3.3Å; G129-I133 WeakPolarHBondContact O-CG1 3.39Å; G129-I133 PolarHBondContact O-N 3.19Å; G129-I133 VanDerWaalsContact O-N 3.08Å |
| 130 | I | 90 | Very high | 84.7 | Confident | 24 Ų | 24 | 50.1 Ų | 50.1 | 12% | 0.123 | 28% | 0.282 | C | S | . | . | H | α-helix | trans | -64.1 | -44.5 | 176 | -62.8 | 171.4 | 0 | 0 | 0 | 110.3 | G126 D127 D132 I133 V134 L216 L224 | G126-I130 WeakPolarHBondContact O-CG1 3.27Å; G126-I130 PolarHBondContact O-N 3.11Å; D127-I130 PolarHBondContact O-N 3.13Å; I130-D132 PolarHBondContact O-N 3.31Å; I130-I133 PolarHBondContact O-N 3.08Å; I130-V134 HydrophobicContact CG2-CG2 4.41Å; I130-V134 WeakPolarHBondContact O-CG2 3.47Å; I130-V134 PolarHBondContact O-N 2.89Å; I130-L216 HydrophobicContact CG1-CD2 4.28Å; I130-L216 HydrophobicContact CG2-CD2 4.5Å; I130-L224 HydrophobicContact CG2-CD1 3.95Å |
| 131 | Y | 89.6 | Confident | 85.7 | Confident | 2 Ų | 2 | 47 Ų | 47 | 1% | 0.008 | 27% | 0.269 | C | S | . | . | H | α-helix | trans | -57 | -49.4 | 176.1 | 176.9 | -87.7 | 0 | 0 | 0 | 111.6 | E113 M117 D127 Q128 I133 V134 N135 L224 F284 I285 | E113-Y131 PolarHBondContact OE1-OH 2.96Å; M117-Y131 HydrophobicContact CE-CD1 4.01Å; M117-Y131 HydrophobicContact CE-CE1 3.55Å; M117-Y131 HydrophobicContact SD-CD1 3.79Å; M117-Y131 HydrophobicContact SD-CE1 3.94Å; D127-Y131 WeakPolarHBondContact O-CB 3.44Å; D127-Y131 PolarHBondContact O-N 3.36Å; Q128-Y131 PolarHBondContact O-N 3.13Å; Y131-I133 VanDerWaalsContact C-N 3.31Å; Y131-I133 PolarHBondContact O-N 3.43Å; Y131-V134 PolarHBondContact O-N 3.37Å; Y131-N135 HydrophobicContact CE1-CB 4.06Å; Y131-N135 VanDerWaalsContact O-CB 3.29Å; Y131-N135 WeakPolarHBondContact O-CB 3.28Å; Y131-N135 PolarHBondContact O-N 2.73Å; Y131-L224 HydrophobicContact CD2-CD2 4.18Å; Y131-F284 HydrophobicContact CE1-CD1 4.28Å; Y131-F284 HydrophobicContact CE2-CB 4.32Å; Y131-F284 AromaticContact CE2-CD1 3.76Å; Y131-F284 HydrophobicContact CE2-CD1 3.76Å; Y131-F284 HydrophobicContact CE2-CG 4.41Å; Y131-F284 AromaticContact CZ-CD1 3.46Å; Y131-F284 VanDerWaalsContact CZ-CD1 3.46Å; Y131-F284 AromaticContact CZ-CE1 3.94Å; Y131-F284 WeakPolarHBondContact OH-CD1 3.45Å; Y131-F284 WeakPolarHBondContact OH-CE1 3.32Å; Y131-I285 HydrophobicContact CE2-CD1 4.34Å; Y131-I285 HydrophobicContact CE2-CG1 3.72Å |
| 132 | D | 88.6 | Confident | 86.8 | Confident | 62 Ų | 62 | 42 Ų | 42 | 33% | 0.332 | 25% | 0.245 | S | C | . | . | H | α-helix | trans | -61.7 | -39.5 | -179.8 | -84.8 | -16.8 | 0 | 0 | 0 | 112 | Q128 G129 I130 N136 | Q128-D132 WeakPolarHBondContact O-CB 3.46Å; Q128-D132 PolarHBondContact O-N 2.82Å; G129-D132 PolarHBondContact O-N 3.29Å; I130-D132 PolarHBondContact O-N 3.31Å; D132-N136 WeakPolarHBondContact O-CB 3.29Å; D132-N136 PolarHBondContact O-N 3.28Å; D132-N136 PolarHBondContact O-ND2 2.98Å |
| 133 | I | 90.5 | Very high | 87.7 | Confident | 60 Ų | 60 | 46.2 Ų | 46.2 | 31% | 0.308 | 26% | 0.257 | S | S | . | . | H | α-helix | trans | -64.4 | -49.1 | 175.4 | -68.7 | 167 | 0 | 0 | 0 | 110.2 | G129 I130 Y131 N135 N136 L137 Y211 L216 | G129-I133 VanDerWaalsContact O-CG1 3.3Å; G129-I133 WeakPolarHBondContact O-CG1 3.39Å; G129-I133 PolarHBondContact O-N 3.19Å; G129-I133 VanDerWaalsContact O-N 3.08Å; I130-I133 PolarHBondContact O-N 3.08Å; Y131-I133 VanDerWaalsContact C-N 3.31Å; Y131-I133 PolarHBondContact O-N 3.43Å; I133-N135 PolarHBondContact O-N 3.21Å; I133-N136 PolarHBondContact O-N 2.89Å; I133-L137 WeakPolarHBondContact O-CB 3.45Å; I133-L137 PolarHBondContact O-N 3.47Å; I133-Y211 HydrophobicContact CG2-CE1 4.07Å; I133-L216 HydrophobicContact CD1-CD2 3.89Å; I133-L216 HydrophobicContact CG2-CD1 3.89Å; I133-L216 HydrophobicContact CG2-CD2 4.37Å |
| 134 | V | 92.3 | Very high | 88.4 | Confident | 0 Ų | 0 | 52.9 Ų | 52.9 | 0% | 0 | 29% | 0.286 | C | S | . | . | H | α-helix | trans | -63.1 | -42.2 | 179.4 | 170.3 | 0 | 0 | 0 | 0 | 111.4 | I130 Y131 L137 G138 L208 L224 L225 | I130-V134 HydrophobicContact CG2-CG2 4.41Å; I130-V134 WeakPolarHBondContact O-CG2 3.47Å; I130-V134 PolarHBondContact O-N 2.89Å; Y131-V134 PolarHBondContact O-N 3.37Å; V134-L137 PolarHBondContact O-N 2.93Å; V134-G138 PolarHBondContact O-N 2.96Å; V134-L208 HydrophobicContact CG2-CD1 4.44Å; V134-L208 HydrophobicContact CG2-CD2 4.29Å; V134-L224 HydrophobicContact CB-CB 4.25Å; V134-L224 HydrophobicContact CG1-CB 3.84Å; V134-L224 HydrophobicContact CG2-CB 4.15Å; V134-L225 HydrophobicContact CG1-CB 3.93Å; V134-L225 HydrophobicContact CG1-CD1 4.06Å |
| 135 | N | 90.4 | Very high | 88.8 | Confident | 33 Ų | 33 | 53.1 Ų | 53.1 | 18% | 0.176 | 28% | 0.281 | C | S | . | . | H | α-helix | trans | -63.7 | -42.5 | 177.7 | -174.3 | 24.3 | 0 | 0 | 0 | 111.2 | Y131 I133 S139 Y228 | Y131-N135 HydrophobicContact CE1-CB 4.06Å; Y131-N135 VanDerWaalsContact O-CB 3.29Å; Y131-N135 WeakPolarHBondContact O-CB 3.28Å; Y131-N135 PolarHBondContact O-N 2.73Å; I133-N135 PolarHBondContact O-N 3.21Å; N135-S139 WeakPolarHBondContact O-CB 3.33Å; N135-S139 PolarHBondContact O-N 3.49Å; N135-S139 PolarHBondContact O-OG 3.3Å; N135-Y228 HydrophobicContact CB-CE2 4.18Å; N135-Y228 PolarHBondContact O-OH 2.78Å; N135-Y228 WeakPolarHBondContact OD1-CE2 3.22Å; N135-Y228 PolarHBondContact OD1-OH 2.84Å |
| 136 | N | 90.6 | Very high | 89.4 | Confident | 72 Ų | 72 | 45.7 Ų | 45.7 | 39% | 0.385 | 25% | 0.249 | S | C | . | . | H | α-helix | trans | -67.8 | -38.8 | 175.8 | -78.2 | -52.7 | 0 | 0 | 0 | 112.9 | D132 I133 S139 M140 R143 | D132-N136 WeakPolarHBondContact O-CB 3.29Å; D132-N136 PolarHBondContact O-N 3.28Å; D132-N136 PolarHBondContact O-ND2 2.98Å; I133-N136 PolarHBondContact O-N 2.89Å; N136-S139 PolarHBondContact O-OG 3Å; N136-M140 VanDerWaalsContact O-CG 3.32Å; N136-M140 WeakPolarHBondContact O-CG 3.15Å; N136-R143 PolarHBondContact OD1-NH1 3.23Å; N136-R143 PolarHBondContact OD1-NH2 3.37Å |
| 137 | L | 91.1 | Very high | 89.8 | Confident | 37 Ų | 37 | 46.9 Ų | 46.9 | 19% | 0.194 | 24% | 0.243 | C | C | . | . | H | α-helix | trans | -68.3 | -49.3 | 176.9 | -168.9 | 78.9 | 0 | 0 | 0 | 111 | I133 V134 S139 M140 L208 L225 | I133-L137 WeakPolarHBondContact O-CB 3.45Å; I133-L137 PolarHBondContact O-N 3.47Å; V134-L137 PolarHBondContact O-N 2.93Å; L137-S139 PolarHBondContact O-N 3.31Å; L137-M140 HydrophobicContact CD1-CE 3.37Å; L137-M140 HydrophobicContact CD1-SD 4.49Å; L137-M140 HydrophobicContact CG-CE 3.92Å; L137-M140 VanDerWaalsContact O-CB 3.3Å; L137-M140 WeakPolarHBondContact O-CB 3.14Å; L137-M140 WeakPolarHBondContact O-CE 3.4Å; L137-M140 VanDerWaalsContact O-CG 3.31Å; L137-M140 WeakPolarHBondContact O-CG 3.4Å; L137-M140 PolarHBondContact O-N 3.41Å; L137-L208 HydrophobicContact CD2-CD2 4.08Å; L137-L225 HydrophobicContact CD2-CD1 4.38Å; L137-L225 HydrophobicContact CD2-CD2 4.11Å |
| 138 | G | 90 | Very high | 90.2 | Very high | 8 Ų | 8 | 46.8 Ų | 46.8 | 8% | 0.082 | 25% | 0.246 | C | C | . | . | H | α-helix | trans | -65.2 | -39.1 | -179.1 | 0 | 0 | 0 | 0 | 0 | 112.8 | V134 M140 Y228 | V134-G138 PolarHBondContact O-N 2.96Å; G138-M140 PolarHBondContact O-N 2.89Å; G138-Y228 VanDerWaalsContact CA-CD1 3.46Å; G138-Y228 VanDerWaalsContact CA-CE1 3.42Å |
| 139 | S | 90.1 | Very high | 90.5 | Very high | 9 Ų | 9 | 47 Ų | 47 | 6% | 0.063 | 25% | 0.248 | C | C | . | . | H | α-helix | trans | -69.5 | -9.7 | 177.7 | 58.1 | 0 | 0 | 0 | 0 | 113.9 | N135 N136 L137 V141 A142 R143 Y228 | N135-S139 WeakPolarHBondContact O-CB 3.33Å; N135-S139 PolarHBondContact O-N 3.49Å; N135-S139 PolarHBondContact O-OG 3.3Å; N136-S139 PolarHBondContact O-OG 3Å; L137-S139 PolarHBondContact O-N 3.31Å; S139-V141 VanDerWaalsContact C-N 3.31Å; S139-V141 PolarHBondContact O-N 2.91Å; S139-A142 PolarHBondContact O-N 3.04Å; S139-A142 VanDerWaalsContact O-N 3.16Å; S139-R143 VanDerWaalsContact O-CG 3.3Å; S139-R143 WeakPolarHBondContact O-CG 3.37Å; S139-R143 PolarHBondContact O-N 2.87Å; S139-R143 PolarHBondContact OG-NE 2.93Å; S139-R143 PolarHBondContact OG-NH2 3.39Å; S139-Y228 WeakPolarHBondContact CB-OH 3.28Å; S139-Y228 PolarHBondContact N-OH 3.21Å |
| 140 | M | 91 | Very high | 90.7 | Very high | 78 Ų | 78 | 48.5 Ų | 48.5 | 38% | 0.384 | 25% | 0.246 | S | C | . | . | H | α-helix | trans | -58.4 | -41.9 | 179 | -69.4 | -165.9 | -60.6 | 0 | 0 | 112.3 | N136 L137 G138 A142 R143 F144 | N136-M140 VanDerWaalsContact O-CG 3.32Å; N136-M140 WeakPolarHBondContact O-CG 3.15Å; L137-M140 HydrophobicContact CD1-CE 3.37Å; L137-M140 HydrophobicContact CD1-SD 4.49Å; L137-M140 HydrophobicContact CG-CE 3.92Å; L137-M140 VanDerWaalsContact O-CB 3.3Å; L137-M140 WeakPolarHBondContact O-CB 3.14Å; L137-M140 WeakPolarHBondContact O-CE 3.4Å; L137-M140 VanDerWaalsContact O-CG 3.31Å; L137-M140 WeakPolarHBondContact O-CG 3.4Å; L137-M140 PolarHBondContact O-N 3.41Å; G138-M140 PolarHBondContact O-N 2.89Å; M140-A142 VanDerWaalsContact C-N 3.34Å; M140-A142 PolarHBondContact O-N 3.48Å; M140-R143 PolarHBondContact O-N 3.4Å; M140-F144 HydrophobicContact CB-CD2 3.98Å; M140-F144 HydrophobicContact CB-CE2 4.11Å; M140-F144 HydrophobicContact CG-CE2 4.21Å; M140-F144 WeakPolarHBondContact O-CB 3.41Å; M140-F144 WeakPolarHBondContact O-CD2 3.36Å; M140-F144 PolarHBondContact O-N 3.42Å; M140-F144 HydrophobicContact SD-CE2 4.49Å |
| 141 | V | 89.7 | Confident | 90.7 | Very high | 36 Ų | 36 | 52.9 Ų | 52.9 | 22% | 0.218 | 27% | 0.266 | C | S | . | . | H | α-helix | trans | -60.3 | -47.8 | 177.2 | 177.4 | 0 | 0 | 0 | 0 | 110.1 | S139 R143 F144 I145 F146 I196 V232 | S139-V141 VanDerWaalsContact C-N 3.31Å; S139-V141 PolarHBondContact O-N 2.91Å; V141-R143 VanDerWaalsContact C-N 3.32Å; V141-R143 PolarHBondContact O-N 3.32Å; V141-F144 PolarHBondContact O-N 2.84Å; V141-I145 HydrophobicContact CG1-CB 4.47Å; V141-I145 HydrophobicContact CG1-CD1 4.06Å; V141-I145 WeakPolarHBondContact O-CA 3.47Å; V141-I145 VanDerWaalsContact O-CB 3.29Å; V141-I145 WeakPolarHBondContact O-CB 3.26Å; V141-I145 PolarHBondContact O-N 2.98Å; V141-F146 HydrophobicContact CG1-CD2 4.43Å; V141-F146 HydrophobicContact CG1-CE1 4.46Å; V141-F146 HydrophobicContact CG1-CE2 3.82Å; V141-F146 HydrophobicContact CG1-CZ 3.83Å; V141-F146 PolarHBondContact O-N 3.21Å; V141-I196 HydrophobicContact CB-CD1 4.21Å; V141-I196 HydrophobicContact CG1-CD1 3.28Å; V141-I196 HydrophobicContact CG2-CD1 4.02Å; V141-V232 HydrophobicContact CB-CG1 4.23Å; V141-V232 HydrophobicContact CG1-CG1 3.99Å |
| 142 | A | 89.6 | Confident | 90.8 | Very high | 19 Ų | 19 | 56.1 Ų | 56.1 | 16% | 0.157 | 29% | 0.289 | C | S | . | . | I | π-helix | trans | -60.4 | -43.5 | 178.1 | 0 | 0 | 0 | 0 | 0 | 111.4 | S139 M140 F146 L147 L235 | S139-A142 PolarHBondContact O-N 3.04Å; S139-A142 VanDerWaalsContact O-N 3.16Å; M140-A142 VanDerWaalsContact C-N 3.34Å; M140-A142 PolarHBondContact O-N 3.48Å; A142-F146 HydrophobicContact CB-CD2 4.21Å; A142-F146 PolarHBondContact O-N 2.78Å; A142-L147 WeakPolarHBondContact O-CB 3.5Å; A142-L147 PolarHBondContact O-N 2.84Å; A142-L235 HydrophobicContact CB-CD1 3.93Å |
| 143 | R | 90.2 | Very high | 91 | Very high | 123 Ų | 123 | 54.5 Ų | 54.5 | 46% | 0.464 | 28% | 0.279 | S | S | . | . | I | π-helix | trans | -69.1 | -39.4 | -179 | -69.5 | 171.4 | -175.7 | 169.9 | 4 | 113.7 | N136 S139 M140 V141 P148 | N136-R143 PolarHBondContact OD1-NH1 3.23Å; N136-R143 PolarHBondContact OD1-NH2 3.37Å; S139-R143 VanDerWaalsContact O-CG 3.3Å; S139-R143 WeakPolarHBondContact O-CG 3.37Å; S139-R143 PolarHBondContact O-N 2.87Å; S139-R143 PolarHBondContact OG-NE 2.93Å; S139-R143 PolarHBondContact OG-NH2 3.39Å; M140-R143 PolarHBondContact O-N 3.4Å; V141-R143 VanDerWaalsContact C-N 3.32Å; V141-R143 PolarHBondContact O-N 3.32Å; R143-P148 WeakPolarHBondContact O-CD 3.46Å |
| 144 | F | 90.3 | Very high | 91.2 | Very high | 155 Ų | 155 | 55.8 Ų | 55.8 | 68% | 0.68 | 28% | 0.281 | S | S | * | . | I | π-helix | trans | -97.5 | -24.3 | -172.5 | -66.6 | -58.6 | 0 | 0 | 0 | 114.1 | M140 V141 | M140-F144 HydrophobicContact CB-CD2 3.98Å; M140-F144 HydrophobicContact CB-CE2 4.11Å; M140-F144 HydrophobicContact CG-CE2 4.21Å; M140-F144 WeakPolarHBondContact O-CB 3.41Å; M140-F144 WeakPolarHBondContact O-CD2 3.36Å; M140-F144 PolarHBondContact O-N 3.42Å; M140-F144 HydrophobicContact SD-CE2 4.49Å; V141-F144 PolarHBondContact O-N 2.84Å |
| 145 | I | 90.8 | Very high | 91.2 | Very high | 70 Ų | 70 | 60.1 Ų | 60.1 | 36% | 0.359 | 30% | 0.302 | S | S | . | . | I | π-helix | trans | -110.6 | -59.1 | -177.4 | -53.8 | -177.1 | 0 | 0 | 0 | 110.2 | V141 I149 | V141-I145 HydrophobicContact CG1-CB 4.47Å; V141-I145 HydrophobicContact CG1-CD1 4.06Å; V141-I145 WeakPolarHBondContact O-CA 3.47Å; V141-I145 VanDerWaalsContact O-CB 3.29Å; V141-I145 WeakPolarHBondContact O-CB 3.26Å; V141-I145 PolarHBondContact O-N 2.98Å; I145-I149 HydrophobicContact CG2-CD1 4.06Å; I145-I149 WeakPolarHBondContact O-CD1 3.24Å; I145-I149 VanDerWaalsContact O-CG1 3.22Å; I145-I149 WeakPolarHBondContact O-CG1 3.48Å; I145-I149 PolarHBondContact O-N 2.79Å |
| 146 | F | 93.7 | Very high | 91.4 | Very high | 10 Ų | 10 | 61.3 Ų | 61.3 | 4% | 0.044 | 31% | 0.306 | C | S | . | . | I | π-helix | trans | -75.2 | -41.9 | -170.6 | -55.6 | -33.1 | 0 | 0 | 0 | 113.2 | V141 A142 I149 E150 V189 I192 V232 A236 | V141-F146 HydrophobicContact CG1-CD2 4.43Å; V141-F146 HydrophobicContact CG1-CE1 4.46Å; V141-F146 HydrophobicContact CG1-CE2 3.82Å; V141-F146 HydrophobicContact CG1-CZ 3.83Å; V141-F146 PolarHBondContact O-N 3.21Å; A142-F146 HydrophobicContact CB-CD2 4.21Å; A142-F146 PolarHBondContact O-N 2.78Å; F146-I149 WeakPolarHBondContact O-CB 3.27Å; F146-I149 PolarHBondContact O-N 3.23Å; F146-I149 VanDerWaalsContact O-N 3.15Å; F146-E150 WeakPolarHBondContact O-CB 3.39Å; F146-E150 PolarHBondContact O-N 3.48Å; F146-V189 HydrophobicContact CD1-CG1 4.45Å; F146-V189 HydrophobicContact CE1-CB 4.49Å; F146-I192 HydrophobicContact CE1-CB 4.29Å; F146-I192 HydrophobicContact CE1-CG2 3.78Å; F146-I192 HydrophobicContact CZ-CG2 3.93Å; F146-V232 HydrophobicContact CE2-CG1 3.68Å; F146-V232 HydrophobicContact CZ-CG1 4.26Å; F146-A236 HydrophobicContact CD1-CB 4.45Å; F146-A236 HydrophobicContact CD2-CB 3.98Å; F146-A236 HydrophobicContact CE1-CB 4.03Å; F146-A236 HydrophobicContact CE2-CB 3.49Å; F146-A236 VanDerWaalsContact CE2-CB 3.49Å; F146-A236 HydrophobicContact CG-CB 4.45Å; F146-A236 HydrophobicContact CZ-CB 3.53Å |
| 147 | L | 91.1 | Very high | 91.7 | Very high | 73 Ų | 73 | 57.9 Ų | 57.9 | 38% | 0.382 | 29% | 0.288 | S | S | . | . | H | α-helix | trans | -60.4 | -47.7 | -178.9 | 175.9 | 69.3 | 0 | 0 | 0 | 112.5 | A142 I149 E150 E151 | A142-L147 WeakPolarHBondContact O-CB 3.5Å; A142-L147 PolarHBondContact O-N 2.84Å; L147-I149 VanDerWaalsContact C-N 3.29Å; L147-I149 PolarHBondContact O-N 3.39Å; L147-E150 WeakPolarHBondContact O-CB 3.31Å; L147-E150 PolarHBondContact O-N 3.43Å; L147-E151 HydrophobicContact CD1-CG 4.26Å; L147-E151 WeakPolarHBondContact O-CG 3.46Å; L147-E151 PolarHBondContact O-N 3.3Å |
| 148 | P | 92.2 | Very high | 91.8 | Very high | 56 Ų | 56 | 57.9 Ų | 57.9 | 36% | 0.364 | 29% | 0.293 | S | S | . | . | H | α-helix | trans | -62.3 | -34.5 | 174.6 | -25.5 | 35.6 | 0 | 0 | 0 | 113.9 | R143 S152 | R143-P148 WeakPolarHBondContact O-CD 3.46Å; P148-S152 WeakPolarHBondContact O-CB 3.39Å; P148-S152 PolarHBondContact O-N 2.87Å; P148-S152 VanDerWaalsContact O-N 3.1Å; P148-S152 PolarHBondContact O-OG 2.99Å |
| 149 | I | 90.6 | Very high | 91.9 | Very high | 29 Ų | 29 | 65.6 Ų | 65.6 | 15% | 0.149 | 33% | 0.325 | C | S | . | . | H | α-helix | trans | -64.5 | -50.7 | 174.1 | -69.9 | 171.2 | 0 | 0 | 0 | 108.9 | I145 F146 L147 E151 S152 F153 L185 V189 | I145-I149 HydrophobicContact CG2-CD1 4.06Å; I145-I149 WeakPolarHBondContact O-CD1 3.24Å; I145-I149 VanDerWaalsContact O-CG1 3.22Å; I145-I149 WeakPolarHBondContact O-CG1 3.48Å; I145-I149 PolarHBondContact O-N 2.79Å; F146-I149 WeakPolarHBondContact O-CB 3.27Å; F146-I149 PolarHBondContact O-N 3.23Å; F146-I149 VanDerWaalsContact O-N 3.15Å; L147-I149 VanDerWaalsContact C-N 3.29Å; L147-I149 PolarHBondContact O-N 3.39Å; I149-E151 PolarHBondContact O-N 3.41Å; I149-S152 PolarHBondContact O-N 3.36Å; I149-F153 HydrophobicContact CG2-CD2 3.71Å; I149-F153 HydrophobicContact CG2-CE2 4.07Å; I149-F153 WeakPolarHBondContact O-CB 3.26Å; I149-F153 WeakPolarHBondContact O-CD2 3.44Å; I149-F153 PolarHBondContact O-N 2.78Å; I149-L185 HydrophobicContact CG2-CD2 4.31Å; I149-V189 HydrophobicContact CG2-CG1 4.47Å |
| 150 | E | 92.5 | Very high | 92.1 | Very high | 63 Ų | 63 | 66.5 Ų | 66.5 | 29% | 0.294 | 33% | 0.33 | S | S | . | . | H | α-helix | trans | -54 | -53.2 | 179.5 | -169.1 | -175.7 | 143.5 | 0 | 0 | 111.9 | F146 L147 S152 F153 Y154 G239 C243 | F146-E150 WeakPolarHBondContact O-CB 3.39Å; F146-E150 PolarHBondContact O-N 3.48Å; L147-E150 WeakPolarHBondContact O-CB 3.31Å; L147-E150 PolarHBondContact O-N 3.43Å; E150-S152 PolarHBondContact O-N 3.09Å; E150-F153 PolarHBondContact O-N 2.82Å; E150-Y154 VanDerWaalsContact O-CB 3.28Å; E150-Y154 WeakPolarHBondContact O-CB 3.49Å; E150-Y154 PolarHBondContact O-N 3.47Å; E150-G239 WeakPolarHBondContact OE2-CA 3.29Å; E150-C243 HydrophobicContact CG-CB 3.58Å |
| 151 | E | 90.8 | Very high | 92.2 | Very high | 115 Ų | 115 | 63.1 Ų | 63.1 | 54% | 0.537 | 31% | 0.313 | S | S | . | . | H | α-helix | trans | -62.9 | -43.1 | 179.9 | -70.1 | -179.2 | 167.9 | 0 | 0 | 112.1 | L147 I149 I155 | L147-E151 HydrophobicContact CD1-CG 4.26Å; L147-E151 WeakPolarHBondContact O-CG 3.46Å; L147-E151 PolarHBondContact O-N 3.3Å; I149-E151 PolarHBondContact O-N 3.41Å; E151-I155 WeakPolarHBondContact O-CG1 3.26Å; E151-I155 PolarHBondContact O-N 3.01Å |
| 152 | S | 90.3 | Very high | 92.3 | Very high | 70 Ų | 70 | 65.7 Ų | 65.7 | 49% | 0.49 | 32% | 0.323 | S | S | . | . | H | α-helix | trans | -64.8 | -42.6 | -179.2 | -64.3 | 0 | 0 | 0 | 0 | 111.8 | P148 I149 E150 F156 | P148-S152 WeakPolarHBondContact O-CB 3.39Å; P148-S152 PolarHBondContact O-N 2.87Å; P148-S152 VanDerWaalsContact O-N 3.1Å; P148-S152 PolarHBondContact O-OG 2.99Å; I149-S152 PolarHBondContact O-N 3.36Å; E150-S152 PolarHBondContact O-N 3.09Å; S152-F156 PolarHBondContact O-N 3.19Å |
| 153 | F | 93.8 | Very high | 92.5 | Very high | 28 Ų | 28 | 70.1 Ų | 70.1 | 12% | 0.123 | 34% | 0.335 | C | S | . | . | H | α-helix | trans | -83.7 | -26 | -177.2 | -74.1 | -72.6 | 0 | 0 | 0 | 113.2 | I149 E150 I155 F156 F157 V181 L185 F379 | I149-F153 HydrophobicContact CG2-CD2 3.71Å; I149-F153 HydrophobicContact CG2-CE2 4.07Å; I149-F153 WeakPolarHBondContact O-CB 3.26Å; I149-F153 WeakPolarHBondContact O-CD2 3.44Å; I149-F153 PolarHBondContact O-N 2.78Å; E150-F153 PolarHBondContact O-N 2.82Å; F153-I155 VanDerWaalsContact C-N 3.33Å; F153-I155 PolarHBondContact O-N 2.88Å; F153-F156 HydrophobicContact CD1-CB 4.24Å; F153-F156 HydrophobicContact CD1-CD1 4.27Å; F153-F156 HydrophobicContact CD1-CG 4.37Å; F153-F156 WeakPolarHBondContact O-CB 3.4Å; F153-F156 PolarHBondContact O-N 3.4Å; F153-F157 HydrophobicContact CB-CD2 4.4Å; F153-F157 HydrophobicContact CB-CE2 4.04Å; F153-F157 WeakPolarHBondContact O-CD2 3.41Å; F153-F157 WeakPolarHBondContact O-CG 3.36Å; F153-F157 PolarHBondContact O-N 2.88Å; F153-V181 HydrophobicContact CD1-CG1 3.89Å; F153-V181 HydrophobicContact CE1-CG1 3.82Å; F153-L185 HydrophobicContact CB-CD1 3.77Å; F153-L185 HydrophobicContact CD1-CD1 3.38Å; F153-L185 HydrophobicContact CD1-CD2 4.32Å; F153-L185 HydrophobicContact CD1-CG 4.35Å; F153-L185 HydrophobicContact CD2-CD1 3.68Å; F153-L185 HydrophobicContact CD2-CD2 3.59Å; F153-L185 HydrophobicContact CD2-CG 4.28Å; F153-L185 HydrophobicContact CE1-CD1 3.8Å; F153-L185 HydrophobicContact CE1-CD2 4.03Å; F153-L185 HydrophobicContact CE1-CG 4.32Å; F153-L185 HydrophobicContact CE2-CD1 4.12Å; F153-L185 HydrophobicContact CE2-CD2 3.3Å; F153-L185 HydrophobicContact CE2-CG 4.3Å; F153-L185 HydrophobicContact CG-CD1 3.3Å; F153-L185 HydrophobicContact CG-CD2 4.11Å; F153-L185 HydrophobicContact CG-CG 4.32Å; F153-L185 HydrophobicContact CZ-CD1 4.17Å; F153-L185 HydrophobicContact CZ-CD2 3.54Å; F153-L185 HydrophobicContact CZ-CG 4.31Å; F153-F379 HydrophobicContact CE1-CZ 4.12Å; F153-F379 HydrophobicContact CZ-CE1 4.47Å; F153-F379 AromaticContact CZ-CZ 3.93Å; F153-F379 HydrophobicContact CZ-CZ 3.93Å |
| 154 | Y | 94.8 | Very high | 92.3 | Very high | 88 Ų | 88 | 66 Ų | 66 | 35% | 0.345 | 33% | 0.332 | S | S | . | . | H | α-helix | trans | -54.5 | -50.4 | 164.3 | 172.3 | -103.1 | 0 | 0 | 0 | 111.2 | E150 F156 F157 A158 R163 C243 F246 A247 | E150-Y154 VanDerWaalsContact O-CB 3.28Å; E150-Y154 WeakPolarHBondContact O-CB 3.49Å; E150-Y154 PolarHBondContact O-N 3.47Å; Y154-F156 VanDerWaalsContact C-N 3.27Å; Y154-F156 PolarHBondContact O-N 2.97Å; Y154-F157 PolarHBondContact O-N 3.35Å; Y154-A158 VanDerWaalsContact O-CB 3.26Å; Y154-A158 WeakPolarHBondContact O-CB 3.37Å; Y154-A158 PolarHBondContact O-N 2.97Å; Y154-R163 PolarHBondContact OH-NH2 3.21Å; Y154-C243 WeakPolarHBondContact CD2-O 3.19Å; Y154-F246 HydrophobicContact CD2-CB 4.39Å; Y154-F246 HydrophobicContact CE2-CB 3.98Å; Y154-A247 HydrophobicContact CD2-CB 4.14Å; Y154-A247 HydrophobicContact CE2-CB 4.34Å |
| 155 | I | 92.7 | Very high | 92.3 | Very high | 90 Ų | 90 | 64.3 Ų | 64.3 | 46% | 0.462 | 32% | 0.321 | S | S | . | . | H | α-helix | trans | -62.5 | -37.7 | 178.5 | -65.8 | 168.6 | 0 | 0 | 0 | 111.1 | E151 F153 K159 | E151-I155 WeakPolarHBondContact O-CG1 3.26Å; E151-I155 PolarHBondContact O-N 3.01Å; F153-I155 VanDerWaalsContact C-N 3.33Å; F153-I155 PolarHBondContact O-N 2.88Å; I155-K159 HydrophobicContact CG2-CD 4.18Å; I155-K159 VanDerWaalsContact O-CG 3.28Å; I155-K159 WeakPolarHBondContact O-CG 3.44Å; I155-K159 PolarHBondContact O-N 3.35Å |
| 156 | F | 93.8 | Very high | 92.2 | Very high | 58 Ų | 58 | 66.8 Ų | 66.8 | 25% | 0.254 | 34% | 0.335 | S | S | . | . | H | α-helix | trans | -63.1 | -54.8 | 176.1 | 171.4 | -97 | 0 | 0 | 0 | 111.6 | S152 F153 Y154 A158 K159 V160 I177 V181 | S152-F156 PolarHBondContact O-N 3.19Å; F153-F156 HydrophobicContact CD1-CB 4.24Å; F153-F156 HydrophobicContact CD1-CD1 4.27Å; F153-F156 HydrophobicContact CD1-CG 4.37Å; F153-F156 WeakPolarHBondContact O-CB 3.4Å; F153-F156 PolarHBondContact O-N 3.4Å; Y154-F156 VanDerWaalsContact C-N 3.27Å; Y154-F156 PolarHBondContact O-N 2.97Å; F156-A158 VanDerWaalsContact C-N 3.3Å; F156-A158 PolarHBondContact O-N 3.39Å; F156-K159 PolarHBondContact O-N 3.48Å; F156-V160 HydrophobicContact CD2-CG2 4.12Å; F156-V160 HydrophobicContact CE1-CG2 4.17Å; F156-V160 HydrophobicContact CE2-CG2 3.76Å; F156-V160 HydrophobicContact CG-CG2 4.49Å; F156-V160 HydrophobicContact CZ-CG2 3.79Å; F156-V160 WeakPolarHBondContact O-CG2 3.3Å; F156-V160 PolarHBondContact O-N 3.41Å; F156-I177 HydrophobicContact CZ-CG2 3.8Å; F156-V181 HydrophobicContact CD1-CG1 4.08Å; F156-V181 HydrophobicContact CE1-CB 3.82Å; F156-V181 HydrophobicContact CE1-CG1 3.68Å; F156-V181 HydrophobicContact CE1-CG2 3.83Å; F156-V181 HydrophobicContact CZ-CB 4.3Å; F156-V181 HydrophobicContact CZ-CG1 4.35Å; F156-V181 HydrophobicContact CZ-CG2 3.78Å |
| 157 | F | 96 | Very high | 92 | Very high | 0 Ų | 0 | 66.9 Ų | 66.9 | 0% | 0 | 34% | 0.336 | C | S | . | . | H | α-helix | trans | -61.7 | -39.8 | -179.2 | -66.4 | -52 | 0 | 0 | 0 | 111.7 | F153 Y154 K159 V160 L161 A178 V181 L182 L185 F244 A247 | F153-F157 HydrophobicContact CB-CD2 4.4Å; F153-F157 HydrophobicContact CB-CE2 4.04Å; F153-F157 WeakPolarHBondContact O-CD2 3.41Å; F153-F157 WeakPolarHBondContact O-CG 3.36Å; F153-F157 PolarHBondContact O-N 2.88Å; Y154-F157 PolarHBondContact O-N 3.35Å; F157-K159 PolarHBondContact O-N 2.73Å; F157-V160 PolarHBondContact O-N 3.22Å; F157-L161 WeakPolarHBondContact O-CB 3.3Å; F157-L161 PolarHBondContact O-N 3.03Å; F157-A178 HydrophobicContact CD1-CB 4.22Å; F157-A178 HydrophobicContact CE1-CB 4.42Å; F157-A178 WeakPolarHBondContact CE1-O 3.42Å; F157-V181 HydrophobicContact CE1-CB 4.34Å; F157-V181 HydrophobicContact CE1-CG1 4.13Å; F157-V181 HydrophobicContact CZ-CG1 4.08Å; F157-L182 HydrophobicContact CE1-CB 4.27Å; F157-L182 HydrophobicContact CE2-CD1 4.48Å; F157-L182 HydrophobicContact CZ-CB 3.99Å; F157-L182 HydrophobicContact CZ-CD1 4.2Å; F157-L185 HydrophobicContact CE2-CD1 4.2Å; F157-L185 HydrophobicContact CZ-CD1 3.96Å; F157-F244 AromaticContact CD1-CD2 3.86Å; F157-F244 HydrophobicContact CD1-CD2 3.86Å; F157-F244 HydrophobicContact CD1-CE2 4.33Å; F157-F244 HydrophobicContact CD2-CB 4.08Å; F157-F244 HydrophobicContact CD2-CD2 4.05Å; F157-F244 AromaticContact CE1-CD2 3.97Å; F157-F244 HydrophobicContact CE1-CD2 3.97Å; F157-F244 HydrophobicContact CE2-CB 4.08Å; F157-F244 HydrophobicContact CE2-CD2 4.15Å; F157-F244 AromaticContact CG-CD2 3.91Å; F157-F244 HydrophobicContact CG-CD2 3.91Å; F157-F244 HydrophobicContact CZ-CD2 4.12Å; F157-A247 HydrophobicContact CB-CB 3.46Å; F157-A247 VanDerWaalsContact CB-CB 3.46Å |
| 158 | A | 93.4 | Very high | 91.7 | Very high | 37 Ų | 37 | 70.7 Ų | 70.7 | 31% | 0.306 | 35% | 0.352 | S | S | . | . | H | α-helix | trans | -66.8 | -17.4 | 178 | 0 | 0 | 0 | 0 | 0 | 113.8 | Y154 F156 A247 | Y154-A158 VanDerWaalsContact O-CB 3.26Å; Y154-A158 WeakPolarHBondContact O-CB 3.37Å; Y154-A158 PolarHBondContact O-N 2.97Å; F156-A158 VanDerWaalsContact C-N 3.3Å; F156-A158 PolarHBondContact O-N 3.39Å; A158-A247 HydrophobicContact CB-CB 4.22Å |
| 159 | K | 92.9 | Very high | 91.5 | Very high | 171 Ų | 171 | 71.2 Ų | 71.2 | 74% | 0.743 | 36% | 0.357 | S | S | * | . | H | α-helix | trans | -93.3 | -32.5 | 174.6 | -75.7 | 176.3 | 179.6 | -179.2 | 0 | 113.1 | I155 F156 F157 | I155-K159 HydrophobicContact CG2-CD 4.18Å; I155-K159 VanDerWaalsContact O-CG 3.28Å; I155-K159 WeakPolarHBondContact O-CG 3.44Å; I155-K159 PolarHBondContact O-N 3.35Å; F156-K159 PolarHBondContact O-N 3.48Å; F157-K159 PolarHBondContact O-N 2.73Å |
| 160 | V | 93.5 | Very high | 91.5 | Very high | 28 Ų | 28 | 70.7 Ų | 70.7 | 17% | 0.17 | 35% | 0.354 | C | S | . | . | H | α-helix | trans | -84.6 | -36.6 | -177.1 | 175 | 0 | 0 | 0 | 0 | 111.1 | F156 F157 D174 A178 | F156-V160 HydrophobicContact CD2-CG2 4.12Å; F156-V160 HydrophobicContact CE1-CG2 4.17Å; F156-V160 HydrophobicContact CE2-CG2 3.76Å; F156-V160 HydrophobicContact CG-CG2 4.49Å; F156-V160 HydrophobicContact CZ-CG2 3.79Å; F156-V160 WeakPolarHBondContact O-CG2 3.3Å; F156-V160 PolarHBondContact O-N 3.41Å; F157-V160 PolarHBondContact O-N 3.22Å; V160-D174 HydrophobicContact CG1-CB 3.89Å; V160-D174 WeakPolarHBondContact CG1-O 3.31Å; V160-A178 HydrophobicContact CG1-CB 4.14Å |
| 161 | L | 94.1 | Very high | 91.5 | Very high | 7 Ų | 7 | 74.5 Ų | 74.5 | 4% | 0.037 | 37% | 0.369 | C | S | . | . | S | Bend | trans | -101.2 | 146.4 | -178.7 | -61.3 | 175.1 | 0 | 0 | 0 | 111.5 | F157 V175 A178 F244 A248 | F157-L161 WeakPolarHBondContact O-CB 3.3Å; F157-L161 PolarHBondContact O-N 3.03Å; L161-V175 HydrophobicContact CD2-CG2 4.27Å; L161-A178 HydrophobicContact CD1-CB 4.08Å; L161-A178 HydrophobicContact CD2-CB 3.8Å; L161-A178 HydrophobicContact CG-CB 3.98Å; L161-F244 HydrophobicContact CD1-CD2 4.44Å; L161-F244 HydrophobicContact CD1-CE2 3.63Å; L161-F244 HydrophobicContact CD1-CZ 4.05Å; L161-A248 HydrophobicContact CD1-CB 4.4Å |
| 162 | E | 92.1 | Very high | 91.5 | Very high | 89 Ų | 89 | 76.3 Ų | 76.3 | 42% | 0.416 | 38% | 0.375 | S | S | . | . | P | Polyproline II helix | trans | -88.4 | 122 | 169.9 | -67.7 | -175.6 | -156.6 | 0 | 0 | 109.7 | G164 R165 Q170 | E162-G164 PolarHBondContact O-N 3.03Å; E162-R165 HydrophobicContact CB-CB 4.29Å; E162-R165 HydrophobicContact CB-CG 4.29Å; E162-R165 PolarHBondContact O-N 3.1Å; E162-R165 IonicContact OE1-NH1 3.41Å; E162-R165 VanDerWaalsContact OE2-CD 3.27Å; E162-R165 WeakPolarHBondContact OE2-CD 3.31Å; E162-R165 IonicContact OE2-CZ 3.9Å; E162-R165 IonicContact OE2-NE 2.65Å; E162-R165 PolarHBondContact OE2-NE 3.49Å; E162-R165 IonicContact OE2-NH1 3.63Å; E162-R165 PolarHBondContact OE2-NH1 3.48Å; E162-R165 IonicContact OE2-NH2 2.93Å; E162-Q170 HydrophobicContact CB-CG 4.49Å |
| 163 | R | 92.1 | Very high | 91.5 | Very high | 112 Ų | 112 | 80.2 Ų | 80.2 | 42% | 0.423 | 39% | 0.386 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -58.8 | 133.8 | -178.5 | -84.5 | -174.1 | 175.7 | -152.7 | -3.3 | 112.7 | Y154 R165 F246 A247 | Y154-R163 PolarHBondContact OH-NH2 3.21Å; R163-R165 PolarHBondContact O-N 3.47Å; R163-F246 PolarHBondContact NH2-O 3.05Å; R163-F246 VanDerWaalsContact NH2-O 3.12Å; R163-A247 WeakPolarHBondContact CG-O 3.32Å |
| 164 | G | 87.6 | Confident | 91.5 | Very high | 38 Ų | 38 | 81.5 Ų | 81.5 | 39% | 0.392 | 39% | 0.394 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 70.8 | 15.5 | 174.8 | 0 | 0 | 0 | 0 | 0 | 114.4 | E162 A248 | E162-G164 PolarHBondContact O-N 3.03Å; G164-A248 PolarHBondContact N-O 2.77Å |
| 165 | R | 90 | Very high | 91.4 | Very high | 119 Ų | 119 | 77.3 Ų | 77.3 | 45% | 0.449 | 38% | 0.378 | S | S | . | . | trans | -107 | 139.6 | 174.4 | -75.5 | -157.1 | 178.5 | 168 | 8.9 | 111.5 | E162 R163 Q170 Y306 | E162-R165 HydrophobicContact CB-CB 4.29Å; E162-R165 HydrophobicContact CB-CG 4.29Å; E162-R165 PolarHBondContact O-N 3.1Å; E162-R165 IonicContact OE1-NH1 3.41Å; E162-R165 VanDerWaalsContact OE2-CD 3.27Å; E162-R165 WeakPolarHBondContact OE2-CD 3.31Å; E162-R165 IonicContact OE2-CZ 3.9Å; E162-R165 IonicContact OE2-NE 2.65Å; E162-R165 PolarHBondContact OE2-NE 3.49Å; E162-R165 IonicContact OE2-NH1 3.63Å; E162-R165 PolarHBondContact OE2-NH1 3.48Å; E162-R165 IonicContact OE2-NH2 2.93Å; R163-R165 PolarHBondContact O-N 3.47Å; R165-Q170 HydrophobicContact CB-CG 3.92Å; R165-Q170 PolarHBondContact O-NE2 3.34Å; R165-Y306 WeakPolarHBondContact O-CE2 3.43Å; R165-Y306 PolarHBondContact O-OH 2.99Å | ||
| 166 | D | 88 | Confident | 91.5 | Very high | 121 Ų | 121 | 74.4 Ų | 74.4 | 65% | 0.647 | 37% | 0.367 | S | S | * | . | trans | -70.5 | 156 | 174.3 | -65.6 | -40.4 | 0 | 0 | 0 | 111.1 | E168 S169 Q170 | D166-E168 PolarHBondContact O-N 2.94Å; D166-S169 PolarHBondContact N-OG 3.16Å; D166-S169 PolarHBondContact O-N 3.38Å; D166-S169 VanDerWaalsContact O-N 3.11Å; D166-S169 PolarHBondContact O-OG 2.96Å; D166-Q170 PolarHBondContact O-NE2 3.09Å; D166-Q170 VanDerWaalsContact O-NE2 3.14Å | ||
| 167 | V | 88.9 | Confident | 91.4 | Very high | 12 Ų | 12 | 75.3 Ų | 75.3 | 7% | 0.073 | 37% | 0.374 | C | S | . | . | G | 310 helix | trans | -55.3 | -36.8 | -179.4 | 166.7 | 0 | 0 | 0 | 0 | 113 | S169 Q170 V175 Y306 F307 W312 | V167-S169 VanDerWaalsContact C-N 3.29Å; V167-S169 PolarHBondContact O-N 2.98Å; V167-Q170 PolarHBondContact O-N 3.37Å; V167-V175 HydrophobicContact CB-CG1 4.49Å; V167-V175 HydrophobicContact CG1-CG1 3.81Å; V167-V175 HydrophobicContact CG2-CG1 4.09Å; V167-Y306 HydrophobicContact CG2-CD1 3.59Å; V167-Y306 HydrophobicContact CG2-CE1 3.33Å; V167-Y306 HydrophobicContact CG2-CE2 4.4Å; V167-Y306 HydrophobicContact CG2-CG 4.25Å; V167-Y306 WeakPolarHBondContact CG2-O 3.34Å; V167-F307 HydrophobicContact CG2-CD1 4.3Å; V167-F307 HydrophobicContact CG2-CE1 4.47Å; V167-W312 HydrophobicContact CG1-CE3 4.2Å; V167-W312 HydrophobicContact CG1-CZ3 3.62Å |
| 168 | E | 86.5 | Confident | 91.3 | Very high | 154 Ų | 154 | 75.3 Ų | 75.3 | 72% | 0.72 | 37% | 0.374 | S | S | * | . | G | 310 helix | trans | -70 | -25.8 | -178.1 | -63.9 | -179.6 | -173.4 | 0 | 0 | 113.5 | D166 Q170 S309 | D166-E168 PolarHBondContact O-N 2.94Å; E168-Q170 VanDerWaalsContact C-N 3.34Å; E168-S309 VanDerWaalsContact OE1-CB 3.28Å; E168-S309 WeakPolarHBondContact OE1-CB 3.42Å |
| 169 | S | 87 | Confident | 91.4 | Very high | 67 Ų | 67 | 73.7 Ų | 73.7 | 47% | 0.469 | 36% | 0.36 | S | S | . | . | G | 310 helix | trans | -90.3 | 1 | -176.7 | 70.9 | 0 | 0 | 0 | 0 | 113.7 | D166 V167 | D166-S169 PolarHBondContact N-OG 3.16Å; D166-S169 PolarHBondContact O-N 3.38Å; D166-S169 VanDerWaalsContact O-N 3.11Å; D166-S169 PolarHBondContact O-OG 2.96Å; V167-S169 VanDerWaalsContact C-N 3.29Å; V167-S169 PolarHBondContact O-N 2.98Å |
| 170 | Q | 91.4 | Very high | 91.4 | Very high | 18 Ų | 18 | 71.8 Ų | 71.8 | 8% | 0.084 | 35% | 0.354 | C | S | . | . | S | Bend | trans | -113.3 | 164.8 | -176 | -69.7 | 176.9 | 88.2 | 0 | 0 | 111.4 | E162 R165 D166 V167 E168 K172 V175 Y306 | E162-Q170 HydrophobicContact CB-CG 4.49Å; R165-Q170 HydrophobicContact CB-CG 3.92Å; R165-Q170 PolarHBondContact O-NE2 3.34Å; D166-Q170 PolarHBondContact O-NE2 3.09Å; D166-Q170 VanDerWaalsContact O-NE2 3.14Å; V167-Q170 PolarHBondContact O-N 3.37Å; E168-Q170 VanDerWaalsContact C-N 3.34Å; Q170-K172 PolarHBondContact O-N 2.95Å; Q170-V175 HydrophobicContact CB-CG2 3.79Å; Q170-Y306 PolarHBondContact NE2-OH 3.32Å |
| 171 | K | 91.3 | Very high | 91.4 | Very high | 142 Ų | 142 | 71.2 Ų | 71.2 | 62% | 0.617 | 35% | 0.351 | S | S | * | . | trans | -63.9 | 121.8 | 175 | -66 | -178.9 | -171.2 | 167 | 0 | 109.5 | E173 D174 V175 | K171-E173 PolarHBondContact O-N 3.33Å; K171-E173 VanDerWaalsContact O-N 3.16Å; K171-D174 HydrophobicContact CB-CB 4.32Å; K171-D174 WeakPolarHBondContact CD-OD2 3.3Å; K171-D174 PolarHBondContact O-N 3.48Å; K171-D174 VanDerWaalsContact O-N 3.12Å; K171-V175 PolarHBondContact O-N 3.08Å; K171-V175 VanDerWaalsContact O-N 3.15Å | ||
| 172 | K | 90.8 | Very high | 91.5 | Very high | 153 Ų | 153 | 70.9 Ų | 70.9 | 67% | 0.665 | 35% | 0.349 | S | S | * | . | H | α-helix | trans | -57.2 | -32.6 | -178.1 | -67.8 | -174.4 | 178.2 | -179.2 | 0 | 112.9 | Q170 A176 W312 | Q170-K172 PolarHBondContact O-N 2.95Å; K172-A176 VanDerWaalsContact O-CB 3.28Å; K172-A176 WeakPolarHBondContact O-CB 3.36Å; K172-A176 PolarHBondContact O-N 3.37Å; K172-W312 HydrophobicContact CB-CH2 4.12Å; K172-W312 HydrophobicContact CG-CH2 4.37Å; K172-W312 WeakPolarHBondContact O-CZ2 3.32Å |
| 173 | E | 91.5 | Very high | 91.7 | Very high | 153 Ų | 153 | 68.8 Ų | 68.8 | 72% | 0.715 | 34% | 0.339 | S | S | * | . | H | α-helix | trans | -65 | -47.4 | 177.2 | -66.9 | 173.9 | -173.1 | 0 | 0 | 111.8 | K171 V175 A176 I177 | K171-E173 PolarHBondContact O-N 3.33Å; K171-E173 VanDerWaalsContact O-N 3.16Å; E173-V175 PolarHBondContact O-N 3.39Å; E173-A176 WeakPolarHBondContact O-CB 3.21Å; E173-A176 PolarHBondContact O-N 3.2Å; E173-I177 VanDerWaalsContact O-CG1 3.31Å; E173-I177 WeakPolarHBondContact O-CG1 3.19Å; E173-I177 PolarHBondContact O-N 2.98Å |
| 174 | D | 92.3 | Very high | 91.7 | Very high | 54 Ų | 54 | 64 Ų | 64 | 29% | 0.289 | 32% | 0.323 | S | S | . | . | H | α-helix | trans | -65.1 | -41.8 | 179.7 | -66.7 | -28 | 0 | 0 | 0 | 111.4 | V160 K171 I177 A178 | V160-D174 HydrophobicContact CG1-CB 3.89Å; V160-D174 WeakPolarHBondContact CG1-O 3.31Å; K171-D174 HydrophobicContact CB-CB 4.32Å; K171-D174 WeakPolarHBondContact CD-OD2 3.3Å; K171-D174 PolarHBondContact O-N 3.48Å; K171-D174 VanDerWaalsContact O-N 3.12Å; D174-I177 PolarHBondContact O-N 3.48Å; D174-A178 WeakPolarHBondContact O-CB 3.3Å; D174-A178 PolarHBondContact O-N 3.47Å |
| 175 | V | 93.7 | Very high | 92 | Very high | 0 Ų | 0 | 62.2 Ų | 62.2 | 0% | 0 | 30% | 0.304 | C | S | . | . | H | α-helix | trans | -65.8 | -39.6 | 175.9 | -178 | 0 | 0 | 0 | 0 | 111.5 | L161 V167 Q170 K171 E173 A178 A179 F307 W312 | L161-V175 HydrophobicContact CD2-CG2 4.27Å; V167-V175 HydrophobicContact CB-CG1 4.49Å; V167-V175 HydrophobicContact CG1-CG1 3.81Å; V167-V175 HydrophobicContact CG2-CG1 4.09Å; Q170-V175 HydrophobicContact CB-CG2 3.79Å; K171-V175 PolarHBondContact O-N 3.08Å; K171-V175 VanDerWaalsContact O-N 3.15Å; E173-V175 PolarHBondContact O-N 3.39Å; V175-A178 PolarHBondContact O-N 3.2Å; V175-A179 WeakPolarHBondContact O-CB 3.32Å; V175-A179 PolarHBondContact O-N 3.08Å; V175-F307 HydrophobicContact CG1-CD1 4.5Å; V175-F307 HydrophobicContact CG1-CE1 3.78Å; V175-W312 HydrophobicContact CB-CE3 4.49Å; V175-W312 HydrophobicContact CB-CH2 4.2Å; V175-W312 HydrophobicContact CB-CZ3 3.97Å; V175-W312 HydrophobicContact CG1-CE3 3.67Å; V175-W312 HydrophobicContact CG1-CH2 4.23Å; V175-W312 HydrophobicContact CG1-CZ3 3.52Å |
| 176 | A | 93.8 | Very high | 92.3 | Very high | 29 Ų | 29 | 56.6 Ų | 56.6 | 24% | 0.24 | 28% | 0.283 | C | S | . | . | H | α-helix | trans | -61 | -46 | 176 | 0 | 0 | 0 | 0 | 0 | 111.3 | K172 E173 A179 E180 W312 | K172-A176 VanDerWaalsContact O-CB 3.28Å; K172-A176 WeakPolarHBondContact O-CB 3.36Å; K172-A176 PolarHBondContact O-N 3.37Å; E173-A176 WeakPolarHBondContact O-CB 3.21Å; E173-A176 PolarHBondContact O-N 3.2Å; A176-A179 PolarHBondContact O-N 3.35Å; A176-E180 WeakPolarHBondContact O-CB 3.39Å; A176-E180 PolarHBondContact O-N 2.84Å; A176-W312 HydrophobicContact CB-CZ2 3.78Å |
| 177 | I | 92.8 | Very high | 92.7 | Very high | 77 Ų | 77 | 51.9 Ų | 51.9 | 40% | 0.395 | 26% | 0.257 | S | S | . | . | H | α-helix | trans | -60.6 | -46.8 | 176.5 | -69.4 | 165.6 | 0 | 0 | 0 | 110.5 | F156 E173 D174 A179 E180 V181 | F156-I177 HydrophobicContact CZ-CG2 3.8Å; E173-I177 VanDerWaalsContact O-CG1 3.31Å; E173-I177 WeakPolarHBondContact O-CG1 3.19Å; E173-I177 PolarHBondContact O-N 2.98Å; D174-I177 PolarHBondContact O-N 3.48Å; I177-A179 VanDerWaalsContact C-N 3.34Å; I177-A179 PolarHBondContact O-N 3.35Å; I177-E180 PolarHBondContact O-N 3.26Å; I177-V181 HydrophobicContact CG2-CG2 4.44Å; I177-V181 WeakPolarHBondContact O-CB 3.36Å; I177-V181 VanDerWaalsContact O-CG2 3.27Å; I177-V181 WeakPolarHBondContact O-CG2 3.36Å; I177-V181 PolarHBondContact O-N 2.88Å |
| 178 | A | 94.4 | Very high | 92.9 | Very high | 0 Ų | 0 | 52.4 Ų | 52.4 | 0% | 0 | 26% | 0.259 | C | S | . | . | H | α-helix | trans | -61.4 | -42.2 | 178.5 | 0 | 0 | 0 | 0 | 0 | 112 | F157 V160 L161 D174 V175 L182 | F157-A178 HydrophobicContact CD1-CB 4.22Å; F157-A178 HydrophobicContact CE1-CB 4.42Å; F157-A178 WeakPolarHBondContact CE1-O 3.42Å; V160-A178 HydrophobicContact CG1-CB 4.14Å; L161-A178 HydrophobicContact CD1-CB 4.08Å; L161-A178 HydrophobicContact CD2-CB 3.8Å; L161-A178 HydrophobicContact CG-CB 3.98Å; D174-A178 WeakPolarHBondContact O-CB 3.3Å; D174-A178 PolarHBondContact O-N 3.47Å; V175-A178 PolarHBondContact O-N 3.2Å; A178-L182 VanDerWaalsContact O-CB 3.27Å; A178-L182 WeakPolarHBondContact O-CB 3.33Å; A178-L182 PolarHBondContact O-N 3.16Å |
| 179 | A | 95.3 | Very high | 93.3 | Very high | 3 Ų | 3 | 45.1 Ų | 45.1 | 3% | 0.025 | 23% | 0.225 | C | C | . | . | H | α-helix | trans | -65.7 | -45.3 | 177.9 | 0 | 0 | 0 | 0 | 0 | 112.3 | V175 A176 I177 L182 E183 F307 W312 P314 | V175-A179 WeakPolarHBondContact O-CB 3.32Å; V175-A179 PolarHBondContact O-N 3.08Å; A176-A179 PolarHBondContact O-N 3.35Å; I177-A179 VanDerWaalsContact C-N 3.34Å; I177-A179 PolarHBondContact O-N 3.35Å; A179-L182 PolarHBondContact O-N 3.44Å; A179-E183 WeakPolarHBondContact O-CB 3.38Å; A179-E183 PolarHBondContact O-N 3.4Å; A179-F307 HydrophobicContact CB-CE1 3.78Å; A179-F307 HydrophobicContact CB-CZ 4.05Å; A179-W312 HydrophobicContact CB-CB 3.67Å; A179-W312 HydrophobicContact CB-CG 4.01Å; A179-P314 HydrophobicContact CB-CB 4.5Å; A179-P314 WeakPolarHBondContact O-CB 3.4Å |
| 180 | E | 93.1 | Very high | 93.7 | Very high | 131 Ų | 131 | 42.8 Ų | 42.8 | 61% | 0.612 | 21% | 0.207 | S | C | * | . | H | α-helix | trans | -62.4 | -44.3 | 178.2 | -175.2 | -178.6 | 174.3 | 0 | 0 | 111.6 | A176 I177 E183 C184 | A176-E180 WeakPolarHBondContact O-CB 3.39Å; A176-E180 PolarHBondContact O-N 2.84Å; I177-E180 PolarHBondContact O-N 3.26Å; E180-E183 PolarHBondContact O-N 3.23Å; E180-C184 PolarHBondContact O-N 3.42Å; E180-C184 PolarHBondContact O-SG 3.05Å |
| 181 | V | 93.6 | Very high | 93.9 | Very high | 17 Ų | 17 | 42.3 Ų | 42.3 | 10% | 0.103 | 21% | 0.205 | C | C | . | . | H | α-helix | trans | -64.6 | -43.8 | 176.8 | 172.2 | 0 | 0 | 0 | 0 | 110.8 | F153 F156 F157 I177 E183 C184 L185 F379 | F153-V181 HydrophobicContact CD1-CG1 3.89Å; F153-V181 HydrophobicContact CE1-CG1 3.82Å; F156-V181 HydrophobicContact CD1-CG1 4.08Å; F156-V181 HydrophobicContact CE1-CB 3.82Å; F156-V181 HydrophobicContact CE1-CG1 3.68Å; F156-V181 HydrophobicContact CE1-CG2 3.83Å; F156-V181 HydrophobicContact CZ-CB 4.3Å; F156-V181 HydrophobicContact CZ-CG1 4.35Å; F156-V181 HydrophobicContact CZ-CG2 3.78Å; F157-V181 HydrophobicContact CE1-CB 4.34Å; F157-V181 HydrophobicContact CE1-CG1 4.13Å; F157-V181 HydrophobicContact CZ-CG1 4.08Å; I177-V181 HydrophobicContact CG2-CG2 4.44Å; I177-V181 WeakPolarHBondContact O-CB 3.36Å; I177-V181 VanDerWaalsContact O-CG2 3.27Å; I177-V181 WeakPolarHBondContact O-CG2 3.36Å; I177-V181 PolarHBondContact O-N 2.88Å; V181-E183 VanDerWaalsContact C-N 3.35Å; V181-E183 PolarHBondContact O-N 2.88Å; V181-C184 PolarHBondContact O-N 3.07Å; V181-L185 HydrophobicContact CG1-CD1 3.68Å; V181-L185 HydrophobicContact CG1-CG 4.19Å; V181-L185 WeakPolarHBondContact O-CB 3.43Å; V181-L185 WeakPolarHBondContact O-CG 3.4Å; V181-L185 PolarHBondContact O-N 2.92Å; V181-F379 HydrophobicContact CG1-CE2 4.25Å; V181-F379 HydrophobicContact CG1-CZ 4.33Å; V181-F379 HydrophobicContact CG2-CE2 4.21Å |
| 182 | L | 95.9 | Very high | 94 | Very high | 0 Ų | 0 | 37.6 Ų | 37.6 | 0% | 0 | 19% | 0.187 | C | C | . | . | H | α-helix | trans | -60.6 | -43.9 | 176.5 | -179.4 | 61.6 | 0 | 0 | 0 | 111.7 | F157 A178 A179 L185 L186 V240 F244 I303 F307 P314 | F157-L182 HydrophobicContact CE1-CB 4.27Å; F157-L182 HydrophobicContact CE2-CD1 4.48Å; F157-L182 HydrophobicContact CZ-CB 3.99Å; F157-L182 HydrophobicContact CZ-CD1 4.2Å; A178-L182 VanDerWaalsContact O-CB 3.27Å; A178-L182 WeakPolarHBondContact O-CB 3.33Å; A178-L182 PolarHBondContact O-N 3.16Å; A179-L182 PolarHBondContact O-N 3.44Å; L182-L185 PolarHBondContact O-N 3.47Å; L182-L186 HydrophobicContact CD1-CD1 4.07Å; L182-L186 HydrophobicContact CD1-CG 4.07Å; L182-L186 HydrophobicContact CG-CD1 3.96Å; L182-L186 HydrophobicContact CG-CG 4.39Å; L182-L186 WeakPolarHBondContact O-CB 3.16Å; L182-L186 VanDerWaalsContact O-CG 3.28Å; L182-L186 WeakPolarHBondContact O-CG 3.11Å; L182-L186 PolarHBondContact O-N 3Å; L182-V240 HydrophobicContact CD1-CG1 3.96Å; L182-F244 HydrophobicContact CD1-CB 3.89Å; L182-F244 HydrophobicContact CD1-CD2 4.26Å; L182-F244 HydrophobicContact CD1-CG 4.1Å; L182-F244 HydrophobicContact CD2-CB 4.41Å; L182-F244 HydrophobicContact CD2-CD1 3.95Å; L182-F244 HydrophobicContact CD2-CD2 3.73Å; L182-F244 HydrophobicContact CD2-CE1 4.15Å; L182-F244 HydrophobicContact CD2-CE2 3.92Å; L182-F244 HydrophobicContact CD2-CG 3.74Å; L182-F244 HydrophobicContact CD2-CZ 4.15Å; L182-F244 HydrophobicContact CG-CD2 4.39Å; L182-F244 HydrophobicContact CG-CG 4.5Å; L182-I303 HydrophobicContact CD2-CD1 4.43Å; L182-I303 HydrophobicContact CD2-CG2 4.09Å; L182-F307 HydrophobicContact CD2-CE2 4.27Å; L182-P314 HydrophobicContact CB-CB 4.06Å; L182-P314 HydrophobicContact CD2-CB 3.8Å; L182-P314 HydrophobicContact CD2-CG 3.89Å; L182-P314 HydrophobicContact CG-CB 3.97Å |
| 183 | E | 95.5 | Very high | 94.3 | Very high | 45 Ų | 45 | 30.3 Ų | 30.3 | 21% | 0.21 | 16% | 0.155 | C | C | . | . | H | α-helix | trans | -59 | -48.7 | 176.6 | -169.9 | 169.8 | 166.4 | 0 | 0 | 111.7 | A179 E180 V181 L185 K187 P314 G317 | A179-E183 WeakPolarHBondContact O-CB 3.38Å; A179-E183 PolarHBondContact O-N 3.4Å; E180-E183 PolarHBondContact O-N 3.23Å; V181-E183 VanDerWaalsContact C-N 3.35Å; V181-E183 PolarHBondContact O-N 2.88Å; E183-L185 VanDerWaalsContact C-N 3.35Å; E183-L185 PolarHBondContact O-N 3.38Å; E183-K187 WeakPolarHBondContact O-CB 3.35Å; E183-K187 PolarHBondContact O-N 2.67Å; E183-K187 VanDerWaalsContact O-N 3.09Å; E183-P314 WeakPolarHBondContact CA-O 3.31Å; E183-P314 HydrophobicContact CB-CB 4.3Å; E183-G317 WeakPolarHBondContact O-CA 3.29Å |
| 184 | C | 92.8 | Very high | 94.5 | Very high | 12 Ų | 12 | 24.5 Ų | 24.5 | 8% | 0.081 | 13% | 0.129 | C | C | . | . | H | α-helix | trans | -63.6 | -39.8 | 179 | -69.1 | 0 | 0 | 0 | 0 | 112.1 | E180 V181 K187 L188 F379 | E180-C184 PolarHBondContact O-N 3.42Å; E180-C184 PolarHBondContact O-SG 3.05Å; V181-C184 PolarHBondContact O-N 3.07Å; C184-K187 PolarHBondContact O-N 3.3Å; C184-L188 WeakPolarHBondContact O-CB 3.36Å; C184-L188 PolarHBondContact O-N 2.79Å; C184-F379 HydrophobicContact CB-CB 4.11Å; C184-F379 HydrophobicContact CB-CD1 3.99Å; C184-F379 HydrophobicContact CB-CD2 3.79Å; C184-F379 HydrophobicContact CB-CE1 4.35Å; C184-F379 HydrophobicContact CB-CE2 4.17Å; C184-F379 HydrophobicContact CB-CG 3.69Å; C184-F379 HydrophobicContact CB-CZ 4.44Å |
| 185 | L | 94.1 | Very high | 94.7 | Very high | 0 Ų | 0 | 23.3 Ų | 23.3 | 0% | 0 | 12% | 0.122 | C | C | . | . | H | α-helix | trans | -69.7 | -45 | 179.3 | -71.6 | 171 | 0 | 0 | 0 | 112.8 | I149 F153 F157 V181 L182 E183 K187 L188 V189 V240 F379 | I149-L185 HydrophobicContact CG2-CD2 4.31Å; F153-L185 HydrophobicContact CB-CD1 3.77Å; F153-L185 HydrophobicContact CD1-CD1 3.38Å; F153-L185 HydrophobicContact CD1-CD2 4.32Å; F153-L185 HydrophobicContact CD1-CG 4.35Å; F153-L185 HydrophobicContact CD2-CD1 3.68Å; F153-L185 HydrophobicContact CD2-CD2 3.59Å; F153-L185 HydrophobicContact CD2-CG 4.28Å; F153-L185 HydrophobicContact CE1-CD1 3.8Å; F153-L185 HydrophobicContact CE1-CD2 4.03Å; F153-L185 HydrophobicContact CE1-CG 4.32Å; F153-L185 HydrophobicContact CE2-CD1 4.12Å; F153-L185 HydrophobicContact CE2-CD2 3.3Å; F153-L185 HydrophobicContact CE2-CG 4.3Å; F153-L185 HydrophobicContact CG-CD1 3.3Å; F153-L185 HydrophobicContact CG-CD2 4.11Å; F153-L185 HydrophobicContact CG-CG 4.32Å; F153-L185 HydrophobicContact CZ-CD1 4.17Å; F153-L185 HydrophobicContact CZ-CD2 3.54Å; F153-L185 HydrophobicContact CZ-CG 4.31Å; F157-L185 HydrophobicContact CE2-CD1 4.2Å; F157-L185 HydrophobicContact CZ-CD1 3.96Å; V181-L185 HydrophobicContact CG1-CD1 3.68Å; V181-L185 HydrophobicContact CG1-CG 4.19Å; V181-L185 WeakPolarHBondContact O-CB 3.43Å; V181-L185 WeakPolarHBondContact O-CG 3.4Å; V181-L185 PolarHBondContact O-N 2.92Å; L182-L185 PolarHBondContact O-N 3.47Å; E183-L185 VanDerWaalsContact C-N 3.35Å; E183-L185 PolarHBondContact O-N 3.38Å; L185-K187 PolarHBondContact O-N 3.05Å; L185-L188 WeakPolarHBondContact O-CB 3.4Å; L185-L188 PolarHBondContact O-N 3.37Å; L185-L188 VanDerWaalsContact O-N 3.16Å; L185-V189 WeakPolarHBondContact O-CG2 3.47Å; L185-V189 PolarHBondContact O-N 2.8Å; L185-V240 HydrophobicContact CB-CG1 3.82Å; L185-F379 HydrophobicContact CD2-CE1 3.92Å; L185-F379 HydrophobicContact CD2-CZ 3.98Å; L185-F379 HydrophobicContact CG-CE1 4.48Å; L185-F379 HydrophobicContact CG-CZ 4.23Å |
| 186 | L | 96.1 | Very high | 94.8 | Very high | 0 Ų | 0 | 25 Ų | 25 | 0% | 0 | 13% | 0.131 | C | C | . | . | H | α-helix | trans | -57.4 | -43.8 | 175.7 | -73 | 171.5 | 0 | 0 | 0 | 110.3 | L182 L190 V240 T241 L315 L318 | L182-L186 HydrophobicContact CD1-CD1 4.07Å; L182-L186 HydrophobicContact CD1-CG 4.07Å; L182-L186 HydrophobicContact CG-CD1 3.96Å; L182-L186 HydrophobicContact CG-CG 4.39Å; L182-L186 WeakPolarHBondContact O-CB 3.16Å; L182-L186 VanDerWaalsContact O-CG 3.28Å; L182-L186 WeakPolarHBondContact O-CG 3.11Å; L182-L186 PolarHBondContact O-N 3Å; L186-L190 WeakPolarHBondContact O-CB 3.32Å; L186-L190 PolarHBondContact O-N 3.27Å; L186-V240 HydrophobicContact CD2-CB 4.11Å; L186-V240 HydrophobicContact CD2-CG1 3.71Å; L186-V240 HydrophobicContact CG-CG1 4.02Å; L186-T241 HydrophobicContact CD2-CG2 3.58Å; L186-L315 HydrophobicContact CD1-CD2 4.2Å; L186-L318 HydrophobicContact CB-CD2 4.21Å; L186-L318 HydrophobicContact CB-CG 4.35Å; L186-L318 HydrophobicContact CD1-CG 4.37Å; L186-L318 HydrophobicContact CD2-CD2 4.13Å |
| 187 | K | 95.1 | Very high | 94.9 | Very high | 23 Ų | 23 | 24.3 Ų | 24.3 | 10% | 0.1 | 13% | 0.125 | C | C | . | . | H | α-helix | trans | -62.9 | -46.1 | 175.3 | -176.6 | 172.7 | -80.9 | -163.5 | 0 | 112.4 | E183 C184 L185 L190 V191 G317 E373 L376 | E183-K187 WeakPolarHBondContact O-CB 3.35Å; E183-K187 PolarHBondContact O-N 2.67Å; E183-K187 VanDerWaalsContact O-N 3.09Å; C184-K187 PolarHBondContact O-N 3.3Å; L185-K187 PolarHBondContact O-N 3.05Å; K187-L190 PolarHBondContact O-N 3.49Å; K187-V191 WeakPolarHBondContact O-CB 3.35Å; K187-V191 VanDerWaalsContact O-CG2 3.27Å; K187-V191 WeakPolarHBondContact O-CG2 3.39Å; K187-V191 PolarHBondContact O-N 2.82Å; K187-G317 WeakPolarHBondContact CA-O 3.27Å; K187-G317 WeakPolarHBondContact CB-O 3.36Å; K187-G317 PolarHBondContact N-O 3.28Å; K187-E373 WeakPolarHBondContact CD-OE2 3.31Å; K187-E373 WeakPolarHBondContact CE-OE2 3.37Å; K187-E373 IonicContact NZ-OE2 3.51Å; K187-E373 PolarHBondContact NZ-OE2 2.89Å; K187-L376 HydrophobicContact CD-CB 4.28Å; K187-L376 HydrophobicContact CG-CD2 4.45Å |
| 188 | L | 93.5 | Very high | 95.1 | Very high | 22 Ų | 22 | 21.9 Ų | 21.9 | 12% | 0.115 | 11% | 0.113 | C | C | . | . | H | α-helix | trans | -56.1 | -56 | 178.2 | -179.1 | 61.2 | 0 | 0 | 0 | 111.5 | C184 L185 L190 V191 I192 L376 V380 L384 | C184-L188 WeakPolarHBondContact O-CB 3.36Å; C184-L188 PolarHBondContact O-N 2.79Å; L185-L188 WeakPolarHBondContact O-CB 3.4Å; L185-L188 PolarHBondContact O-N 3.37Å; L185-L188 VanDerWaalsContact O-N 3.16Å; L188-L190 VanDerWaalsContact C-N 3.33Å; L188-L190 PolarHBondContact O-N 3.36Å; L188-V191 PolarHBondContact O-N 3.21Å; L188-I192 HydrophobicContact CD1-CD1 3.91Å; L188-I192 HydrophobicContact CG-CD1 3.99Å; L188-I192 WeakPolarHBondContact O-CG1 3.16Å; L188-I192 PolarHBondContact O-N 2.97Å; L188-L376 HydrophobicContact CB-CD1 3.57Å; L188-L376 HydrophobicContact CD1-CD1 3.9Å; L188-L376 HydrophobicContact CD1-CD2 4.47Å; L188-L376 HydrophobicContact CG-CD1 4.27Å; L188-V380 HydrophobicContact CD1-CG2 4.28Å; L188-L384 HydrophobicContact CD2-CD1 4.39Å |
| 189 | V | 94.6 | Very high | 95.2 | Very high | 1 Ų | 1 | 23 Ų | 23 | 1% | 0.006 | 12% | 0.118 | C | C | . | . | H | α-helix | trans | -71.3 | -31.7 | -174.2 | -57.2 | 0 | 0 | 0 | 0 | 111.6 | F146 I149 L185 G193 A236 V240 | F146-V189 HydrophobicContact CD1-CG1 4.45Å; F146-V189 HydrophobicContact CE1-CB 4.49Å; I149-V189 HydrophobicContact CG2-CG1 4.47Å; L185-V189 WeakPolarHBondContact O-CG2 3.47Å; L185-V189 PolarHBondContact O-N 2.8Å; V189-G193 PolarHBondContact O-N 3.44Å; V189-A236 HydrophobicContact CB-CB 4.05Å; V189-A236 HydrophobicContact CG2-CB 4.33Å; V189-A236 WeakPolarHBondContact CG2-O 3.45Å; V189-V240 HydrophobicContact CB-CG2 4.21Å; V189-V240 HydrophobicContact CG1-CG2 3.59Å; V189-V240 HydrophobicContact CG2-CB 4.25Å; V189-V240 HydrophobicContact CG2-CG2 3.7Å |
| 190 | L | 95.8 | Very high | 95.1 | Very high | 19 Ų | 19 | 23.8 Ų | 23.8 | 10% | 0.099 | 13% | 0.127 | C | C | . | . | H | α-helix | trans | -64 | -48.5 | 173.2 | -174.6 | 80.4 | 0 | 0 | 0 | 111.1 | L186 K187 L188 I192 G193 L194 L233 V237 L318 P320 | L186-L190 WeakPolarHBondContact O-CB 3.32Å; L186-L190 PolarHBondContact O-N 3.27Å; K187-L190 PolarHBondContact O-N 3.49Å; L188-L190 VanDerWaalsContact C-N 3.33Å; L188-L190 PolarHBondContact O-N 3.36Å; L190-I192 PolarHBondContact O-N 3.22Å; L190-G193 PolarHBondContact O-N 3.35Å; L190-L194 HydrophobicContact CD2-CD1 4.32Å; L190-L194 HydrophobicContact CG-CD1 4.05Å; L190-L194 HydrophobicContact CG-CG 4.33Å; L190-L194 WeakPolarHBondContact O-CB 3.37Å; L190-L194 VanDerWaalsContact O-CG 3.28Å; L190-L194 WeakPolarHBondContact O-CG 3.3Å; L190-L194 PolarHBondContact O-N 3.47Å; L190-L233 HydrophobicContact CD1-CD1 3.81Å; L190-V237 HydrophobicContact CD1-CG2 3.87Å; L190-L318 HydrophobicContact CD1-CD2 4.4Å; L190-L318 VanDerWaalsContact CD2-O 3.3Å; L190-L318 WeakPolarHBondContact CD2-O 3.5Å; L190-P320 HydrophobicContact CD2-CB 4.46Å; L190-P320 HydrophobicContact CD2-CG 4.03Å |
| 191 | V | 95.4 | Very high | 95.2 | Very high | 7 Ų | 7 | 23 Ų | 23 | 4% | 0.042 | 12% | 0.119 | C | C | . | . | H | α-helix | trans | -61.5 | -44.7 | 179.1 | 170.7 | 0 | 0 | 0 | 0 | 110.8 | K187 L188 L194 I195 L324 V369 | K187-V191 WeakPolarHBondContact O-CB 3.35Å; K187-V191 VanDerWaalsContact O-CG2 3.27Å; K187-V191 WeakPolarHBondContact O-CG2 3.39Å; K187-V191 PolarHBondContact O-N 2.82Å; L188-V191 PolarHBondContact O-N 3.21Å; V191-L194 PolarHBondContact O-N 3.03Å; V191-I195 HydrophobicContact CG1-CD1 4.01Å; V191-I195 VanDerWaalsContact O-CG1 3.28Å; V191-I195 WeakPolarHBondContact O-CG1 3.32Å; V191-I195 PolarHBondContact O-N 3.2Å; V191-L324 HydrophobicContact CG1-CD2 4.35Å; V191-L324 HydrophobicContact CG2-CD2 3.8Å; V191-V369 HydrophobicContact CG1-CG1 4.34Å; V191-V369 HydrophobicContact CG1-CG2 3.67Å |
| 192 | I | 94.8 | Very high | 95.2 | Very high | 43 Ų | 43 | 22.2 Ų | 22.2 | 22% | 0.221 | 11% | 0.114 | C | C | . | . | H | α-helix | trans | -60.6 | -47.7 | 175.2 | -66.1 | 168.5 | 0 | 0 | 0 | 110.6 | F146 L188 L190 L194 I195 I196 | F146-I192 HydrophobicContact CE1-CB 4.29Å; F146-I192 HydrophobicContact CE1-CG2 3.78Å; F146-I192 HydrophobicContact CZ-CG2 3.93Å; L188-I192 HydrophobicContact CD1-CD1 3.91Å; L188-I192 HydrophobicContact CG-CD1 3.99Å; L188-I192 WeakPolarHBondContact O-CG1 3.16Å; L188-I192 PolarHBondContact O-N 2.97Å; L190-I192 PolarHBondContact O-N 3.22Å; I192-L194 VanDerWaalsContact C-N 3.33Å; I192-L194 PolarHBondContact O-N 3.03Å; I192-I195 PolarHBondContact O-N 2.65Å; I192-I196 HydrophobicContact CG2-CD1 3.78Å; I192-I196 VanDerWaalsContact O-CG1 3.32Å; I192-I196 WeakPolarHBondContact O-CG1 3.43Å; I192-I196 PolarHBondContact O-N 3.33Å |
| 193 | G | 96.1 | Very high | 95.1 | Very high | 0 Ų | 0 | 24 Ų | 24 | 0% | 0 | 12% | 0.121 | C | C | . | . | H | α-helix | trans | -60.9 | -39.6 | 178.5 | 0 | 0 | 0 | 0 | 0 | 112.9 | V189 L190 I196 A197 | V189-G193 PolarHBondContact O-N 3.44Å; L190-G193 PolarHBondContact O-N 3.35Å; G193-I196 PolarHBondContact O-N 2.96Å; G193-A197 WeakPolarHBondContact O-CB 3.33Å; G193-A197 PolarHBondContact O-N 2.9Å |
| 194 | L | 96.6 | Very high | 95.1 | Very high | 31 Ų | 31 | 21.9 Ų | 21.9 | 16% | 0.162 | 11% | 0.112 | C | C | . | . | H | α-helix | trans | -66.9 | -43.4 | 177.8 | -78.2 | 174.9 | 0 | 0 | 0 | 112 | L190 V191 I192 I196 A197 V198 L233 P320 L325 L328 | L190-L194 HydrophobicContact CD2-CD1 4.32Å; L190-L194 HydrophobicContact CG-CD1 4.05Å; L190-L194 HydrophobicContact CG-CG 4.33Å; L190-L194 WeakPolarHBondContact O-CB 3.37Å; L190-L194 VanDerWaalsContact O-CG 3.28Å; L190-L194 WeakPolarHBondContact O-CG 3.3Å; L190-L194 PolarHBondContact O-N 3.47Å; V191-L194 PolarHBondContact O-N 3.03Å; I192-L194 VanDerWaalsContact C-N 3.33Å; I192-L194 PolarHBondContact O-N 3.03Å; L194-I196 VanDerWaalsContact C-N 3.31Å; L194-I196 PolarHBondContact O-N 3.42Å; L194-A197 PolarHBondContact O-N 3.41Å; L194-V198 WeakPolarHBondContact O-CG2 3.36Å; L194-V198 PolarHBondContact O-N 3.35Å; L194-L233 HydrophobicContact CD2-CD1 4.21Å; L194-L233 HydrophobicContact CD2-CD2 3.97Å; L194-L233 HydrophobicContact CG-CD1 4.05Å; L194-P320 HydrophobicContact CD1-CG 4.2Å; L194-L325 HydrophobicContact CD1-CD2 4.45Å; L194-L328 HydrophobicContact CB-CD1 3.96Å; L194-L328 HydrophobicContact CD1-CD1 4.03Å |
| 195 | I | 96.4 | Very high | 95.1 | Very high | 29 Ų | 29 | 23.4 Ų | 23.4 | 15% | 0.149 | 12% | 0.116 | C | C | . | . | H | α-helix | trans | -57.4 | -49.2 | 173.2 | -69.8 | 168.8 | 0 | 0 | 0 | 109.1 | V191 I192 A197 V198 F199 L328 L362 V365 | V191-I195 HydrophobicContact CG1-CD1 4.01Å; V191-I195 VanDerWaalsContact O-CG1 3.28Å; V191-I195 WeakPolarHBondContact O-CG1 3.32Å; V191-I195 PolarHBondContact O-N 3.2Å; I192-I195 PolarHBondContact O-N 2.65Å; I195-A197 VanDerWaalsContact C-N 3.35Å; I195-A197 PolarHBondContact O-N 3.21Å; I195-V198 PolarHBondContact O-N 2.87Å; I195-F199 HydrophobicContact CG2-CD2 3.74Å; I195-F199 HydrophobicContact CG2-CE2 4.12Å; I195-F199 VanDerWaalsContact O-CD2 3.26Å; I195-F199 WeakPolarHBondContact O-CD2 3.46Å; I195-F199 PolarHBondContact O-N 3.14Å; I195-L328 HydrophobicContact CG1-CD2 4.31Å; I195-L362 HydrophobicContact CG2-CD1 3.86Å; I195-V365 HydrophobicContact CD1-CG1 4.05Å; I195-V365 HydrophobicContact CG1-CG1 3.87Å |
| 196 | I | 96.1 | Very high | 95 | Very high | 37 Ų | 37 | 24.6 Ų | 24.6 | 19% | 0.19 | 12% | 0.122 | C | C | . | . | H | α-helix | trans | -64.7 | -39 | -179.5 | -65 | 166.5 | 0 | 0 | 0 | 111.7 | V141 I192 G193 L194 G200 V232 | V141-I196 HydrophobicContact CB-CD1 4.21Å; V141-I196 HydrophobicContact CG1-CD1 3.28Å; V141-I196 HydrophobicContact CG2-CD1 4.02Å; I192-I196 HydrophobicContact CG2-CD1 3.78Å; I192-I196 VanDerWaalsContact O-CG1 3.32Å; I192-I196 WeakPolarHBondContact O-CG1 3.43Å; I192-I196 PolarHBondContact O-N 3.33Å; G193-I196 PolarHBondContact O-N 2.96Å; L194-I196 VanDerWaalsContact C-N 3.31Å; L194-I196 PolarHBondContact O-N 3.42Å; I196-G200 WeakPolarHBondContact O-CA 3.31Å; I196-G200 PolarHBondContact O-N 3.27Å; I196-V232 HydrophobicContact CB-CG1 4.41Å; I196-V232 HydrophobicContact CD1-CG1 4.1Å; I196-V232 HydrophobicContact CG2-CB 4.21Å; I196-V232 HydrophobicContact CG2-CG1 3.93Å |
| 197 | A | 95.9 | Very high | 94.9 | Very high | 14 Ų | 14 | 26.7 Ų | 26.7 | 12% | 0.116 | 14% | 0.14 | C | C | . | . | H | α-helix | trans | -62.3 | -45 | 176.5 | 0 | 0 | 0 | 0 | 0 | 111.7 | G193 L194 I195 Y201 | G193-A197 WeakPolarHBondContact O-CB 3.33Å; G193-A197 PolarHBondContact O-N 2.9Å; L194-A197 PolarHBondContact O-N 3.41Å; I195-A197 VanDerWaalsContact C-N 3.35Å; I195-A197 PolarHBondContact O-N 3.21Å; A197-Y201 VanDerWaalsContact O-CB 3.32Å; A197-Y201 WeakPolarHBondContact O-CB 3.3Å; A197-Y201 PolarHBondContact O-N 2.98Å |
| 198 | V | 95.8 | Very high | 94.8 | Very high | 25 Ų | 25 | 25.6 Ų | 25.6 | 15% | 0.152 | 14% | 0.135 | C | C | . | . | H | α-helix | trans | -68.7 | -55.5 | -178.7 | 168.2 | 0 | 0 | 0 | 0 | 112 | L194 I195 L328 A332 | L194-V198 WeakPolarHBondContact O-CG2 3.36Å; L194-V198 PolarHBondContact O-N 3.35Å; I195-V198 PolarHBondContact O-N 2.87Å; V198-L328 HydrophobicContact CG2-CD2 4.22Å; V198-A332 HydrophobicContact CG1-CB 3.68Å; V198-A332 HydrophobicContact CG2-CB 4.24Å |
| 199 | F | 95.9 | Very high | 94.7 | Very high | 24 Ų | 24 | 25.8 Ų | 25.8 | 11% | 0.105 | 14% | 0.136 | C | C | . | . | H | α-helix | trans | -76.9 | -37.8 | -176.9 | -67.5 | -84.5 | 0 | 0 | 0 | 111.2 | I195 Y201 A202 Y203 T335 C361 L362 V365 | I195-F199 HydrophobicContact CG2-CD2 3.74Å; I195-F199 HydrophobicContact CG2-CE2 4.12Å; I195-F199 VanDerWaalsContact O-CD2 3.26Å; I195-F199 WeakPolarHBondContact O-CD2 3.46Å; I195-F199 PolarHBondContact O-N 3.14Å; F199-Y201 PolarHBondContact O-N 2.79Å; F199-A202 PolarHBondContact O-N 3.38Å; F199-Y203 HydrophobicContact CB-CD2 4.32Å; F199-Y203 HydrophobicContact CD1-CD2 4.4Å; F199-Y203 AromaticContact CD1-CE2 3.99Å; F199-Y203 HydrophobicContact CD1-CE2 3.99Å; F199-Y203 WeakPolarHBondContact O-CB 3.49Å; F199-Y203 WeakPolarHBondContact O-CD2 3.5Å; F199-Y203 PolarHBondContact O-N 3.21Å; F199-T335 HydrophobicContact CD1-CG2 4.26Å; F199-T335 HydrophobicContact CE1-CG2 4.05Å; F199-C361 HydrophobicContact CE1-CB 3.93Å; F199-C361 HydrophobicContact CZ-CB 4.09Å; F199-L362 HydrophobicContact CD2-CD1 4.23Å; F199-L362 HydrophobicContact CE1-CB 4.03Å; F199-L362 HydrophobicContact CE2-CB 4.44Å; F199-L362 HydrophobicContact CE2-CD1 3.8Å; F199-L362 HydrophobicContact CZ-CB 3.86Å; F199-L362 HydrophobicContact CZ-CD1 4.09Å; F199-V365 HydrophobicContact CE2-CG2 4.24Å; F199-V365 HydrophobicContact CZ-CG2 4.22Å |
| 200 | G | 94.6 | Very high | 94.6 | Very high | 19 Ų | 19 | 31.7 Ų | 31.7 | 20% | 0.196 | 17% | 0.167 | C | C | . | . | H | α-helix | trans | -57 | -37.4 | 174.9 | 0 | 0 | 0 | 0 | 0 | 112.1 | I196 S204 S229 | I196-G200 WeakPolarHBondContact O-CA 3.31Å; I196-G200 PolarHBondContact O-N 3.27Å; G200-S204 WeakPolarHBondContact O-CB 3.19Å; G200-S204 PolarHBondContact O-N 3.47Å; G200-S204 VanDerWaalsContact O-N 3.13Å; G200-S204 PolarHBondContact O-OG 2.91Å; G200-S229 WeakPolarHBondContact CA-OG 3.43Å |
| 201 | Y | 94.2 | Very high | 94.3 | Very high | 115 Ų | 115 | 38.3 Ų | 38.3 | 45% | 0.451 | 19% | 0.192 | S | C | . | . | H | α-helix | trans | -61.3 | -55.9 | 176.2 | -171 | -81.5 | 0 | 0 | 0 | 112.7 | A197 F199 Y203 R226 | A197-Y201 VanDerWaalsContact O-CB 3.32Å; A197-Y201 WeakPolarHBondContact O-CB 3.3Å; A197-Y201 PolarHBondContact O-N 2.98Å; F199-Y201 PolarHBondContact O-N 2.79Å; Y201-Y203 VanDerWaalsContact C-N 3.34Å; Y201-Y203 PolarHBondContact O-N 3.49Å; Y201-R226 HydrophobicContact CD1-CG 4.37Å; Y201-R226 HydrophobicContact CD2-CB 3.68Å; Y201-R226 HydrophobicContact CD2-CG 3.77Å; Y201-R226 HydrophobicContact CE2-CB 3.88Å; Y201-R226 HydrophobicContact CE2-CG 4.01Å; Y201-R226 HydrophobicContact CG-CB 4.34Å; Y201-R226 HydrophobicContact CG-CG 3.97Å; Y201-R226 VanDerWaalsContact O-CG 3.26Å; Y201-R226 WeakPolarHBondContact O-CG 3.28Å; Y201-R226 PolarHBondContact O-NE 3.37Å |
| 202 | A | 93.3 | Very high | 94 | Very high | 1 Ų | 1 | 39.6 Ų | 39.6 | 1% | 0.008 | 21% | 0.206 | C | C | . | . | H | α-helix | trans | -72.4 | -24.6 | -174.3 | 0 | 0 | 0 | 0 | 0 | 113.8 | F199 T335 E339 H354 | F199-A202 PolarHBondContact O-N 3.38Å; A202-T335 WeakPolarHBondContact CB-OG1 3.16Å; A202-E339 WeakPolarHBondContact O-CG 3.41Å; A202-H354 PolarHBondContact O-NE2 3.15Å |
| 203 | Y | 94.6 | Very high | 93.7 | Very high | 37 Ų | 37 | 38.7 Ų | 38.7 | 15% | 0.145 | 21% | 0.208 | C | C | . | . | H | α-helix | trans | -103.1 | 2.7 | -176.7 | -68.4 | -92.2 | 0 | 0 | 0 | 113.3 | F199 Y201 Y205 L206 A207 T335 H354 G358 | F199-Y203 HydrophobicContact CB-CD2 4.32Å; F199-Y203 HydrophobicContact CD1-CD2 4.4Å; F199-Y203 AromaticContact CD1-CE2 3.99Å; F199-Y203 HydrophobicContact CD1-CE2 3.99Å; F199-Y203 WeakPolarHBondContact O-CB 3.49Å; F199-Y203 WeakPolarHBondContact O-CD2 3.5Å; F199-Y203 PolarHBondContact O-N 3.21Å; Y201-Y203 VanDerWaalsContact C-N 3.34Å; Y201-Y203 PolarHBondContact O-N 3.49Å; Y203-Y205 PolarHBondContact O-N 2.87Å; Y203-L206 HydrophobicContact CD1-CD2 4.14Å; Y203-L206 PolarHBondContact O-N 3.36Å; Y203-A207 WeakPolarHBondContact O-CB 3.45Å; Y203-A207 PolarHBondContact O-N 3.07Å; Y203-T335 HydrophobicContact CE2-CG2 3.91Å; Y203-H354 AromaticContact CD1-CD2 3.77Å; Y203-H354 AromaticContact CD1-NE2 3.5Å; Y203-H354 WeakPolarHBondContact CD1-NE2 3.28Å; Y203-H354 AromaticContact CE1-CD2 3.4Å; Y203-H354 WeakPolarHBondContact CE1-CD2 3.18Å; Y203-H354 AromaticContact CE1-CE1 3.8Å; Y203-H354 AromaticContact CE1-NE2 3.24Å; Y203-H354 WeakPolarHBondContact CE1-NE2 3.4Å; Y203-H354 AromaticContact CZ-CE1 3.67Å; Y203-H354 AromaticContact CZ-NE2 3.56Å; Y203-H354 PolarHBondContact OH-O 3.19Å; Y203-G358 WeakPolarHBondContact OH-CA 3.41Å; Y203-G358 PolarHBondContact OH-N 3.29Å |
| 204 | S | 94.6 | Very high | 93.3 | Very high | 1 Ų | 1 | 41.8 Ų | 41.8 | 1% | 0.007 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -57.4 | -45.3 | -177.4 | -81.7 | 0 | 0 | 0 | 0 | 113.2 | G200 L208 L225 R226 | G200-S204 WeakPolarHBondContact O-CB 3.19Å; G200-S204 PolarHBondContact O-N 3.47Å; G200-S204 VanDerWaalsContact O-N 3.13Å; G200-S204 PolarHBondContact O-OG 2.91Å; S204-L208 WeakPolarHBondContact O-CG 3.26Å; S204-L208 PolarHBondContact O-N 3.24Å; S204-L208 VanDerWaalsContact O-N 3.11Å; S204-L225 WeakPolarHBondContact OG-CG 3.23Å; S204-R226 PolarHBondContact OG-N 3.13Å |
| 205 | Y | 93.5 | Very high | 92.9 | Very high | 43 Ų | 43 | 47.6 Ų | 47.6 | 17% | 0.169 | 26% | 0.261 | C | S | . | . | H | α-helix | trans | -61.9 | -51.9 | 178 | 176.4 | -86.4 | 0 | 0 | 0 | 111 | Y203 A207 L208 D209 S217 P222 C343 C344 | Y203-Y205 PolarHBondContact O-N 2.87Å; Y205-A207 VanDerWaalsContact C-N 3.32Å; Y205-A207 PolarHBondContact O-N 3.03Å; Y205-L208 PolarHBondContact O-N 2.96Å; Y205-D209 HydrophobicContact CE1-CB 4.27Å; Y205-D209 WeakPolarHBondContact O-CB 3.32Å; Y205-D209 PolarHBondContact O-N 3.47Å; Y205-S217 WeakPolarHBondContact CD2-O 3.28Å; Y205-S217 VanDerWaalsContact CE2-O 3.31Å; Y205-S217 WeakPolarHBondContact CE2-O 3.49Å; Y205-P222 HydrophobicContact CD2-CG 3.91Å; Y205-C343 WeakPolarHBondContact CD1-SG 3.4Å; Y205-C343 WeakPolarHBondContact CE1-SG 3.38Å; Y205-C344 HydrophobicContact CE1-CB 4.35Å; Y205-C344 VanDerWaalsContact CZ-SG 3.54Å |
| 206 | L | 92.5 | Very high | 92.5 | Very high | 25 Ų | 25 | 46.5 Ų | 46.5 | 13% | 0.131 | 26% | 0.256 | C | S | . | . | H | α-helix | trans | -59.8 | -42.9 | -178.6 | 179.6 | 66.3 | 0 | 0 | 0 | 111.8 | Y203 D209 L210 R351 I355 | Y203-L206 HydrophobicContact CD1-CD2 4.14Å; Y203-L206 PolarHBondContact O-N 3.36Å; L206-D209 PolarHBondContact O-N 2.79Å; L206-L210 WeakPolarHBondContact O-CB 3.4Å; L206-L210 PolarHBondContact O-N 3.42Å; L206-R351 HydrophobicContact CD1-CB 4.19Å; L206-R351 HydrophobicContact CD1-CG 4.19Å; L206-I355 HydrophobicContact CD2-CD1 3.96Å; L206-I355 HydrophobicContact CD2-CG1 3.57Å |
| 207 | A | 93.1 | Very high | 92.2 | Very high | 45 Ų | 45 | 45 Ų | 45 | 37% | 0.372 | 25% | 0.248 | S | C | . | . | H | α-helix | trans | -62.8 | -44.3 | 179.4 | 0 | 0 | 0 | 0 | 0 | 111.9 | Y203 Y205 Y211 L225 | Y203-A207 WeakPolarHBondContact O-CB 3.45Å; Y203-A207 PolarHBondContact O-N 3.07Å; Y205-A207 VanDerWaalsContact C-N 3.32Å; Y205-A207 PolarHBondContact O-N 3.03Å; A207-Y211 WeakPolarHBondContact O-CB 3.39Å; A207-Y211 PolarHBondContact O-N 3.05Å; A207-Y211 VanDerWaalsContact O-N 3.1Å; A207-L225 HydrophobicContact CB-CD2 4.44Å |
| 208 | L | 93.7 | Very high | 91.7 | Very high | 0 Ų | 0 | 49 Ų | 49 | 0% | 0 | 28% | 0.276 | C | S | . | . | H | α-helix | trans | -70.8 | -38.3 | 178.1 | -70.5 | 176 | 0 | 0 | 0 | 112.5 | V134 L137 S204 Y205 L210 Y211 G212 G213 L216 G221 P222 L225 | V134-L208 HydrophobicContact CG2-CD1 4.44Å; V134-L208 HydrophobicContact CG2-CD2 4.29Å; L137-L208 HydrophobicContact CD2-CD2 4.08Å; S204-L208 WeakPolarHBondContact O-CG 3.26Å; S204-L208 PolarHBondContact O-N 3.24Å; S204-L208 VanDerWaalsContact O-N 3.11Å; Y205-L208 PolarHBondContact O-N 2.96Å; L208-L210 VanDerWaalsContact C-N 3.34Å; L208-Y211 PolarHBondContact O-N 2.98Å; L208-G212 PolarHBondContact O-N 3.43Å; L208-G213 PolarHBondContact O-N 3.33Å; L208-L216 HydrophobicContact CB-CB 4.06Å; L208-L216 HydrophobicContact CD2-CB 4.38Å; L208-L216 HydrophobicContact CD2-CD1 4.31Å; L208-G221 WeakPolarHBondContact CD1-O 3.29Å; L208-P222 HydrophobicContact CD1-CG 4.28Å; L208-L225 HydrophobicContact CD1-CB 4.13Å; L208-L225 HydrophobicContact CD1-CD2 4.17Å; L208-L225 HydrophobicContact CD2-CD2 4.05Å; L208-L225 HydrophobicContact CG-CD2 3.78Å |
| 209 | D | 91.9 | Very high | 91.3 | Very high | 25 Ų | 25 | 49.9 Ų | 49.9 | 13% | 0.134 | 29% | 0.29 | C | S | . | . | H | α-helix | trans | -66.4 | -38 | 177.2 | -162.6 | 63.7 | 0 | 0 | 0 | 111.7 | Y205 L206 Y211 G213 S217 R351 | Y205-D209 HydrophobicContact CE1-CB 4.27Å; Y205-D209 WeakPolarHBondContact O-CB 3.32Å; Y205-D209 PolarHBondContact O-N 3.47Å; L206-D209 PolarHBondContact O-N 2.79Å; D209-Y211 VanDerWaalsContact C-N 3.32Å; D209-Y211 PolarHBondContact O-N 3.28Å; D209-G213 WeakPolarHBondContact O-CA 3.28Å; D209-G213 PolarHBondContact O-N 3.43Å; D209-S217 WeakPolarHBondContact OD1-CB 3.31Å; D209-S217 PolarHBondContact OD1-OG 2.81Å; D209-R351 IonicContact OD2-CZ 3.2Å; D209-R351 IonicContact OD2-NH1 2.73Å; D209-R351 PolarHBondContact OD2-NH1 3.25Å; D209-R351 IonicContact OD2-NH2 3.27Å; D209-R351 PolarHBondContact OD2-NH2 3.09Å |
| 210 | L | 90.8 | Very high | 90.9 | Very high | 126 Ų | 126 | 50.7 Ų | 50.7 | 66% | 0.66 | 30% | 0.299 | S | S | * | . | H | α-helix | trans | -66.6 | -35.4 | 173.6 | -176 | 63.8 | 0 | 0 | 0 | 112.2 | L206 L208 W348 | L206-L210 WeakPolarHBondContact O-CB 3.4Å; L206-L210 PolarHBondContact O-N 3.42Å; L208-L210 VanDerWaalsContact C-N 3.34Å; L210-W348 HydrophobicContact CD1-CH2 4.08Å |
| 211 | Y | 91.1 | Very high | 90.8 | Very high | 158 Ų | 158 | 49.8 Ų | 49.8 | 62% | 0.62 | 29% | 0.289 | S | S | * | . | H | α-helix | trans | -81.6 | -48.9 | -175 | -177.5 | -102.5 | 0 | 0 | 0 | 113.3 | I133 A207 L208 D209 L216 | I133-Y211 HydrophobicContact CG2-CE1 4.07Å; A207-Y211 WeakPolarHBondContact O-CB 3.39Å; A207-Y211 PolarHBondContact O-N 3.05Å; A207-Y211 VanDerWaalsContact O-N 3.1Å; L208-Y211 PolarHBondContact O-N 2.98Å; D209-Y211 VanDerWaalsContact C-N 3.32Å; D209-Y211 PolarHBondContact O-N 3.28Å; Y211-L216 HydrophobicContact CD1-CD1 3.72Å; Y211-L216 HydrophobicContact CE1-CD1 4.31Å |
| 212 | G | 87.4 | Confident | 90.8 | Very high | 33 Ų | 33 | 44.7 Ų | 44.7 | 34% | 0.34 | 27% | 0.27 | S | S | . | . | H | α-helix | trans | -132.3 | 10.2 | -174 | 0 | 0 | 0 | 0 | 0 | 114.6 | L208 | L208-G212 PolarHBondContact O-N 3.43Å |
| 213 | G | 89.6 | Confident | 90.9 | Very high | 25 Ų | 25 | 45.9 Ų | 45.9 | 26% | 0.258 | 28% | 0.282 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 62.4 | -156.7 | 179.1 | 0 | 0 | 0 | 0 | 0 | 113.8 | L208 D209 M215 L216 S217 | L208-G213 PolarHBondContact O-N 3.33Å; D209-G213 WeakPolarHBondContact O-CA 3.28Å; D209-G213 PolarHBondContact O-N 3.43Å; G213-M215 PolarHBondContact O-N 3.48Å; G213-L216 PolarHBondContact O-N 2.86Å; G213-S217 PolarHBondContact O-N 3.48Å; G213-S217 PolarHBondContact O-OG 2.89Å |
| 214 | A | 87.8 | Confident | 90.9 | Very high | 64 Ų | 64 | 44.2 Ų | 44.2 | 53% | 0.529 | 28% | 0.276 | S | S | . | . | H | α-helix | trans | -52.5 | -32.2 | -179.3 | 0 | 0 | 0 | 0 | 0 | 113.4 | L216 S217 S218 | A214-L216 PolarHBondContact O-N 3.24Å; A214-S217 VanDerWaalsContact CA-OG 3.32Å; A214-S217 WeakPolarHBondContact CA-OG 3.41Å; A214-S217 PolarHBondContact O-N 2.95Å; A214-S218 WeakPolarHBondContact O-CB 3.47Å; A214-S218 PolarHBondContact O-N 3.45Å; A214-S218 PolarHBondContact O-OG 3.25Å |
| 215 | M | 87.5 | Confident | 90.9 | Very high | 154 Ų | 154 | 44.9 Ų | 44.9 | 76% | 0.759 | 28% | 0.279 | S | S | * | . | H | α-helix | trans | -55.8 | -36.3 | 178.5 | -173.3 | -177 | -175.1 | 0 | 0 | 112.6 | G213 | G213-M215 PolarHBondContact O-N 3.48Å |
| 216 | L | 89.1 | Confident | 91 | Very high | 5 Ų | 5 | 45.9 Ų | 45.9 | 3% | 0.026 | 28% | 0.283 | C | S | . | . | H | α-helix | trans | -100.4 | -27.7 | 178.6 | -62.9 | -177.6 | 0 | 0 | 0 | 112.9 | I130 I133 L208 Y211 G213 A214 G221 P222 | I130-L216 HydrophobicContact CG1-CD2 4.28Å; I130-L216 HydrophobicContact CG2-CD2 4.5Å; I133-L216 HydrophobicContact CD1-CD2 3.89Å; I133-L216 HydrophobicContact CG2-CD1 3.89Å; I133-L216 HydrophobicContact CG2-CD2 4.37Å; L208-L216 HydrophobicContact CB-CB 4.06Å; L208-L216 HydrophobicContact CD2-CB 4.38Å; L208-L216 HydrophobicContact CD2-CD1 4.31Å; Y211-L216 HydrophobicContact CD1-CD1 3.72Å; Y211-L216 HydrophobicContact CE1-CD1 4.31Å; G213-L216 PolarHBondContact O-N 2.86Å; A214-L216 PolarHBondContact O-N 3.24Å; L216-G221 WeakPolarHBondContact O-CA 3.2Å; L216-P222 WeakPolarHBondContact O-CD 3.46Å |
| 217 | S | 90.1 | Very high | 91.1 | Very high | 5 Ų | 5 | 45.6 Ų | 45.6 | 4% | 0.035 | 28% | 0.283 | C | S | . | . | H | α-helix | trans | -90.2 | -26.5 | -172.8 | 69.1 | 0 | 0 | 0 | 0 | 114.4 | Y205 D209 G213 A214 P222 | Y205-S217 WeakPolarHBondContact CD2-O 3.28Å; Y205-S217 VanDerWaalsContact CE2-O 3.31Å; Y205-S217 WeakPolarHBondContact CE2-O 3.49Å; D209-S217 WeakPolarHBondContact OD1-CB 3.31Å; D209-S217 PolarHBondContact OD1-OG 2.81Å; G213-S217 PolarHBondContact O-N 3.48Å; G213-S217 PolarHBondContact O-OG 2.89Å; A214-S217 VanDerWaalsContact CA-OG 3.32Å; A214-S217 WeakPolarHBondContact CA-OG 3.41Å; A214-S217 PolarHBondContact O-N 2.95Å; S217-P222 VanDerWaalsContact O-CG 3.25Å; S217-P222 WeakPolarHBondContact O-CG 3.38Å |
| 218 | S | 85.4 | Confident | 91.3 | Very high | 99 Ų | 99 | 43.8 Ų | 43.8 | 69% | 0.692 | 27% | 0.266 | S | S | * | . | S | Bend | trans | -87.1 | -10.8 | -176.7 | 76.9 | 0 | 0 | 0 | 0 | 114.7 | A214 | A214-S218 WeakPolarHBondContact O-CB 3.47Å; A214-S218 PolarHBondContact O-N 3.45Å; A214-S218 PolarHBondContact O-OG 3.25Å |
| 219 | G | 86.1 | Confident | 91.4 | Very high | 44 Ų | 44 | 44.1 Ų | 44.1 | 45% | 0.454 | 27% | 0.269 | S | S | . | . | S | Bend | trans | -107 | -145.5 | -175.1 | 0 | 0 | 0 | 0 | 0 | 114.1 | G221 P222 | G219-G221 PolarHBondContact O-N 2.87Å; G219-P222 WeakPolarHBondContact O-CD 3.3Å |
| 220 | S | 88.9 | Confident | 91.5 | Very high | 41 Ų | 41 | 45.9 Ų | 45.9 | 29% | 0.287 | 28% | 0.282 | S | S | . | . | S | Bend | trans | -70.7 | -13.1 | 178 | 53.9 | 0 | 0 | 0 | 0 | 114 | D127 G223 L224 | D127-S220 PolarHBondContact OD1-OG 3.21Å; S220-G223 PolarHBondContact O-N 2.99Å; S220-L224 WeakPolarHBondContact O-CG 3.23Å; S220-L224 PolarHBondContact O-N 3.41Å |
| 221 | G | 92.3 | Very high | 91.8 | Very high | 0 Ų | 0 | 40.6 Ų | 40.6 | 0% | 0 | 25% | 0.253 | C | S | . | . | H | α-helix | trans | -52.5 | -55 | -173.7 | 0 | 0 | 0 | 0 | 0 | 115.1 | L208 L216 G219 G223 L224 L225 | L208-G221 WeakPolarHBondContact CD1-O 3.29Å; L216-G221 WeakPolarHBondContact O-CA 3.2Å; G219-G221 PolarHBondContact O-N 2.87Å; G221-G223 VanDerWaalsContact C-N 3.29Å; G221-G223 PolarHBondContact O-N 2.93Å; G221-L224 WeakPolarHBondContact O-CB 3.32Å; G221-L224 PolarHBondContact O-N 2.86Å; G221-L224 VanDerWaalsContact O-N 3.14Å; G221-L225 PolarHBondContact O-N 2.68Å |
| 222 | P | 93.8 | Very high | 92 | Very high | 8 Ų | 8 | 33.1 Ų | 33.1 | 5% | 0.052 | 22% | 0.224 | C | C | . | . | H | α-helix | trans | -61.5 | -37.7 | -178.8 | -23.5 | 34.1 | 0 | 0 | 0 | 112.4 | Y205 L208 L216 S217 G219 L225 R226 | Y205-P222 HydrophobicContact CD2-CG 3.91Å; L208-P222 HydrophobicContact CD1-CG 4.28Å; L216-P222 WeakPolarHBondContact O-CD 3.46Å; S217-P222 VanDerWaalsContact O-CG 3.25Å; S217-P222 WeakPolarHBondContact O-CG 3.38Å; G219-P222 WeakPolarHBondContact O-CD 3.3Å; P222-L225 PolarHBondContact O-N 2.93Å; P222-R226 WeakPolarHBondContact O-CB 3.45Å; P222-R226 WeakPolarHBondContact O-CD 3.48Å; P222-R226 WeakPolarHBondContact O-CG 3.27Å; P222-R226 PolarHBondContact O-N 2.87Å |
| 223 | G | 94.1 | Very high | 92.4 | Very high | 25 Ų | 25 | 33.4 Ų | 33.4 | 26% | 0.258 | 22% | 0.218 | S | C | . | . | H | α-helix | trans | -64 | -42.1 | 175.5 | 0 | 0 | 0 | 0 | 0 | 112.5 | S220 G221 C227 | S220-G223 PolarHBondContact O-N 2.99Å; G221-G223 VanDerWaalsContact C-N 3.29Å; G221-G223 PolarHBondContact O-N 2.93Å; G223-C227 PolarHBondContact O-N 3.35Å; G223-C227 VanDerWaalsContact O-N 3.09Å |
| 224 | L | 94.7 | Very high | 92.8 | Very high | 3 Ų | 3 | 34.2 Ų | 34.2 | 2% | 0.016 | 22% | 0.216 | C | C | . | . | H | α-helix | trans | -62.7 | -48.3 | 175.2 | -69.1 | 168 | 0 | 0 | 0 | 111.2 | I130 Y131 V134 S220 G221 R226 C227 Y228 I282 I285 | I130-L224 HydrophobicContact CG2-CD1 3.95Å; Y131-L224 HydrophobicContact CD2-CD2 4.18Å; V134-L224 HydrophobicContact CB-CB 4.25Å; V134-L224 HydrophobicContact CG1-CB 3.84Å; V134-L224 HydrophobicContact CG2-CB 4.15Å; S220-L224 WeakPolarHBondContact O-CG 3.23Å; S220-L224 PolarHBondContact O-N 3.41Å; G221-L224 WeakPolarHBondContact O-CB 3.32Å; G221-L224 PolarHBondContact O-N 2.86Å; G221-L224 VanDerWaalsContact O-N 3.14Å; L224-R226 VanDerWaalsContact C-N 3.34Å; L224-R226 PolarHBondContact O-N 3.35Å; L224-C227 PolarHBondContact O-N 3.01Å; L224-Y228 WeakPolarHBondContact O-CB 3.48Å; L224-Y228 PolarHBondContact O-N 3.16Å; L224-I282 HydrophobicContact CD2-CG1 3.86Å; L224-I282 HydrophobicContact CG-CG1 4.39Å; L224-I285 HydrophobicContact CB-CD1 4.12Å; L224-I285 HydrophobicContact CD2-CD1 3.77Å; L224-I285 HydrophobicContact CD2-CG1 4.49Å; L224-I285 VanDerWaalsContact O-CD1 3.26Å; L224-I285 WeakPolarHBondContact O-CD1 3.23Å |
| 225 | L | 95.6 | Very high | 93.1 | Very high | 14 Ų | 14 | 32.6 Ų | 32.6 | 7% | 0.073 | 20% | 0.198 | C | C | . | . | H | α-helix | trans | -68.8 | -32.9 | -177.6 | -173.1 | 61.6 | 0 | 0 | 0 | 112.2 | V134 L137 S204 A207 L208 G221 P222 Y228 S229 | V134-L225 HydrophobicContact CG1-CB 3.93Å; V134-L225 HydrophobicContact CG1-CD1 4.06Å; L137-L225 HydrophobicContact CD2-CD1 4.38Å; L137-L225 HydrophobicContact CD2-CD2 4.11Å; S204-L225 WeakPolarHBondContact OG-CG 3.23Å; A207-L225 HydrophobicContact CB-CD2 4.44Å; L208-L225 HydrophobicContact CD1-CB 4.13Å; L208-L225 HydrophobicContact CD1-CD2 4.17Å; L208-L225 HydrophobicContact CD2-CD2 4.05Å; L208-L225 HydrophobicContact CG-CD2 3.78Å; G221-L225 PolarHBondContact O-N 2.68Å; P222-L225 PolarHBondContact O-N 2.93Å; L225-Y228 PolarHBondContact O-N 3Å; L225-S229 WeakPolarHBondContact O-CB 3.36Å; L225-S229 PolarHBondContact O-N 3.48Å; L225-S229 PolarHBondContact O-OG 2.8Å |
| 226 | R | 95.6 | Very high | 93.5 | Very high | 65 Ų | 65 | 25.3 Ų | 25.3 | 25% | 0.245 | 16% | 0.162 | C | C | . | . | H | α-helix | trans | -59.8 | -50.3 | 170.2 | -78.7 | 170.2 | -177 | 155.4 | 1.4 | 111.5 | Y201 S204 P222 L224 Y228 S229 C230 E339 | Y201-R226 HydrophobicContact CD1-CG 4.37Å; Y201-R226 HydrophobicContact CD2-CB 3.68Å; Y201-R226 HydrophobicContact CD2-CG 3.77Å; Y201-R226 HydrophobicContact CE2-CB 3.88Å; Y201-R226 HydrophobicContact CE2-CG 4.01Å; Y201-R226 HydrophobicContact CG-CB 4.34Å; Y201-R226 HydrophobicContact CG-CG 3.97Å; Y201-R226 VanDerWaalsContact O-CG 3.26Å; Y201-R226 WeakPolarHBondContact O-CG 3.28Å; Y201-R226 PolarHBondContact O-NE 3.37Å; S204-R226 PolarHBondContact OG-N 3.13Å; P222-R226 WeakPolarHBondContact O-CB 3.45Å; P222-R226 WeakPolarHBondContact O-CD 3.48Å; P222-R226 WeakPolarHBondContact O-CG 3.27Å; P222-R226 PolarHBondContact O-N 2.87Å; L224-R226 VanDerWaalsContact C-N 3.34Å; L224-R226 PolarHBondContact O-N 3.35Å; R226-Y228 VanDerWaalsContact C-N 3.32Å; R226-Y228 PolarHBondContact O-N 3.25Å; R226-S229 WeakPolarHBondContact O-CB 3.3Å; R226-S229 PolarHBondContact O-N 3.42Å; R226-C230 PolarHBondContact O-N 3.06Å; R226-E339 IonicContact CZ-OE1 3.75Å; R226-E339 VanDerWaalsContact NH2-CD 3.29Å; R226-E339 IonicContact NH2-OE1 2.66Å; R226-E339 PolarHBondContact NH2-OE1 3.44Å; R226-E339 IonicContact NH2-OE2 3.3Å; R226-E339 PolarHBondContact NH2-OE2 3.37Å |
| 227 | C | 95.4 | Very high | 93.9 | Very high | 19 Ų | 19 | 25.6 Ų | 25.6 | 13% | 0.128 | 17% | 0.165 | C | C | . | . | H | α-helix | trans | -63.4 | -41.4 | 177.5 | -167.7 | 0 | 0 | 0 | 0 | 111.2 | G223 L224 S229 C230 Y231 I282 I285 | G223-C227 PolarHBondContact O-N 3.35Å; G223-C227 VanDerWaalsContact O-N 3.09Å; L224-C227 PolarHBondContact O-N 3.01Å; C227-S229 VanDerWaalsContact C-N 3.31Å; C227-S229 PolarHBondContact O-N 3.36Å; C227-C230 WeakPolarHBondContact O-CB 3.4Å; C227-C230 PolarHBondContact O-N 2.84Å; C227-Y231 PolarHBondContact O-N 3.26Å; C227-I282 HydrophobicContact CB-CG2 4.36Å; C227-I285 HydrophobicContact CB-CB 4.49Å; C227-I285 HydrophobicContact CB-CD1 4.25Å; C227-I285 HydrophobicContact CB-CG2 4.18Å; C227-I285 VanDerWaalsContact SG-CG2 3.55Å |
| 228 | Y | 95.8 | Very high | 94.2 | Very high | 7 Ų | 7 | 25.8 Ų | 25.8 | 3% | 0.027 | 17% | 0.165 | C | C | . | . | H | α-helix | trans | -63.1 | -36.5 | 176.9 | -153.9 | -75.5 | 0 | 0 | 0 | 112.2 | N135 G138 S139 L224 L225 R226 C230 Y231 V232 I285 | N135-Y228 HydrophobicContact CB-CE2 4.18Å; N135-Y228 PolarHBondContact O-OH 2.78Å; N135-Y228 WeakPolarHBondContact OD1-CE2 3.22Å; N135-Y228 PolarHBondContact OD1-OH 2.84Å; G138-Y228 VanDerWaalsContact CA-CD1 3.46Å; G138-Y228 VanDerWaalsContact CA-CE1 3.42Å; S139-Y228 WeakPolarHBondContact CB-OH 3.28Å; S139-Y228 PolarHBondContact N-OH 3.21Å; L224-Y228 WeakPolarHBondContact O-CB 3.48Å; L224-Y228 PolarHBondContact O-N 3.16Å; L225-Y228 PolarHBondContact O-N 3Å; R226-Y228 VanDerWaalsContact C-N 3.32Å; R226-Y228 PolarHBondContact O-N 3.25Å; Y228-C230 VanDerWaalsContact C-N 3.25Å; Y228-C230 PolarHBondContact O-N 3.29Å; Y228-Y231 HydrophobicContact CD1-CD1 4.35Å; Y228-Y231 HydrophobicContact CD2-CD1 4.2Å; Y228-Y231 AromaticContact CE1-CD1 3.99Å; Y228-Y231 HydrophobicContact CE1-CD1 3.99Å; Y228-Y231 AromaticContact CE2-CD1 3.85Å; Y228-Y231 HydrophobicContact CE2-CD1 3.85Å; Y228-Y231 HydrophobicContact CE2-CE1 4.23Å; Y228-Y231 HydrophobicContact CG-CD1 4.45Å; Y228-Y231 AromaticContact CZ-CD1 3.76Å; Y228-Y231 CarbonylContact O-C 3.55Å; Y228-Y231 WeakPolarHBondContact O-CA 3.32Å; Y228-Y231 VanDerWaalsContact O-CB 3.26Å; Y228-Y231 WeakPolarHBondContact O-CB 3.44Å; Y228-Y231 PolarHBondContact O-N 3.47Å; Y228-V232 HydrophobicContact CD1-CG2 3.76Å; Y228-V232 HydrophobicContact CE1-CG2 3.84Å; Y228-V232 WeakPolarHBondContact O-CG2 3.47Å; Y228-V232 PolarHBondContact O-N 2.97Å; Y228-I285 HydrophobicContact CD2-CD1 4.11Å; Y228-I285 HydrophobicContact CD2-CG1 4.49Å |
| 229 | S | 95.6 | Very high | 94.6 | Very high | 7 Ų | 7 | 21.3 Ų | 21.3 | 5% | 0.049 | 13% | 0.134 | C | C | . | . | H | α-helix | trans | -59.9 | -38 | 176.7 | -60.2 | 0 | 0 | 0 | 0 | 111.5 | G200 L225 R226 C227 | G200-S229 WeakPolarHBondContact CA-OG 3.43Å; L225-S229 WeakPolarHBondContact O-CB 3.36Å; L225-S229 PolarHBondContact O-N 3.48Å; L225-S229 PolarHBondContact O-OG 2.8Å; R226-S229 WeakPolarHBondContact O-CB 3.3Å; R226-S229 PolarHBondContact O-N 3.42Å; C227-S229 VanDerWaalsContact C-N 3.31Å; C227-S229 PolarHBondContact O-N 3.36Å |
| 230 | C | 95.2 | Very high | 95.2 | Very high | 61 Ų | 61 | 19.4 Ų | 19.4 | 41% | 0.412 | 11% | 0.114 | S | C | . | . | H | α-helix | trans | -69.3 | -36.4 | 170.5 | -61.7 | 0 | 0 | 0 | 0 | 112.3 | R226 C227 Y228 V232 L233 | R226-C230 PolarHBondContact O-N 3.06Å; C227-C230 WeakPolarHBondContact O-CB 3.4Å; C227-C230 PolarHBondContact O-N 2.84Å; Y228-C230 VanDerWaalsContact C-N 3.25Å; Y228-C230 PolarHBondContact O-N 3.29Å; C230-V232 VanDerWaalsContact C-N 3.31Å; C230-V232 PolarHBondContact O-N 3.28Å; C230-L233 WeakPolarHBondContact O-CB 3.23Å; C230-L233 PolarHBondContact O-N 3.42Å |
| 231 | Y | 95.9 | Very high | 95.5 | Very high | 15 Ų | 15 | 17.5 Ų | 17.5 | 6% | 0.059 | 10% | 0.1 | C | C | . | . | H | α-helix | trans | -62.6 | -35.9 | 175.7 | 180 | -127.7 | 0 | 0 | 0 | 112.7 | C227 Y228 L233 L234 L235 I285 N288 C289 M292 | C227-Y231 PolarHBondContact O-N 3.26Å; Y228-Y231 HydrophobicContact CD1-CD1 4.35Å; Y228-Y231 HydrophobicContact CD2-CD1 4.2Å; Y228-Y231 AromaticContact CE1-CD1 3.99Å; Y228-Y231 HydrophobicContact CE1-CD1 3.99Å; Y228-Y231 AromaticContact CE2-CD1 3.85Å; Y228-Y231 HydrophobicContact CE2-CD1 3.85Å; Y228-Y231 HydrophobicContact CE2-CE1 4.23Å; Y228-Y231 HydrophobicContact CG-CD1 4.45Å; Y228-Y231 AromaticContact CZ-CD1 3.76Å; Y228-Y231 CarbonylContact O-C 3.55Å; Y228-Y231 WeakPolarHBondContact O-CA 3.32Å; Y228-Y231 VanDerWaalsContact O-CB 3.26Å; Y228-Y231 WeakPolarHBondContact O-CB 3.44Å; Y228-Y231 PolarHBondContact O-N 3.47Å; Y231-L233 PolarHBondContact O-N 2.85Å; Y231-L234 WeakPolarHBondContact O-CA 3.25Å; Y231-L234 WeakPolarHBondContact O-CB 3.44Å; Y231-L234 PolarHBondContact O-N 3.18Å; Y231-L235 HydrophobicContact CD1-CD1 3.98Å; Y231-L235 HydrophobicContact CD1-CG 4.3Å; Y231-L235 HydrophobicContact CE1-CD1 3.73Å; Y231-L235 HydrophobicContact CE1-CD2 4.08Å; Y231-L235 HydrophobicContact CE1-CG 3.98Å; Y231-L235 HydrophobicContact CE2-CD2 4.25Å; Y231-L235 HydrophobicContact CE2-CG 4.32Å; Y231-L235 PolarHBondContact O-N 3.35Å; Y231-I285 HydrophobicContact CG-CG2 4.44Å; Y231-N288 HydrophobicContact CE1-CB 4.5Å; Y231-N288 HydrophobicContact CE2-CB 3.87Å; Y231-C289 HydrophobicContact CD2-CB 4.42Å; Y231-C289 VanDerWaalsContact CD2-SG 3.56Å; Y231-M292 HydrophobicContact CE2-CB 4.22Å; Y231-M292 HydrophobicContact CE2-CG 3.48Å; Y231-M292 VanDerWaalsContact CE2-CG 3.48Å; Y231-M292 VanDerWaalsContact OH-CE 3.32Å; Y231-M292 WeakPolarHBondContact OH-CE 3.26Å |
| 232 | V | 96.1 | Very high | 95.6 | Very high | 2 Ų | 2 | 17.9 Ų | 17.9 | 1% | 0.012 | 10% | 0.102 | C | C | . | . | H | α-helix | trans | -58.1 | -35 | 176.2 | 173.4 | 0 | 0 | 0 | 0 | 112.1 | V141 F146 I196 Y228 C230 L234 L235 A236 | V141-V232 HydrophobicContact CB-CG1 4.23Å; V141-V232 HydrophobicContact CG1-CG1 3.99Å; F146-V232 HydrophobicContact CE2-CG1 3.68Å; F146-V232 HydrophobicContact CZ-CG1 4.26Å; I196-V232 HydrophobicContact CB-CG1 4.41Å; I196-V232 HydrophobicContact CD1-CG1 4.1Å; I196-V232 HydrophobicContact CG2-CB 4.21Å; I196-V232 HydrophobicContact CG2-CG1 3.93Å; Y228-V232 HydrophobicContact CD1-CG2 3.76Å; Y228-V232 HydrophobicContact CE1-CG2 3.84Å; Y228-V232 WeakPolarHBondContact O-CG2 3.47Å; Y228-V232 PolarHBondContact O-N 2.97Å; C230-V232 VanDerWaalsContact C-N 3.31Å; C230-V232 PolarHBondContact O-N 3.28Å; V232-L234 VanDerWaalsContact C-N 3.32Å; V232-L234 PolarHBondContact O-N 3.35Å; V232-L235 PolarHBondContact O-N 3.35Å; V232-A236 WeakPolarHBondContact O-CB 3.31Å; V232-A236 PolarHBondContact O-N 3.48Å |
| 233 | L | 96 | Very high | 95.7 | Very high | 38 Ų | 38 | 17.7 Ų | 17.7 | 20% | 0.199 | 10% | 0.101 | C | C | . | . | H | α-helix | trans | -61.6 | -39.9 | 173.3 | 175.3 | 65.9 | 0 | 0 | 0 | 112 | L190 L194 C230 Y231 A236 V237 | L190-L233 HydrophobicContact CD1-CD1 3.81Å; L194-L233 HydrophobicContact CD2-CD1 4.21Å; L194-L233 HydrophobicContact CD2-CD2 3.97Å; L194-L233 HydrophobicContact CG-CD1 4.05Å; C230-L233 WeakPolarHBondContact O-CB 3.23Å; C230-L233 PolarHBondContact O-N 3.42Å; Y231-L233 PolarHBondContact O-N 2.85Å; L233-A236 WeakPolarHBondContact O-CB 3.4Å; L233-V237 PolarHBondContact O-N 3.08Å |
| 234 | L | 97 | Very high | 95.8 | Very high | 43 Ų | 43 | 16.5 Ų | 16.5 | 23% | 0.225 | 9% | 0.089 | C | C | . | . | H | α-helix | trans | -70.2 | -41.1 | 177.1 | -60.7 | 177.4 | 0 | 0 | 0 | 111 | Y231 V232 A236 V237 N238 C289 M292 I296 | Y231-L234 WeakPolarHBondContact O-CA 3.25Å; Y231-L234 WeakPolarHBondContact O-CB 3.44Å; Y231-L234 PolarHBondContact O-N 3.18Å; V232-L234 VanDerWaalsContact C-N 3.32Å; V232-L234 PolarHBondContact O-N 3.35Å; L234-A236 VanDerWaalsContact C-N 3.31Å; L234-A236 PolarHBondContact O-N 3.01Å; L234-V237 PolarHBondContact O-N 2.85Å; L234-N238 WeakPolarHBondContact O-CB 3.19Å; L234-N238 PolarHBondContact O-N 2.8Å; L234-C289 HydrophobicContact CD1-CB 3.63Å; L234-C289 WeakPolarHBondContact CD1-O 3.32Å; L234-M292 HydrophobicContact CB-CB 4.02Å; L234-I296 HydrophobicContact CB-CD1 4.11Å; L234-I296 HydrophobicContact CD2-CD1 3.96Å; L234-I296 WeakPolarHBondContact O-CD1 3.24Å |
| 235 | L | 95.8 | Very high | 95.8 | Very high | 29 Ų | 29 | 16.4 Ų | 16.4 | 15% | 0.152 | 9% | 0.088 | C | C | . | . | H | α-helix | trans | -57.9 | -43.7 | 174.5 | -68.8 | 176.1 | 0 | 0 | 0 | 111.9 | A142 Y231 V232 N238 G239 M292 | A142-L235 HydrophobicContact CB-CD1 3.93Å; Y231-L235 HydrophobicContact CD1-CD1 3.98Å; Y231-L235 HydrophobicContact CD1-CG 4.3Å; Y231-L235 HydrophobicContact CE1-CD1 3.73Å; Y231-L235 HydrophobicContact CE1-CD2 4.08Å; Y231-L235 HydrophobicContact CE1-CG 3.98Å; Y231-L235 HydrophobicContact CE2-CD2 4.25Å; Y231-L235 HydrophobicContact CE2-CG 4.32Å; Y231-L235 PolarHBondContact O-N 3.35Å; V232-L235 PolarHBondContact O-N 3.35Å; L235-N238 PolarHBondContact O-N 3.49Å; L235-G239 PolarHBondContact O-N 3.41Å; L235-M292 HydrophobicContact CD2-CE 3.8Å; L235-M292 HydrophobicContact CD2-CG 4.39Å; L235-M292 HydrophobicContact CD2-SD 4.34Å |
| 236 | A | 95.3 | Very high | 95.7 | Very high | 1 Ų | 1 | 18.2 Ų | 18.2 | 1% | 0.008 | 10% | 0.096 | C | C | . | . | H | α-helix | trans | -55.5 | -53 | 177.1 | 0 | 0 | 0 | 0 | 0 | 112.3 | F146 V189 V232 L233 L234 | F146-A236 HydrophobicContact CD1-CB 4.45Å; F146-A236 HydrophobicContact CD2-CB 3.98Å; F146-A236 HydrophobicContact CE1-CB 4.03Å; F146-A236 HydrophobicContact CE2-CB 3.49Å; F146-A236 VanDerWaalsContact CE2-CB 3.49Å; F146-A236 HydrophobicContact CG-CB 4.45Å; F146-A236 HydrophobicContact CZ-CB 3.53Å; V189-A236 HydrophobicContact CB-CB 4.05Å; V189-A236 HydrophobicContact CG2-CB 4.33Å; V189-A236 WeakPolarHBondContact CG2-O 3.45Å; V232-A236 WeakPolarHBondContact O-CB 3.31Å; V232-A236 PolarHBondContact O-N 3.48Å; L233-A236 WeakPolarHBondContact O-CB 3.4Å; L234-A236 VanDerWaalsContact C-N 3.31Å; L234-A236 PolarHBondContact O-N 3.01Å |
| 237 | V | 96.9 | Very high | 95.7 | Very high | 12 Ų | 12 | 15.1 Ų | 15.1 | 7% | 0.073 | 8% | 0.084 | C | C | . | . | H | α-helix | trans | -70.3 | -39.7 | -178.1 | 176.9 | 0 | 0 | 0 | 0 | 111.1 | L190 L233 L234 T241 I296 L318 | L190-V237 HydrophobicContact CD1-CG2 3.87Å; L233-V237 PolarHBondContact O-N 3.08Å; L234-V237 PolarHBondContact O-N 2.85Å; V237-T241 HydrophobicContact CG1-CG2 4.15Å; V237-T241 WeakPolarHBondContact O-CB 3.44Å; V237-T241 WeakPolarHBondContact O-CG2 3.29Å; V237-T241 PolarHBondContact O-N 3.26Å; V237-T241 PolarHBondContact O-OG1 3.31Å; V237-I296 HydrophobicContact CB-CD1 4.21Å; V237-I296 HydrophobicContact CG1-CD1 4.27Å; V237-I296 HydrophobicContact CG1-CG1 4.32Å; V237-I296 HydrophobicContact CG1-CG2 3.91Å; V237-L318 HydrophobicContact CG1-CD2 3.86Å; V237-L318 HydrophobicContact CG2-CD2 4.09Å |
| 238 | N | 96.4 | Very high | 95.6 | Very high | 9 Ų | 9 | 14.2 Ų | 14.2 | 5% | 0.048 | 8% | 0.078 | C | C | . | . | H | α-helix | trans | -60.5 | -50 | 179 | -178.6 | -112.4 | 0 | 0 | 0 | 111.6 | L234 L235 V240 T241 E242 M292 R295 I296 | L234-N238 WeakPolarHBondContact O-CB 3.19Å; L234-N238 PolarHBondContact O-N 2.8Å; L235-N238 PolarHBondContact O-N 3.49Å; N238-V240 PolarHBondContact O-N 3.3Å; N238-T241 PolarHBondContact O-N 3.11Å; N238-T241 PolarHBondContact O-OG1 2.84Å; N238-T241 VanDerWaalsContact O-OG1 3.07Å; N238-E242 VanDerWaalsContact ND2-CD 3.33Å; N238-E242 PolarHBondContact ND2-OE1 3.02Å; N238-E242 WeakPolarHBondContact O-CB 3.19Å; N238-E242 PolarHBondContact O-N 3.26Å; N238-M292 HydrophobicContact CB-SD 4.39Å; N238-R295 WeakPolarHBondContact ND2-CB 3.4Å; N238-I296 HydrophobicContact CB-CD1 4.15Å; N238-I296 HydrophobicContact CB-CG1 3.73Å |
| 239 | G | 95.3 | Very high | 95.4 | Very high | 4 Ų | 4 | 14.1 Ų | 14.1 | 4% | 0.041 | 8% | 0.078 | C | C | . | . | H | α-helix | trans | -56.7 | -49.8 | -178.5 | 0 | 0 | 0 | 0 | 0 | 112.7 | E150 L235 C243 | E150-G239 WeakPolarHBondContact OE2-CA 3.29Å; L235-G239 PolarHBondContact O-N 3.41Å; G239-C243 VanDerWaalsContact O-CB 3.26Å; G239-C243 WeakPolarHBondContact O-CB 3.34Å; G239-C243 PolarHBondContact O-N 3.48Å |
| 240 | V | 96.7 | Very high | 95.2 | Very high | 5 Ų | 5 | 15.2 Ų | 15.2 | 3% | 0.03 | 9% | 0.085 | C | C | . | . | H | α-helix | trans | -68.1 | -39.7 | -179.8 | 176.4 | 0 | 0 | 0 | 0 | 112.6 | L182 L185 L186 V189 N238 C243 F244 | L182-V240 HydrophobicContact CD1-CG1 3.96Å; L185-V240 HydrophobicContact CB-CG1 3.82Å; L186-V240 HydrophobicContact CD2-CB 4.11Å; L186-V240 HydrophobicContact CD2-CG1 3.71Å; L186-V240 HydrophobicContact CG-CG1 4.02Å; V189-V240 HydrophobicContact CB-CG2 4.21Å; V189-V240 HydrophobicContact CG1-CG2 3.59Å; V189-V240 HydrophobicContact CG2-CB 4.25Å; V189-V240 HydrophobicContact CG2-CG2 3.7Å; N238-V240 PolarHBondContact O-N 3.3Å; V240-C243 PolarHBondContact O-SG 3Å; V240-F244 PolarHBondContact O-N 2.87Å |
| 241 | T | 97.1 | Very high | 94.9 | Very high | 0 Ų | 0 | 18 Ų | 18 | 0% | 0 | 9% | 0.092 | C | C | . | . | H | α-helix | trans | -69.2 | -43.6 | 179.6 | 52.6 | 0 | 0 | 0 | 0 | 111.8 | L186 V237 N238 V245 L300 I303 | L186-T241 HydrophobicContact CD2-CG2 3.58Å; V237-T241 HydrophobicContact CG1-CG2 4.15Å; V237-T241 WeakPolarHBondContact O-CB 3.44Å; V237-T241 WeakPolarHBondContact O-CG2 3.29Å; V237-T241 PolarHBondContact O-N 3.26Å; V237-T241 PolarHBondContact O-OG1 3.31Å; N238-T241 PolarHBondContact O-N 3.11Å; N238-T241 PolarHBondContact O-OG1 2.84Å; N238-T241 VanDerWaalsContact O-OG1 3.07Å; T241-V245 WeakPolarHBondContact O-CG2 3.43Å; T241-V245 PolarHBondContact O-N 3.2Å; T241-V245 VanDerWaalsContact O-N 3.13Å; T241-L300 HydrophobicContact CG2-CD2 3.84Å; T241-I303 HydrophobicContact CG2-CD1 4.03Å |
| 242 | E | 94.4 | Very high | 94.5 | Very high | 9 Ų | 9 | 25 Ų | 25 | 4% | 0.042 | 13% | 0.126 | C | C | . | . | H | α-helix | trans | -68.8 | -40.7 | 178 | -78.1 | -172.6 | -169.3 | 0 | 0 | 112.6 | N238 F244 V245 F246 Y257 R295 S299 | N238-E242 VanDerWaalsContact ND2-CD 3.33Å; N238-E242 PolarHBondContact ND2-OE1 3.02Å; N238-E242 WeakPolarHBondContact O-CB 3.19Å; N238-E242 PolarHBondContact O-N 3.26Å; E242-F244 VanDerWaalsContact C-N 3.27Å; E242-F244 PolarHBondContact O-N 3.34Å; E242-V245 PolarHBondContact O-N 2.7Å; E242-V245 VanDerWaalsContact O-N 3.11Å; E242-F246 HydrophobicContact CB-CD2 4.16Å; E242-F246 HydrophobicContact CB-CE2 4.28Å; E242-F246 WeakPolarHBondContact O-CB 3.5Å; E242-F246 VanDerWaalsContact O-CD2 3.24Å; E242-F246 WeakPolarHBondContact O-CD2 3.48Å; E242-F246 PolarHBondContact O-N 2.97Å; E242-Y257 PolarHBondContact OE1-OH 3.34Å; E242-Y257 VanDerWaalsContact OE1-OH 3.07Å; E242-R295 WeakPolarHBondContact OE1-CB 3.42Å; E242-R295 IonicContact OE1-CZ 2.73Å; E242-R295 VanDerWaalsContact OE1-CZ 3.27Å; E242-R295 IonicContact OE1-NE 2.67Å; E242-R295 PolarHBondContact OE1-NE 3.38Å; E242-R295 IonicContact OE1-NH2 3.85Å; E242-R295 PolarHBondContact OE1-NH2 2.84Å; E242-R295 IonicContact OE2-CZ 3.11Å; E242-R295 IonicContact OE2-NE 2.76Å; E242-R295 IonicContact OE2-NH2 3.25Å; E242-R295 PolarHBondContact OE2-NH2 2.89Å; E242-S299 WeakPolarHBondContact CG-OG 3.28Å |
| 243 | C | 94.8 | Very high | 94.2 | Very high | 3 Ų | 3 | 28.2 Ų | 28.2 | 2% | 0.02 | 14% | 0.141 | C | C | . | . | H | α-helix | trans | -62.6 | -37.1 | -179.1 | 84.1 | 0 | 0 | 0 | 0 | 112.1 | E150 Y154 G239 V240 A247 | E150-C243 HydrophobicContact CG-CB 3.58Å; Y154-C243 WeakPolarHBondContact CD2-O 3.19Å; G239-C243 VanDerWaalsContact O-CB 3.26Å; G239-C243 WeakPolarHBondContact O-CB 3.34Å; G239-C243 PolarHBondContact O-N 3.48Å; V240-C243 PolarHBondContact O-SG 3Å; C243-A247 WeakPolarHBondContact O-CB 3.32Å; C243-A247 PolarHBondContact O-N 3.45Å; C243-A247 VanDerWaalsContact O-N 3.13Å |
| 244 | F | 96.8 | Very high | 93.8 | Very high | 0 Ų | 0 | 27.2 Ų | 27.2 | 0% | 0 | 14% | 0.136 | C | C | . | . | H | α-helix | trans | -65.1 | -49 | 171.5 | 174 | -90.6 | 0 | 0 | 0 | 111.6 | F157 L161 L182 V240 E242 F246 A247 A248 I303 Y306 F307 | F157-F244 AromaticContact CD1-CD2 3.86Å; F157-F244 HydrophobicContact CD1-CD2 3.86Å; F157-F244 HydrophobicContact CD1-CE2 4.33Å; F157-F244 HydrophobicContact CD2-CB 4.08Å; F157-F244 HydrophobicContact CD2-CD2 4.05Å; F157-F244 AromaticContact CE1-CD2 3.97Å; F157-F244 HydrophobicContact CE1-CD2 3.97Å; F157-F244 HydrophobicContact CE2-CB 4.08Å; F157-F244 HydrophobicContact CE2-CD2 4.15Å; F157-F244 AromaticContact CG-CD2 3.91Å; F157-F244 HydrophobicContact CG-CD2 3.91Å; F157-F244 HydrophobicContact CZ-CD2 4.12Å; L161-F244 HydrophobicContact CD1-CD2 4.44Å; L161-F244 HydrophobicContact CD1-CE2 3.63Å; L161-F244 HydrophobicContact CD1-CZ 4.05Å; L182-F244 HydrophobicContact CD1-CB 3.89Å; L182-F244 HydrophobicContact CD1-CD2 4.26Å; L182-F244 HydrophobicContact CD1-CG 4.1Å; L182-F244 HydrophobicContact CD2-CB 4.41Å; L182-F244 HydrophobicContact CD2-CD1 3.95Å; L182-F244 HydrophobicContact CD2-CD2 3.73Å; L182-F244 HydrophobicContact CD2-CE1 4.15Å; L182-F244 HydrophobicContact CD2-CE2 3.92Å; L182-F244 HydrophobicContact CD2-CG 3.74Å; L182-F244 HydrophobicContact CD2-CZ 4.15Å; L182-F244 HydrophobicContact CG-CD2 4.39Å; L182-F244 HydrophobicContact CG-CG 4.5Å; V240-F244 PolarHBondContact O-N 2.87Å; E242-F244 VanDerWaalsContact C-N 3.27Å; E242-F244 PolarHBondContact O-N 3.34Å; F244-F246 PolarHBondContact O-N 3.48Å; F244-A247 WeakPolarHBondContact O-CB 3.14Å; F244-A247 PolarHBondContact O-N 3.33Å; F244-A247 VanDerWaalsContact O-N 3.08Å; F244-A248 HydrophobicContact CE1-CB 4.36Å; F244-A248 HydrophobicContact CZ-CB 4.49Å; F244-A248 PolarHBondContact O-N 2.94Å; F244-I303 HydrophobicContact CD1-CD1 4.14Å; F244-I303 HydrophobicContact CD1-CG1 3.68Å; F244-I303 HydrophobicContact CE1-CG1 3.94Å; F244-Y306 HydrophobicContact CE1-CD1 4.38Å; F244-Y306 HydrophobicContact CZ-CD1 4.07Å; F244-Y306 HydrophobicContact CZ-CE1 4.07Å; F244-F307 AromaticContact CE1-CE2 3.93Å; F244-F307 HydrophobicContact CE1-CE2 3.93Å; F244-F307 HydrophobicContact CE2-CE2 4.24Å; F244-F307 HydrophobicContact CE2-CZ 4.19Å; F244-F307 AromaticContact CZ-CE2 3.45Å; F244-F307 HydrophobicContact CZ-CE2 3.45Å; F244-F307 VanDerWaalsContact CZ-CE2 3.45Å; F244-F307 AromaticContact CZ-CZ 3.68Å; F244-F307 HydrophobicContact CZ-CZ 3.68Å |
| 245 | V | 95.1 | Very high | 93.2 | Very high | 1 Ų | 1 | 29.1 Ų | 29.1 | 1% | 0.006 | 15% | 0.146 | C | C | . | . | H | α-helix | trans | -59.3 | -46.5 | -178.3 | 169.5 | 0 | 0 | 0 | 0 | 111.1 | T241 E242 A247 A248 M249 Y302 I303 | T241-V245 WeakPolarHBondContact O-CG2 3.43Å; T241-V245 PolarHBondContact O-N 3.2Å; T241-V245 VanDerWaalsContact O-N 3.13Å; E242-V245 PolarHBondContact O-N 2.7Å; E242-V245 VanDerWaalsContact O-N 3.11Å; V245-A247 VanDerWaalsContact C-N 3.27Å; V245-A247 PolarHBondContact O-N 3.26Å; V245-A248 PolarHBondContact O-N 3.43Å; V245-M249 HydrophobicContact CG1-CE 3.28Å; V245-M249 HydrophobicContact CG1-CG 3.95Å; V245-M249 HydrophobicContact CG1-SD 3.46Å; V245-M249 WeakPolarHBondContact CG1-SD 3.48Å; V245-M249 WeakPolarHBondContact O-CB 3.43Å; V245-M249 VanDerWaalsContact O-CG 3.27Å; V245-M249 WeakPolarHBondContact O-CG 3.39Å; V245-M249 PolarHBondContact O-N 2.98Å; V245-Y302 HydrophobicContact CB-CD1 4.34Å; V245-Y302 HydrophobicContact CG1-CD1 3.97Å; V245-Y302 HydrophobicContact CG1-CE1 4.39Å; V245-Y302 HydrophobicContact CG1-CG 4.13Å; V245-Y302 HydrophobicContact CG2-CD1 3.83Å; V245-Y302 HydrophobicContact CG2-CG 4.3Å; V245-I303 HydrophobicContact CG2-CD1 4.2Å; V245-I303 HydrophobicContact CG2-CG1 3.88Å |
| 246 | F | 93.4 | Very high | 92.8 | Very high | 52 Ų | 52 | 35 Ų | 35 | 23% | 0.228 | 17% | 0.171 | C | C | . | . | H | α-helix | trans | -65.7 | -28.4 | 176.1 | -82.4 | -66.4 | 0 | 0 | 0 | 113.5 | Y154 R163 E242 F244 V254 Y257 M261 | Y154-F246 HydrophobicContact CD2-CB 4.39Å; Y154-F246 HydrophobicContact CE2-CB 3.98Å; R163-F246 PolarHBondContact NH2-O 3.05Å; R163-F246 VanDerWaalsContact NH2-O 3.12Å; E242-F246 HydrophobicContact CB-CD2 4.16Å; E242-F246 HydrophobicContact CB-CE2 4.28Å; E242-F246 WeakPolarHBondContact O-CB 3.5Å; E242-F246 VanDerWaalsContact O-CD2 3.24Å; E242-F246 WeakPolarHBondContact O-CD2 3.48Å; E242-F246 PolarHBondContact O-N 2.97Å; F244-F246 PolarHBondContact O-N 3.48Å; F246-V254 HydrophobicContact CD1-CG2 4.35Å; F246-V254 HydrophobicContact CE1-CG1 4.36Å; F246-Y257 AromaticContact CE1-CD1 3.82Å; F246-Y257 HydrophobicContact CE1-CD1 3.82Å; F246-Y257 HydrophobicContact CE1-CE1 4.02Å; F246-Y257 HydrophobicContact CE2-CD1 4.45Å; F246-Y257 AromaticContact CE2-CE1 3.82Å; F246-Y257 HydrophobicContact CE2-CE1 3.82Å; F246-Y257 AromaticContact CZ-CD1 3.63Å; F246-Y257 HydrophobicContact CZ-CD1 3.63Å; F246-Y257 AromaticContact CZ-CE1 3.34Å; F246-Y257 HydrophobicContact CZ-CE1 3.34Å; F246-M261 HydrophobicContact CZ-CE 4.05Å |
| 247 | A | 94.3 | Very high | 92.4 | Very high | 0 Ų | 0 | 35.1 Ų | 35.1 | 0% | 0 | 17% | 0.171 | C | C | . | . | H | α-helix | trans | -73.7 | -33.2 | 174.3 | 0 | 0 | 0 | 0 | 0 | 112.3 | Y154 F157 A158 R163 C243 F244 V245 | Y154-A247 HydrophobicContact CD2-CB 4.14Å; Y154-A247 HydrophobicContact CE2-CB 4.34Å; F157-A247 HydrophobicContact CB-CB 3.46Å; F157-A247 VanDerWaalsContact CB-CB 3.46Å; A158-A247 HydrophobicContact CB-CB 4.22Å; R163-A247 WeakPolarHBondContact CG-O 3.32Å; C243-A247 WeakPolarHBondContact O-CB 3.32Å; C243-A247 PolarHBondContact O-N 3.45Å; C243-A247 VanDerWaalsContact O-N 3.13Å; F244-A247 WeakPolarHBondContact O-CB 3.14Å; F244-A247 PolarHBondContact O-N 3.33Å; F244-A247 VanDerWaalsContact O-N 3.08Å; V245-A247 VanDerWaalsContact C-N 3.27Å; V245-A247 PolarHBondContact O-N 3.26Å |
| 248 | A | 93.6 | Very high | 91.7 | Very high | 0 Ų | 0 | 37.9 Ų | 37.9 | 0% | 0 | 19% | 0.185 | C | C | . | . | H | α-helix | trans | -88.9 | -35.5 | -176.4 | 0 | 0 | 0 | 0 | 0 | 114.2 | L161 G164 F244 V245 Y302 Y306 | L161-A248 HydrophobicContact CD1-CB 4.4Å; G164-A248 PolarHBondContact N-O 2.77Å; F244-A248 HydrophobicContact CE1-CB 4.36Å; F244-A248 HydrophobicContact CZ-CB 4.49Å; F244-A248 PolarHBondContact O-N 2.94Å; V245-A248 PolarHBondContact O-N 3.43Å; A248-Y302 HydrophobicContact CB-CE1 4.34Å; A248-Y306 HydrophobicContact CB-CE2 4.3Å |
| 249 | M | 92.7 | Very high | 91.2 | Very high | 5 Ų | 5 | 43.2 Ų | 43.2 | 3% | 0.025 | 21% | 0.213 | C | C | . | . | trans | -61.7 | 145.2 | -174.9 | -80.6 | 178.5 | 166.9 | 0 | 0 | 113.7 | V245 E253 V254 Y302 | V245-M249 HydrophobicContact CG1-CE 3.28Å; V245-M249 HydrophobicContact CG1-CG 3.95Å; V245-M249 HydrophobicContact CG1-SD 3.46Å; V245-M249 WeakPolarHBondContact CG1-SD 3.48Å; V245-M249 WeakPolarHBondContact O-CB 3.43Å; V245-M249 VanDerWaalsContact O-CG 3.27Å; V245-M249 WeakPolarHBondContact O-CG 3.39Å; V245-M249 PolarHBondContact O-N 2.98Å; M249-E253 HydrophobicContact CB-CB 3.98Å; M249-E253 HydrophobicContact CG-CB 3.91Å; M249-E253 HydrophobicContact SD-CB 4.22Å; M249-V254 HydrophobicContact CB-CG2 3.78Å; M249-V254 HydrophobicContact SD-CG2 4.48Å; M249-Y302 HydrophobicContact CE-CD1 4.47Å; M249-Y302 HydrophobicContact CE-CD2 3.39Å; M249-Y302 HydrophobicContact CE-CE2 3.55Å; M249-Y302 HydrophobicContact CE-CG 3.89Å; M249-Y302 HydrophobicContact CG-CD2 4.45Å; M249-Y302 HydrophobicContact CG-CE1 4.04Å; M249-Y302 HydrophobicContact CG-CE2 3.72Å; M249-Y302 VanDerWaalsContact CG-CZ 3.47Å; M249-Y302 WeakPolarHBondContact CG-OH 3.24Å | ||
| 250 | S | 91.2 | Very high | 90.8 | Very high | 30 Ų | 30 | 45.4 Ų | 45.4 | 21% | 0.21 | 23% | 0.226 | C | C | . | . | trans | -69.5 | 164.3 | 164.8 | 66.6 | 0 | 0 | 0 | 0 | 111.8 | Q252 E253 V254 | S250-Q252 VanDerWaalsContact C-N 3.27Å; S250-Q252 PolarHBondContact O-N 2.73Å; S250-E253 VanDerWaalsContact CB-OE2 3.31Å; S250-E253 WeakPolarHBondContact CB-OE2 3.33Å; S250-E253 PolarHBondContact N-OE2 2.85Å; S250-E253 PolarHBondContact O-N 2.81Å; S250-E253 VanDerWaalsContact OG-CG 3.29Å; S250-E253 WeakPolarHBondContact OG-CG 3.37Å; S250-E253 PolarHBondContact OG-N 3.42Å; S250-E253 PolarHBondContact OG-OE2 2.79Å; S250-V254 WeakPolarHBondContact O-CG2 3.5Å; S250-V254 PolarHBondContact O-N 3.41Å | ||
| 251 | Q | 88.1 | Confident | 90.1 | Very high | 120 Ų | 120 | 47.3 Ų | 47.3 | 56% | 0.561 | 24% | 0.235 | S | C | * | . | H | α-helix | trans | -57.3 | -40.8 | 176.1 | -173.9 | 60.8 | 43.4 | 0 | 0 | 112.3 | E253 V254 D255 | Q251-E253 PolarHBondContact O-N 3.07Å; Q251-V254 PolarHBondContact O-N 2.87Å; Q251-D255 PolarHBondContact NE2-OD1 2.9Å; Q251-D255 VanDerWaalsContact O-CG 3.23Å; Q251-D255 PolarHBondContact O-N 3.05Å |
| 252 | Q | 88.6 | Confident | 89.3 | Confident | 163 Ų | 163 | 50.1 Ų | 50.1 | 76% | 0.762 | 25% | 0.249 | S | C | * | . | H | α-helix | trans | -65.9 | -38.6 | 179.9 | -64.9 | 179.8 | -0 | 0 | 0 | 112.1 | S250 D255 K256 | S250-Q252 VanDerWaalsContact C-N 3.27Å; S250-Q252 PolarHBondContact O-N 2.73Å; Q252-D255 PolarHBondContact O-N 3.12Å; Q252-K256 WeakPolarHBondContact O-CB 3.46Å; Q252-K256 PolarHBondContact O-N 3.27Å |
| 253 | E | 88.9 | Confident | 89 | Confident | 69 Ų | 69 | 52.1 Ų | 52.1 | 32% | 0.322 | 27% | 0.267 | S | S | . | . | H | α-helix | trans | -68.6 | -39.6 | 175.4 | -70.9 | 167.4 | 115.8 | 0 | 0 | 111.7 | M249 S250 Q251 D255 K256 Y257 Y302 | M249-E253 HydrophobicContact CB-CB 3.98Å; M249-E253 HydrophobicContact CG-CB 3.91Å; M249-E253 HydrophobicContact SD-CB 4.22Å; S250-E253 VanDerWaalsContact CB-OE2 3.31Å; S250-E253 WeakPolarHBondContact CB-OE2 3.33Å; S250-E253 PolarHBondContact N-OE2 2.85Å; S250-E253 PolarHBondContact O-N 2.81Å; S250-E253 VanDerWaalsContact OG-CG 3.29Å; S250-E253 WeakPolarHBondContact OG-CG 3.37Å; S250-E253 PolarHBondContact OG-N 3.42Å; S250-E253 PolarHBondContact OG-OE2 2.79Å; Q251-E253 PolarHBondContact O-N 3.07Å; E253-D255 VanDerWaalsContact C-N 3.35Å; E253-K256 PolarHBondContact O-N 2.71Å; E253-Y257 VanDerWaalsContact O-CB 3.28Å; E253-Y257 WeakPolarHBondContact O-CB 3.44Å; E253-Y257 PolarHBondContact O-N 3.32Å; E253-Y302 WeakPolarHBondContact OE1-CE2 3.41Å; E253-Y302 PolarHBondContact OE1-OH 3.49Å |
| 254 | V | 87.7 | Confident | 88.4 | Confident | 17 Ų | 17 | 53.2 Ų | 53.2 | 10% | 0.103 | 27% | 0.273 | C | S | . | . | H | α-helix | trans | -61.4 | -43.6 | 173.7 | 171.5 | 0 | 0 | 0 | 0 | 110.8 | F246 M249 S250 Q251 K256 Y257 N258 | F246-V254 HydrophobicContact CD1-CG2 4.35Å; F246-V254 HydrophobicContact CE1-CG1 4.36Å; M249-V254 HydrophobicContact CB-CG2 3.78Å; M249-V254 HydrophobicContact SD-CG2 4.48Å; S250-V254 WeakPolarHBondContact O-CG2 3.5Å; S250-V254 PolarHBondContact O-N 3.41Å; Q251-V254 PolarHBondContact O-N 2.87Å; V254-K256 PolarHBondContact O-N 3.11Å; V254-Y257 WeakPolarHBondContact O-CB 3.47Å; V254-Y257 PolarHBondContact O-N 2.87Å; V254-N258 VanDerWaalsContact O-CG 3.25Å; V254-N258 PolarHBondContact O-N 2.98Å; V254-N258 PolarHBondContact O-ND2 3.37Å |
| 255 | D | 85.1 | Confident | 87.7 | Confident | 83 Ų | 83 | 54.9 Ų | 54.9 | 44% | 0.444 | 29% | 0.285 | S | S | . | . | H | α-helix | trans | -64.4 | -41.9 | 178.3 | -67.3 | -23.4 | 0 | 0 | 0 | 111.5 | Q251 Q252 E253 Y257 N258 L259 | Q251-D255 PolarHBondContact NE2-OD1 2.9Å; Q251-D255 VanDerWaalsContact O-CG 3.23Å; Q251-D255 PolarHBondContact O-N 3.05Å; Q252-D255 PolarHBondContact O-N 3.12Å; E253-D255 VanDerWaalsContact C-N 3.35Å; D255-Y257 VanDerWaalsContact C-N 3.34Å; D255-N258 PolarHBondContact O-N 2.84Å; D255-L259 PolarHBondContact O-N 3.33Å |
| 256 | K | 87.6 | Confident | 87.1 | Confident | 152 Ų | 152 | 60.4 Ų | 60.4 | 66% | 0.661 | 31% | 0.312 | S | S | * | . | H | α-helix | trans | -63.3 | -40.7 | 172.9 | -174.3 | 178.1 | -180 | 178.8 | 0 | 111.7 | Q252 E253 V254 L259 V260 | Q252-K256 WeakPolarHBondContact O-CB 3.46Å; Q252-K256 PolarHBondContact O-N 3.27Å; E253-K256 PolarHBondContact O-N 2.71Å; V254-K256 PolarHBondContact O-N 3.11Å; K256-L259 WeakPolarHBondContact O-CB 3.43Å; K256-L259 PolarHBondContact O-N 3.49Å; K256-V260 PolarHBondContact O-N 3.08Å; K256-V260 VanDerWaalsContact O-N 3.12Å |
| 257 | Y | 86.7 | Confident | 86.8 | Confident | 3 Ų | 3 | 60 Ų | 60 | 1% | 0.012 | 32% | 0.316 | C | S | . | . | H | α-helix | trans | -65.1 | -40.2 | 177.2 | -179.1 | -108.5 | 0 | 0 | 0 | 111.8 | E242 F246 E253 V254 D255 L259 V260 M261 H298 | E242-Y257 PolarHBondContact OE1-OH 3.34Å; E242-Y257 VanDerWaalsContact OE1-OH 3.07Å; F246-Y257 AromaticContact CE1-CD1 3.82Å; F246-Y257 HydrophobicContact CE1-CD1 3.82Å; F246-Y257 HydrophobicContact CE1-CE1 4.02Å; F246-Y257 HydrophobicContact CE2-CD1 4.45Å; F246-Y257 AromaticContact CE2-CE1 3.82Å; F246-Y257 HydrophobicContact CE2-CE1 3.82Å; F246-Y257 AromaticContact CZ-CD1 3.63Å; F246-Y257 HydrophobicContact CZ-CD1 3.63Å; F246-Y257 AromaticContact CZ-CE1 3.34Å; F246-Y257 HydrophobicContact CZ-CE1 3.34Å; E253-Y257 VanDerWaalsContact O-CB 3.28Å; E253-Y257 WeakPolarHBondContact O-CB 3.44Å; E253-Y257 PolarHBondContact O-N 3.32Å; V254-Y257 WeakPolarHBondContact O-CB 3.47Å; V254-Y257 PolarHBondContact O-N 2.87Å; D255-Y257 VanDerWaalsContact C-N 3.34Å; Y257-L259 VanDerWaalsContact C-N 3.26Å; Y257-L259 PolarHBondContact O-N 2.73Å; Y257-V260 CarbonylContact O-C 3.54Å; Y257-V260 WeakPolarHBondContact O-CA 3.11Å; Y257-V260 WeakPolarHBondContact O-CB 3.44Å; Y257-V260 PolarHBondContact O-N 3.12Å; Y257-M261 HydrophobicContact CD1-CE 3.95Å; Y257-M261 HydrophobicContact CD1-CG 3.99Å; Y257-M261 HydrophobicContact CD1-SD 4.16Å; Y257-M261 HydrophobicContact CE1-CE 3.73Å; Y257-M261 HydrophobicContact CE1-CG 3.53Å; Y257-M261 HydrophobicContact CE1-SD 3.41Å; Y257-M261 WeakPolarHBondContact CE1-SD 3.41Å; Y257-M261 HydrophobicContact CE2-CG 4.27Å; Y257-M261 WeakPolarHBondContact O-CG 3.42Å; Y257-M261 PolarHBondContact O-N 3.38Å; Y257-H298 AromaticContact CD2-CE1 3.36Å; Y257-H298 WeakPolarHBondContact CD2-CE1 3.43Å; Y257-H298 AromaticContact CD2-ND1 3.58Å; Y257-H298 AromaticContact CE2-CE1 3.7Å; Y257-H298 AromaticContact CE2-ND1 3.37Å; Y257-H298 WeakPolarHBondContact CE2-ND1 3.41Å |
| 258 | N | 82.4 | Confident | 86.3 | Confident | 71 Ų | 71 | 61 Ų | 61 | 38% | 0.38 | 32% | 0.32 | S | S | . | . | H | α-helix | trans | -59.8 | -36.9 | 174.5 | -73.2 | -30 | 0 | 0 | 0 | 111.9 | V254 D255 M261 L262 | V254-N258 VanDerWaalsContact O-CG 3.25Å; V254-N258 PolarHBondContact O-N 2.98Å; V254-N258 PolarHBondContact O-ND2 3.37Å; D255-N258 PolarHBondContact O-N 2.84Å; N258-M261 PolarHBondContact O-N 3.42Å; N258-M261 WeakPolarHBondContact OD1-CE 3.33Å; N258-L262 PolarHBondContact O-N 2.85Å |
| 259 | L | 84.9 | Confident | 85.8 | Confident | 120 Ų | 120 | 63.2 Ų | 63.2 | 63% | 0.628 | 33% | 0.332 | S | S | * | . | H | α-helix | trans | -66.2 | -40.5 | 173.3 | -172.4 | 70 | 0 | 0 | 0 | 111.9 | D255 K256 Y257 L262 A263 | D255-L259 PolarHBondContact O-N 3.33Å; K256-L259 WeakPolarHBondContact O-CB 3.43Å; K256-L259 PolarHBondContact O-N 3.49Å; Y257-L259 VanDerWaalsContact C-N 3.26Å; Y257-L259 PolarHBondContact O-N 2.73Å; L259-L262 WeakPolarHBondContact O-CB 3.37Å; L259-L262 PolarHBondContact O-N 2.99Å; L259-A263 PolarHBondContact O-N 3.17Å; L259-A263 VanDerWaalsContact O-N 3.17Å |
| 260 | V | 86.3 | Confident | 85.5 | Confident | 50 Ų | 50 | 68 Ų | 68 | 30% | 0.303 | 36% | 0.357 | S | S | . | . | H | α-helix | trans | -64 | -43.4 | 173.8 | 175 | 0 | 0 | 0 | 0 | 110.8 | K256 Y257 L262 A263 L264 | K256-V260 PolarHBondContact O-N 3.08Å; K256-V260 VanDerWaalsContact O-N 3.12Å; Y257-V260 CarbonylContact O-C 3.54Å; Y257-V260 WeakPolarHBondContact O-CA 3.11Å; Y257-V260 WeakPolarHBondContact O-CB 3.44Å; Y257-V260 PolarHBondContact O-N 3.12Å; V260-L262 VanDerWaalsContact C-N 3.28Å; V260-L262 PolarHBondContact O-N 3.29Å; V260-A263 WeakPolarHBondContact O-CB 3.43Å; V260-A263 PolarHBondContact O-N 3.37Å; V260-A263 VanDerWaalsContact O-N 3.11Å; V260-L264 HydrophobicContact CG1-CD1 4.19Å; V260-L264 HydrophobicContact CG1-CG 4.32Å; V260-L264 WeakPolarHBondContact O-CG 3.37Å; V260-L264 PolarHBondContact O-N 3Å |
| 261 | M | 81.8 | Confident | 85.3 | Confident | 45 Ų | 45 | 68.7 Ų | 68.7 | 22% | 0.222 | 36% | 0.358 | C | S | . | . | H | α-helix | trans | -60.5 | -36.9 | 175.7 | -74.5 | -152.1 | -69.7 | 0 | 0 | 112.3 | F246 Y257 N258 L264 S265 | F246-M261 HydrophobicContact CZ-CE 4.05Å; Y257-M261 HydrophobicContact CD1-CE 3.95Å; Y257-M261 HydrophobicContact CD1-CG 3.99Å; Y257-M261 HydrophobicContact CD1-SD 4.16Å; Y257-M261 HydrophobicContact CE1-CE 3.73Å; Y257-M261 HydrophobicContact CE1-CG 3.53Å; Y257-M261 HydrophobicContact CE1-SD 3.41Å; Y257-M261 WeakPolarHBondContact CE1-SD 3.41Å; Y257-M261 HydrophobicContact CE2-CG 4.27Å; Y257-M261 WeakPolarHBondContact O-CG 3.42Å; Y257-M261 PolarHBondContact O-N 3.38Å; N258-M261 PolarHBondContact O-N 3.42Å; N258-M261 WeakPolarHBondContact OD1-CE 3.33Å; M261-L264 PolarHBondContact O-N 2.83Å; M261-S265 WeakPolarHBondContact O-CB 3.44Å; M261-S265 PolarHBondContact O-N 3.29Å; M261-S265 PolarHBondContact O-OG 3.19Å |
| 262 | L | 81.9 | Confident | 85.3 | Confident | 59 Ų | 59 | 63 Ų | 63 | 31% | 0.309 | 33% | 0.332 | S | S | . | . | H | α-helix | trans | -61.5 | -45.5 | 173.6 | -176.4 | 67 | 0 | 0 | 0 | 111.2 | L109 N258 L259 V260 S265 M266 | L109-L262 HydrophobicContact CD1-CD1 3.96Å; L109-L262 HydrophobicContact CD2-CD1 3.61Å; L109-L262 HydrophobicContact CG-CD1 4.38Å; N258-L262 PolarHBondContact O-N 2.85Å; L259-L262 WeakPolarHBondContact O-CB 3.37Å; L259-L262 PolarHBondContact O-N 2.99Å; V260-L262 VanDerWaalsContact C-N 3.28Å; V260-L262 PolarHBondContact O-N 3.29Å; L262-S265 PolarHBondContact O-N 3.44Å; L262-M266 HydrophobicContact CG-CE 4.38Å; L262-M266 PolarHBondContact O-N 2.96Å |
| 263 | A | 86.4 | Confident | 85.1 | Confident | 51 Ų | 51 | 60.3 Ų | 60.3 | 42% | 0.421 | 32% | 0.315 | S | S | . | . | H | α-helix | trans | -63.6 | -42.9 | 176.2 | 0 | 0 | 0 | 0 | 0 | 112.4 | L259 V260 S265 M266 S267 | L259-A263 PolarHBondContact O-N 3.17Å; L259-A263 VanDerWaalsContact O-N 3.17Å; V260-A263 WeakPolarHBondContact O-CB 3.43Å; V260-A263 PolarHBondContact O-N 3.37Å; V260-A263 VanDerWaalsContact O-N 3.11Å; A263-S265 VanDerWaalsContact C-N 3.32Å; A263-S265 PolarHBondContact O-N 2.97Å; A263-M266 PolarHBondContact O-N 3.42Å; A263-S267 PolarHBondContact O-N 2.89Å |
| 264 | L | 84.1 | Confident | 85.1 | Confident | 26 Ų | 26 | 62.5 Ų | 62.5 | 14% | 0.136 | 33% | 0.327 | C | S | . | . | H | α-helix | trans | -62 | -39.1 | 174.6 | -70.3 | 178.6 | 0 | 0 | 0 | 111.8 | V260 M261 S267 F268 L294 R295 | V260-L264 HydrophobicContact CG1-CD1 4.19Å; V260-L264 HydrophobicContact CG1-CG 4.32Å; V260-L264 WeakPolarHBondContact O-CG 3.37Å; V260-L264 PolarHBondContact O-N 3Å; M261-L264 PolarHBondContact O-N 2.83Å; L264-S267 PolarHBondContact O-N 3.01Å; L264-F268 WeakPolarHBondContact O-CB 3.5Å; L264-F268 PolarHBondContact O-N 3.27Å; L264-L294 HydrophobicContact CD2-CB 3.84Å; L264-L294 HydrophobicContact CD2-CD1 3.78Å; L264-L294 HydrophobicContact CD2-CG 4.4Å; L264-R295 HydrophobicContact CD1-CG 3.88Å |
| 265 | S | 80.1 | Confident | 85.1 | Confident | 36 Ų | 36 | 63.5 Ų | 63.5 | 25% | 0.252 | 33% | 0.331 | S | S | . | . | H | α-helix | trans | -64.6 | -42.1 | 176.9 | -57.9 | 0 | 0 | 0 | 0 | 111.9 | M261 L262 A263 F268 L269 | M261-S265 WeakPolarHBondContact O-CB 3.44Å; M261-S265 PolarHBondContact O-N 3.29Å; M261-S265 PolarHBondContact O-OG 3.19Å; L262-S265 PolarHBondContact O-N 3.44Å; A263-S265 VanDerWaalsContact C-N 3.32Å; A263-S265 PolarHBondContact O-N 2.97Å; S265-F268 WeakPolarHBondContact O-CB 3.44Å; S265-F268 PolarHBondContact O-N 3.25Å; S265-L269 WeakPolarHBondContact O-CG 3.22Å; S265-L269 PolarHBondContact O-N 3.16Å |
| 266 | M | 83.3 | Confident | 85.2 | Confident | 116 Ų | 116 | 59.7 Ų | 59.7 | 57% | 0.571 | 31% | 0.311 | S | S | * | . | H | α-helix | trans | -64.6 | -42.3 | 174 | -69.9 | -174.9 | -68.1 | 0 | 0 | 111.9 | L262 A263 F268 L269 L270 | L262-M266 HydrophobicContact CG-CE 4.38Å; L262-M266 PolarHBondContact O-N 2.96Å; A263-M266 PolarHBondContact O-N 3.42Å; M266-F268 VanDerWaalsContact C-N 3.33Å; M266-F268 PolarHBondContact O-N 3.43Å; M266-L269 PolarHBondContact O-N 2.94Å; M266-L270 PolarHBondContact O-N 2.73Å |
| 267 | S | 86.2 | Confident | 85.1 | Confident | 45 Ų | 45 | 61.9 Ų | 61.9 | 32% | 0.315 | 32% | 0.315 | S | S | . | . | H | α-helix | trans | -61.7 | -41.8 | 174.9 | 179.3 | 0 | 0 | 0 | 0 | 111.7 | A263 L264 L270 L271 | A263-S267 PolarHBondContact O-N 2.89Å; L264-S267 PolarHBondContact O-N 3.01Å; S267-L270 PolarHBondContact O-N 3.44Å; S267-L271 WeakPolarHBondContact O-CB 3.43Å; S267-L271 VanDerWaalsContact O-CD1 3.3Å; S267-L271 WeakPolarHBondContact O-CD1 3.49Å; S267-L271 PolarHBondContact O-N 2.89Å |
| 268 | F | 85.4 | Confident | 85 | Confident | 20 Ų | 20 | 71 Ų | 71 | 9% | 0.088 | 35% | 0.35 | C | S | . | . | H | α-helix | trans | -60.2 | -44.2 | 175.6 | 164 | -105.5 | 0 | 0 | 0 | 112.3 | E113 L264 S265 M266 L270 L271 S272 F284 A287 N288 N291 | E113-F268 HydrophobicContact CB-CE1 4.29Å; E113-F268 HydrophobicContact CB-CZ 4.45Å; L264-F268 WeakPolarHBondContact O-CB 3.5Å; L264-F268 PolarHBondContact O-N 3.27Å; S265-F268 WeakPolarHBondContact O-CB 3.44Å; S265-F268 PolarHBondContact O-N 3.25Å; M266-F268 VanDerWaalsContact C-N 3.33Å; M266-F268 PolarHBondContact O-N 3.43Å; F268-L270 VanDerWaalsContact C-N 3.32Å; F268-L270 PolarHBondContact O-N 3.31Å; F268-L271 PolarHBondContact O-N 2.88Å; F268-S272 WeakPolarHBondContact CD2-OG 3.39Å; F268-S272 WeakPolarHBondContact CE2-OG 3.06Å; F268-S272 WeakPolarHBondContact CZ-OG 3.31Å; F268-S272 WeakPolarHBondContact O-CB 3.37Å; F268-S272 PolarHBondContact O-N 2.97Å; F268-S272 PolarHBondContact O-OG 3.47Å; F268-F284 HydrophobicContact CZ-CE1 4.41Å; F268-F284 AromaticContact CZ-CZ 3.9Å; F268-F284 HydrophobicContact CZ-CZ 3.9Å; F268-A287 HydrophobicContact CD2-CB 4.46Å; F268-A287 HydrophobicContact CE2-CB 4.34Å; F268-N288 HydrophobicContact CE2-CB 4.19Å; F268-N288 VanDerWaalsContact CE2-CG 3.43Å; F268-N288 VanDerWaalsContact CE2-OD1 3.27Å; F268-N288 WeakPolarHBondContact CE2-OD1 3.36Å; F268-N288 WeakPolarHBondContact CZ-OD1 3.13Å; F268-N291 HydrophobicContact CB-CB 4.08Å; F268-N291 HydrophobicContact CD2-CB 3.78Å; F268-N291 HydrophobicContact CG-CB 4.22Å |
| 269 | L | 83.3 | Confident | 85.2 | Confident | 47 Ų | 47 | 69.3 Ų | 69.3 | 25% | 0.246 | 35% | 0.346 | C | S | . | . | H | α-helix | trans | -60.8 | -42.7 | 177.3 | -69.3 | 173.8 | 0 | 0 | 0 | 111.5 | V116 S265 M266 S272 Y273 | V116-L269 HydrophobicContact CG2-CD2 3.94Å; S265-L269 WeakPolarHBondContact O-CG 3.22Å; S265-L269 PolarHBondContact O-N 3.16Å; M266-L269 PolarHBondContact O-N 2.94Å; L269-S272 PolarHBondContact O-N 3.28Å; L269-Y273 PolarHBondContact O-N 3.37Å |
| 270 | L | 85.8 | Confident | 85.3 | Confident | 105 Ų | 105 | 64.8 Ų | 64.8 | 55% | 0.55 | 33% | 0.328 | S | S | . | . | H | α-helix | trans | -65 | -49.1 | 176.7 | -179 | 64.3 | 0 | 0 | 0 | 111.8 | M266 S267 F268 S272 Y273 M274 | M266-L270 PolarHBondContact O-N 2.73Å; S267-L270 PolarHBondContact O-N 3.44Å; F268-L270 VanDerWaalsContact C-N 3.32Å; F268-L270 PolarHBondContact O-N 3.31Å; L270-S272 VanDerWaalsContact C-N 3.3Å; L270-S272 PolarHBondContact O-N 3Å; L270-Y273 PolarHBondContact O-N 3.33Å; L270-M274 WeakPolarHBondContact O-CG 3.33Å; L270-M274 PolarHBondContact O-N 3.16Å |
| 271 | L | 87.5 | Confident | 85.3 | Confident | 45 Ų | 45 | 62.8 Ų | 62.8 | 24% | 0.236 | 32% | 0.318 | C | S | . | . | H | α-helix | trans | -60.1 | -42.5 | 177.2 | -99.1 | 77 | 0 | 0 | 0 | 111.3 | S267 F268 Y273 M274 L275 A287 L290 | S267-L271 WeakPolarHBondContact O-CB 3.43Å; S267-L271 VanDerWaalsContact O-CD1 3.3Å; S267-L271 WeakPolarHBondContact O-CD1 3.49Å; S267-L271 PolarHBondContact O-N 2.89Å; F268-L271 PolarHBondContact O-N 2.88Å; L271-Y273 VanDerWaalsContact C-N 3.32Å; L271-Y273 PolarHBondContact O-N 3.5Å; L271-M274 PolarHBondContact O-N 3.33Å; L271-L275 HydrophobicContact CB-CD1 4.45Å; L271-L275 HydrophobicContact CG-CD1 4.38Å; L271-L275 WeakPolarHBondContact O-CB 3.26Å; L271-L275 VanDerWaalsContact O-CD1 3.3Å; L271-L275 WeakPolarHBondContact O-CD1 3.37Å; L271-L275 PolarHBondContact O-N 3.19Å; L271-A287 HydrophobicContact CB-CB 4.22Å; L271-L290 HydrophobicContact CD2-CB 3.94Å; L271-L290 HydrophobicContact CD2-CD1 3.56Å; L271-L290 HydrophobicContact CD2-CG 4.4Å |
| 272 | S | 86.3 | Confident | 85.7 | Confident | 1 Ų | 1 | 63.8 Ų | 63.8 | 1% | 0.007 | 32% | 0.323 | C | S | . | . | H | α-helix | trans | -59.7 | -45.4 | 178.5 | -63.8 | 0 | 0 | 0 | 0 | 110.7 | F268 L269 L270 T276 A287 | F268-S272 WeakPolarHBondContact CD2-OG 3.39Å; F268-S272 WeakPolarHBondContact CE2-OG 3.06Å; F268-S272 WeakPolarHBondContact CZ-OG 3.31Å; F268-S272 WeakPolarHBondContact O-CB 3.37Å; F268-S272 PolarHBondContact O-N 2.97Å; F268-S272 PolarHBondContact O-OG 3.47Å; L269-S272 PolarHBondContact O-N 3.28Å; L270-S272 VanDerWaalsContact C-N 3.3Å; L270-S272 PolarHBondContact O-N 3Å; S272-T276 WeakPolarHBondContact O-CB 3.42Å; S272-T276 PolarHBondContact O-N 2.88Å; S272-T276 PolarHBondContact O-OG1 3.49Å; S272-A287 WeakPolarHBondContact OG-CB 3.37Å |
| 273 | Y | 85.4 | Confident | 86.2 | Confident | 106 Ų | 106 | 61 Ų | 61 | 42% | 0.416 | 31% | 0.308 | S | S | . | . | H | α-helix | trans | -59.2 | -50.4 | 174.4 | 177.5 | -101.2 | 0 | 0 | 0 | 112.1 | M120 V122 L269 L270 L271 W277 | M120-Y273 HydrophobicContact CB-CD2 4.2Å; M120-Y273 HydrophobicContact CB-CE2 4.18Å; M120-Y273 HydrophobicContact CG-CD2 4.18Å; M120-Y273 HydrophobicContact CG-CE2 4.38Å; M120-Y273 HydrophobicContact SD-CD2 4.46Å; M120-Y273 HydrophobicContact SD-CE2 4.31Å; V122-Y273 HydrophobicContact CG2-CD2 4.38Å; L269-Y273 PolarHBondContact O-N 3.37Å; L270-Y273 PolarHBondContact O-N 3.33Å; L271-Y273 VanDerWaalsContact C-N 3.32Å; L271-Y273 PolarHBondContact O-N 3.5Å; Y273-W277 WeakPolarHBondContact O-CB 3.45Å; Y273-W277 PolarHBondContact O-N 3.37Å |
| 274 | M | 87.9 | Confident | 86.2 | Confident | 115 Ų | 115 | 58.6 Ų | 58.6 | 57% | 0.567 | 29% | 0.288 | S | S | * | . | H | α-helix | trans | -64.9 | -47.1 | -177.1 | -65.9 | -166.3 | 80.4 | 0 | 0 | 113.2 | L270 L271 W277 W278 | L270-M274 WeakPolarHBondContact O-CG 3.33Å; L270-M274 PolarHBondContact O-N 3.16Å; L271-M274 PolarHBondContact O-N 3.33Å; M274-W277 PolarHBondContact O-N 3.02Å; M274-W278 PolarHBondContact O-N 2.92Å |
| 275 | L | 88.8 | Confident | 86.6 | Confident | 37 Ų | 37 | 57.4 Ų | 57.4 | 19% | 0.194 | 28% | 0.282 | C | S | . | . | H | α-helix | trans | -73.1 | -34.3 | -177.5 | -85.5 | 68.6 | 0 | 0 | 0 | 111.4 | L271 W277 W278 A279 G283 L286 A287 L290 | L271-L275 HydrophobicContact CB-CD1 4.45Å; L271-L275 HydrophobicContact CG-CD1 4.38Å; L271-L275 WeakPolarHBondContact O-CB 3.26Å; L271-L275 VanDerWaalsContact O-CD1 3.3Å; L271-L275 WeakPolarHBondContact O-CD1 3.37Å; L271-L275 PolarHBondContact O-N 3.19Å; L275-W277 VanDerWaalsContact C-N 3.33Å; L275-W278 PolarHBondContact O-N 3.25Å; L275-A279 PolarHBondContact O-N 2.95Å; L275-G283 VanDerWaalsContact CB-O 3.29Å; L275-G283 WeakPolarHBondContact CB-O 3.24Å; L275-G283 WeakPolarHBondContact O-CA 3.26Å; L275-L286 HydrophobicContact CD2-CB 3.79Å; L275-A287 HydrophobicContact CD2-CB 4.27Å; L275-L290 HydrophobicContact CD2-CD1 3.97Å |
| 276 | T | 87 | Confident | 87.2 | Confident | 3 Ų | 3 | 58.6 Ų | 58.6 | 2% | 0.018 | 29% | 0.286 | C | S | . | . | H | α-helix | trans | -68.1 | -36.4 | 175.9 | -51.5 | 0 | 0 | 0 | 0 | 111 | V122 L123 S272 W278 G280 F284 | V122-T276 HydrophobicContact CB-CG2 3.69Å; V122-T276 VanDerWaalsContact CG1-C 3.46Å; V122-T276 HydrophobicContact CG1-CG2 3.46Å; V122-T276 VanDerWaalsContact CG1-CG2 3.46Å; L123-T276 HydrophobicContact CD1-CG2 3.62Å; L123-T276 HydrophobicContact CG-CG2 4.09Å; S272-T276 WeakPolarHBondContact O-CB 3.42Å; S272-T276 PolarHBondContact O-N 2.88Å; S272-T276 PolarHBondContact O-OG1 3.49Å; T276-W278 PolarHBondContact O-N 3.38Å; T276-G280 WeakPolarHBondContact CA-O 3.3Å; T276-G280 WeakPolarHBondContact CG2-O 2.86Å; T276-G280 WeakPolarHBondContact O-CA 3.36Å; T276-G280 PolarHBondContact O-N 3.32Å; T276-F284 HydrophobicContact CG2-CB 4.42Å; T276-F284 WeakPolarHBondContact OG1-CB 3.4Å; T276-F284 WeakPolarHBondContact OG1-CD2 3.5Å |
| 277 | W | 85.1 | Confident | 87.5 | Confident | 199 Ų | 199 | 53.1 Ų | 53.1 | 75% | 0.754 | 26% | 0.258 | S | S | * | . | H | α-helix | trans | -61.9 | -34.8 | 172.5 | -176.3 | 82.1 | 0 | 0 | 0 | 112.2 | V122 Y273 M274 L275 | V122-W277 HydrophobicContact CG1-CB 4.28Å; Y273-W277 WeakPolarHBondContact O-CB 3.45Å; Y273-W277 PolarHBondContact O-N 3.37Å; M274-W277 PolarHBondContact O-N 3.02Å; L275-W277 VanDerWaalsContact C-N 3.33Å |
| 278 | W | 85.8 | Confident | 87.8 | Confident | 195 Ų | 195 | 51.6 Ų | 51.6 | 74% | 0.739 | 25% | 0.247 | S | C | * | . | H | α-helix | trans | -81.5 | -42.6 | -179.5 | 179.2 | 61.6 | 0 | 0 | 0 | 114.4 | M274 L275 T276 | M274-W278 PolarHBondContact O-N 2.92Å; L275-W278 PolarHBondContact O-N 3.25Å; T276-W278 PolarHBondContact O-N 3.38Å |
| 279 | A | 85.7 | Confident | 88.2 | Confident | 35 Ų | 35 | 51.5 Ų | 51.5 | 29% | 0.289 | 25% | 0.249 | S | C | . | . | H | α-helix | trans | -131.8 | 17.2 | -168.5 | 0 | 0 | 0 | 0 | 0 | 114.1 | L275 I282 G283 | L275-A279 PolarHBondContact O-N 2.95Å; A279-I282 PolarHBondContact O-N 3.16Å; A279-G283 PolarHBondContact O-N 3.01Å |
| 280 | G | 87.4 | Confident | 88.6 | Confident | 25 Ų | 25 | 53.2 Ų | 53.2 | 26% | 0.258 | 26% | 0.257 | S | S | . | . | H | α-helix | trans | 56.7 | -139.5 | -179.8 | 0 | 0 | 0 | 0 | 0 | 112.4 | T276 I282 G283 F284 | T276-G280 WeakPolarHBondContact CA-O 3.3Å; T276-G280 WeakPolarHBondContact CG2-O 2.86Å; T276-G280 WeakPolarHBondContact O-CA 3.36Å; T276-G280 PolarHBondContact O-N 3.32Å; G280-I282 PolarHBondContact O-N 3.24Å; G280-G283 WeakPolarHBondContact O-CA 3.32Å; G280-G283 PolarHBondContact O-N 2.92Å; G280-F284 PolarHBondContact O-N 2.95Å; G280-F284 VanDerWaalsContact O-N 3.15Å |
| 281 | G | 86.6 | Confident | 88.9 | Confident | 8 Ų | 8 | 49 Ų | 49 | 8% | 0.082 | 24% | 0.235 | C | C | . | . | H | α-helix | trans | -63.9 | -28 | -176.3 | 0 | 0 | 0 | 0 | 0 | 113.4 | G283 F284 I285 | G281-G283 VanDerWaalsContact C-N 3.35Å; G281-F284 WeakPolarHBondContact O-CB 3.19Å; G281-F284 PolarHBondContact O-N 3.34Å; G281-I285 PolarHBondContact O-N 2.73Å; G281-I285 VanDerWaalsContact O-N 3.11Å |
| 282 | I | 89.9 | Confident | 89.1 | Confident | 66 Ų | 66 | 47.6 Ų | 47.6 | 34% | 0.338 | 23% | 0.228 | S | C | . | . | H | α-helix | trans | -66 | -43.3 | 173.7 | -62.8 | 173.6 | 0 | 0 | 0 | 109.5 | L224 C227 A279 G280 F284 I285 L286 | L224-I282 HydrophobicContact CD2-CG1 3.86Å; L224-I282 HydrophobicContact CG-CG1 4.39Å; C227-I282 HydrophobicContact CB-CG2 4.36Å; A279-I282 PolarHBondContact O-N 3.16Å; G280-I282 PolarHBondContact O-N 3.24Å; I282-F284 PolarHBondContact O-N 2.99Å; I282-I285 PolarHBondContact O-N 3.3Å; I282-I285 VanDerWaalsContact O-N 3.15Å; I282-L286 HydrophobicContact CG2-CD1 4.2Å; I282-L286 HydrophobicContact CG2-CG 4.4Å; I282-L286 WeakPolarHBondContact O-CG 3.26Å; I282-L286 PolarHBondContact O-N 3.23Å |
| 283 | G | 91 | Very high | 89.5 | Confident | 0 Ų | 0 | 49.4 Ų | 49.4 | 0% | 0 | 24% | 0.243 | C | C | . | . | H | α-helix | trans | -56.3 | -39 | 173.4 | 0 | 0 | 0 | 0 | 0 | 112.6 | L275 A279 G280 G281 L286 A287 | L275-G283 VanDerWaalsContact CB-O 3.29Å; L275-G283 WeakPolarHBondContact CB-O 3.24Å; L275-G283 WeakPolarHBondContact O-CA 3.26Å; A279-G283 PolarHBondContact O-N 3.01Å; G280-G283 WeakPolarHBondContact O-CA 3.32Å; G280-G283 PolarHBondContact O-N 2.92Å; G281-G283 VanDerWaalsContact C-N 3.35Å; G283-L286 PolarHBondContact O-N 3Å; G283-A287 PolarHBondContact O-N 3.29Å |
| 284 | F | 88.2 | Confident | 89.8 | Confident | 0 Ų | 0 | 48.2 Ų | 48.2 | 0% | 0 | 24% | 0.243 | C | C | . | . | H | α-helix | trans | -64.1 | -44.2 | 175.5 | -164.2 | -83.8 | 0 | 0 | 0 | 112.6 | E113 M117 Y131 F268 T276 G280 G281 I282 L286 A287 N288 | E113-F284 HydrophobicContact CB-CE1 4.48Å; E113-F284 HydrophobicContact CB-CZ 3.74Å; E113-F284 HydrophobicContact CG-CE1 3.61Å; E113-F284 HydrophobicContact CG-CE2 4.27Å; E113-F284 HydrophobicContact CG-CZ 3.24Å; E113-F284 VanDerWaalsContact OE1-CE1 3.24Å; E113-F284 WeakPolarHBondContact OE1-CE1 3.41Å; E113-F284 WeakPolarHBondContact OE2-CE1 3.39Å; M117-F284 HydrophobicContact CE-CE1 4.07Å; M117-F284 HydrophobicContact CE-CZ 4.15Å; M117-F284 HydrophobicContact CG-CE2 4.48Å; Y131-F284 HydrophobicContact CE1-CD1 4.28Å; Y131-F284 HydrophobicContact CE2-CB 4.32Å; Y131-F284 AromaticContact CE2-CD1 3.76Å; Y131-F284 HydrophobicContact CE2-CD1 3.76Å; Y131-F284 HydrophobicContact CE2-CG 4.41Å; Y131-F284 AromaticContact CZ-CD1 3.46Å; Y131-F284 VanDerWaalsContact CZ-CD1 3.46Å; Y131-F284 AromaticContact CZ-CE1 3.94Å; Y131-F284 WeakPolarHBondContact OH-CD1 3.45Å; Y131-F284 WeakPolarHBondContact OH-CE1 3.32Å; F268-F284 HydrophobicContact CZ-CE1 4.41Å; F268-F284 AromaticContact CZ-CZ 3.9Å; F268-F284 HydrophobicContact CZ-CZ 3.9Å; T276-F284 HydrophobicContact CG2-CB 4.42Å; T276-F284 WeakPolarHBondContact OG1-CB 3.4Å; T276-F284 WeakPolarHBondContact OG1-CD2 3.5Å; G280-F284 PolarHBondContact O-N 2.95Å; G280-F284 VanDerWaalsContact O-N 3.15Å; G281-F284 WeakPolarHBondContact O-CB 3.19Å; G281-F284 PolarHBondContact O-N 3.34Å; I282-F284 PolarHBondContact O-N 2.99Å; F284-L286 VanDerWaalsContact C-N 3.33Å; F284-L286 PolarHBondContact O-N 2.93Å; F284-A287 PolarHBondContact O-N 2.99Å; F284-N288 VanDerWaalsContact CE1-ND2 3.28Å; F284-N288 WeakPolarHBondContact CE1-ND2 3.33Å; F284-N288 PolarHBondContact O-N 3.32Å |
| 285 | I | 91.1 | Very high | 90.1 | Very high | 1 Ų | 1 | 45.2 Ų | 45.2 | 1% | 0.005 | 23% | 0.226 | C | C | . | . | H | α-helix | trans | -61.8 | -41.8 | 173.2 | -59.1 | 176.3 | 0 | 0 | 0 | 110.7 | Y131 L224 C227 Y228 Y231 G281 I282 A287 N288 C289 | Y131-I285 HydrophobicContact CE2-CD1 4.34Å; Y131-I285 HydrophobicContact CE2-CG1 3.72Å; L224-I285 HydrophobicContact CB-CD1 4.12Å; L224-I285 HydrophobicContact CD2-CD1 3.77Å; L224-I285 HydrophobicContact CD2-CG1 4.49Å; L224-I285 VanDerWaalsContact O-CD1 3.26Å; L224-I285 WeakPolarHBondContact O-CD1 3.23Å; C227-I285 HydrophobicContact CB-CB 4.49Å; C227-I285 HydrophobicContact CB-CD1 4.25Å; C227-I285 HydrophobicContact CB-CG2 4.18Å; C227-I285 VanDerWaalsContact SG-CG2 3.55Å; Y228-I285 HydrophobicContact CD2-CD1 4.11Å; Y228-I285 HydrophobicContact CD2-CG1 4.49Å; Y231-I285 HydrophobicContact CG-CG2 4.44Å; G281-I285 PolarHBondContact O-N 2.73Å; G281-I285 VanDerWaalsContact O-N 3.11Å; I282-I285 PolarHBondContact O-N 3.3Å; I282-I285 VanDerWaalsContact O-N 3.15Å; I285-A287 VanDerWaalsContact C-N 3.34Å; I285-A287 PolarHBondContact O-N 3.24Å; I285-N288 CarbonylContact O-C 3.56Å; I285-N288 WeakPolarHBondContact O-CA 3.46Å; I285-N288 VanDerWaalsContact O-CB 3.28Å; I285-N288 WeakPolarHBondContact O-CB 3.42Å; I285-N288 PolarHBondContact O-N 3.37Å; I285-N288 VanDerWaalsContact O-N 3.12Å; I285-C289 PolarHBondContact O-N 3.3Å; I285-C289 PolarHBondContact O-SG 2.59Å; I285-C289 VanDerWaalsContact O-SG 3.36Å |
| 286 | L | 92.9 | Very high | 90.4 | Very high | 62 Ų | 62 | 44.1 Ų | 44.1 | 33% | 0.325 | 22% | 0.22 | S | C | . | . | H | α-helix | trans | -62.9 | -38.5 | 178 | -71.5 | 174.5 | 0 | 0 | 0 | 112.5 | L275 I282 G283 F284 N288 C289 L290 | L275-L286 HydrophobicContact CD2-CB 3.79Å; I282-L286 HydrophobicContact CG2-CD1 4.2Å; I282-L286 HydrophobicContact CG2-CG 4.4Å; I282-L286 WeakPolarHBondContact O-CG 3.26Å; I282-L286 PolarHBondContact O-N 3.23Å; G283-L286 PolarHBondContact O-N 3Å; F284-L286 VanDerWaalsContact C-N 3.33Å; F284-L286 PolarHBondContact O-N 2.93Å; L286-N288 VanDerWaalsContact C-N 3.29Å; L286-N288 PolarHBondContact O-N 2.89Å; L286-C289 WeakPolarHBondContact O-CB 3.37Å; L286-C289 PolarHBondContact O-N 2.76Å; L286-L290 WeakPolarHBondContact O-CG 3.32Å; L286-L290 PolarHBondContact O-N 3.42Å |
| 287 | A | 91.1 | Very high | 90.8 | Very high | 0 Ų | 0 | 46.9 Ų | 46.9 | 0% | 0 | 24% | 0.239 | C | C | . | . | H | α-helix | trans | -61.3 | -40.4 | 173.1 | 0 | 0 | 0 | 0 | 0 | 111.5 | F268 L271 S272 L275 G283 F284 I285 L290 N291 | F268-A287 HydrophobicContact CD2-CB 4.46Å; F268-A287 HydrophobicContact CE2-CB 4.34Å; L271-A287 HydrophobicContact CB-CB 4.22Å; S272-A287 WeakPolarHBondContact OG-CB 3.37Å; L275-A287 HydrophobicContact CD2-CB 4.27Å; G283-A287 PolarHBondContact O-N 3.29Å; F284-A287 PolarHBondContact O-N 2.99Å; I285-A287 VanDerWaalsContact C-N 3.34Å; I285-A287 PolarHBondContact O-N 3.24Å; A287-L290 PolarHBondContact O-N 3.13Å; A287-N291 WeakPolarHBondContact O-CB 3.46Å; A287-N291 PolarHBondContact O-N 3.19Å |
| 288 | N | 90.4 | Very high | 91.2 | Very high | 13 Ų | 13 | 40.1 Ų | 40.1 | 7% | 0.07 | 22% | 0.216 | C | C | . | . | H | α-helix | trans | -63.6 | -41.4 | 172.7 | -98.8 | -53.6 | 0 | 0 | 0 | 112.4 | E113 Y231 F268 F284 I285 L286 L290 N291 M292 | E113-N288 PolarHBondContact OE2-ND2 3.37Å; Y231-N288 HydrophobicContact CE1-CB 4.5Å; Y231-N288 HydrophobicContact CE2-CB 3.87Å; F268-N288 HydrophobicContact CE2-CB 4.19Å; F268-N288 VanDerWaalsContact CE2-CG 3.43Å; F268-N288 VanDerWaalsContact CE2-OD1 3.27Å; F268-N288 WeakPolarHBondContact CE2-OD1 3.36Å; F268-N288 WeakPolarHBondContact CZ-OD1 3.13Å; F284-N288 VanDerWaalsContact CE1-ND2 3.28Å; F284-N288 WeakPolarHBondContact CE1-ND2 3.33Å; F284-N288 PolarHBondContact O-N 3.32Å; I285-N288 CarbonylContact O-C 3.56Å; I285-N288 WeakPolarHBondContact O-CA 3.46Å; I285-N288 VanDerWaalsContact O-CB 3.28Å; I285-N288 WeakPolarHBondContact O-CB 3.42Å; I285-N288 PolarHBondContact O-N 3.37Å; I285-N288 VanDerWaalsContact O-N 3.12Å; L286-N288 VanDerWaalsContact C-N 3.29Å; L286-N288 PolarHBondContact O-N 2.89Å; N288-L290 PolarHBondContact O-N 3.45Å; N288-N291 PolarHBondContact O-N 2.94Å; N288-M292 WeakPolarHBondContact O-CG 3.11Å; N288-M292 PolarHBondContact O-N 3.39Å |
| 289 | C | 93.9 | Very high | 91.6 | Very high | 19 Ų | 19 | 30.9 Ų | 30.9 | 13% | 0.128 | 18% | 0.181 | C | C | . | . | H | α-helix | trans | -58.9 | -45.9 | 172.9 | -68.9 | 0 | 0 | 0 | 0 | 111.8 | Y231 L234 I285 L286 M292 A293 | Y231-C289 HydrophobicContact CD2-CB 4.42Å; Y231-C289 VanDerWaalsContact CD2-SG 3.56Å; L234-C289 HydrophobicContact CD1-CB 3.63Å; L234-C289 WeakPolarHBondContact CD1-O 3.32Å; I285-C289 PolarHBondContact O-N 3.3Å; I285-C289 PolarHBondContact O-SG 2.59Å; I285-C289 VanDerWaalsContact O-SG 3.36Å; L286-C289 WeakPolarHBondContact O-CB 3.37Å; L286-C289 PolarHBondContact O-N 2.76Å; C289-M292 PolarHBondContact O-N 3.44Å; C289-A293 WeakPolarHBondContact O-CB 3.38Å; C289-A293 PolarHBondContact O-N 2.96Å |
| 290 | L | 93.2 | Very high | 92.1 | Very high | 82 Ų | 82 | 31.3 Ų | 31.3 | 43% | 0.429 | 18% | 0.178 | S | C | . | . | H | α-helix | trans | -63.9 | -43.2 | 178.5 | -70.7 | 171.4 | 0 | 0 | 0 | 111.7 | L271 L275 L286 A287 N288 M292 A293 L294 | L271-L290 HydrophobicContact CD2-CB 3.94Å; L271-L290 HydrophobicContact CD2-CD1 3.56Å; L271-L290 HydrophobicContact CD2-CG 4.4Å; L275-L290 HydrophobicContact CD2-CD1 3.97Å; L286-L290 WeakPolarHBondContact O-CG 3.32Å; L286-L290 PolarHBondContact O-N 3.42Å; A287-L290 PolarHBondContact O-N 3.13Å; N288-L290 PolarHBondContact O-N 3.45Å; L290-M292 PolarHBondContact O-N 3.5Å; L290-A293 PolarHBondContact O-N 3.45Å; L290-L294 WeakPolarHBondContact O-CG 3.35Å; L290-L294 PolarHBondContact O-N 3.11Å |
| 291 | N | 90.9 | Very high | 92.5 | Very high | 16 Ų | 16 | 34.6 Ų | 34.6 | 9% | 0.086 | 19% | 0.189 | C | C | . | . | H | α-helix | trans | -59.3 | -46.8 | 174.7 | -174.6 | 39.1 | 0 | 0 | 0 | 111.7 | F268 A287 N288 A293 L294 R295 | F268-N291 HydrophobicContact CB-CB 4.08Å; F268-N291 HydrophobicContact CD2-CB 3.78Å; F268-N291 HydrophobicContact CG-CB 4.22Å; A287-N291 WeakPolarHBondContact O-CB 3.46Å; A287-N291 PolarHBondContact O-N 3.19Å; N288-N291 PolarHBondContact O-N 2.94Å; N291-A293 PolarHBondContact O-N 2.85Å; N291-L294 PolarHBondContact O-N 3.45Å; N291-R295 WeakPolarHBondContact O-CG 3.49Å; N291-R295 PolarHBondContact O-N 3.32Å |
| 292 | M | 92.6 | Very high | 92.8 | Very high | 17 Ų | 17 | 35.7 Ų | 35.7 | 8% | 0.084 | 19% | 0.191 | C | C | . | . | H | α-helix | trans | -65 | -37.5 | 176.1 | -69.3 | -57.1 | 174.1 | 0 | 0 | 112.4 | Y231 L234 L235 N238 N288 C289 L290 L294 R295 I296 | Y231-M292 HydrophobicContact CE2-CB 4.22Å; Y231-M292 HydrophobicContact CE2-CG 3.48Å; Y231-M292 VanDerWaalsContact CE2-CG 3.48Å; Y231-M292 VanDerWaalsContact OH-CE 3.32Å; Y231-M292 WeakPolarHBondContact OH-CE 3.26Å; L234-M292 HydrophobicContact CB-CB 4.02Å; L235-M292 HydrophobicContact CD2-CE 3.8Å; L235-M292 HydrophobicContact CD2-CG 4.39Å; L235-M292 HydrophobicContact CD2-SD 4.34Å; N238-M292 HydrophobicContact CB-SD 4.39Å; N288-M292 WeakPolarHBondContact O-CG 3.11Å; N288-M292 PolarHBondContact O-N 3.39Å; C289-M292 PolarHBondContact O-N 3.44Å; L290-M292 PolarHBondContact O-N 3.5Å; M292-L294 PolarHBondContact O-N 3.24Å; M292-R295 PolarHBondContact O-N 3.1Å; M292-I296 WeakPolarHBondContact O-CB 3.37Å; M292-I296 WeakPolarHBondContact O-CD1 3.49Å; M292-I296 WeakPolarHBondContact O-CG1 3.35Å; M292-I296 PolarHBondContact O-N 2.95Å |
| 293 | A | 94.9 | Very high | 93.1 | Very high | 38 Ų | 38 | 32.6 Ų | 32.6 | 31% | 0.314 | 18% | 0.175 | S | C | . | . | H | α-helix | trans | -63.2 | -40.5 | 176.3 | 0 | 0 | 0 | 0 | 0 | 112.4 | C289 L290 N291 S297 | C289-A293 WeakPolarHBondContact O-CB 3.38Å; C289-A293 PolarHBondContact O-N 2.96Å; L290-A293 PolarHBondContact O-N 3.45Å; N291-A293 PolarHBondContact O-N 2.85Å; A293-S297 WeakPolarHBondContact O-CB 3.42Å; A293-S297 PolarHBondContact O-N 2.96Å; A293-S297 PolarHBondContact O-OG 2.84Å |
| 294 | L | 92.2 | Very high | 93.3 | Very high | 81 Ų | 81 | 37.6 Ų | 37.6 | 42% | 0.424 | 20% | 0.198 | S | C | . | . | H | α-helix | trans | -63.8 | -44.1 | 174.1 | -70 | 172.9 | 0 | 0 | 0 | 111.6 | L264 L290 N291 M292 S297 H298 | L264-L294 HydrophobicContact CD2-CB 3.84Å; L264-L294 HydrophobicContact CD2-CD1 3.78Å; L264-L294 HydrophobicContact CD2-CG 4.4Å; L290-L294 WeakPolarHBondContact O-CG 3.35Å; L290-L294 PolarHBondContact O-N 3.11Å; N291-L294 PolarHBondContact O-N 3.45Å; M292-L294 PolarHBondContact O-N 3.24Å; L294-S297 WeakPolarHBondContact O-CB 3.38Å; L294-S297 PolarHBondContact O-N 3.25Å; L294-H298 PolarHBondContact O-N 3.29Å |
| 295 | R | 92.4 | Very high | 93.6 | Very high | 53 Ų | 53 | 45.9 Ų | 45.9 | 20% | 0.2 | 23% | 0.229 | C | C | . | . | H | α-helix | trans | -61.1 | -48.4 | 176.2 | -71.9 | 174.2 | 66.9 | 177 | 0.6 | 112.1 | N238 E242 L264 N291 M292 S297 H298 S299 | N238-R295 WeakPolarHBondContact ND2-CB 3.4Å; E242-R295 WeakPolarHBondContact OE1-CB 3.42Å; E242-R295 IonicContact OE1-CZ 2.73Å; E242-R295 VanDerWaalsContact OE1-CZ 3.27Å; E242-R295 IonicContact OE1-NE 2.67Å; E242-R295 PolarHBondContact OE1-NE 3.38Å; E242-R295 IonicContact OE1-NH2 3.85Å; E242-R295 PolarHBondContact OE1-NH2 2.84Å; E242-R295 IonicContact OE2-CZ 3.11Å; E242-R295 IonicContact OE2-NE 2.76Å; E242-R295 IonicContact OE2-NH2 3.25Å; E242-R295 PolarHBondContact OE2-NH2 2.89Å; L264-R295 HydrophobicContact CD1-CG 3.88Å; N291-R295 WeakPolarHBondContact O-CG 3.49Å; N291-R295 PolarHBondContact O-N 3.32Å; M292-R295 PolarHBondContact O-N 3.1Å; R295-S297 VanDerWaalsContact C-N 3.33Å; R295-S297 PolarHBondContact O-N 3.47Å; R295-H298 PolarHBondContact O-N 3.48Å; R295-S299 PolarHBondContact O-N 2.73Å; R295-S299 PolarHBondContact O-OG 2.88Å |
| 296 | I | 95.6 | Very high | 93.7 | Very high | 14 Ų | 14 | 46.8 Ų | 46.8 | 7% | 0.072 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -56.7 | -48.8 | 174.2 | -68.8 | 162.8 | 0 | 0 | 0 | 109.7 | L234 V237 N238 M292 H298 S299 L300 | L234-I296 HydrophobicContact CB-CD1 4.11Å; L234-I296 HydrophobicContact CD2-CD1 3.96Å; L234-I296 WeakPolarHBondContact O-CD1 3.24Å; V237-I296 HydrophobicContact CB-CD1 4.21Å; V237-I296 HydrophobicContact CG1-CD1 4.27Å; V237-I296 HydrophobicContact CG1-CG1 4.32Å; V237-I296 HydrophobicContact CG1-CG2 3.91Å; N238-I296 HydrophobicContact CB-CD1 4.15Å; N238-I296 HydrophobicContact CB-CG1 3.73Å; M292-I296 WeakPolarHBondContact O-CB 3.37Å; M292-I296 WeakPolarHBondContact O-CD1 3.49Å; M292-I296 WeakPolarHBondContact O-CG1 3.35Å; M292-I296 PolarHBondContact O-N 2.95Å; I296-H298 VanDerWaalsContact C-N 3.3Å; I296-H298 PolarHBondContact O-N 3.05Å; I296-S299 PolarHBondContact O-N 3.4Å; I296-S299 VanDerWaalsContact O-N 3.11Å; I296-L300 HydrophobicContact CG2-CD1 3.61Å; I296-L300 HydrophobicContact CG2-CG 3.88Å; I296-L300 WeakPolarHBondContact O-CB 3.45Å; I296-L300 VanDerWaalsContact O-CG 3.23Å; I296-L300 WeakPolarHBondContact O-CG 3.41Å; I296-L300 PolarHBondContact O-N 3.28Å |
| 297 | S | 94.9 | Very high | 93.7 | Very high | 61 Ų | 61 | 44.3 Ų | 44.3 | 43% | 0.427 | 22% | 0.219 | S | C | . | . | H | α-helix | trans | -56.6 | -44.6 | -179.8 | -60.3 | 0 | 0 | 0 | 0 | 111.7 | A293 L294 R295 L300 L301 | A293-S297 WeakPolarHBondContact O-CB 3.42Å; A293-S297 PolarHBondContact O-N 2.96Å; A293-S297 PolarHBondContact O-OG 2.84Å; L294-S297 WeakPolarHBondContact O-CB 3.38Å; L294-S297 PolarHBondContact O-N 3.25Å; R295-S297 VanDerWaalsContact C-N 3.33Å; R295-S297 PolarHBondContact O-N 3.47Å; S297-L300 PolarHBondContact O-N 3.29Å; S297-L301 WeakPolarHBondContact O-CB 3.29Å; S297-L301 VanDerWaalsContact O-CG 3.24Å; S297-L301 WeakPolarHBondContact O-CG 3.35Å; S297-L301 PolarHBondContact O-N 3.22Å |
| 298 | H | 93.6 | Very high | 93.7 | Very high | 57 Ų | 57 | 50.5 Ų | 50.5 | 26% | 0.264 | 25% | 0.249 | S | C | . | . | H | α-helix | trans | -61.2 | -47.6 | 175.4 | -175.9 | -76.9 | 0 | 0 | 0 | 112.2 | Y257 L294 R295 I296 L300 L301 Y302 | Y257-H298 AromaticContact CD2-CE1 3.36Å; Y257-H298 WeakPolarHBondContact CD2-CE1 3.43Å; Y257-H298 AromaticContact CD2-ND1 3.58Å; Y257-H298 AromaticContact CE2-CE1 3.7Å; Y257-H298 AromaticContact CE2-ND1 3.37Å; Y257-H298 WeakPolarHBondContact CE2-ND1 3.41Å; L294-H298 PolarHBondContact O-N 3.29Å; R295-H298 PolarHBondContact O-N 3.48Å; I296-H298 VanDerWaalsContact C-N 3.3Å; I296-H298 PolarHBondContact O-N 3.05Å; H298-L300 PolarHBondContact O-N 3.43Å; H298-L301 PolarHBondContact O-N 2.78Å; H298-Y302 PolarHBondContact O-N 3.19Å |
| 299 | S | 95 | Very high | 93.4 | Very high | 0 Ų | 0 | 54.2 Ų | 54.2 | 0% | 0 | 28% | 0.276 | C | S | . | . | H | α-helix | trans | -63.5 | -40.2 | 178.8 | -62.2 | 0 | 0 | 0 | 0 | 112.3 | E242 R295 I296 Y302 I303 | E242-S299 WeakPolarHBondContact CG-OG 3.28Å; R295-S299 PolarHBondContact O-N 2.73Å; R295-S299 PolarHBondContact O-OG 2.88Å; I296-S299 PolarHBondContact O-N 3.4Å; I296-S299 VanDerWaalsContact O-N 3.11Å; S299-Y302 PolarHBondContact O-N 2.85Å; S299-I303 VanDerWaalsContact O-CG1 3.27Å; S299-I303 WeakPolarHBondContact O-CG1 3.28Å; S299-I303 PolarHBondContact O-N 2.93Å |
| 300 | L | 96.3 | Very high | 93 | Very high | 44 Ų | 44 | 54.4 Ų | 54.4 | 23% | 0.23 | 28% | 0.277 | C | S | . | . | H | α-helix | trans | -64.4 | -41.1 | 175.5 | -67 | 180 | 0 | 0 | 0 | 112 | T241 I296 S297 H298 Y302 I303 H304 L315 L318 | T241-L300 HydrophobicContact CG2-CD2 3.84Å; I296-L300 HydrophobicContact CG2-CD1 3.61Å; I296-L300 HydrophobicContact CG2-CG 3.88Å; I296-L300 WeakPolarHBondContact O-CB 3.45Å; I296-L300 VanDerWaalsContact O-CG 3.23Å; I296-L300 WeakPolarHBondContact O-CG 3.41Å; I296-L300 PolarHBondContact O-N 3.28Å; S297-L300 PolarHBondContact O-N 3.29Å; H298-L300 PolarHBondContact O-N 3.43Å; L300-Y302 VanDerWaalsContact C-N 3.31Å; L300-Y302 PolarHBondContact O-N 2.98Å; L300-I303 PolarHBondContact O-N 3.26Å; L300-H304 VanDerWaalsContact O-CB 3.25Å; L300-H304 WeakPolarHBondContact O-CB 3.3Å; L300-H304 PolarHBondContact O-N 2.94Å; L300-L315 HydrophobicContact CD2-CD2 3.58Å; L300-L318 HydrophobicContact CD1-CD1 4.29Å; L300-L318 HydrophobicContact CD2-CD1 3.49Å; L300-L318 VanDerWaalsContact CD2-CD1 3.49Å |
| 301 | L | 94.9 | Very high | 92.8 | Very high | 94 Ų | 94 | 58 Ų | 58 | 49% | 0.492 | 29% | 0.291 | S | S | . | . | H | α-helix | trans | -62.2 | -40.1 | 174.6 | -72.9 | 171.3 | 0 | 0 | 0 | 111.6 | S297 H298 R305 | S297-L301 WeakPolarHBondContact O-CB 3.29Å; S297-L301 VanDerWaalsContact O-CG 3.24Å; S297-L301 WeakPolarHBondContact O-CG 3.35Å; S297-L301 PolarHBondContact O-N 3.22Å; H298-L301 PolarHBondContact O-N 2.78Å; L301-R305 WeakPolarHBondContact O-CB 3.38Å; L301-R305 VanDerWaalsContact O-CG 3.29Å; L301-R305 WeakPolarHBondContact O-CG 3.49Å; L301-R305 PolarHBondContact O-N 3.49Å; L301-R305 VanDerWaalsContact O-N 3.08Å |
| 302 | Y | 94.6 | Very high | 92.9 | Very high | 32 Ų | 32 | 59.8 Ų | 59.8 | 13% | 0.125 | 30% | 0.297 | C | S | . | . | H | α-helix | trans | -63.9 | -51.9 | 175 | -172.9 | -88.5 | 0 | 0 | 0 | 111.6 | V245 A248 M249 E253 H298 S299 L300 H304 R305 Y306 | V245-Y302 HydrophobicContact CB-CD1 4.34Å; V245-Y302 HydrophobicContact CG1-CD1 3.97Å; V245-Y302 HydrophobicContact CG1-CE1 4.39Å; V245-Y302 HydrophobicContact CG1-CG 4.13Å; V245-Y302 HydrophobicContact CG2-CD1 3.83Å; V245-Y302 HydrophobicContact CG2-CG 4.3Å; A248-Y302 HydrophobicContact CB-CE1 4.34Å; M249-Y302 HydrophobicContact CE-CD1 4.47Å; M249-Y302 HydrophobicContact CE-CD2 3.39Å; M249-Y302 HydrophobicContact CE-CE2 3.55Å; M249-Y302 HydrophobicContact CE-CG 3.89Å; M249-Y302 HydrophobicContact CG-CD2 4.45Å; M249-Y302 HydrophobicContact CG-CE1 4.04Å; M249-Y302 HydrophobicContact CG-CE2 3.72Å; M249-Y302 VanDerWaalsContact CG-CZ 3.47Å; M249-Y302 WeakPolarHBondContact CG-OH 3.24Å; E253-Y302 WeakPolarHBondContact OE1-CE2 3.41Å; E253-Y302 PolarHBondContact OE1-OH 3.49Å; H298-Y302 PolarHBondContact O-N 3.19Å; S299-Y302 PolarHBondContact O-N 2.85Å; L300-Y302 VanDerWaalsContact C-N 3.31Å; L300-Y302 PolarHBondContact O-N 2.98Å; Y302-H304 VanDerWaalsContact C-N 3.29Å; Y302-H304 PolarHBondContact O-N 3.34Å; Y302-R305 PolarHBondContact O-N 3.07Å; Y302-Y306 HydrophobicContact CE1-CD2 4.25Å; Y302-Y306 WeakPolarHBondContact O-CB 3.27Å; Y302-Y306 PolarHBondContact O-N 3.35Å |
| 303 | I | 95.9 | Very high | 92.9 | Very high | 0 Ų | 0 | 65.2 Ų | 65.2 | 0% | 0 | 32% | 0.32 | C | S | . | . | H | α-helix | trans | -58.5 | -43.5 | 179.3 | -66 | 164.5 | 0 | 0 | 0 | 110.5 | L182 T241 F244 V245 S299 L300 R305 Y306 F307 P314 L315 | L182-I303 HydrophobicContact CD2-CD1 4.43Å; L182-I303 HydrophobicContact CD2-CG2 4.09Å; T241-I303 HydrophobicContact CG2-CD1 4.03Å; F244-I303 HydrophobicContact CD1-CD1 4.14Å; F244-I303 HydrophobicContact CD1-CG1 3.68Å; F244-I303 HydrophobicContact CE1-CG1 3.94Å; V245-I303 HydrophobicContact CG2-CD1 4.2Å; V245-I303 HydrophobicContact CG2-CG1 3.88Å; S299-I303 VanDerWaalsContact O-CG1 3.27Å; S299-I303 WeakPolarHBondContact O-CG1 3.28Å; S299-I303 PolarHBondContact O-N 2.93Å; L300-I303 PolarHBondContact O-N 3.26Å; I303-R305 PolarHBondContact O-N 3.37Å; I303-Y306 PolarHBondContact O-N 2.95Å; I303-F307 HydrophobicContact CG2-CD2 3.84Å; I303-F307 HydrophobicContact CG2-CE2 4.09Å; I303-F307 WeakPolarHBondContact O-CD2 3.04Å; I303-F307 PolarHBondContact O-N 3.08Å; I303-F307 VanDerWaalsContact O-N 3.08Å; I303-P314 HydrophobicContact CG2-CG 4.17Å; I303-L315 HydrophobicContact CB-CD2 4.1Å; I303-L315 HydrophobicContact CD1-CD2 4.31Å; I303-L315 HydrophobicContact CG2-CD1 4.37Å; I303-L315 HydrophobicContact CG2-CD2 3.58Å; I303-L315 HydrophobicContact CG2-CG 3.9Å |
| 304 | H | 95.2 | Very high | 92.8 | Very high | 105 Ų | 105 | 63.5 Ų | 63.5 | 49% | 0.486 | 31% | 0.306 | S | S | . | . | H | α-helix | trans | -59.4 | -47.9 | 177.8 | -178.7 | 68 | 0 | 0 | 0 | 111.7 | L300 Y302 F307 Q308 L315 | L300-H304 VanDerWaalsContact O-CB 3.25Å; L300-H304 WeakPolarHBondContact O-CB 3.3Å; L300-H304 PolarHBondContact O-N 2.94Å; Y302-H304 VanDerWaalsContact C-N 3.29Å; Y302-H304 PolarHBondContact O-N 3.34Å; H304-F307 PolarHBondContact O-N 3.39Å; H304-Q308 WeakPolarHBondContact O-CA 3.38Å; H304-Q308 WeakPolarHBondContact O-CB 3.14Å; H304-Q308 PolarHBondContact O-N 3.35Å; H304-L315 HydrophobicContact CB-CD1 4.05Å |
| 305 | R | 93.6 | Very high | 92.9 | Very high | 174 Ų | 174 | 61.6 Ų | 61.6 | 66% | 0.657 | 30% | 0.296 | S | S | * | . | H | α-helix | trans | -64.2 | -42.6 | 177.5 | -72.6 | 174.8 | -174.9 | 168.6 | 3.4 | 112 | L301 Y302 I303 F307 Q308 | L301-R305 WeakPolarHBondContact O-CB 3.38Å; L301-R305 VanDerWaalsContact O-CG 3.29Å; L301-R305 WeakPolarHBondContact O-CG 3.49Å; L301-R305 PolarHBondContact O-N 3.49Å; L301-R305 VanDerWaalsContact O-N 3.08Å; Y302-R305 PolarHBondContact O-N 3.07Å; I303-R305 PolarHBondContact O-N 3.37Å; R305-F307 VanDerWaalsContact C-N 3.31Å; R305-F307 PolarHBondContact O-N 3.5Å; R305-Q308 WeakPolarHBondContact O-CB 3.49Å; R305-Q308 PolarHBondContact O-N 3.31Å |
| 306 | Y | 93.1 | Very high | 93 | Very high | 21 Ų | 21 | 66.1 Ų | 66.1 | 8% | 0.082 | 31% | 0.313 | C | S | . | . | H | α-helix | trans | -58.1 | -42.5 | 179.5 | -172.2 | -97.5 | 0 | 0 | 0 | 112.1 | R165 V167 Q170 F244 A248 Y302 I303 | R165-Y306 WeakPolarHBondContact O-CE2 3.43Å; R165-Y306 PolarHBondContact O-OH 2.99Å; V167-Y306 HydrophobicContact CG2-CD1 3.59Å; V167-Y306 HydrophobicContact CG2-CE1 3.33Å; V167-Y306 HydrophobicContact CG2-CE2 4.4Å; V167-Y306 HydrophobicContact CG2-CG 4.25Å; V167-Y306 WeakPolarHBondContact CG2-O 3.34Å; Q170-Y306 PolarHBondContact NE2-OH 3.32Å; F244-Y306 HydrophobicContact CE1-CD1 4.38Å; F244-Y306 HydrophobicContact CZ-CD1 4.07Å; F244-Y306 HydrophobicContact CZ-CE1 4.07Å; A248-Y306 HydrophobicContact CB-CE2 4.3Å; Y302-Y306 HydrophobicContact CE1-CD2 4.25Å; Y302-Y306 WeakPolarHBondContact O-CB 3.27Å; Y302-Y306 PolarHBondContact O-N 3.35Å; I303-Y306 PolarHBondContact O-N 2.95Å |
| 307 | F | 93.9 | Very high | 92.7 | Very high | 9 Ų | 9 | 65.4 Ų | 65.4 | 4% | 0.039 | 31% | 0.31 | C | S | . | . | H | α-helix | trans | -94.2 | 1.1 | 179.3 | -69.8 | -75.5 | 0 | 0 | 0 | 114.4 | V167 V175 A179 L182 F244 I303 H304 R305 S309 S310 W312 P314 | V167-F307 HydrophobicContact CG2-CD1 4.3Å; V167-F307 HydrophobicContact CG2-CE1 4.47Å; V175-F307 HydrophobicContact CG1-CD1 4.5Å; V175-F307 HydrophobicContact CG1-CE1 3.78Å; A179-F307 HydrophobicContact CB-CE1 3.78Å; A179-F307 HydrophobicContact CB-CZ 4.05Å; L182-F307 HydrophobicContact CD2-CE2 4.27Å; F244-F307 AromaticContact CE1-CE2 3.93Å; F244-F307 HydrophobicContact CE1-CE2 3.93Å; F244-F307 HydrophobicContact CE2-CE2 4.24Å; F244-F307 HydrophobicContact CE2-CZ 4.19Å; F244-F307 AromaticContact CZ-CE2 3.45Å; F244-F307 HydrophobicContact CZ-CE2 3.45Å; F244-F307 VanDerWaalsContact CZ-CE2 3.45Å; F244-F307 AromaticContact CZ-CZ 3.68Å; F244-F307 HydrophobicContact CZ-CZ 3.68Å; I303-F307 HydrophobicContact CG2-CD2 3.84Å; I303-F307 HydrophobicContact CG2-CE2 4.09Å; I303-F307 WeakPolarHBondContact O-CD2 3.04Å; I303-F307 PolarHBondContact O-N 3.08Å; I303-F307 VanDerWaalsContact O-N 3.08Å; H304-F307 PolarHBondContact O-N 3.39Å; R305-F307 VanDerWaalsContact C-N 3.31Å; R305-F307 PolarHBondContact O-N 3.5Å; F307-S309 VanDerWaalsContact C-N 3.35Å; F307-S309 PolarHBondContact O-N 3.45Å; F307-S310 WeakPolarHBondContact O-CA 3.35Å; F307-S310 WeakPolarHBondContact O-CB 3.44Å; F307-S310 PolarHBondContact O-N 2.86Å; F307-S310 PolarHBondContact O-OG 2.8Å; F307-W312 HydrophobicContact CD1-CB 4.25Å; F307-W312 HydrophobicContact CD1-CE3 4.49Å; F307-P314 HydrophobicContact CD2-CG 3.53Å; F307-P314 HydrophobicContact CE2-CG 3.53Å; F307-P314 HydrophobicContact CG-CG 4.08Å; F307-P314 HydrophobicContact CZ-CG 4.08Å |
| 308 | Q | 90.1 | Very high | 92.7 | Very high | 131 Ų | 131 | 64.4 Ų | 64.4 | 61% | 0.612 | 30% | 0.299 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -61.2 | -39.9 | -171.9 | -173.2 | 175.8 | -13.9 | 0 | 0 | 113.1 | H304 R305 S310 | H304-Q308 WeakPolarHBondContact O-CA 3.38Å; H304-Q308 WeakPolarHBondContact O-CB 3.14Å; H304-Q308 PolarHBondContact O-N 3.35Å; R305-Q308 WeakPolarHBondContact O-CB 3.49Å; R305-Q308 PolarHBondContact O-N 3.31Å; Q308-S310 PolarHBondContact O-N 3.29Å |
| 309 | S | 83.9 | Confident | 92.6 | Very high | 91 Ų | 91 | 67.8 Ų | 67.8 | 64% | 0.636 | 32% | 0.319 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -80.8 | 0.7 | 177.2 | -50.2 | 0 | 0 | 0 | 0 | 113.3 | E168 F307 | E168-S309 VanDerWaalsContact OE1-CB 3.28Å; E168-S309 WeakPolarHBondContact OE1-CB 3.42Å; F307-S309 VanDerWaalsContact C-N 3.35Å; F307-S309 PolarHBondContact O-N 3.45Å |
| 310 | S | 86.8 | Confident | 92.3 | Very high | 23 Ų | 23 | 68.8 Ų | 68.8 | 16% | 0.161 | 33% | 0.325 | C | S | . | . | S | Bend | trans | -109.9 | 165.3 | -174.7 | 87.6 | 0 | 0 | 0 | 0 | 112.2 | F307 Q308 W312 | F307-S310 WeakPolarHBondContact O-CA 3.35Å; F307-S310 WeakPolarHBondContact O-CB 3.44Å; F307-S310 PolarHBondContact O-N 2.86Å; F307-S310 PolarHBondContact O-OG 2.8Å; Q308-S310 PolarHBondContact O-N 3.29Å; S310-W312 VanDerWaalsContact C-N 3.34Å; S310-W312 VanDerWaalsContact CB-CE3 3.5Å; S310-W312 PolarHBondContact OG-N 3.4Å |
| 311 | Q | 89.4 | Confident | 92.1 | Very high | 156 Ų | 156 | 67.7 Ų | 67.7 | 73% | 0.729 | 32% | 0.321 | S | S | * | . | S | Bend | trans | -81.5 | -13.3 | 176.6 | 44.4 | -174.8 | -17.1 | 0 | 0 | 113.3 | ||
| 312 | W | 91.5 | Very high | 92 | Very high | 54 Ų | 54 | 68.2 Ų | 68.2 | 21% | 0.205 | 33% | 0.33 | C | S | . | . | trans | -87.9 | 142 | -176.1 | -51.6 | -76 | 0 | 0 | 0 | 111.8 | V167 K172 V175 A176 A179 F307 S310 | V167-W312 HydrophobicContact CG1-CE3 4.2Å; V167-W312 HydrophobicContact CG1-CZ3 3.62Å; K172-W312 HydrophobicContact CB-CH2 4.12Å; K172-W312 HydrophobicContact CG-CH2 4.37Å; K172-W312 WeakPolarHBondContact O-CZ2 3.32Å; V175-W312 HydrophobicContact CB-CE3 4.49Å; V175-W312 HydrophobicContact CB-CH2 4.2Å; V175-W312 HydrophobicContact CB-CZ3 3.97Å; V175-W312 HydrophobicContact CG1-CE3 3.67Å; V175-W312 HydrophobicContact CG1-CH2 4.23Å; V175-W312 HydrophobicContact CG1-CZ3 3.52Å; A176-W312 HydrophobicContact CB-CZ2 3.78Å; A179-W312 HydrophobicContact CB-CB 3.67Å; A179-W312 HydrophobicContact CB-CG 4.01Å; F307-W312 HydrophobicContact CD1-CB 4.25Å; F307-W312 HydrophobicContact CD1-CE3 4.49Å; S310-W312 VanDerWaalsContact C-N 3.34Å; S310-W312 VanDerWaalsContact CB-CE3 3.5Å; S310-W312 PolarHBondContact OG-N 3.4Å | ||
| 313 | K | 92.6 | Very high | 91.9 | Very high | 131 Ų | 131 | 71.5 Ų | 71.5 | 57% | 0.57 | 35% | 0.349 | S | S | * | . | trans | -133 | 68.2 | -177 | -64.6 | -172.6 | -179.3 | -176.8 | 0 | 111.5 | L315 R316 | K313-L315 PolarHBondContact O-N 2.95Å; K313-L315 VanDerWaalsContact O-N 3.1Å; K313-R316 HydrophobicContact CB-CG 4.2Å; K313-R316 WeakPolarHBondContact O-CB 3.4Å; K313-R316 WeakPolarHBondContact O-CG 3.46Å; K313-R316 PolarHBondContact O-N 3.49Å | ||
| 314 | P | 93.9 | Very high | 91.8 | Very high | 2 Ų | 2 | 71.5 Ų | 71.5 | 1% | 0.013 | 35% | 0.349 | C | S | . | . | G | 310 helix | trans | -63.2 | -22.6 | -172.5 | 24.6 | -34.4 | 0 | 0 | 0 | 114.1 | A179 L182 E183 I303 F307 R316 G317 | A179-P314 HydrophobicContact CB-CB 4.5Å; A179-P314 WeakPolarHBondContact O-CB 3.4Å; L182-P314 HydrophobicContact CB-CB 4.06Å; L182-P314 HydrophobicContact CD2-CB 3.8Å; L182-P314 HydrophobicContact CD2-CG 3.89Å; L182-P314 HydrophobicContact CG-CB 3.97Å; E183-P314 WeakPolarHBondContact CA-O 3.31Å; E183-P314 HydrophobicContact CB-CB 4.3Å; I303-P314 HydrophobicContact CG2-CG 4.17Å; F307-P314 HydrophobicContact CD2-CG 3.53Å; F307-P314 HydrophobicContact CE2-CG 3.53Å; F307-P314 HydrophobicContact CG-CG 4.08Å; F307-P314 HydrophobicContact CZ-CG 4.08Å; P314-R316 PolarHBondContact O-N 3.07Å; P314-R316 VanDerWaalsContact O-N 3.08Å; P314-G317 PolarHBondContact O-N 3.44Å |
| 315 | L | 94.8 | Very high | 91.7 | Very high | 42 Ų | 42 | 69.8 Ų | 69.8 | 22% | 0.22 | 34% | 0.343 | C | S | . | . | G | 310 helix | trans | -63.6 | -12.2 | 175.3 | -60.6 | -175.1 | 0 | 0 | 0 | 113.6 | L186 L300 I303 H304 K313 G317 L318 | L186-L315 HydrophobicContact CD1-CD2 4.2Å; L300-L315 HydrophobicContact CD2-CD2 3.58Å; I303-L315 HydrophobicContact CB-CD2 4.1Å; I303-L315 HydrophobicContact CD1-CD2 4.31Å; I303-L315 HydrophobicContact CG2-CD1 4.37Å; I303-L315 HydrophobicContact CG2-CD2 3.58Å; I303-L315 HydrophobicContact CG2-CG 3.9Å; H304-L315 HydrophobicContact CB-CD1 4.05Å; K313-L315 PolarHBondContact O-N 2.95Å; K313-L315 VanDerWaalsContact O-N 3.1Å; L315-G317 PolarHBondContact O-N 3.23Å; L315-L318 HydrophobicContact CD2-CD1 4.37Å; L315-L318 WeakPolarHBondContact O-CB 3.24Å; L315-L318 PolarHBondContact O-N 3.05Å |
| 316 | R | 92.6 | Very high | 91.8 | Very high | 147 Ų | 147 | 65.1 Ų | 65.1 | 56% | 0.555 | 33% | 0.334 | S | S | * | . | G | 310 helix | trans | -59 | -23.7 | 168.6 | -74.7 | 178.2 | 172.6 | 179.9 | -2.8 | 112.8 | K313 P314 L318 L319 | K313-R316 HydrophobicContact CB-CG 4.2Å; K313-R316 WeakPolarHBondContact O-CB 3.4Å; K313-R316 WeakPolarHBondContact O-CG 3.46Å; K313-R316 PolarHBondContact O-N 3.49Å; P314-R316 PolarHBondContact O-N 3.07Å; P314-R316 VanDerWaalsContact O-N 3.08Å; R316-L318 PolarHBondContact O-N 3.27Å; R316-L318 VanDerWaalsContact O-N 3.16Å; R316-L319 WeakPolarHBondContact O-CB 3.47Å; R316-L319 PolarHBondContact O-N 3.33Å |
| 317 | G | 90.5 | Very high | 92 | Very high | 0 Ų | 0 | 65.5 Ų | 65.5 | 0% | 0 | 34% | 0.338 | C | S | . | . | G | 310 helix | trans | -59.4 | -23.7 | 173.3 | 0 | 0 | 0 | 0 | 0 | 113.4 | E183 K187 P314 L315 L319 | E183-G317 WeakPolarHBondContact O-CA 3.29Å; K187-G317 WeakPolarHBondContact CA-O 3.27Å; K187-G317 WeakPolarHBondContact CB-O 3.36Å; K187-G317 PolarHBondContact N-O 3.28Å; P314-G317 PolarHBondContact O-N 3.44Å; L315-G317 PolarHBondContact O-N 3.23Å; G317-L319 PolarHBondContact O-N 3.05Å |
| 318 | L | 94.1 | Very high | 92.1 | Very high | 40 Ų | 40 | 65.4 Ų | 65.4 | 21% | 0.209 | 34% | 0.338 | C | S | . | . | G | 310 helix | trans | -80.1 | -3.7 | 176.6 | -65.4 | 171 | 0 | 0 | 0 | 114 | L186 L190 V237 L300 L315 R316 P320 | L186-L318 HydrophobicContact CB-CD2 4.21Å; L186-L318 HydrophobicContact CB-CG 4.35Å; L186-L318 HydrophobicContact CD1-CG 4.37Å; L186-L318 HydrophobicContact CD2-CD2 4.13Å; L190-L318 HydrophobicContact CD1-CD2 4.4Å; L190-L318 VanDerWaalsContact CD2-O 3.3Å; L190-L318 WeakPolarHBondContact CD2-O 3.5Å; V237-L318 HydrophobicContact CG1-CD2 3.86Å; V237-L318 HydrophobicContact CG2-CD2 4.09Å; L300-L318 HydrophobicContact CD1-CD1 4.29Å; L300-L318 HydrophobicContact CD2-CD1 3.49Å; L300-L318 VanDerWaalsContact CD2-CD1 3.49Å; L315-L318 HydrophobicContact CD2-CD1 4.37Å; L315-L318 WeakPolarHBondContact O-CB 3.24Å; L315-L318 PolarHBondContact O-N 3.05Å; R316-L318 PolarHBondContact O-N 3.27Å; R316-L318 VanDerWaalsContact O-N 3.16Å; L318-P320 VanDerWaalsContact O-CD 3.26Å; L318-P320 WeakPolarHBondContact O-CD 3.47Å |
| 319 | L | 92.8 | Very high | 92.4 | Very high | 128 Ų | 128 | 65 Ų | 65 | 67% | 0.67 | 34% | 0.339 | S | S | * | . | S | Bend | trans | -106.3 | 94.9 | 178 | -71.8 | 152.8 | 0 | 0 | 0 | 108.6 | R316 G317 | R316-L319 WeakPolarHBondContact O-CB 3.47Å; R316-L319 PolarHBondContact O-N 3.33Å; G317-L319 PolarHBondContact O-N 3.05Å |
| 320 | P | 89 | Confident | 93 | Very high | 20 Ų | 20 | 65.5 Ų | 65.5 | 13% | 0.13 | 33% | 0.334 | C | S | . | . | trans | -68.9 | 157.7 | 174.4 | 29.3 | -31.8 | 0 | 0 | 0 | 110.1 | L190 L194 L318 L324 L325 | L190-P320 HydrophobicContact CD2-CB 4.46Å; L190-P320 HydrophobicContact CD2-CG 4.03Å; L194-P320 HydrophobicContact CD1-CG 4.2Å; L318-P320 VanDerWaalsContact O-CD 3.26Å; L318-P320 WeakPolarHBondContact O-CD 3.47Å; P320-L324 HydrophobicContact CB-CD2 4.23Å; P320-L325 HydrophobicContact CG-CD1 4.1Å; P320-L325 HydrophobicContact CG-CD2 3.67Å; P320-L325 HydrophobicContact CG-CG 3.82Å | ||
| 321 | S | 91.1 | Very high | 93.5 | Very high | 22 Ų | 22 | 64.6 Ų | 64.6 | 15% | 0.154 | 33% | 0.327 | C | S | . | . | trans | -56.7 | 139.5 | 176.6 | 49.9 | 0 | 0 | 0 | 0 | 112.1 | L323 L324 L325 T372 E373 | S321-L323 PolarHBondContact O-N 3.47Å; S321-L324 WeakPolarHBondContact O-CB 3.18Å; S321-L324 PolarHBondContact O-N 3.31Å; S321-L324 VanDerWaalsContact OG-CB 3.3Å; S321-L324 WeakPolarHBondContact OG-CB 3.45Å; S321-L325 PolarHBondContact O-N 2.96Å; S321-L325 VanDerWaalsContact O-N 3.16Å; S321-T372 WeakPolarHBondContact OG-CB 3.37Å; S321-T372 PolarHBondContact OG-OG1 3.44Å; S321-E373 VanDerWaalsContact CB-OE1 3.23Å; S321-E373 WeakPolarHBondContact CB-OE1 3.48Å; S321-E373 PolarHBondContact N-OE1 2.91Å; S321-E373 PolarHBondContact OG-OE1 3.07Å | ||
| 322 | P | 92.3 | Very high | 93.8 | Very high | 104 Ų | 104 | 58.8 Ų | 58.8 | 68% | 0.675 | 31% | 0.306 | S | S | * | . | H | α-helix | trans | -56.7 | -35.4 | 179.5 | -27 | 34.5 | 0 | 0 | 0 | 113.2 | L325 V326 | P322-L325 PolarHBondContact O-N 3.14Å; P322-V326 WeakPolarHBondContact O-CG2 3.5Å; P322-V326 PolarHBondContact O-N 2.88Å |
| 323 | L | 92.5 | Very high | 94 | Very high | 102 Ų | 102 | 58.5 Ų | 58.5 | 53% | 0.534 | 32% | 0.32 | S | S | . | . | H | α-helix | trans | -62.8 | -43.1 | 176 | -179.6 | 61.9 | 0 | 0 | 0 | 111.7 | S321 L325 V326 V327 T372 | S321-L323 PolarHBondContact O-N 3.47Å; L323-L325 VanDerWaalsContact C-N 3.34Å; L323-L325 PolarHBondContact O-N 2.79Å; L323-V326 PolarHBondContact O-N 3.37Å; L323-V327 HydrophobicContact CD1-CG2 4.41Å; L323-V327 WeakPolarHBondContact O-CG2 3.17Å; L323-V327 PolarHBondContact O-N 3.5Å; L323-T372 HydrophobicContact CB-CG2 4.05Å; L323-T372 HydrophobicContact CD2-CG2 3.65Å; L323-T372 HydrophobicContact CG-CG2 4.15Å |
| 324 | L | 93.6 | Very high | 94.2 | Very high | 0 Ų | 0 | 55.5 Ų | 55.5 | 0% | 0 | 31% | 0.312 | C | S | . | . | H | α-helix | trans | -62.7 | -41.5 | 176.9 | 177.5 | 59.7 | 0 | 0 | 0 | 111.5 | V191 P320 S321 V327 L328 V365 A368 V369 E373 | V191-L324 HydrophobicContact CG1-CD2 4.35Å; V191-L324 HydrophobicContact CG2-CD2 3.8Å; P320-L324 HydrophobicContact CB-CD2 4.23Å; S321-L324 WeakPolarHBondContact O-CB 3.18Å; S321-L324 PolarHBondContact O-N 3.31Å; S321-L324 VanDerWaalsContact OG-CB 3.3Å; S321-L324 WeakPolarHBondContact OG-CB 3.45Å; L324-V327 PolarHBondContact O-N 3.34Å; L324-L328 HydrophobicContact CD1-CD1 4.23Å; L324-L328 HydrophobicContact CD1-CG 4.28Å; L324-L328 HydrophobicContact CG-CD1 4.03Å; L324-L328 WeakPolarHBondContact O-CB 3.27Å; L324-L328 WeakPolarHBondContact O-CG 3.21Å; L324-L328 PolarHBondContact O-N 3.42Å; L324-V365 HydrophobicContact CD1-CG1 4.22Å; L324-A368 HydrophobicContact CD1-CB 4.29Å; L324-V369 HydrophobicContact CD1-CG2 3.58Å; L324-V369 HydrophobicContact CD2-CG2 3.96Å; L324-V369 HydrophobicContact CG-CG2 4.45Å; L324-E373 HydrophobicContact CD2-CG 4.32Å |
| 325 | L | 94.6 | Very high | 94.3 | Very high | 69 Ų | 69 | 55.4 Ų | 55.4 | 36% | 0.361 | 31% | 0.311 | S | S | . | . | H | α-helix | trans | -60.9 | -44.5 | 175.1 | -71.7 | 175.2 | 0 | 0 | 0 | 112 | L194 P320 S321 P322 L323 V327 L328 I329 | L194-L325 HydrophobicContact CD1-CD2 4.45Å; P320-L325 HydrophobicContact CG-CD1 4.1Å; P320-L325 HydrophobicContact CG-CD2 3.67Å; P320-L325 HydrophobicContact CG-CG 3.82Å; S321-L325 PolarHBondContact O-N 2.96Å; S321-L325 VanDerWaalsContact O-N 3.16Å; P322-L325 PolarHBondContact O-N 3.14Å; L323-L325 VanDerWaalsContact C-N 3.34Å; L323-L325 PolarHBondContact O-N 2.79Å; L325-V327 PolarHBondContact O-N 2.91Å; L325-L328 PolarHBondContact O-N 2.93Å; L325-I329 WeakPolarHBondContact O-CB 3.37Å; L325-I329 VanDerWaalsContact O-CG1 3.24Å; L325-I329 WeakPolarHBondContact O-CG1 3.46Å; L325-I329 PolarHBondContact O-N 3.23Å |
| 326 | V | 95.6 | Very high | 94.2 | Very high | 75 Ų | 75 | 55.1 Ų | 55.1 | 46% | 0.455 | 32% | 0.316 | S | S | . | . | H | α-helix | trans | -60.5 | -46.6 | 176.4 | 171 | 0 | 0 | 0 | 0 | 110.9 | P322 L323 L328 I329 I330 | P322-V326 WeakPolarHBondContact O-CG2 3.5Å; P322-V326 PolarHBondContact O-N 2.88Å; L323-V326 PolarHBondContact O-N 3.37Å; V326-L328 VanDerWaalsContact C-N 3.33Å; V326-L328 PolarHBondContact O-N 3.29Å; V326-I329 PolarHBondContact O-N 2.9Å; V326-I330 HydrophobicContact CG1-CD1 3.72Å; V326-I330 HydrophobicContact CG1-CG1 4.42Å; V326-I330 VanDerWaalsContact O-CG1 3.29Å; V326-I330 WeakPolarHBondContact O-CG1 3.5Å; V326-I330 PolarHBondContact O-N 2.9Å |
| 327 | V | 96.3 | Very high | 94.3 | Very high | 29 Ų | 29 | 49.9 Ų | 49.9 | 18% | 0.176 | 31% | 0.307 | C | S | . | . | H | α-helix | trans | -63.1 | -39.5 | 178.4 | 175.9 | 0 | 0 | 0 | 0 | 111.4 | L323 L324 L325 S331 V365 A368 | L323-V327 HydrophobicContact CD1-CG2 4.41Å; L323-V327 WeakPolarHBondContact O-CG2 3.17Å; L323-V327 PolarHBondContact O-N 3.5Å; L324-V327 PolarHBondContact O-N 3.34Å; L325-V327 PolarHBondContact O-N 2.91Å; V327-S331 VanDerWaalsContact O-CB 3.26Å; V327-S331 WeakPolarHBondContact O-CB 3.48Å; V327-S331 PolarHBondContact O-N 3.25Å; V327-S331 PolarHBondContact O-OG 3.46Å; V327-V365 HydrophobicContact CG1-CG2 3.87Å; V327-A368 HydrophobicContact CB-CB 4.33Å; V327-A368 HydrophobicContact CG1-CB 4.22Å; V327-A368 HydrophobicContact CG2-CB 4.13Å |
| 328 | L | 96.4 | Very high | 94.4 | Very high | 7 Ų | 7 | 50.3 Ų | 50.3 | 4% | 0.037 | 31% | 0.31 | C | S | . | . | H | α-helix | trans | -65.5 | -42.9 | 175.4 | -78.4 | 167.2 | 0 | 0 | 0 | 112.3 | L194 I195 V198 L324 L325 V326 S331 A332 V365 | L194-L328 HydrophobicContact CB-CD1 3.96Å; L194-L328 HydrophobicContact CD1-CD1 4.03Å; I195-L328 HydrophobicContact CG1-CD2 4.31Å; V198-L328 HydrophobicContact CG2-CD2 4.22Å; L324-L328 HydrophobicContact CD1-CD1 4.23Å; L324-L328 HydrophobicContact CD1-CG 4.28Å; L324-L328 HydrophobicContact CG-CD1 4.03Å; L324-L328 WeakPolarHBondContact O-CB 3.27Å; L324-L328 WeakPolarHBondContact O-CG 3.21Å; L324-L328 PolarHBondContact O-N 3.42Å; L325-L328 PolarHBondContact O-N 2.93Å; V326-L328 VanDerWaalsContact C-N 3.33Å; V326-L328 PolarHBondContact O-N 3.29Å; L328-S331 PolarHBondContact O-N 2.91Å; L328-A332 WeakPolarHBondContact O-CB 3.5Å; L328-A332 PolarHBondContact O-N 3.31Å; L328-V365 HydrophobicContact CD2-CG1 3.85Å; L328-V365 HydrophobicContact CD2-CG2 4.08Å; L328-V365 HydrophobicContact CG-CG1 4.44Å |
| 329 | I | 96.5 | Very high | 94.3 | Very high | 122 Ų | 122 | 49.2 Ų | 49.2 | 63% | 0.626 | 30% | 0.304 | S | S | * | . | H | α-helix | trans | -64.7 | -45.2 | 177.7 | -69.5 | 164.5 | 0 | 0 | 0 | 110.6 | L325 V326 S331 A332 G333 | L325-I329 WeakPolarHBondContact O-CB 3.37Å; L325-I329 VanDerWaalsContact O-CG1 3.24Å; L325-I329 WeakPolarHBondContact O-CG1 3.46Å; L325-I329 PolarHBondContact O-N 3.23Å; V326-I329 PolarHBondContact O-N 2.9Å; I329-S331 VanDerWaalsContact C-N 3.33Å; I329-S331 PolarHBondContact O-N 2.89Å; I329-A332 WeakPolarHBondContact O-CB 3.48Å; I329-A332 PolarHBondContact O-N 2.92Å; I329-G333 PolarHBondContact O-N 3.35Å |
| 330 | I | 96.8 | Very high | 94.1 | Very high | 103 Ų | 103 | 47.3 Ų | 47.3 | 53% | 0.528 | 31% | 0.307 | S | S | . | . | H | α-helix | trans | -60.6 | -46.7 | 175.4 | -68.1 | 168.4 | 0 | 0 | 0 | 109.8 | V326 A332 G333 V334 | V326-I330 HydrophobicContact CG1-CD1 3.72Å; V326-I330 HydrophobicContact CG1-CG1 4.42Å; V326-I330 VanDerWaalsContact O-CG1 3.29Å; V326-I330 WeakPolarHBondContact O-CG1 3.5Å; V326-I330 PolarHBondContact O-N 2.9Å; I330-A332 VanDerWaalsContact C-N 3.32Å; I330-A332 PolarHBondContact O-N 3.33Å; I330-G333 PolarHBondContact O-N 3.49Å; I330-V334 HydrophobicContact CG2-CG2 4.25Å; I330-V334 VanDerWaalsContact O-CG2 3.31Å; I330-V334 WeakPolarHBondContact O-CG2 3.38Å; I330-V334 PolarHBondContact O-N 3.24Å |
| 331 | S | 97 | Very high | 94 | Very high | 4 Ų | 4 | 51.7 Ų | 51.7 | 3% | 0.028 | 33% | 0.332 | C | S | . | . | H | α-helix | trans | -59.5 | -44.2 | 177.9 | -61.4 | 0 | 0 | 0 | 0 | 111.2 | V327 L328 I329 G333 V334 T335 V365 | V327-S331 VanDerWaalsContact O-CB 3.26Å; V327-S331 WeakPolarHBondContact O-CB 3.48Å; V327-S331 PolarHBondContact O-N 3.25Å; V327-S331 PolarHBondContact O-OG 3.46Å; L328-S331 PolarHBondContact O-N 2.91Å; I329-S331 VanDerWaalsContact C-N 3.33Å; I329-S331 PolarHBondContact O-N 2.89Å; S331-G333 PolarHBondContact O-N 2.88Å; S331-V334 PolarHBondContact O-N 3.43Å; S331-T335 WeakPolarHBondContact O-CB 3.43Å; S331-T335 WeakPolarHBondContact O-CG2 3.26Å; S331-T335 PolarHBondContact O-N 3.49Å; S331-T335 PolarHBondContact O-OG1 3.45Å; S331-V365 WeakPolarHBondContact OG-CG2 3.37Å |
| 332 | A | 96.2 | Very high | 93.7 | Very high | 33 Ų | 33 | 53.4 Ų | 53.4 | 27% | 0.273 | 34% | 0.337 | S | S | . | . | H | α-helix | trans | -58.8 | -46.4 | 176.9 | 0 | 0 | 0 | 0 | 0 | 112.2 | V198 L328 I329 I330 T335 A336 | V198-A332 HydrophobicContact CG1-CB 3.68Å; V198-A332 HydrophobicContact CG2-CB 4.24Å; L328-A332 WeakPolarHBondContact O-CB 3.5Å; L328-A332 PolarHBondContact O-N 3.31Å; I329-A332 WeakPolarHBondContact O-CB 3.48Å; I329-A332 PolarHBondContact O-N 2.92Å; I330-A332 VanDerWaalsContact C-N 3.32Å; I330-A332 PolarHBondContact O-N 3.33Å; A332-T335 PolarHBondContact O-OG1 3Å; A332-A336 WeakPolarHBondContact O-CB 3.38Å; A332-A336 PolarHBondContact O-N 3.3Å |
| 333 | G | 96.1 | Very high | 92.8 | Very high | 49 Ų | 49 | 50.4 Ų | 50.4 | 51% | 0.505 | 32% | 0.318 | S | S | . | . | H | α-helix | trans | -63.1 | -45.2 | 176.8 | 0 | 0 | 0 | 0 | 0 | 112.6 | I329 I330 S331 G337 | I329-G333 PolarHBondContact O-N 3.35Å; I330-G333 PolarHBondContact O-N 3.49Å; S331-G333 PolarHBondContact O-N 2.88Å; G333-G337 PolarHBondContact O-N 2.82Å |
| 334 | V | 96.6 | Very high | 91.6 | Very high | 67 Ų | 67 | 47.7 Ų | 47.7 | 41% | 0.406 | 31% | 0.307 | S | S | . | . | H | α-helix | trans | -64.8 | -45.3 | 179 | 172.1 | 0 | 0 | 0 | 0 | 111.3 | I330 S331 G337 S338 V357 | I330-V334 HydrophobicContact CG2-CG2 4.25Å; I330-V334 VanDerWaalsContact O-CG2 3.31Å; I330-V334 WeakPolarHBondContact O-CG2 3.38Å; I330-V334 PolarHBondContact O-N 3.24Å; S331-V334 PolarHBondContact O-N 3.43Å; V334-G337 PolarHBondContact O-N 2.83Å; V334-S338 WeakPolarHBondContact O-CB 3.32Å; V334-S338 PolarHBondContact O-N 2.84Å; V334-V357 HydrophobicContact CG1-CG1 3.66Å |
| 335 | T | 95.4 | Very high | 90.4 | Very high | 0 Ų | 0 | 55.3 Ų | 55.3 | 0% | 0 | 35% | 0.348 | C | S | . | . | H | α-helix | trans | -70.9 | -37.4 | -179.7 | 55.1 | 0 | 0 | 0 | 0 | 112.1 | F199 A202 Y203 S331 A332 S338 E339 H354 C361 | F199-T335 HydrophobicContact CD1-CG2 4.26Å; F199-T335 HydrophobicContact CE1-CG2 4.05Å; A202-T335 WeakPolarHBondContact CB-OG1 3.16Å; Y203-T335 HydrophobicContact CE2-CG2 3.91Å; S331-T335 WeakPolarHBondContact O-CB 3.43Å; S331-T335 WeakPolarHBondContact O-CG2 3.26Å; S331-T335 PolarHBondContact O-N 3.49Å; S331-T335 PolarHBondContact O-OG1 3.45Å; A332-T335 PolarHBondContact O-OG1 3Å; T335-S338 PolarHBondContact O-N 3.26Å; T335-E339 PolarHBondContact O-N 2.9Å; T335-H354 PolarHBondContact O-CE1 3.3Å; T335-C361 HydrophobicContact CG2-CB 4.22Å |
| 336 | A | 93.4 | Very high | 89.2 | Confident | 37 Ų | 37 | 54 Ų | 54 | 31% | 0.306 | 35% | 0.351 | S | S | . | . | H | α-helix | trans | -67.1 | -41.4 | 174.8 | 0 | 0 | 0 | 0 | 0 | 111.8 | A332 S338 E339 A340 | A332-A336 WeakPolarHBondContact O-CB 3.38Å; A332-A336 PolarHBondContact O-N 3.3Å; A336-S338 VanDerWaalsContact C-N 3.33Å; A336-E339 PolarHBondContact O-N 3.3Å; A336-A340 PolarHBondContact O-N 3.43Å |
| 337 | G | 92.9 | Very high | 88.6 | Confident | 36 Ų | 36 | 52.1 Ų | 52.1 | 37% | 0.371 | 35% | 0.347 | S | S | . | . | H | α-helix | trans | -63.3 | -40.5 | 172.5 | 0 | 0 | 0 | 0 | 0 | 112.1 | G333 V334 A340 V341 | G333-G337 PolarHBondContact O-N 2.82Å; V334-G337 PolarHBondContact O-N 2.83Å; G337-A340 PolarHBondContact O-N 3.4Å; G337-V341 VanDerWaalsContact O-CG2 3.29Å; G337-V341 WeakPolarHBondContact O-CG2 3.43Å; G337-V341 PolarHBondContact O-N 2.76Å |
| 338 | S | 93.5 | Very high | 88.1 | Confident | 9 Ų | 9 | 58.2 Ų | 58.2 | 6% | 0.063 | 37% | 0.367 | C | S | . | . | H | α-helix | trans | -63.3 | -40.8 | 175.4 | -178.4 | 0 | 0 | 0 | 0 | 112.3 | V334 T335 A336 V341 F342 H354 | V334-S338 WeakPolarHBondContact O-CB 3.32Å; V334-S338 PolarHBondContact O-N 2.84Å; T335-S338 PolarHBondContact O-N 3.26Å; A336-S338 VanDerWaalsContact C-N 3.33Å; S338-V341 PolarHBondContact O-N 2.68Å; S338-F342 VanDerWaalsContact O-CB 3.27Å; S338-F342 WeakPolarHBondContact O-CB 3.43Å; S338-F342 WeakPolarHBondContact O-CD2 3.47Å; S338-F342 PolarHBondContact O-N 3.27Å; S338-F342 WeakPolarHBondContact OG-CD2 3.46Å; S338-H354 WeakPolarHBondContact CB-ND1 3.34Å; S338-H354 PolarHBondContact OG-ND1 3.02Å |
| 339 | E | 90.9 | Very high | 87.8 | Confident | 18 Ų | 18 | 65 Ų | 65 | 8% | 0.084 | 40% | 0.403 | C | S | . | . | H | α-helix | trans | -60.6 | -50.9 | 172.6 | -174.7 | -174.1 | -160.5 | 0 | 0 | 109.9 | A202 R226 T335 A336 V341 F342 C343 H354 | A202-E339 WeakPolarHBondContact O-CG 3.41Å; R226-E339 IonicContact CZ-OE1 3.75Å; R226-E339 VanDerWaalsContact NH2-CD 3.29Å; R226-E339 IonicContact NH2-OE1 2.66Å; R226-E339 PolarHBondContact NH2-OE1 3.44Å; R226-E339 IonicContact NH2-OE2 3.3Å; R226-E339 PolarHBondContact NH2-OE2 3.37Å; T335-E339 PolarHBondContact O-N 2.9Å; A336-E339 PolarHBondContact O-N 3.3Å; E339-V341 VanDerWaalsContact C-N 3.26Å; E339-V341 PolarHBondContact O-N 2.87Å; E339-F342 PolarHBondContact O-N 2.66Å; E339-C343 HydrophobicContact CG-CB 4.44Å; E339-C343 WeakPolarHBondContact O-CA 3.44Å; E339-C343 WeakPolarHBondContact O-CB 3.25Å; E339-C343 PolarHBondContact O-N 3.18Å; E339-H354 PolarHBondContact N-CE1 3Å; E339-H354 PolarHBondContact N-ND1 3.32Å |
| 340 | A | 89.1 | Confident | 87.4 | Confident | 88 Ų | 88 | 63.8 Ų | 63.8 | 73% | 0.727 | 39% | 0.393 | S | S | * | . | H | α-helix | trans | -59.6 | -34.5 | -178.7 | 0 | 0 | 0 | 0 | 0 | 113.7 | A336 G337 | A336-A340 PolarHBondContact O-N 3.43Å; G337-A340 PolarHBondContact O-N 3.4Å |
| 341 | V | 87.9 | Confident | 87.1 | Confident | 111 Ų | 111 | 60.9 Ų | 60.9 | 67% | 0.673 | 38% | 0.375 | S | S | * | . | H | α-helix | trans | -86.7 | -38.2 | -178 | 176.6 | 0 | 0 | 0 | 0 | 112.7 | G337 S338 E339 | G337-V341 VanDerWaalsContact O-CG2 3.29Å; G337-V341 WeakPolarHBondContact O-CG2 3.43Å; G337-V341 PolarHBondContact O-N 2.76Å; S338-V341 PolarHBondContact O-N 2.68Å; E339-V341 VanDerWaalsContact C-N 3.26Å; E339-V341 PolarHBondContact O-N 2.87Å |
| 342 | F | 84.6 | Confident | 86.8 | Confident | 58 Ų | 58 | 65.9 Ų | 65.9 | 25% | 0.254 | 40% | 0.4 | S | S | . | . | H | α-helix | trans | -102.6 | -2.2 | -172.6 | -58.7 | -37.9 | 0 | 0 | 0 | 114 | S338 E339 F350 A353 H354 V357 | S338-F342 VanDerWaalsContact O-CB 3.27Å; S338-F342 WeakPolarHBondContact O-CB 3.43Å; S338-F342 WeakPolarHBondContact O-CD2 3.47Å; S338-F342 PolarHBondContact O-N 3.27Å; S338-F342 WeakPolarHBondContact OG-CD2 3.46Å; E339-F342 PolarHBondContact O-N 2.66Å; F342-F350 HydrophobicContact CB-CB 4.13Å; F342-F350 AromaticContact CD1-CD1 3.67Å; F342-F350 HydrophobicContact CD1-CD1 3.67Å; F342-F350 HydrophobicContact CD1-CE1 4.4Å; F342-F350 HydrophobicContact CE1-CD1 4.26Å; F342-F350 HydrophobicContact CG-CD1 4.46Å; F342-A353 HydrophobicContact CD2-CB 4.39Å; F342-A353 HydrophobicContact CE2-CB 4.41Å; F342-H354 HydrophobicContact CB-CB 4.17Å; F342-H354 HydrophobicContact CD2-CB 4.26Å; F342-V357 HydrophobicContact CE2-CG2 4.26Å |
| 343 | C | 73.1 | Confident | 86.6 | Confident | 41 Ų | 41 | 66.3 Ų | 66.3 | 28% | 0.277 | 40% | 0.403 | S | S | . | . | trans | -71.6 | 150.6 | -176.4 | -167.9 | 0 | 0 | 0 | 0 | 114.7 | Y205 E339 D345 | Y205-C343 WeakPolarHBondContact CD1-SG 3.4Å; Y205-C343 WeakPolarHBondContact CE1-SG 3.38Å; E339-C343 HydrophobicContact CG-CB 4.44Å; E339-C343 WeakPolarHBondContact O-CA 3.44Å; E339-C343 WeakPolarHBondContact O-CB 3.25Å; E339-C343 PolarHBondContact O-N 3.18Å; C343-D345 PolarHBondContact O-N 3.34Å; C343-D345 VanDerWaalsContact O-N 3.07Å | ||
| 344 | C | 68.1 | Low | 86.5 | Confident | 45 Ų | 45 | 64.4 Ų | 64.4 | 30% | 0.304 | 38% | 0.381 | S | S | . | . | S | Bend | trans | 80.9 | -62.4 | 147.3 | -50.6 | 0 | 0 | 0 | 0 | 115 | Y205 | Y205-C344 HydrophobicContact CE1-CB 4.35Å; Y205-C344 VanDerWaalsContact CZ-SG 3.54Å |
| 345 | D | 68.3 | Low | 86.4 | Confident | 161 Ų | 161 | 64.8 Ų | 64.8 | 86% | 0.861 | 38% | 0.38 | S | S | * | . | S | Bend | trans | -108.4 | -7.7 | -168.5 | -62.1 | -35.1 | 0 | 0 | 0 | 114.9 | C343 G347 | C343-D345 PolarHBondContact O-N 3.34Å; C343-D345 VanDerWaalsContact O-N 3.07Å; D345-G347 VanDerWaalsContact C-N 3.28Å; D345-G347 PolarHBondContact O-N 2.67Å |
| 346 | G | 68.3 | Low | 86.3 | Confident | 41 Ų | 41 | 66.7 Ų | 66.7 | 42% | 0.423 | 40% | 0.4 | S | S | . | . | S | Bend | trans | -73.5 | -11.7 | -177 | 0 | 0 | 0 | 0 | 0 | 115.3 | F350 | G346-F350 WeakPolarHBondContact O-CD2 3.33Š|
| 347 | G | 83.4 | Confident | 86.4 | Confident | 36 Ų | 36 | 66.9 Ų | 66.9 | 37% | 0.371 | 40% | 0.397 | S | S | . | . | trans | 83.5 | -175.7 | -173.5 | 0 | 0 | 0 | 0 | 0 | 114.3 | D345 L349 F350 R351 | D345-G347 VanDerWaalsContact C-N 3.28Å; D345-G347 PolarHBondContact O-N 2.67Å; G347-L349 VanDerWaalsContact C-N 3.29Å; G347-L349 PolarHBondContact O-N 3.45Å; G347-F350 PolarHBondContact O-N 3.32Å; G347-R351 PolarHBondContact O-N 3.18Å | ||
| 348 | W | 86.2 | Confident | 86.5 | Confident | 156 Ų | 156 | 65.5 Ų | 65.5 | 59% | 0.591 | 38% | 0.383 | S | S | * | . | H | α-helix | trans | -61.9 | -29.9 | -170.7 | -88.8 | 101.3 | 0 | 0 | 0 | 114.7 | L210 F350 R351 M352 | L210-W348 HydrophobicContact CD1-CH2 4.08Å; W348-F350 PolarHBondContact O-N 3.14Å; W348-R351 PolarHBondContact O-N 2.94Å; W348-M352 VanDerWaalsContact O-CG 3.3Å; W348-M352 WeakPolarHBondContact O-CG 3.46Å; W348-M352 PolarHBondContact O-N 3.45Å |
| 349 | L | 88.8 | Confident | 86.6 | Confident | 150 Ų | 150 | 67.1 Ų | 67.1 | 79% | 0.785 | 40% | 0.401 | S | S | * | . | H | α-helix | trans | -61.8 | -45.1 | 179.3 | -72.4 | 170.8 | 0 | 0 | 0 | 112 | G347 M352 A353 | G347-L349 VanDerWaalsContact C-N 3.29Å; G347-L349 PolarHBondContact O-N 3.45Å; L349-M352 PolarHBondContact O-N 2.82Å; L349-A353 PolarHBondContact O-N 2.9Å |
| 350 | F | 89.6 | Confident | 86.9 | Confident | 96 Ų | 96 | 70 Ų | 70 | 42% | 0.421 | 42% | 0.42 | S | S | . | . | H | α-helix | trans | -71.1 | -34.7 | 178.3 | -68.6 | -84 | 0 | 0 | 0 | 112.1 | F342 G346 G347 W348 M352 A353 H354 | F342-F350 HydrophobicContact CB-CB 4.13Å; F342-F350 AromaticContact CD1-CD1 3.67Å; F342-F350 HydrophobicContact CD1-CD1 3.67Å; F342-F350 HydrophobicContact CD1-CE1 4.4Å; F342-F350 HydrophobicContact CE1-CD1 4.26Å; F342-F350 HydrophobicContact CG-CD1 4.46Å; G346-F350 WeakPolarHBondContact O-CD2 3.33Å; G347-F350 PolarHBondContact O-N 3.32Å; W348-F350 PolarHBondContact O-N 3.14Å; F350-M352 PolarHBondContact O-N 3.49Å; F350-A353 WeakPolarHBondContact O-CB 3.26Å; F350-A353 PolarHBondContact O-N 2.95Å; F350-H354 PolarHBondContact O-N 2.92Å |
| 351 | R | 90 | Very high | 87.2 | Confident | 42 Ų | 42 | 66.5 Ų | 66.5 | 16% | 0.158 | 39% | 0.39 | C | S | . | . | H | α-helix | trans | -61.2 | -44.2 | 172.1 | -64.2 | 178.6 | 180 | -153.7 | -6.5 | 111.5 | L206 D209 G347 W348 H354 I355 | L206-R351 HydrophobicContact CD1-CB 4.19Å; L206-R351 HydrophobicContact CD1-CG 4.19Å; D209-R351 IonicContact OD2-CZ 3.2Å; D209-R351 IonicContact OD2-NH1 2.73Å; D209-R351 PolarHBondContact OD2-NH1 3.25Å; D209-R351 IonicContact OD2-NH2 3.27Å; D209-R351 PolarHBondContact OD2-NH2 3.09Å; G347-R351 PolarHBondContact O-N 3.18Å; W348-R351 PolarHBondContact O-N 2.94Å; R351-H354 WeakPolarHBondContact O-CB 3.37Å; R351-H354 PolarHBondContact O-N 3.32Å; R351-I355 WeakPolarHBondContact O-CG1 3.33Å; R351-I355 PolarHBondContact O-N 3.11Å |
| 352 | M | 90.8 | Very high | 87.7 | Confident | 109 Ų | 109 | 64.2 Ų | 64.2 | 54% | 0.537 | 37% | 0.373 | S | S | . | . | H | α-helix | trans | -66.2 | -36.9 | 175.6 | -69 | -59.6 | -68.1 | 0 | 0 | 112.2 | W348 L349 F350 I355 G356 | W348-M352 VanDerWaalsContact O-CG 3.3Å; W348-M352 WeakPolarHBondContact O-CG 3.46Å; W348-M352 PolarHBondContact O-N 3.45Å; L349-M352 PolarHBondContact O-N 2.82Å; F350-M352 PolarHBondContact O-N 3.49Å; M352-I355 PolarHBondContact O-N 3.36Å; M352-I355 HydrophobicContact SD-CD1 3.93Å; M352-G356 PolarHBondContact O-N 3.07Å |
| 353 | A | 92.2 | Very high | 88.2 | Confident | 42 Ų | 42 | 66.7 Ų | 66.7 | 35% | 0.347 | 39% | 0.388 | S | S | . | . | H | α-helix | trans | -61.7 | -44.3 | 173.2 | 0 | 0 | 0 | 0 | 0 | 111.6 | F342 L349 F350 G356 V357 | F342-A353 HydrophobicContact CD2-CB 4.39Å; F342-A353 HydrophobicContact CE2-CB 4.41Å; L349-A353 PolarHBondContact O-N 2.9Å; F350-A353 WeakPolarHBondContact O-CB 3.26Å; F350-A353 PolarHBondContact O-N 2.95Å; A353-G356 PolarHBondContact O-N 3.12Å; A353-G356 VanDerWaalsContact O-N 3.16Å; A353-V357 WeakPolarHBondContact O-CG2 3.37Å; A353-V357 PolarHBondContact O-N 3.33Å |
| 354 | H | 93.6 | Very high | 89.3 | Confident | 10 Ų | 10 | 71 Ų | 71 | 5% | 0.046 | 40% | 0.403 | C | S | . | . | H | α-helix | trans | -59.9 | -47.4 | 174.6 | -177.1 | 55.1 | 0 | 0 | 0 | 111.8 | A202 Y203 T335 S338 E339 F342 F350 R351 G356 V357 G358 | A202-H354 PolarHBondContact O-NE2 3.15Å; Y203-H354 AromaticContact CD1-CD2 3.77Å; Y203-H354 AromaticContact CD1-NE2 3.5Å; Y203-H354 WeakPolarHBondContact CD1-NE2 3.28Å; Y203-H354 AromaticContact CE1-CD2 3.4Å; Y203-H354 WeakPolarHBondContact CE1-CD2 3.18Å; Y203-H354 AromaticContact CE1-CE1 3.8Å; Y203-H354 AromaticContact CE1-NE2 3.24Å; Y203-H354 WeakPolarHBondContact CE1-NE2 3.4Å; Y203-H354 AromaticContact CZ-CE1 3.67Å; Y203-H354 AromaticContact CZ-NE2 3.56Å; Y203-H354 PolarHBondContact OH-O 3.19Å; T335-H354 PolarHBondContact O-CE1 3.3Å; S338-H354 WeakPolarHBondContact CB-ND1 3.34Å; S338-H354 PolarHBondContact OG-ND1 3.02Å; E339-H354 PolarHBondContact N-CE1 3Å; E339-H354 PolarHBondContact N-ND1 3.32Å; F342-H354 HydrophobicContact CB-CB 4.17Å; F342-H354 HydrophobicContact CD2-CB 4.26Å; F350-H354 PolarHBondContact O-N 2.92Å; R351-H354 WeakPolarHBondContact O-CB 3.37Å; R351-H354 PolarHBondContact O-N 3.32Å; H354-G356 VanDerWaalsContact C-N 3.26Å; H354-G356 PolarHBondContact O-N 3.17Å; H354-V357 PolarHBondContact O-N 2.92Å; H354-G358 PolarHBondContact O-N 3.05Å |
| 355 | I | 93.6 | Very high | 90.6 | Very high | 74 Ų | 74 | 68.8 Ų | 68.8 | 38% | 0.379 | 39% | 0.388 | S | S | . | . | H | α-helix | trans | -56.7 | -42.1 | 173.6 | -65.8 | 165.3 | 0 | 0 | 0 | 111.1 | L206 R351 M352 G358 G359 | L206-I355 HydrophobicContact CD2-CD1 3.96Å; L206-I355 HydrophobicContact CD2-CG1 3.57Å; R351-I355 WeakPolarHBondContact O-CG1 3.33Å; R351-I355 PolarHBondContact O-N 3.11Å; M352-I355 PolarHBondContact O-N 3.36Å; M352-I355 HydrophobicContact SD-CD1 3.93Å; I355-G358 PolarHBondContact O-N 3.45Å; I355-G359 PolarHBondContact O-N 3.46Å |
| 356 | G | 94.4 | Very high | 91.8 | Very high | 40 Ų | 40 | 65 Ų | 65 | 41% | 0.412 | 37% | 0.368 | S | S | . | . | H | α-helix | trans | -60.1 | -46.5 | 177 | 0 | 0 | 0 | 0 | 0 | 112.8 | M352 A353 H354 G358 G359 V360 | M352-G356 PolarHBondContact O-N 3.07Å; A353-G356 PolarHBondContact O-N 3.12Å; A353-G356 VanDerWaalsContact O-N 3.16Å; H354-G356 VanDerWaalsContact C-N 3.26Å; H354-G356 PolarHBondContact O-N 3.17Å; G356-G358 VanDerWaalsContact C-N 3.29Å; G356-G358 PolarHBondContact O-N 3.44Å; G356-G359 PolarHBondContact O-N 2.92Å; G356-V360 WeakPolarHBondContact O-CG2 3.42Å; G356-V360 PolarHBondContact O-N 3.33Å |
| 357 | V | 94.9 | Very high | 93 | Very high | 41 Ų | 41 | 66.2 Ų | 66.2 | 25% | 0.248 | 37% | 0.367 | C | S | . | . | H | α-helix | trans | -58.1 | -44.6 | 174.3 | 174.1 | 0 | 0 | 0 | 0 | 110.5 | V334 F342 A353 H354 V360 C361 | V334-V357 HydrophobicContact CG1-CG1 3.66Å; F342-V357 HydrophobicContact CE2-CG2 4.26Å; A353-V357 WeakPolarHBondContact O-CG2 3.37Å; A353-V357 PolarHBondContact O-N 3.33Å; H354-V357 PolarHBondContact O-N 2.92Å; V357-V360 PolarHBondContact O-N 2.82Å; V357-C361 WeakPolarHBondContact O-CB 3.48Å; V357-C361 PolarHBondContact O-N 3.46Å; V357-C361 PolarHBondContact O-SG 3.15Å |
| 358 | G | 94.9 | Very high | 93.5 | Very high | 7 Ų | 7 | 64.9 Ų | 64.9 | 7% | 0.072 | 35% | 0.352 | C | S | . | . | H | α-helix | trans | -59.4 | -46.3 | 175.6 | 0 | 0 | 0 | 0 | 0 | 113.6 | Y203 H354 I355 G356 V360 C361 L362 | Y203-G358 WeakPolarHBondContact OH-CA 3.41Å; Y203-G358 PolarHBondContact OH-N 3.29Å; H354-G358 PolarHBondContact O-N 3.05Å; I355-G358 PolarHBondContact O-N 3.45Å; G356-G358 VanDerWaalsContact C-N 3.29Å; G356-G358 PolarHBondContact O-N 3.44Å; G358-V360 VanDerWaalsContact C-N 3.32Å; G358-V360 PolarHBondContact O-N 3.36Å; G358-C361 PolarHBondContact O-N 3.26Å; G358-L362 VanDerWaalsContact O-CB 3.23Å; G358-L362 WeakPolarHBondContact O-CB 3.45Å; G358-L362 PolarHBondContact O-N 2.72Å |
| 359 | G | 95.9 | Very high | 93.8 | Very high | 43 Ų | 43 | 58.2 Ų | 58.2 | 44% | 0.443 | 33% | 0.328 | S | S | . | . | H | α-helix | trans | -59.6 | -42.6 | 177.7 | 0 | 0 | 0 | 0 | 0 | 112.3 | I355 G356 L363 | I355-G359 PolarHBondContact O-N 3.46Å; G356-G359 PolarHBondContact O-N 2.92Å; G359-L363 WeakPolarHBondContact O-CB 3.35Å; G359-L363 PolarHBondContact O-N 2.91Å |
| 360 | V | 96.8 | Very high | 93.8 | Very high | 80 Ų | 80 | 56.2 Ų | 56.2 | 49% | 0.485 | 32% | 0.318 | S | S | . | . | H | α-helix | trans | -66.8 | -48.6 | 177 | 174.3 | 0 | 0 | 0 | 0 | 111.2 | G356 V357 G358 L362 L363 F364 | G356-V360 WeakPolarHBondContact O-CG2 3.42Å; G356-V360 PolarHBondContact O-N 3.33Å; V357-V360 PolarHBondContact O-N 2.82Å; G358-V360 VanDerWaalsContact C-N 3.32Å; G358-V360 PolarHBondContact O-N 3.36Å; V360-L362 VanDerWaalsContact C-N 3.33Å; V360-L362 PolarHBondContact O-N 3.42Å; V360-L363 WeakPolarHBondContact O-CB 3.38Å; V360-L363 PolarHBondContact O-N 3Å; V360-F364 HydrophobicContact CG1-CD2 3.82Å; V360-F364 HydrophobicContact CG1-CE2 3.56Å; V360-F364 WeakPolarHBondContact O-CD2 3.38Å; V360-F364 PolarHBondContact O-N 3.17Å |
| 361 | C | 96.7 | Very high | 93.8 | Very high | 14 Ų | 14 | 57.8 Ų | 57.8 | 10% | 0.095 | 33% | 0.33 | C | S | . | . | H | α-helix | trans | -60.1 | -42.9 | 177 | -73.1 | 0 | 0 | 0 | 0 | 112 | F199 T335 V357 G358 L363 F364 V365 | F199-C361 HydrophobicContact CE1-CB 3.93Å; F199-C361 HydrophobicContact CZ-CB 4.09Å; T335-C361 HydrophobicContact CG2-CB 4.22Å; V357-C361 WeakPolarHBondContact O-CB 3.48Å; V357-C361 PolarHBondContact O-N 3.46Å; V357-C361 PolarHBondContact O-SG 3.15Å; G358-C361 PolarHBondContact O-N 3.26Å; C361-L363 VanDerWaalsContact C-N 3.34Å; C361-L363 PolarHBondContact O-N 3.42Å; C361-F364 PolarHBondContact O-N 3.49Å; C361-V365 WeakPolarHBondContact O-CG2 3.49Å; C361-V365 PolarHBondContact O-N 3.49Å |
| 362 | L | 96.6 | Very high | 93.7 | Very high | 62 Ų | 62 | 57.6 Ų | 57.6 | 33% | 0.325 | 33% | 0.333 | S | S | . | . | H | α-helix | trans | -62.9 | -42.1 | 177.3 | -177.9 | 62.7 | 0 | 0 | 0 | 111.1 | I195 F199 G358 V360 F364 V365 L366 | I195-L362 HydrophobicContact CG2-CD1 3.86Å; F199-L362 HydrophobicContact CD2-CD1 4.23Å; F199-L362 HydrophobicContact CE1-CB 4.03Å; F199-L362 HydrophobicContact CE2-CB 4.44Å; F199-L362 HydrophobicContact CE2-CD1 3.8Å; F199-L362 HydrophobicContact CZ-CB 3.86Å; F199-L362 HydrophobicContact CZ-CD1 4.09Å; G358-L362 VanDerWaalsContact O-CB 3.23Å; G358-L362 WeakPolarHBondContact O-CB 3.45Å; G358-L362 PolarHBondContact O-N 2.72Å; V360-L362 VanDerWaalsContact C-N 3.33Å; V360-L362 PolarHBondContact O-N 3.42Å; L362-F364 VanDerWaalsContact C-N 3.34Å; L362-F364 PolarHBondContact O-N 2.78Å; L362-V365 PolarHBondContact O-N 3.36Å; L362-L366 HydrophobicContact CD1-CG 4.4Å; L362-L366 HydrophobicContact CG-CD1 4.21Å; L362-L366 HydrophobicContact CG-CG 4.42Å; L362-L366 VanDerWaalsContact O-CG 3.29Å; L362-L366 WeakPolarHBondContact O-CG 3.21Å; L362-L366 PolarHBondContact O-N 2.9Å |
| 363 | L | 96.2 | Very high | 93.5 | Very high | 110 Ų | 110 | 52.6 Ų | 52.6 | 58% | 0.576 | 31% | 0.309 | S | S | * | . | H | α-helix | trans | -59.6 | -44.5 | 175.2 | -177.3 | 65.5 | 0 | 0 | 0 | 111.4 | G359 V360 C361 V365 L366 V367 | G359-L363 WeakPolarHBondContact O-CB 3.35Å; G359-L363 PolarHBondContact O-N 2.91Å; V360-L363 WeakPolarHBondContact O-CB 3.38Å; V360-L363 PolarHBondContact O-N 3Å; C361-L363 VanDerWaalsContact C-N 3.34Å; C361-L363 PolarHBondContact O-N 3.42Å; L363-V365 PolarHBondContact O-N 3.1Å; L363-L366 PolarHBondContact O-N 3.09Å; L363-V367 HydrophobicContact CD1-CG2 4.49Å; L363-V367 VanDerWaalsContact O-CG2 3.31Å; L363-V367 WeakPolarHBondContact O-CG2 3.42Å; L363-V367 PolarHBondContact O-N 3.19Å |
| 364 | F | 95.3 | Very high | 92.8 | Very high | 131 Ų | 131 | 54.5 Ų | 54.5 | 58% | 0.575 | 32% | 0.316 | S | S | * | . | H | α-helix | trans | -61 | -42.9 | 175.3 | -81.8 | -66.4 | 0 | 0 | 0 | 112.5 | V360 C361 L362 V367 A368 | V360-F364 HydrophobicContact CG1-CD2 3.82Å; V360-F364 HydrophobicContact CG1-CE2 3.56Å; V360-F364 WeakPolarHBondContact O-CD2 3.38Å; V360-F364 PolarHBondContact O-N 3.17Å; C361-F364 PolarHBondContact O-N 3.49Å; L362-F364 VanDerWaalsContact C-N 3.34Å; L362-F364 PolarHBondContact O-N 2.78Å; F364-V367 PolarHBondContact O-N 3.38Å; F364-A368 WeakPolarHBondContact O-CB 3.48Å; F364-A368 PolarHBondContact O-N 3.06Å |
| 365 | V | 95.8 | Very high | 92 | Very high | 0 Ų | 0 | 59.3 Ų | 59.3 | 0% | 0 | 34% | 0.339 | C | S | . | . | H | α-helix | trans | -61.5 | -45.7 | 175.2 | 173.2 | 0 | 0 | 0 | 0 | 110.8 | I195 F199 L324 V327 L328 S331 C361 L362 L363 V367 A368 V369 | I195-V365 HydrophobicContact CD1-CG1 4.05Å; I195-V365 HydrophobicContact CG1-CG1 3.87Å; F199-V365 HydrophobicContact CE2-CG2 4.24Å; F199-V365 HydrophobicContact CZ-CG2 4.22Å; L324-V365 HydrophobicContact CD1-CG1 4.22Å; V327-V365 HydrophobicContact CG1-CG2 3.87Å; L328-V365 HydrophobicContact CD2-CG1 3.85Å; L328-V365 HydrophobicContact CD2-CG2 4.08Å; L328-V365 HydrophobicContact CG-CG1 4.44Å; S331-V365 WeakPolarHBondContact OG-CG2 3.37Å; C361-V365 WeakPolarHBondContact O-CG2 3.49Å; C361-V365 PolarHBondContact O-N 3.49Å; L362-V365 PolarHBondContact O-N 3.36Å; L363-V365 PolarHBondContact O-N 3.1Å; V365-V367 PolarHBondContact O-N 2.86Å; V365-A368 WeakPolarHBondContact O-CB 3.36Å; V365-A368 PolarHBondContact O-N 3.35Å; V365-V369 HydrophobicContact CG1-CG2 4.49Å; V365-V369 WeakPolarHBondContact O-CG2 3.19Å; V365-V369 PolarHBondContact O-N 3.33Å |
| 366 | L | 94.4 | Very high | 91.2 | Very high | 82 Ų | 82 | 56.2 Ų | 56.2 | 43% | 0.429 | 32% | 0.323 | S | S | . | . | H | α-helix | trans | -63.1 | -42.3 | 178.4 | -69.7 | 174.9 | 0 | 0 | 0 | 112 | L362 L363 A368 V369 L370 | L362-L366 HydrophobicContact CD1-CG 4.4Å; L362-L366 HydrophobicContact CG-CD1 4.21Å; L362-L366 HydrophobicContact CG-CG 4.42Å; L362-L366 VanDerWaalsContact O-CG 3.29Å; L362-L366 WeakPolarHBondContact O-CG 3.21Å; L362-L366 PolarHBondContact O-N 2.9Å; L363-L366 PolarHBondContact O-N 3.09Å; L366-A368 VanDerWaalsContact C-N 3.35Å; L366-V369 PolarHBondContact O-N 3.11Å; L366-L370 VanDerWaalsContact O-CG 3.32Å; L366-L370 WeakPolarHBondContact O-CG 3.23Å; L366-L370 PolarHBondContact O-N 3.2Å |
| 367 | V | 93.6 | Very high | 90.4 | Very high | 66 Ų | 66 | 56.5 Ų | 56.5 | 40% | 0.4 | 32% | 0.317 | S | S | . | . | H | α-helix | trans | -62.3 | -43.4 | 174 | 171.3 | 0 | 0 | 0 | 0 | 110.6 | L363 F364 V365 V369 L370 L371 | L363-V367 HydrophobicContact CD1-CG2 4.49Å; L363-V367 VanDerWaalsContact O-CG2 3.31Å; L363-V367 WeakPolarHBondContact O-CG2 3.42Å; L363-V367 PolarHBondContact O-N 3.19Å; F364-V367 PolarHBondContact O-N 3.38Å; V365-V367 PolarHBondContact O-N 2.86Å; V367-V369 PolarHBondContact O-N 3.43Å; V367-L370 PolarHBondContact O-N 3.29Å; V367-L371 HydrophobicContact CG1-CD1 3.8Å; V367-L371 HydrophobicContact CG1-CG 4.31Å; V367-L371 VanDerWaalsContact O-CG 3.3Å; V367-L371 WeakPolarHBondContact O-CG 3.35Å; V367-L371 PolarHBondContact O-N 3.21Å |
| 368 | A | 93 | Very high | 89.6 | Confident | 8 Ų | 8 | 60.6 Ų | 60.6 | 7% | 0.066 | 33% | 0.333 | C | S | . | . | H | α-helix | trans | -59.4 | -46.6 | 176 | 0 | 0 | 0 | 0 | 0 | 111.3 | L324 V327 F364 V365 L366 L370 L371 T372 | L324-A368 HydrophobicContact CD1-CB 4.29Å; V327-A368 HydrophobicContact CB-CB 4.33Å; V327-A368 HydrophobicContact CG1-CB 4.22Å; V327-A368 HydrophobicContact CG2-CB 4.13Å; F364-A368 WeakPolarHBondContact O-CB 3.48Å; F364-A368 PolarHBondContact O-N 3.06Å; V365-A368 WeakPolarHBondContact O-CB 3.36Å; V365-A368 PolarHBondContact O-N 3.35Å; L366-A368 VanDerWaalsContact C-N 3.35Å; A368-L370 VanDerWaalsContact C-N 3.33Å; A368-L370 PolarHBondContact O-N 2.87Å; A368-L371 PolarHBondContact O-N 3.45Å; A368-T372 WeakPolarHBondContact O-CG2 3.11Å; A368-T372 PolarHBondContact O-N 2.9Å; A368-T372 PolarHBondContact O-OG1 3.48Å |
| 369 | V | 92.6 | Very high | 88.7 | Confident | 16 Ų | 16 | 61.1 Ų | 61.1 | 10% | 0.097 | 33% | 0.333 | C | S | . | . | H | α-helix | trans | -56.9 | -45.3 | 175 | 172.5 | 0 | 0 | 0 | 0 | 111.3 | V191 L324 V365 L366 V367 L371 E373 L376 | V191-V369 HydrophobicContact CG1-CG1 4.34Å; V191-V369 HydrophobicContact CG1-CG2 3.67Å; L324-V369 HydrophobicContact CD1-CG2 3.58Å; L324-V369 HydrophobicContact CD2-CG2 3.96Å; L324-V369 HydrophobicContact CG-CG2 4.45Å; V365-V369 HydrophobicContact CG1-CG2 4.49Å; V365-V369 WeakPolarHBondContact O-CG2 3.19Å; V365-V369 PolarHBondContact O-N 3.33Å; L366-V369 PolarHBondContact O-N 3.11Å; V367-V369 PolarHBondContact O-N 3.43Å; V369-L371 VanDerWaalsContact C-N 3.3Å; V369-L371 PolarHBondContact O-N 3.42Å; V369-E373 HydrophobicContact CG1-CB 4.46Å; V369-E373 WeakPolarHBondContact O-CB 3.29Å; V369-E373 PolarHBondContact O-N 3.22Å; V369-L376 HydrophobicContact CG1-CD2 4.28Å |
| 370 | L | 89.6 | Confident | 87.7 | Confident | 107 Ų | 107 | 61.2 Ų | 61.2 | 56% | 0.56 | 33% | 0.325 | S | S | * | . | H | α-helix | trans | -64.8 | -33.7 | -179.9 | -70.9 | 175.2 | 0 | 0 | 0 | 113 | L366 V367 A368 V377 | L366-L370 VanDerWaalsContact O-CG 3.32Å; L366-L370 WeakPolarHBondContact O-CG 3.23Å; L366-L370 PolarHBondContact O-N 3.2Å; V367-L370 PolarHBondContact O-N 3.29Å; A368-L370 VanDerWaalsContact C-N 3.33Å; A368-L370 PolarHBondContact O-N 2.87Å; L370-V377 HydrophobicContact CD2-CG1 4.42Å; L370-V377 HydrophobicContact CD2-CG2 3.79Å |
| 371 | L | 88.8 | Confident | 86.6 | Confident | 129 Ų | 129 | 66.4 Ų | 66.4 | 68% | 0.675 | 34% | 0.336 | S | S | * | . | H | α-helix | trans | -83.3 | -38.5 | -178.6 | -67.6 | 175.6 | 0 | 0 | 0 | 112.8 | V367 A368 V369 | V367-L371 HydrophobicContact CG1-CD1 3.8Å; V367-L371 HydrophobicContact CG1-CG 4.31Å; V367-L371 VanDerWaalsContact O-CG 3.3Å; V367-L371 WeakPolarHBondContact O-CG 3.35Å; V367-L371 PolarHBondContact O-N 3.21Å; A368-L371 PolarHBondContact O-N 3.45Å; V369-L371 VanDerWaalsContact C-N 3.3Å; V369-L371 PolarHBondContact O-N 3.42Å |
| 372 | T | 87.4 | Confident | 85.3 | Confident | 38 Ų | 38 | 69.7 Ų | 69.7 | 23% | 0.233 | 36% | 0.356 | C | S | . | . | H | α-helix | trans | -94.1 | -34.2 | -173.2 | 62.8 | 0 | 0 | 0 | 0 | 113.4 | S321 L323 A368 T374 | S321-T372 WeakPolarHBondContact OG-CB 3.37Å; S321-T372 PolarHBondContact OG-OG1 3.44Å; L323-T372 HydrophobicContact CB-CG2 4.05Å; L323-T372 HydrophobicContact CD2-CG2 3.65Å; L323-T372 HydrophobicContact CG-CG2 4.15Å; A368-T372 WeakPolarHBondContact O-CG2 3.11Å; A368-T372 PolarHBondContact O-N 2.9Å; A368-T372 PolarHBondContact O-OG1 3.48Å; T372-T374 PolarHBondContact O-N 2.98Å |
| 373 | E | 86.5 | Confident | 84 | Confident | 5 Ų | 5 | 71.7 Ų | 71.7 | 2% | 0.023 | 36% | 0.364 | C | S | . | . | trans | -100.3 | 54 | -174.5 | -53.6 | -58 | 162 | 0 | 0 | 111.6 | K187 S321 L324 V369 Q375 L376 V377 | K187-E373 WeakPolarHBondContact CD-OE2 3.31Å; K187-E373 WeakPolarHBondContact CE-OE2 3.37Å; K187-E373 IonicContact NZ-OE2 3.51Å; K187-E373 PolarHBondContact NZ-OE2 2.89Å; S321-E373 VanDerWaalsContact CB-OE1 3.23Å; S321-E373 WeakPolarHBondContact CB-OE1 3.48Å; S321-E373 PolarHBondContact N-OE1 2.91Å; S321-E373 PolarHBondContact OG-OE1 3.07Å; L324-E373 HydrophobicContact CD2-CG 4.32Å; V369-E373 HydrophobicContact CG1-CB 4.46Å; V369-E373 WeakPolarHBondContact O-CB 3.29Å; V369-E373 PolarHBondContact O-N 3.22Å; E373-Q375 VanDerWaalsContact C-N 3.29Å; E373-Q375 PolarHBondContact O-N 3Å; E373-L376 HydrophobicContact CB-CB 3.85Å; E373-L376 HydrophobicContact CB-CD2 4.16Å; E373-L376 WeakPolarHBondContact O-CA 2.99Å; E373-L376 VanDerWaalsContact O-CB 3.3Å; E373-L376 WeakPolarHBondContact O-CB 3.45Å; E373-L376 PolarHBondContact O-N 3.29Å; E373-V377 WeakPolarHBondContact O-CG2 3.43Å; E373-V377 PolarHBondContact O-N 3.36Å | ||
| 374 | T | 78.1 | Confident | 82.5 | Confident | 82 Ų | 82 | 70 Ų | 70 | 50% | 0.503 | 36% | 0.355 | S | S | . | . | H | α-helix | trans | -56.6 | -38.3 | -176 | 53.9 | 0 | 0 | 0 | 0 | 113.7 | T372 V377 Q378 | T372-T374 PolarHBondContact O-N 2.98Å; T374-V377 PolarHBondContact O-N 3.23Å; T374-Q378 WeakPolarHBondContact O-CG 3.42Å; T374-Q378 PolarHBondContact O-N 3.29Å |
| 375 | Q | 75.9 | Confident | 80.8 | Confident | 111 Ų | 111 | 68.8 Ų | 68.8 | 52% | 0.519 | 35% | 0.354 | S | S | . | . | H | α-helix | trans | -61.9 | -42.1 | 174.4 | -71.7 | 179.5 | -32 | 0 | 0 | 112.2 | E373 Q378 F379 | E373-Q375 VanDerWaalsContact C-N 3.29Å; E373-Q375 PolarHBondContact O-N 3Å; Q375-Q378 PolarHBondContact O-N 3.32Å; Q375-F379 WeakPolarHBondContact O-CB 3.18Å; Q375-F379 PolarHBondContact O-N 3.3Å |
| 376 | L | 77.9 | Confident | 78.9 | Confident | 8 Ų | 8 | 71.8 Ų | 71.8 | 4% | 0.042 | 37% | 0.373 | C | S | . | . | H | α-helix | trans | -64.1 | -45 | 177 | -179.9 | 68.4 | 0 | 0 | 0 | 110.7 | K187 L188 V369 E373 Q378 F379 V380 | K187-L376 HydrophobicContact CD-CB 4.28Å; K187-L376 HydrophobicContact CG-CD2 4.45Å; L188-L376 HydrophobicContact CB-CD1 3.57Å; L188-L376 HydrophobicContact CD1-CD1 3.9Å; L188-L376 HydrophobicContact CD1-CD2 4.47Å; L188-L376 HydrophobicContact CG-CD1 4.27Å; V369-L376 HydrophobicContact CG1-CD2 4.28Å; E373-L376 HydrophobicContact CB-CB 3.85Å; E373-L376 HydrophobicContact CB-CD2 4.16Å; E373-L376 WeakPolarHBondContact O-CA 2.99Å; E373-L376 VanDerWaalsContact O-CB 3.3Å; E373-L376 WeakPolarHBondContact O-CB 3.45Å; E373-L376 PolarHBondContact O-N 3.29Å; L376-Q378 VanDerWaalsContact C-N 3.31Å; L376-Q378 PolarHBondContact O-N 3.23Å; L376-F379 WeakPolarHBondContact O-CB 3.48Å; L376-F379 PolarHBondContact O-N 2.85Å; L376-V380 WeakPolarHBondContact O-CG2 3.38Å; L376-V380 PolarHBondContact O-N 2.56Å |
| 377 | V | 76.6 | Confident | 76.9 | Confident | 47 Ų | 47 | 77.1 Ų | 77.1 | 29% | 0.285 | 39% | 0.387 | S | S | . | . | H | α-helix | trans | -60.3 | -43.1 | 177.8 | 176.7 | 0 | 0 | 0 | 0 | 111.1 | L370 E373 T374 R381 | L370-V377 HydrophobicContact CD2-CG1 4.42Å; L370-V377 HydrophobicContact CD2-CG2 3.79Å; E373-V377 WeakPolarHBondContact O-CG2 3.43Å; E373-V377 PolarHBondContact O-N 3.36Å; T374-V377 PolarHBondContact O-N 3.23Å; V377-R381 VanDerWaalsContact O-CB 3.27Å; V377-R381 WeakPolarHBondContact O-CB 3.3Å; V377-R381 PolarHBondContact O-N 3.01Å |
| 378 | Q | 77.8 | Confident | 74.6 | Confident | 127 Ų | 127 | 81.9 Ų | 81.9 | 59% | 0.593 | 40% | 0.399 | S | S | * | . | H | α-helix | trans | -63.7 | -43.8 | 175.9 | -74.7 | 177.3 | -9.9 | 0 | 0 | 111.9 | T374 Q375 L376 R381 T382 | T374-Q378 WeakPolarHBondContact O-CG 3.42Å; T374-Q378 PolarHBondContact O-N 3.29Å; Q375-Q378 PolarHBondContact O-N 3.32Å; L376-Q378 VanDerWaalsContact C-N 3.31Å; L376-Q378 PolarHBondContact O-N 3.23Å; Q378-R381 PolarHBondContact O-N 3.38Å; Q378-T382 WeakPolarHBondContact O-CB 3.41Å; Q378-T382 WeakPolarHBondContact O-CG2 3.1Å; Q378-T382 PolarHBondContact O-N 3.21Å; Q378-T382 PolarHBondContact O-OG1 2.66Å |
| 379 | F | 77.3 | Confident | 72.1 | Confident | 17 Ų | 17 | 91.4 Ų | 91.4 | 8% | 0.075 | 43% | 0.434 | C | S | . | . | H | α-helix | trans | -59.1 | -49.2 | 176.5 | 177.3 | -99.2 | 0 | 0 | 0 | 111.9 | F153 V181 C184 L185 Q375 L376 R381 T382 Q383 | F153-F379 HydrophobicContact CE1-CZ 4.12Å; F153-F379 HydrophobicContact CZ-CE1 4.47Å; F153-F379 AromaticContact CZ-CZ 3.93Å; F153-F379 HydrophobicContact CZ-CZ 3.93Å; V181-F379 HydrophobicContact CG1-CE2 4.25Å; V181-F379 HydrophobicContact CG1-CZ 4.33Å; V181-F379 HydrophobicContact CG2-CE2 4.21Å; C184-F379 HydrophobicContact CB-CB 4.11Å; C184-F379 HydrophobicContact CB-CD1 3.99Å; C184-F379 HydrophobicContact CB-CD2 3.79Å; C184-F379 HydrophobicContact CB-CE1 4.35Å; C184-F379 HydrophobicContact CB-CE2 4.17Å; C184-F379 HydrophobicContact CB-CG 3.69Å; C184-F379 HydrophobicContact CB-CZ 4.44Å; L185-F379 HydrophobicContact CD2-CE1 3.92Å; L185-F379 HydrophobicContact CD2-CZ 3.98Å; L185-F379 HydrophobicContact CG-CE1 4.48Å; L185-F379 HydrophobicContact CG-CZ 4.23Å; Q375-F379 WeakPolarHBondContact O-CB 3.18Å; Q375-F379 PolarHBondContact O-N 3.3Å; L376-F379 WeakPolarHBondContact O-CB 3.48Å; L376-F379 PolarHBondContact O-N 2.85Å; F379-R381 VanDerWaalsContact C-N 3.33Å; F379-R381 PolarHBondContact O-N 2.84Å; F379-T382 PolarHBondContact O-N 3.19Å; F379-T382 PolarHBondContact O-OG1 2.96Å; F379-Q383 HydrophobicContact CD2-CB 4.39Å; F379-Q383 HydrophobicContact CD2-CG 3.96Å; F379-Q383 HydrophobicContact CE2-CB 4.19Å; F379-Q383 HydrophobicContact CE2-CG 3.94Å; F379-Q383 HydrophobicContact CZ-CB 4.46Å; F379-Q383 WeakPolarHBondContact O-CB 3.29Å; F379-Q383 PolarHBondContact O-N 2.81Å |
| 380 | V | 75 | Confident | 69.9 | Low | 45 Ų | 45 | 99 Ų | 99 | 27% | 0.273 | 47% | 0.466 | S | S | . | . | I | π-helix | trans | -61.3 | -43.3 | 178.2 | 174.4 | 0 | 0 | 0 | 0 | 111 | L188 L376 L384 L385 | L188-V380 HydrophobicContact CD1-CG2 4.28Å; L376-V380 WeakPolarHBondContact O-CG2 3.38Å; L376-V380 PolarHBondContact O-N 2.56Å; V380-L384 HydrophobicContact CB-CD1 4.46Å; V380-L384 HydrophobicContact CG1-CD1 4.33Å; V380-L384 HydrophobicContact CG2-CD1 4.16Å; V380-L384 WeakPolarHBondContact O-CB 3.3Å; V380-L384 PolarHBondContact O-N 3.37Å; V380-L385 HydrophobicContact CG1-CD1 4.38Å; V380-L385 PolarHBondContact O-N 3.23Å; V380-L385 VanDerWaalsContact O-N 3.15Å |
| 381 | R | 72.8 | Confident | 67.6 | Low | 189 Ų | 189 | 102.4 Ų | 102.4 | 71% | 0.713 | 48% | 0.476 | S | S | * | . | I | π-helix | trans | -67.3 | -34.8 | -179.5 | -170.5 | 177.1 | -179.7 | -178.5 | 0.3 | 113.6 | V377 Q378 F379 P386 | V377-R381 VanDerWaalsContact O-CB 3.27Å; V377-R381 WeakPolarHBondContact O-CB 3.3Å; V377-R381 PolarHBondContact O-N 3.01Å; Q378-R381 PolarHBondContact O-N 3.38Å; F379-R381 VanDerWaalsContact C-N 3.33Å; F379-R381 PolarHBondContact O-N 2.84Å; R381-P386 WeakPolarHBondContact O-CD 3.46Å |
| 382 | T | 70.4 | Confident | 65.3 | Low | 84 Ų | 84 | 102.9 Ų | 102.9 | 52% | 0.515 | 47% | 0.474 | S | S | . | . | I | π-helix | trans | -94.2 | -34.3 | -174.4 | 54.5 | 0 | 0 | 0 | 0 | 113.4 | Q378 F379 P386 | Q378-T382 WeakPolarHBondContact O-CB 3.41Å; Q378-T382 WeakPolarHBondContact O-CG2 3.1Å; Q378-T382 PolarHBondContact O-N 3.21Å; Q378-T382 PolarHBondContact O-OG1 2.66Å; F379-T382 PolarHBondContact O-N 3.19Å; F379-T382 PolarHBondContact O-OG1 2.96Å; T382-P386 WeakPolarHBondContact O-CD 3.41Å; T382-P386 VanDerWaalsContact O-CG 3.27Å; T382-P386 WeakPolarHBondContact O-CG 3.42Å |
| 383 | Q | 69.2 | Low | 62.9 | Low | 104 Ų | 104 | 108.8 Ų | 108.8 | 49% | 0.486 | 51% | 0.511 | S | S | . | . | I | π-helix | trans | -104.1 | -35 | -172.5 | -61.5 | -64.2 | -22.7 | 0 | 0 | 113.7 | F379 | F379-Q383 HydrophobicContact CD2-CB 4.39Å; F379-Q383 HydrophobicContact CD2-CG 3.96Å; F379-Q383 HydrophobicContact CE2-CB 4.19Å; F379-Q383 HydrophobicContact CE2-CG 3.94Å; F379-Q383 HydrophobicContact CZ-CB 4.46Å; F379-Q383 WeakPolarHBondContact O-CB 3.29Å; F379-Q383 PolarHBondContact O-N 2.81Å |
| 384 | L | 65.1 | Low | 61.7 | Low | 74 Ų | 74 | 114 Ų | 114 | 39% | 0.387 | 54% | 0.535 | S | S | . | . | I | π-helix | trans | -94.6 | -48.1 | -176 | -65.2 | 170.7 | 0 | 0 | 0 | 112.8 | L188 V380 | L188-L384 HydrophobicContact CD2-CD1 4.39Å; V380-L384 HydrophobicContact CB-CD1 4.46Å; V380-L384 HydrophobicContact CG1-CD1 4.33Å; V380-L384 HydrophobicContact CG2-CD1 4.16Å; V380-L384 WeakPolarHBondContact O-CB 3.3Å; V380-L384 PolarHBondContact O-N 3.37Å |
| 385 | L | 59.8 | Low | 60.9 | Low | 105 Ų | 105 | 115.7 Ų | 115.7 | 55% | 0.55 | 54% | 0.537 | S | S | . | . | H | α-helix | trans | -65.9 | -39.3 | -175.7 | -87.3 | 154.4 | 0 | 0 | 0 | 115.4 | V380 R387 Y388 R389 | V380-L385 HydrophobicContact CG1-CD1 4.38Å; V380-L385 PolarHBondContact O-N 3.23Å; V380-L385 VanDerWaalsContact O-N 3.15Å; L385-R387 PolarHBondContact O-N 3.44Å; L385-Y388 PolarHBondContact O-N 2.89Å; L385-R389 PolarHBondContact O-N 3.42Å |
| 386 | P | 55.2 | Low | 60 | Low | 63 Ų | 63 | 115.9 Ų | 115.9 | 41% | 0.409 | 54% | 0.538 | S | S | . | . | H | α-helix | trans | -70.6 | -28.1 | -177.2 | -23.7 | 37.7 | 0 | 0 | 0 | 113.9 | R381 T382 Y388 R389 K390 | R381-P386 WeakPolarHBondContact O-CD 3.46Å; T382-P386 WeakPolarHBondContact O-CD 3.41Å; T382-P386 VanDerWaalsContact O-CG 3.27Å; T382-P386 WeakPolarHBondContact O-CG 3.42Å; P386-Y388 VanDerWaalsContact C-N 3.28Å; P386-Y388 PolarHBondContact O-N 3.07Å; P386-R389 PolarHBondContact O-N 2.99Å; P386-K390 PolarHBondContact O-N 3.25Å |
| 387 | R | 51.5 | Low | 59 | Low | 194 Ų | 194 | 122.3 Ų | 122.3 | 73% | 0.732 | 57% | 0.567 | S | S | * | * | H | α-helix | trans | -67.7 | -28.9 | 175 | -76.5 | -172.5 | 175.6 | -175.7 | 2.2 | 112.4 | L385 | L385-R387 PolarHBondContact O-N 3.44Å |
| 388 | Y | 45.1 | Very low | 57.9 | Low | 166 Ų | 166 | 127 Ų | 127 | 65% | 0.651 | 58% | 0.584 | S | S | * | * | H | α-helix | trans | -72.7 | -40.1 | 175.5 | -160.2 | -98.9 | 0 | 0 | 0 | 111.6 | L385 P386 K390 K391 H392 | L385-Y388 PolarHBondContact O-N 2.89Å; P386-Y388 VanDerWaalsContact C-N 3.28Å; P386-Y388 PolarHBondContact O-N 3.07Å; Y388-K390 PolarHBondContact O-N 3.03Å; Y388-K391 PolarHBondContact O-N 3.27Å; Y388-H392 AromaticContact CE1-CD2 3.91Å; Y388-H392 AromaticContact CZ-NE2 3.87Å |
| 389 | R | 41 | Very low | 56.6 | Low | 209 Ų | 209 | 127 Ų | 127 | 79% | 0.789 | 58% | 0.584 | S | S | * | * | H | α-helix | trans | -69.6 | -32.9 | -179.4 | -150.9 | 177.2 | -175.4 | -170.9 | 1 | 113.3 | L385 P386 K391 T393 | L385-R389 PolarHBondContact O-N 3.42Å; P386-R389 PolarHBondContact O-N 2.99Å; R389-K391 VanDerWaalsContact C-N 3.32Å; R389-T393 PolarHBondContact O-OG1 3.45Å |
| 390 | K | 45.9 | Very low | 55.1 | Low | 176 Ų | 176 | 134.9 Ų | 134.9 | 77% | 0.765 | 62% | 0.62 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -75.4 | -12.7 | 174.7 | -90.8 | -174 | 175.7 | -178.1 | 0 | 114.8 | P386 Y388 | P386-K390 PolarHBondContact O-N 3.25Å; Y388-K390 PolarHBondContact O-N 3.03Å |
| 391 | K | 42 | Very low | 53.6 | Low | 178 Ų | 178 | 141.8 Ų | 141.8 | 77% | 0.774 | 65% | 0.647 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -91.5 | -9.6 | 178.9 | -152.8 | 178.3 | -178.4 | -175.9 | 0 | 112.8 | Y388 R389 | Y388-K391 PolarHBondContact O-N 3.27Å; R389-K391 VanDerWaalsContact C-N 3.32Å |
| 392 | H | 39.9 | Very low | 51.9 | Low | 139 Ų | 139 | 137.8 Ų | 137.8 | 64% | 0.644 | 64% | 0.641 | S | S | * | * | trans | -116.8 | 12.6 | -179.1 | -76 | -70 | 0 | 0 | 0 | 113.7 | Y388 | Y388-H392 AromaticContact CE1-CD2 3.91Å; Y388-H392 AromaticContact CZ-NE2 3.87Å | ||
| 393 | T | 38.2 | Very low | 50.3 | Low | 162 Ų | 162 | 142.7 Ų | 142.7 | 99% | 0.994 | 65% | 0.653 | S | S | * | * | trans | -124.2 | 0 | 166.5 | 51.7 | 0 | 0 | 0 | 0 | 107.5 | R389 | R389-T393 PolarHBondContact O-OG1 3.45Š|
Retrieved 393 of 393 residues in 984.4 ms
(Link to these results)