| 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 | 62.6 | Low | 66.7 | Low | 107 Ų | 107 | 35.2 Ų | 35.2 | 53% | 0.527 | 19% | 0.189 | S | C | . | . | 0 | -63.8 | 0 | -59.4 | -48.7 | 172 | 0 | 0 | 112.5 | V3 L4 L5 W171 | M1-V3 VanDerWaalsContact C-N 3.33Å; M1-V3 PolarHBondContact O-N 3.33Å; M1-L4 WeakPolarHBondContact O-CA 3.44Å; M1-L4 WeakPolarHBondContact O-CB 3.18Å; M1-L4 PolarHBondContact O-N 2.66Å; M1-L5 PolarHBondContact O-N 3.2Å; M1-W171 HydrophobicContact CE-CE3 4.03Å; M1-W171 HydrophobicContact CE-CZ3 3.62Å | |||
| 2 | L | 63.8 | Low | 66.7 | Low | 40 Ų | 40 | 32.3 Ų | 32.3 | 21% | 0.209 | 17% | 0.173 | C | C | . | . | H | α-helix | trans | -57.9 | -45 | 178.4 | -71.3 | 169.4 | 0 | 0 | 0 | 113.1 | L4 L5 V6 L109 L126 M168 | L2-L4 PolarHBondContact O-N 2.81Å; L2-L5 WeakPolarHBondContact O-CB 3.28Å; L2-L5 PolarHBondContact O-N 3.11Å; L2-L5 VanDerWaalsContact O-N 3.11Å; L2-V6 WeakPolarHBondContact O-CG2 3.42Å; L2-V6 PolarHBondContact O-N 3.49Å; L2-L109 HydrophobicContact CD1-CB 3.67Å; L2-L109 HydrophobicContact CD1-CD1 4.14Å; L2-L109 HydrophobicContact CD2-CB 4.33Å; L2-L109 HydrophobicContact CD2-CD1 3.33Å; L2-L109 HydrophobicContact CD2-CG 4.46Å; L2-L109 HydrophobicContact CG-CD1 4.34Å; L2-L126 HydrophobicContact CB-CD2 4.07Å; L2-M168 HydrophobicContact CD2-CE 3.61Å; L2-M168 HydrophobicContact CG-CE 4.35Å |
| 3 | V | 66.7 | Low | 66.6 | Low | 47 Ų | 47 | 31.8 Ų | 31.8 | 29% | 0.285 | 17% | 0.17 | S | C | . | . | H | α-helix | trans | -52.8 | -45.2 | 172.9 | -177.8 | 0 | 0 | 0 | 0 | 111.4 | M1 V6 A7 L126 | M1-V3 VanDerWaalsContact C-N 3.33Å; M1-V3 PolarHBondContact O-N 3.33Å; V3-V6 PolarHBondContact O-N 3.29Å; V3-A7 WeakPolarHBondContact O-CB 3.33Å; V3-A7 PolarHBondContact O-N 2.91Å; V3-L126 HydrophobicContact CB-CD2 4.32Å; V3-L126 HydrophobicContact CG2-CD2 3.57Å; V3-L126 HydrophobicContact CG2-CG 4.1Å |
| 4 | L | 67.6 | Low | 66.6 | Low | 81 Ų | 81 | 30.1 Ų | 30.1 | 42% | 0.424 | 16% | 0.16 | S | C | . | . | H | α-helix | trans | -65.7 | -40 | 178.8 | -108.6 | 100 | 0 | 0 | 0 | 112.3 | M1 L2 V6 A7 V8 V164 | M1-L4 WeakPolarHBondContact O-CA 3.44Å; M1-L4 WeakPolarHBondContact O-CB 3.18Å; M1-L4 PolarHBondContact O-N 2.66Å; L2-L4 PolarHBondContact O-N 2.81Å; L4-V6 VanDerWaalsContact C-N 3.33Å; L4-V6 PolarHBondContact O-N 2.94Å; L4-A7 WeakPolarHBondContact O-CB 3.39Å; L4-A7 PolarHBondContact O-N 3.29Å; L4-V8 VanDerWaalsContact O-CG2 3.25Å; L4-V8 WeakPolarHBondContact O-CG2 3.15Å; L4-V8 PolarHBondContact O-N 3.14Å; L4-V164 HydrophobicContact CB-CG2 4.12Å; L4-V164 HydrophobicContact CD2-CG2 3.88Å |
| 5 | L | 66.7 | Low | 66.6 | Low | 16 Ų | 16 | 28.4 Ų | 28.4 | 8% | 0.084 | 15% | 0.151 | C | C | . | . | H | α-helix | trans | -61.1 | -46 | 177.9 | 177.9 | 56.7 | 0 | 0 | 0 | 111.3 | M1 L2 V8 G9 M69 V164 M168 | M1-L5 PolarHBondContact O-N 3.2Å; L2-L5 WeakPolarHBondContact O-CB 3.28Å; L2-L5 PolarHBondContact O-N 3.11Å; L2-L5 VanDerWaalsContact O-N 3.11Å; L5-V8 PolarHBondContact O-N 3.5Å; L5-G9 PolarHBondContact O-N 3.08Å; L5-G9 VanDerWaalsContact O-N 3.17Å; L5-M69 HydrophobicContact CD1-CE 3.19Å; L5-M69 HydrophobicContact CD1-CG 4.48Å; L5-M69 HydrophobicContact CD2-CE 3.84Å; L5-M69 HydrophobicContact CG-CE 4.05Å; L5-V164 HydrophobicContact CB-CG1 4.16Å; L5-V164 HydrophobicContact CD1-CG1 4.32Å; L5-M168 HydrophobicContact CD2-CE 4.34Å; L5-M168 HydrophobicContact CD2-SD 3.9Å |
| 6 | V | 67.2 | Low | 66.4 | Low | 10 Ų | 10 | 27.8 Ų | 27.8 | 6% | 0.061 | 15% | 0.146 | C | C | . | . | H | α-helix | trans | -70.7 | -38.5 | 178.5 | -171.7 | 0 | 0 | 0 | 0 | 110.5 | L2 V3 L4 V8 G9 Q10 A106 I130 | L2-V6 WeakPolarHBondContact O-CG2 3.42Å; L2-V6 PolarHBondContact O-N 3.49Å; V3-V6 PolarHBondContact O-N 3.29Å; L4-V6 VanDerWaalsContact C-N 3.33Å; L4-V6 PolarHBondContact O-N 2.94Å; V6-V8 VanDerWaalsContact C-N 3.31Å; V6-V8 PolarHBondContact O-N 3.07Å; V6-G9 PolarHBondContact O-N 2.87Å; V6-Q10 HydrophobicContact CG1-CG 4.35Å; V6-Q10 WeakPolarHBondContact O-CG 3.45Å; V6-Q10 PolarHBondContact O-N 3.33Å; V6-A106 HydrophobicContact CB-CB 4.48Å; V6-A106 HydrophobicContact CG1-CB 4.41Å; V6-A106 HydrophobicContact CG2-CB 3.26Å; V6-I130 HydrophobicContact CB-CG1 4.33Å; V6-I130 HydrophobicContact CG1-CD1 3.84Å; V6-I130 HydrophobicContact CG1-CG1 3.58Å |
| 7 | A | 68.1 | Low | 66 | Low | 9 Ų | 9 | 26.5 Ų | 26.5 | 7% | 0.074 | 14% | 0.14 | C | C | . | . | H | α-helix | trans | -55.6 | -47.7 | 173.5 | 0 | 0 | 0 | 0 | 0 | 110.8 | V3 L4 G9 Q10 M11 S133 | V3-A7 WeakPolarHBondContact O-CB 3.33Å; V3-A7 PolarHBondContact O-N 2.91Å; L4-A7 WeakPolarHBondContact O-CB 3.39Å; L4-A7 PolarHBondContact O-N 3.29Å; A7-G9 VanDerWaalsContact C-N 3.34Å; A7-G9 PolarHBondContact O-N 3.33Å; A7-Q10 PolarHBondContact O-N 3.33Å; A7-M11 WeakPolarHBondContact O-CA 3.3Å; A7-M11 WeakPolarHBondContact O-CB 3.34Å; A7-M11 WeakPolarHBondContact O-CG 3.41Å; A7-M11 PolarHBondContact O-N 2.85Å; A7-S133 WeakPolarHBondContact CA-OG 2.83Å; A7-S133 WeakPolarHBondContact CB-OG 3.33Å |
| 8 | V | 67.7 | Low | 65.5 | Low | 6 Ų | 6 | 25.9 Ų | 25.9 | 4% | 0.036 | 14% | 0.138 | C | C | . | . | H | α-helix | trans | -60.8 | -42.2 | 177.2 | 170.4 | 0 | 0 | 0 | 0 | 111.4 | L4 L5 V6 M11 A12 F72 L157 L160 C161 | L4-V8 VanDerWaalsContact O-CG2 3.25Å; L4-V8 WeakPolarHBondContact O-CG2 3.15Å; L4-V8 PolarHBondContact O-N 3.14Å; L5-V8 PolarHBondContact O-N 3.5Å; V6-V8 VanDerWaalsContact C-N 3.31Å; V6-V8 PolarHBondContact O-N 3.07Å; V8-M11 PolarHBondContact O-N 2.92Å; V8-A12 WeakPolarHBondContact O-CB 3.25Å; V8-A12 PolarHBondContact O-N 3.39Å; V8-F72 HydrophobicContact CG1-CE1 4.42Å; V8-L157 HydrophobicContact CG1-CD2 4.21Å; V8-L160 HydrophobicContact CG2-CB 4.06Å; V8-L160 HydrophobicContact CG2-CD1 4.4Å; V8-C161 HydrophobicContact CG1-CB 4.44Å |
| 9 | G | 67.3 | Low | 65.4 | Low | 7 Ų | 7 | 24.7 Ų | 24.7 | 7% | 0.072 | 13% | 0.132 | C | C | . | . | H | α-helix | trans | -63.5 | -41.1 | 176.8 | 0 | 0 | 0 | 0 | 0 | 113.5 | L5 V6 A7 Q13 Y41 | L5-G9 PolarHBondContact O-N 3.08Å; L5-G9 VanDerWaalsContact O-N 3.17Å; V6-G9 PolarHBondContact O-N 2.87Å; A7-G9 VanDerWaalsContact C-N 3.34Å; A7-G9 PolarHBondContact O-N 3.33Å; G9-Q13 PolarHBondContact O-N 2.99Å; G9-Y41 PolarHBondContact O-OH 2.76Å |
| 10 | Q | 68.1 | Low | 65.3 | Low | 42 Ų | 42 | 23.8 Ų | 23.8 | 20% | 0.196 | 13% | 0.127 | C | C | . | . | H | α-helix | trans | -74.5 | -37.4 | 176.8 | -65.7 | -63.9 | 87.8 | 0 | 0 | 112.1 | V6 A7 A12 Q13 T14 | V6-Q10 HydrophobicContact CG1-CG 4.35Å; V6-Q10 WeakPolarHBondContact O-CG 3.45Å; V6-Q10 PolarHBondContact O-N 3.33Å; A7-Q10 PolarHBondContact O-N 3.33Å; Q10-A12 VanDerWaalsContact C-N 3.34Å; Q10-Q13 PolarHBondContact O-N 3.4Å; Q10-T14 PolarHBondContact O-N 2.86Å; Q10-T14 VanDerWaalsContact O-N 3.14Å; Q10-T14 PolarHBondContact O-OG1 3.5Å |
| 11 | M | 67.9 | Low | 65 | Low | 22 Ų | 22 | 23.3 Ų | 23.3 | 11% | 0.108 | 13% | 0.127 | C | C | . | . | H | α-helix | trans | -62.5 | -43.2 | 174.4 | -76.5 | 174 | 173.1 | 0 | 0 | 110.1 | A7 V8 Q13 T14 I15 L136 A137 L157 | A7-M11 WeakPolarHBondContact O-CA 3.3Å; A7-M11 WeakPolarHBondContact O-CB 3.34Å; A7-M11 WeakPolarHBondContact O-CG 3.41Å; A7-M11 PolarHBondContact O-N 2.85Å; V8-M11 PolarHBondContact O-N 2.92Å; M11-Q13 PolarHBondContact O-N 3.39Å; M11-T14 PolarHBondContact O-N 3.46Å; M11-T14 PolarHBondContact O-OG1 3.34Å; M11-I15 WeakPolarHBondContact O-CB 3.42Å; M11-I15 WeakPolarHBondContact O-CG2 3.34Å; M11-I15 PolarHBondContact O-N 3.34Å; M11-L136 HydrophobicContact CE-CB 3.86Å; M11-L136 HydrophobicContact CE-CD1 4.24Å; M11-A137 HydrophobicContact CB-CB 3.96Å; M11-A137 HydrophobicContact CG-CB 3.76Å; M11-L157 HydrophobicContact CB-CD2 4.34Å |
| 12 | A | 66.8 | Low | 65.1 | Low | 0 Ų | 0 | 20.4 Ų | 20.4 | 0% | 0 | 11% | 0.113 | C | C | . | . | H | α-helix | trans | -55.2 | -52.5 | 174.2 | 0 | 0 | 0 | 0 | 0 | 110.4 | V8 Q10 T14 I15 Y16 F72 L157 | V8-A12 WeakPolarHBondContact O-CB 3.25Å; V8-A12 PolarHBondContact O-N 3.39Å; Q10-A12 VanDerWaalsContact C-N 3.34Å; A12-T14 VanDerWaalsContact C-N 3.26Å; A12-T14 PolarHBondContact O-N 2.9Å; A12-I15 WeakPolarHBondContact O-CG2 3.43Å; A12-Y16 HydrophobicContact CB-CE2 4.35Å; A12-Y16 WeakPolarHBondContact O-CD2 3.3Å; A12-Y16 WeakPolarHBondContact O-CE2 3.5Å; A12-F72 HydrophobicContact CB-CE2 4.15Å; A12-F72 HydrophobicContact CB-CZ 4.13Å; A12-L157 HydrophobicContact CB-CD2 3.99Å |
| 13 | Q | 65.5 | Low | 65.1 | Low | 27 Ų | 27 | 18.6 Ų | 18.6 | 13% | 0.126 | 10% | 0.104 | C | C | . | . | H | α-helix | trans | -55.2 | -40.1 | -179.8 | -174.3 | -179.3 | -39 | 0 | 0 | 113.5 | G9 Q10 M11 Y41 | G9-Q13 PolarHBondContact O-N 2.99Å; Q10-Q13 PolarHBondContact O-N 3.4Å; M11-Q13 PolarHBondContact O-N 3.39Å; Q13-Y41 HydrophobicContact CB-CD1 4.48Å; Q13-Y41 HydrophobicContact CB-CE1 3.76Å; Q13-Y41 HydrophobicContact CG-CD1 4.31Å; Q13-Y41 HydrophobicContact CG-CE1 3.97Å |
| 14 | T | 66.7 | Low | 65 | Low | 7 Ų | 7 | 16.6 Ų | 16.6 | 4% | 0.043 | 9% | 0.092 | C | C | . | . | H | α-helix | trans | -92.6 | -28.6 | -171.1 | 43.6 | 0 | 0 | 0 | 0 | 113.6 | Q10 M11 A12 Y16 I17 P18 P134 A137 | Q10-T14 PolarHBondContact O-N 2.86Å; Q10-T14 VanDerWaalsContact O-N 3.14Å; Q10-T14 PolarHBondContact O-OG1 3.5Å; M11-T14 PolarHBondContact O-N 3.46Å; M11-T14 PolarHBondContact O-OG1 3.34Å; A12-T14 VanDerWaalsContact C-N 3.26Å; A12-T14 PolarHBondContact O-N 2.9Å; T14-Y16 PolarHBondContact O-N 2.92Å; T14-I17 HydrophobicContact CG2-CD1 4.45Å; T14-I17 WeakPolarHBondContact O-CB 3.48Å; T14-I17 WeakPolarHBondContact O-CG1 3.4Å; T14-I17 PolarHBondContact O-N 3.3Å; T14-P18 WeakPolarHBondContact O-CD 3.17Å; T14-P134 HydrophobicContact CG2-CB 4.3Å; T14-A137 WeakPolarHBondContact OG1-CB 3.46Å |
| 15 | I | 66.1 | Low | 64.9 | Low | 5 Ų | 5 | 20.6 Ų | 20.6 | 3% | 0.026 | 10% | 0.101 | C | C | . | . | H | α-helix | trans | -70.2 | -20.1 | 177.1 | -154.8 | 169 | 0 | 0 | 0 | 112.1 | M11 A12 I17 P18 C153 L157 | M11-I15 WeakPolarHBondContact O-CB 3.42Å; M11-I15 WeakPolarHBondContact O-CG2 3.34Å; M11-I15 PolarHBondContact O-N 3.34Å; A12-I15 WeakPolarHBondContact O-CG2 3.43Å; I15-I17 VanDerWaalsContact C-N 3.29Å; I15-P18 WeakPolarHBondContact O-CD 3.44Å; I15-P18 WeakPolarHBondContact O-CG 3.18Å; I15-C153 HydrophobicContact CD1-CB 3.68Å; I15-C153 HydrophobicContact CG1-CB 3.97Å; I15-L157 HydrophobicContact CD1-CD1 4.34Å; I15-L157 HydrophobicContact CG2-CD1 3.49Å; I15-L157 VanDerWaalsContact CG2-CD1 3.49Å |
| 16 | Y | 62.9 | Low | 65 | Low | 18 Ų | 18 | 25 Ų | 25 | 7% | 0.071 | 13% | 0.125 | C | C | . | . | H | α-helix | trans | -63.3 | -39.6 | 172.5 | -60 | -46.6 | 0 | 0 | 0 | 110.8 | A12 T14 A19 I20 Y41 Q95 Y154 | A12-Y16 HydrophobicContact CB-CE2 4.35Å; A12-Y16 WeakPolarHBondContact O-CD2 3.3Å; A12-Y16 WeakPolarHBondContact O-CE2 3.5Å; T14-Y16 PolarHBondContact O-N 2.92Å; Y16-A19 CarbonylContact O-C 3.58Å; Y16-A19 WeakPolarHBondContact O-CA 3.13Å; Y16-A19 PolarHBondContact O-N 3.34Å; Y16-I20 VanDerWaalsContact O-CG1 3.26Å; Y16-I20 WeakPolarHBondContact O-CG1 3.39Å; Y16-I20 PolarHBondContact O-N 3.29Å; Y16-Y41 HydrophobicContact CE2-CD2 4.07Å; Y16-Y41 HydrophobicContact CE2-CE2 4.17Å; Y16-Y41 HydrophobicContact CE2-CG 4.47Å; Y16-Q95 PolarHBondContact OH-OE1 3.01Å; Y16-Y154 HydrophobicContact CD1-CE1 4.17Å; Y16-Y154 AromaticContact CD1-CZ 3.79Å; Y16-Y154 VanDerWaalsContact CD1-OH 3.32Å; Y16-Y154 WeakPolarHBondContact CD1-OH 3.36Å; Y16-Y154 HydrophobicContact CE1-CD1 4.24Å; Y16-Y154 AromaticContact CE1-CE1 3.31Å; Y16-Y154 HydrophobicContact CE1-CE1 3.31Å; Y16-Y154 HydrophobicContact CE1-CE2 4.42Å; Y16-Y154 AromaticContact CE1-CZ 3.4Å; Y16-Y154 VanDerWaalsContact CE1-CZ 3.4Å; Y16-Y154 WeakPolarHBondContact CE1-OH 3.43Å |
| 17 | I | 60.9 | Low | 65 | Low | 6 Ų | 6 | 25.8 Ų | 25.8 | 3% | 0.031 | 13% | 0.129 | C | C | . | . | H | α-helix | trans | -50.5 | -54.5 | -172.1 | -57.4 | 170.8 | 0 | 0 | 0 | 112.8 | T14 I15 I20 E216 F238 | T14-I17 HydrophobicContact CG2-CD1 4.45Å; T14-I17 WeakPolarHBondContact O-CB 3.48Å; T14-I17 WeakPolarHBondContact O-CG1 3.4Å; T14-I17 PolarHBondContact O-N 3.3Å; I15-I17 VanDerWaalsContact C-N 3.29Å; I17-I20 WeakPolarHBondContact O-CB 3.49Å; I17-I20 PolarHBondContact O-N 2.86Å; I17-E216 HydrophobicContact CD1-CB 3.97Å; I17-F238 HydrophobicContact CD1-CE1 4.14Å; I17-F238 HydrophobicContact CD1-CZ 3.86Å; I17-F238 HydrophobicContact CG2-CE2 3.82Å; I17-F238 HydrophobicContact CG2-CZ 3.8Å |
| 18 | P | 57.3 | Low | 64.9 | Low | 16 Ų | 16 | 32.8 Ų | 32.8 | 10% | 0.104 | 17% | 0.165 | C | C | . | . | H | α-helix | trans | -65.6 | -40.4 | 177.1 | 24 | -33.2 | 0 | 0 | 0 | 112.3 | T14 I15 I20 S231 | T14-P18 WeakPolarHBondContact O-CD 3.17Å; I15-P18 WeakPolarHBondContact O-CD 3.44Å; I15-P18 WeakPolarHBondContact O-CG 3.18Å; P18-I20 PolarHBondContact O-N 3Å; P18-S231 WeakPolarHBondContact CB-OG 3.12Å |
| 19 | A | 62.6 | Low | 64.8 | Low | 3 Ų | 3 | 34.6 Ų | 34.6 | 3% | 0.025 | 18% | 0.176 | C | C | . | . | H | α-helix | trans | -71.9 | -10.2 | -178.8 | 0 | 0 | 0 | 0 | 0 | 113.8 | Y16 A21 D22 M23 W150 | Y16-A19 CarbonylContact O-C 3.58Å; Y16-A19 WeakPolarHBondContact O-CA 3.13Å; Y16-A19 PolarHBondContact O-N 3.34Å; A19-A21 VanDerWaalsContact C-N 3.29Å; A19-A21 PolarHBondContact O-N 2.86Å; A19-D22 PolarHBondContact O-N 2.84Å; A19-M23 HydrophobicContact CB-CE 3.4Å; A19-M23 VanDerWaalsContact O-CB 3.29Å; A19-M23 WeakPolarHBondContact O-CB 3.4Å; A19-M23 VanDerWaalsContact O-CG 3.28Å; A19-M23 WeakPolarHBondContact O-CG 3.38Å; A19-M23 PolarHBondContact O-N 2.9Å; A19-W150 HydrophobicContact CB-CB 3.9Å |
| 20 | I | 63.5 | Low | 64.8 | Low | 6 Ų | 6 | 43.2 Ų | 43.2 | 3% | 0.031 | 21% | 0.206 | C | C | . | . | H | α-helix | trans | -57.8 | -44 | 177.7 | -75.3 | -172.1 | 0 | 0 | 0 | 110.7 | Y16 I17 P18 A24 V34 V221 | Y16-I20 VanDerWaalsContact O-CG1 3.26Å; Y16-I20 WeakPolarHBondContact O-CG1 3.39Å; Y16-I20 PolarHBondContact O-N 3.29Å; I17-I20 WeakPolarHBondContact O-CB 3.49Å; I17-I20 PolarHBondContact O-N 2.86Å; P18-I20 PolarHBondContact O-N 3Å; I20-A24 VanDerWaalsContact O-CB 3.31Å; I20-A24 WeakPolarHBondContact O-CB 3.24Å; I20-A24 PolarHBondContact O-N 3.25Å; I20-V34 HydrophobicContact CB-CG1 3.84Å; I20-V34 HydrophobicContact CD1-CG1 4.13Å; I20-V34 HydrophobicContact CG1-CG1 3.6Å; I20-V34 HydrophobicContact CG2-CB 3.74Å; I20-V34 HydrophobicContact CG2-CG1 3.56Å; I20-V34 HydrophobicContact CG2-CG2 4.38Å; I20-V221 HydrophobicContact CG2-CG2 4.15Å |
| 21 | A | 59.5 | Low | 64.5 | Low | 15 Ų | 15 | 44.1 Ų | 44.1 | 12% | 0.124 | 21% | 0.21 | C | C | . | . | H | α-helix | trans | -67.1 | -43.7 | -176.1 | 0 | 0 | 0 | 0 | 0 | 111.2 | A19 A24 R25 | A19-A21 VanDerWaalsContact C-N 3.29Å; A19-A21 PolarHBondContact O-N 2.86Å; A21-A24 PolarHBondContact O-N 2.61Å; A21-R25 WeakPolarHBondContact O-CG 3.36Å; A21-R25 PolarHBondContact O-N 3.22Å |
| 22 | D | 64.1 | Low | 64.2 | Low | 45 Ų | 45 | 43.6 Ų | 43.6 | 24% | 0.241 | 21% | 0.21 | C | C | . | . | H | α-helix | trans | -72.2 | -37.3 | 179.2 | -74.2 | -13.1 | 0 | 0 | 0 | 112 | A19 R25 D26 | A19-D22 PolarHBondContact O-N 2.84Å; D22-R25 PolarHBondContact O-N 3.19Å; D22-R25 IonicContact OD1-NH1 3.98Å; D22-D26 VanDerWaalsContact O-CB 3.28Å; D22-D26 WeakPolarHBondContact O-CB 3.42Å; D22-D26 PolarHBondContact O-N 2.94Å |
| 23 | M | 64.5 | Low | 64.1 | Low | 3 Ų | 3 | 44.9 Ų | 44.9 | 2% | 0.015 | 22% | 0.221 | C | C | . | . | H | α-helix | trans | -61.5 | -43.9 | 170 | -76.1 | -173.8 | -112.4 | 0 | 0 | 111.4 | A19 R25 D26 L27 L88 W150 Y154 | A19-M23 HydrophobicContact CB-CE 3.4Å; A19-M23 VanDerWaalsContact O-CB 3.29Å; A19-M23 WeakPolarHBondContact O-CB 3.4Å; A19-M23 VanDerWaalsContact O-CG 3.28Å; A19-M23 WeakPolarHBondContact O-CG 3.38Å; A19-M23 PolarHBondContact O-N 2.9Å; M23-R25 VanDerWaalsContact C-N 3.3Å; M23-R25 PolarHBondContact O-N 3.39Å; M23-D26 PolarHBondContact O-N 3.16Å; M23-L27 HydrophobicContact CB-CD1 4.27Å; M23-L27 VanDerWaalsContact O-CB 3.22Å; M23-L27 WeakPolarHBondContact O-CB 3.22Å; M23-L27 WeakPolarHBondContact O-CD1 3.28Å; M23-L27 WeakPolarHBondContact O-CG 3.28Å; M23-L27 PolarHBondContact O-N 3.38Å; M23-L88 HydrophobicContact SD-CD2 3.68Å; M23-W150 HydrophobicContact CG-CB 4.36Å; M23-W150 HydrophobicContact CG-CD2 3.85Å; M23-W150 HydrophobicContact CG-CE3 3.98Å; M23-W150 HydrophobicContact CG-CG 4.04Å; M23-W150 HydrophobicContact SD-CE3 4.15Å; M23-W150 HydrophobicContact SD-CZ3 4.48Å; M23-Y154 HydrophobicContact CE-CE2 3.88Å; M23-Y154 HydrophobicContact SD-CE2 4.25Å |
| 24 | A | 64 | Low | 64 | Low | 4 Ų | 4 | 43.8 Ų | 43.8 | 3% | 0.033 | 22% | 0.217 | C | C | . | . | H | α-helix | trans | -60.7 | -41.2 | 177.8 | 0 | 0 | 0 | 0 | 0 | 111.8 | I20 A21 N28 V29 E31 V34 | I20-A24 VanDerWaalsContact O-CB 3.31Å; I20-A24 WeakPolarHBondContact O-CB 3.24Å; I20-A24 PolarHBondContact O-N 3.25Å; A21-A24 PolarHBondContact O-N 2.61Å; A24-N28 PolarHBondContact O-N 3.3Å; A24-N28 VanDerWaalsContact O-N 3.16Å; A24-V29 PolarHBondContact O-N 2.94Å; A24-V29 VanDerWaalsContact O-N 3.12Å; A24-E31 HydrophobicContact CB-CG 3.95Å; A24-V34 HydrophobicContact CB-CG2 3.81Å |
| 25 | R | 65.6 | Low | 64 | Low | 166 Ų | 166 | 43.5 Ų | 43.5 | 63% | 0.626 | 22% | 0.215 | S | C | * | . | H | α-helix | trans | -67 | -46.6 | 176.7 | -74 | 175.1 | 178.7 | 172.1 | 0.3 | 112.4 | A21 D22 M23 N28 | A21-R25 WeakPolarHBondContact O-CG 3.36Å; A21-R25 PolarHBondContact O-N 3.22Å; D22-R25 PolarHBondContact O-N 3.19Å; D22-R25 IonicContact OD1-NH1 3.98Å; M23-R25 VanDerWaalsContact C-N 3.3Å; M23-R25 PolarHBondContact O-N 3.39Å; R25-N28 PolarHBondContact O-N 3.43Å |
| 26 | D | 69.5 | Low | 64.2 | Low | 107 Ų | 107 | 45.3 Ų | 45.3 | 57% | 0.572 | 23% | 0.228 | S | C | * | . | H | α-helix | trans | -69.2 | -36.3 | -177.6 | -163.2 | 30.4 | 0 | 0 | 0 | 112 | D22 M23 N28 W150 | D22-D26 VanDerWaalsContact O-CB 3.28Å; D22-D26 WeakPolarHBondContact O-CB 3.42Å; D22-D26 PolarHBondContact O-N 2.94Å; M23-D26 PolarHBondContact O-N 3.16Å; D26-N28 VanDerWaalsContact C-N 3.33Å; D26-W150 PolarHBondContact OD2-NE1 3.21Å |
| 27 | L | 67.6 | Low | 64.7 | Low | 28 Ų | 28 | 44.9 Ų | 44.9 | 15% | 0.147 | 23% | 0.227 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -84.1 | -6.3 | 178.2 | -71.6 | 154.5 | 0 | 0 | 0 | 113.4 | M23 V29 S83 L88 | M23-L27 HydrophobicContact CB-CD1 4.27Å; M23-L27 VanDerWaalsContact O-CB 3.22Å; M23-L27 WeakPolarHBondContact O-CB 3.22Å; M23-L27 WeakPolarHBondContact O-CD1 3.28Å; M23-L27 WeakPolarHBondContact O-CG 3.28Å; M23-L27 PolarHBondContact O-N 3.38Å; L27-V29 HydrophobicContact CB-CB 4.48Å; L27-V29 HydrophobicContact CB-CG1 4.2Å; L27-V29 HydrophobicContact CB-CG2 3.65Å; L27-V29 WeakPolarHBondContact O-CG1 3.25Å; L27-V29 PolarHBondContact O-N 3.33Å; L27-S83 WeakPolarHBondContact CD2-O 3.29Å; L27-L88 HydrophobicContact CD1-CD2 4Å |
| 28 | N | 65.6 | Low | 65.2 | Low | 155 Ų | 155 | 45.4 Ų | 45.4 | 83% | 0.829 | 23% | 0.229 | S | C | * | . | T | Hydrogen-bonded Turn | trans | 50.8 | 42 | -174.5 | -158.8 | 1.5 | 0 | 0 | 0 | 112.8 | A24 R25 D26 | A24-N28 PolarHBondContact O-N 3.3Å; A24-N28 VanDerWaalsContact O-N 3.16Å; R25-N28 PolarHBondContact O-N 3.43Å; D26-N28 VanDerWaalsContact C-N 3.33Å |
| 29 | V | 65.5 | Low | 66 | Low | 45 Ų | 45 | 44.7 Ų | 44.7 | 27% | 0.273 | 23% | 0.225 | S | C | . | . | trans | -116.3 | 151.4 | -177.3 | -70.3 | 0 | 0 | 0 | 0 | 110.4 | A24 L27 E31 V34 L85 | A24-V29 PolarHBondContact O-N 2.94Å; A24-V29 VanDerWaalsContact O-N 3.12Å; L27-V29 HydrophobicContact CB-CB 4.48Å; L27-V29 HydrophobicContact CB-CG1 4.2Å; L27-V29 HydrophobicContact CB-CG2 3.65Å; L27-V29 WeakPolarHBondContact O-CG1 3.25Å; L27-V29 PolarHBondContact O-N 3.33Å; V29-E31 PolarHBondContact O-N 3.44Å; V29-V34 HydrophobicContact CG2-CG2 4.34Å; V29-L85 HydrophobicContact CB-CD1 4.33Å; V29-L85 HydrophobicContact CG1-CB 4.23Å; V29-L85 HydrophobicContact CG1-CD1 4.42Å; V29-L85 HydrophobicContact CG2-CD1 3.74Å | ||
| 30 | R | 66.3 | Low | 66.8 | Low | 188 Ų | 188 | 45.4 Ų | 45.4 | 71% | 0.709 | 23% | 0.231 | S | C | * | . | trans | -60.8 | 135.2 | 175.1 | -167.5 | 171.1 | -175.9 | 160.8 | 1.3 | 109.8 | G32 A33 | R30-G32 PolarHBondContact O-N 3.45Å; R30-G32 VanDerWaalsContact O-N 3.08Å; R30-A33 WeakPolarHBondContact O-CB 3.32Å; R30-A33 PolarHBondContact O-N 3.35Å | ||
| 31 | E | 61.8 | Low | 67.5 | Low | 60 Ų | 60 | 45.1 Ų | 45.1 | 28% | 0.28 | 23% | 0.229 | S | C | . | . | H | α-helix | trans | -53.5 | -33.3 | -178.4 | -66 | 172.3 | 172.3 | 0 | 0 | 113.5 | A24 V29 A33 V34 V221 A225 | A24-E31 HydrophobicContact CB-CG 3.95Å; V29-E31 PolarHBondContact O-N 3.44Å; E31-A33 PolarHBondContact O-N 2.86Å; E31-V34 WeakPolarHBondContact O-CB 3.19Å; E31-V34 PolarHBondContact O-N 2.93Å; E31-V221 HydrophobicContact CB-CG1 4.29Å; E31-V221 VanDerWaalsContact OE2-CG1 3.26Å; E31-V221 WeakPolarHBondContact OE2-CG1 3.43Å; E31-A225 VanDerWaalsContact CD-CB 3.43Å; E31-A225 WeakPolarHBondContact OE1-CB 3.15Å; E31-A225 VanDerWaalsContact OE2-CB 3.27Å; E31-A225 WeakPolarHBondContact OE2-CB 3.46Å |
| 32 | G | 61.5 | Low | 68.3 | Low | 11 Ų | 11 | 44.5 Ų | 44.5 | 11% | 0.113 | 22% | 0.224 | C | C | . | . | H | α-helix | trans | -58.4 | -32.6 | 173.5 | 0 | 0 | 0 | 0 | 0 | 113.3 | R30 V34 Q35 A344 | R30-G32 PolarHBondContact O-N 3.45Å; R30-G32 VanDerWaalsContact O-N 3.08Å; G32-V34 PolarHBondContact O-N 3.49Å; G32-Q35 WeakPolarHBondContact O-CB 3.28Å; G32-Q35 PolarHBondContact O-N 2.81Å; G32-A344 WeakPolarHBondContact O-CB 3.17Å |
| 33 | A | 64.6 | Low | 69 | Low | 28 Ų | 28 | 45.7 Ų | 45.7 | 23% | 0.231 | 23% | 0.23 | C | C | . | . | H | α-helix | trans | -66.3 | -27.7 | 176.9 | 0 | 0 | 0 | 0 | 0 | 112.3 | R30 E31 Q35 S36 L85 | R30-A33 WeakPolarHBondContact O-CB 3.32Å; R30-A33 PolarHBondContact O-N 3.35Å; E31-A33 PolarHBondContact O-N 2.86Å; A33-Q35 VanDerWaalsContact C-N 3.33Å; A33-S36 VanDerWaalsContact O-CB 3.29Å; A33-S36 WeakPolarHBondContact O-CB 3.29Å; A33-S36 PolarHBondContact O-N 2.86Å; A33-L85 HydrophobicContact CB-CD1 3.89Å; A33-L85 HydrophobicContact CB-CD2 3.75Å; A33-L85 HydrophobicContact CB-CG 4.5Å |
| 34 | V | 65.1 | Low | 69.8 | Low | 4 Ų | 4 | 46.4 Ų | 46.4 | 2% | 0.024 | 23% | 0.234 | C | C | . | . | H | α-helix | trans | -73.8 | -27.9 | 177.4 | -168.8 | 0 | 0 | 0 | 0 | 111.4 | I20 A24 V29 E31 G32 S36 V37 L85 | I20-V34 HydrophobicContact CB-CG1 3.84Å; I20-V34 HydrophobicContact CD1-CG1 4.13Å; I20-V34 HydrophobicContact CG1-CG1 3.6Å; I20-V34 HydrophobicContact CG2-CB 3.74Å; I20-V34 HydrophobicContact CG2-CG1 3.56Å; I20-V34 HydrophobicContact CG2-CG2 4.38Å; A24-V34 HydrophobicContact CB-CG2 3.81Å; V29-V34 HydrophobicContact CG2-CG2 4.34Å; E31-V34 WeakPolarHBondContact O-CB 3.19Å; E31-V34 PolarHBondContact O-N 2.93Å; G32-V34 PolarHBondContact O-N 3.49Å; V34-S36 PolarHBondContact O-N 3.27Å; V34-V37 HydrophobicContact CG1-CG2 4.31Å; V34-V37 WeakPolarHBondContact O-CB 3.35Å; V34-V37 WeakPolarHBondContact O-CG2 3.31Å; V34-V37 PolarHBondContact O-N 3.43Å; V34-L85 HydrophobicContact CG2-CD1 4.37Å |
| 35 | Q | 65.6 | Low | 70.6 | Confident | 1 Ų | 1 | 47.1 Ų | 47.1 | 1% | 0.005 | 24% | 0.236 | C | C | . | . | H | α-helix | trans | -65.4 | -26.7 | 172.2 | -65.8 | -179.1 | -5.7 | 0 | 0 | 112.3 | G32 A33 V37 M38 G39 A217 A344 Q348 | G32-Q35 WeakPolarHBondContact O-CB 3.28Å; G32-Q35 PolarHBondContact O-N 2.81Å; A33-Q35 VanDerWaalsContact C-N 3.33Å; Q35-V37 PolarHBondContact O-N 3.12Å; Q35-M38 PolarHBondContact O-N 3.48Å; Q35-G39 PolarHBondContact O-N 3.24Å; Q35-A217 HydrophobicContact CG-CB 4.45Å; Q35-A344 HydrophobicContact CB-CB 3.5Å; Q35-A344 VanDerWaalsContact CB-CB 3.5Å; Q35-A344 HydrophobicContact CG-CB 4.48Å; Q35-Q348 VanDerWaalsContact OE1-NE2 3.11Å |
| 36 | S | 69.7 | Low | 71 | Confident | 43 Ų | 43 | 39.2 Ų | 39.2 | 30% | 0.301 | 21% | 0.207 | S | C | . | . | H | α-helix | trans | -63.1 | -27.5 | 170.4 | -52.3 | 0 | 0 | 0 | 0 | 112.5 | A33 V34 G39 A40 | A33-S36 VanDerWaalsContact O-CB 3.29Å; A33-S36 WeakPolarHBondContact O-CB 3.29Å; A33-S36 PolarHBondContact O-N 2.86Å; V34-S36 PolarHBondContact O-N 3.27Å; S36-G39 PolarHBondContact O-N 2.84Å; S36-A40 VanDerWaalsContact O-CB 3.3Å; S36-A40 WeakPolarHBondContact O-CB 3.39Å; S36-A40 PolarHBondContact O-N 3.42Å |
| 37 | V | 73.6 | Confident | 71.5 | Confident | 8 Ų | 8 | 36 Ų | 36 | 5% | 0.048 | 19% | 0.191 | C | C | . | . | H | α-helix | trans | -64.4 | -46 | 174.2 | -175.8 | 0 | 0 | 0 | 0 | 110.2 | V34 Q35 A40 Y41 L88 I89 S92 | V34-V37 HydrophobicContact CG1-CG2 4.31Å; V34-V37 WeakPolarHBondContact O-CB 3.35Å; V34-V37 WeakPolarHBondContact O-CG2 3.31Å; V34-V37 PolarHBondContact O-N 3.43Å; Q35-V37 PolarHBondContact O-N 3.12Å; V37-A40 PolarHBondContact O-N 3.16Å; V37-Y41 WeakPolarHBondContact O-CB 3.24Å; V37-Y41 PolarHBondContact O-N 3.36Å; V37-L88 HydrophobicContact CG2-CD2 4.26Å; V37-I89 HydrophobicContact CG2-CG1 3.71Å; V37-S92 WeakPolarHBondContact CG1-OG 3.46Å |
| 38 | M | 71.7 | Confident | 72 | Confident | 17 Ų | 17 | 34.7 Ų | 34.7 | 8% | 0.084 | 18% | 0.184 | C | C | . | . | H | α-helix | trans | -64.4 | -45.3 | 176 | -178.6 | -174.1 | 135.6 | 0 | 0 | 110.9 | Q35 A40 Y41 L42 A213 A217 A340 | Q35-M38 PolarHBondContact O-N 3.48Å; M38-A40 VanDerWaalsContact C-N 3.32Å; M38-A40 PolarHBondContact O-N 2.85Å; M38-Y41 WeakPolarHBondContact O-CB 3.44Å; M38-Y41 PolarHBondContact O-N 2.64Å; M38-L42 HydrophobicContact CE-CD1 3.57Å; M38-L42 HydrophobicContact CG-CD1 3.48Å; M38-L42 VanDerWaalsContact CG-CD1 3.48Å; M38-L42 WeakPolarHBondContact O-CD1 3.39Å; M38-L42 PolarHBondContact O-N 3.31Å; M38-L42 HydrophobicContact SD-CD1 4.36Å; M38-A213 HydrophobicContact CE-CB 3.61Å; M38-A213 VanDerWaalsContact CE-O 3.27Å; M38-A213 WeakPolarHBondContact CE-O 3.28Å; M38-A217 HydrophobicContact CE-CB 4.04Å; M38-A217 HydrophobicContact SD-CB 3.65Å; M38-A340 HydrophobicContact CE-CB 3.66Å |
| 39 | G | 73.7 | Confident | 72.3 | Confident | 1 Ų | 1 | 27.4 Ų | 27.4 | 1% | 0.01 | 15% | 0.145 | C | C | . | . | H | α-helix | trans | -56.1 | -45.2 | 174.8 | 0 | 0 | 0 | 0 | 0 | 112.9 | Q35 S36 L42 L43 G337 S341 | Q35-G39 PolarHBondContact O-N 3.24Å; S36-G39 PolarHBondContact O-N 2.84Å; G39-L42 PolarHBondContact O-N 3.47Å; G39-L43 WeakPolarHBondContact O-CB 3.09Å; G39-L43 PolarHBondContact O-N 2.79Å; G39-G337 WeakPolarHBondContact CA-O 3.4Å; G39-S341 WeakPolarHBondContact CA-OG 3.44Å |
| 40 | A | 79.1 | Confident | 72.6 | Confident | 18 Ų | 18 | 27.4 Ų | 27.4 | 15% | 0.149 | 14% | 0.143 | C | C | . | . | H | α-helix | trans | -65.6 | -40.6 | 176.2 | 0 | 0 | 0 | 0 | 0 | 112.6 | S36 V37 M38 T44 I89 A93 | S36-A40 VanDerWaalsContact O-CB 3.3Å; S36-A40 WeakPolarHBondContact O-CB 3.39Å; S36-A40 PolarHBondContact O-N 3.42Å; V37-A40 PolarHBondContact O-N 3.16Å; M38-A40 VanDerWaalsContact C-N 3.32Å; M38-A40 PolarHBondContact O-N 2.85Å; A40-T44 WeakPolarHBondContact O-CB 3.37Å; A40-T44 WeakPolarHBondContact O-CG2 3.12Å; A40-T44 PolarHBondContact O-N 3.34Å; A40-T44 PolarHBondContact O-OG1 3.47Å; A40-I89 HydrophobicContact CB-CG2 3.73Å; A40-A93 HydrophobicContact CB-CB 4.36Å |
| 41 | Y | 79.2 | Confident | 73.1 | Confident | 1 Ų | 1 | 24.5 Ų | 24.5 | 0% | 0.004 | 14% | 0.136 | C | C | . | . | H | α-helix | trans | -60.9 | -50.9 | 174.5 | 179.1 | -89.7 | 0 | 0 | 0 | 111.4 | G9 Q13 Y16 V37 M38 L43 T44 Y45 Q95 T99 | G9-Y41 PolarHBondContact O-OH 2.76Å; Q13-Y41 HydrophobicContact CB-CD1 4.48Å; Q13-Y41 HydrophobicContact CB-CE1 3.76Å; Q13-Y41 HydrophobicContact CG-CD1 4.31Å; Q13-Y41 HydrophobicContact CG-CE1 3.97Å; Y16-Y41 HydrophobicContact CE2-CD2 4.07Å; Y16-Y41 HydrophobicContact CE2-CE2 4.17Å; Y16-Y41 HydrophobicContact CE2-CG 4.47Å; V37-Y41 WeakPolarHBondContact O-CB 3.24Å; V37-Y41 PolarHBondContact O-N 3.36Å; M38-Y41 WeakPolarHBondContact O-CB 3.44Å; M38-Y41 PolarHBondContact O-N 2.64Å; Y41-L43 PolarHBondContact O-N 3.49Å; Y41-T44 PolarHBondContact O-N 2.88Å; Y41-T44 PolarHBondContact O-OG1 3.21Å; Y41-Y45 WeakPolarHBondContact O-CB 3.22Å; Y41-Y45 PolarHBondContact O-N 3.32Å; Y41-Q95 HydrophobicContact CD2-CB 4.24Å; Y41-Q95 HydrophobicContact CE2-CB 4.17Å; Y41-T99 HydrophobicContact CE2-CG2 4.34Å; Y41-T99 WeakPolarHBondContact OH-CB 3.3Å; Y41-T99 WeakPolarHBondContact OH-CG2 3.45Å; Y41-T99 PolarHBondContact OH-OG1 3.36Å |
| 42 | L | 75.2 | Confident | 73.4 | Confident | 1 Ų | 1 | 22.8 Ų | 22.8 | 1% | 0.005 | 13% | 0.127 | C | C | . | . | H | α-helix | trans | -66.7 | -38 | 179.8 | -86.8 | 125.4 | 0 | 0 | 0 | 112.7 | M38 G39 Y45 G46 S336 | M38-L42 HydrophobicContact CE-CD1 3.57Å; M38-L42 HydrophobicContact CG-CD1 3.48Å; M38-L42 VanDerWaalsContact CG-CD1 3.48Å; M38-L42 WeakPolarHBondContact O-CD1 3.39Å; M38-L42 PolarHBondContact O-N 3.31Å; M38-L42 HydrophobicContact SD-CD1 4.36Å; G39-L42 PolarHBondContact O-N 3.47Å; L42-Y45 PolarHBondContact O-N 3.47Å; L42-G46 PolarHBondContact O-N 3.4Å; L42-S336 VanDerWaalsContact CD2-OG 3.28Å; L42-S336 WeakPolarHBondContact CD2-OG 3.29Å |
| 43 | L | 79.8 | Confident | 73.6 | Confident | 70 Ų | 70 | 22.9 Ų | 22.9 | 37% | 0.366 | 13% | 0.128 | S | C | . | . | H | α-helix | trans | -63 | -49.9 | 176.5 | -172.4 | 156.6 | 0 | 0 | 0 | 110.4 | G39 Y41 Y45 G46 V47 V338 | G39-L43 WeakPolarHBondContact O-CB 3.09Å; G39-L43 PolarHBondContact O-N 2.79Å; Y41-L43 PolarHBondContact O-N 3.49Å; L43-Y45 VanDerWaalsContact C-N 3.34Å; L43-Y45 PolarHBondContact O-N 3.29Å; L43-G46 PolarHBondContact O-N 3.43Å; L43-V47 HydrophobicContact CD2-CG2 3.96Å; L43-V47 WeakPolarHBondContact O-CB 3.46Å; L43-V47 WeakPolarHBondContact O-CG2 3.42Å; L43-V47 PolarHBondContact O-N 3.42Å; L43-V338 HydrophobicContact CD1-CG2 4.43Å |
| 44 | T | 82.3 | Confident | 73.6 | Confident | 18 Ų | 18 | 22.9 Ų | 22.9 | 11% | 0.11 | 13% | 0.126 | C | C | . | . | H | α-helix | trans | -68.3 | -33.1 | 177.2 | 52.3 | 0 | 0 | 0 | 0 | 112.9 | A40 Y41 S48 A93 G96 | A40-T44 WeakPolarHBondContact O-CB 3.37Å; A40-T44 WeakPolarHBondContact O-CG2 3.12Å; A40-T44 PolarHBondContact O-N 3.34Å; A40-T44 PolarHBondContact O-OG1 3.47Å; Y41-T44 PolarHBondContact O-N 2.88Å; Y41-T44 PolarHBondContact O-OG1 3.21Å; T44-S48 WeakPolarHBondContact O-CB 3.27Å; T44-S48 PolarHBondContact O-N 2.87Å; T44-S48 PolarHBondContact O-OG 3.17Å; T44-A93 WeakPolarHBondContact CB-O 3.4Å; T44-A93 HydrophobicContact CG2-CB 3.59Å; T44-A93 VanDerWaalsContact CG2-O 3.29Å; T44-A93 WeakPolarHBondContact CG2-O 3.17Å; T44-A93 WeakPolarHBondContact OG1-CA 3.45Å; T44-A93 PolarHBondContact OG1-O 3.44Å; T44-G96 WeakPolarHBondContact OG1-CA 3.29Å |
| 45 | Y | 79.5 | Confident | 73.7 | Confident | 19 Ų | 19 | 25.9 Ų | 25.9 | 8% | 0.075 | 14% | 0.141 | C | C | . | . | H | α-helix | trans | -63.9 | -42.2 | 171.4 | -176.3 | -104.9 | 0 | 0 | 0 | 112 | Y41 L42 L43 S48 Q49 G96 T99 G100 N333 | Y41-Y45 WeakPolarHBondContact O-CB 3.22Å; Y41-Y45 PolarHBondContact O-N 3.32Å; L42-Y45 PolarHBondContact O-N 3.47Å; L43-Y45 VanDerWaalsContact C-N 3.34Å; L43-Y45 PolarHBondContact O-N 3.29Å; Y45-S48 VanDerWaalsContact C-OG 3.25Å; Y45-S48 WeakPolarHBondContact CA-OG 3.45Å; Y45-S48 PolarHBondContact O-OG 3.31Å; Y45-Q49 HydrophobicContact CE1-CG 4.5Å; Y45-Q49 VanDerWaalsContact CZ-NE2 3.33Å; Y45-Q49 WeakPolarHBondContact O-CG 3.36Å; Y45-Q49 PolarHBondContact O-N 3.48Å; Y45-Q49 PolarHBondContact OH-NE2 2.88Å; Y45-Q49 VanDerWaalsContact OH-NE2 3.16Å; Y45-G96 WeakPolarHBondContact CA-O 3.1Å; Y45-T99 WeakPolarHBondContact CD2-OG1 3.39Å; Y45-G100 VanDerWaalsContact CD2-CA 3.42Å; Y45-G100 VanDerWaalsContact CE2-CA 3.43Å; Y45-N333 HydrophobicContact CD1-CB 3.99Å; Y45-N333 VanDerWaalsContact CD1-CG 3.49Å; Y45-N333 WeakPolarHBondContact CE1-ND2 3.43Å |
| 46 | G | 75.1 | Confident | 73.6 | Confident | 0 Ų | 0 | 26 Ų | 26 | 0% | 0 | 14% | 0.142 | C | C | . | . | H | α-helix | trans | -71.1 | -41.7 | 176.5 | 0 | 0 | 0 | 0 | 0 | 113.1 | L42 L43 S48 Q49 L50 G330 N333 | L42-G46 PolarHBondContact O-N 3.4Å; L43-G46 PolarHBondContact O-N 3.43Å; G46-S48 VanDerWaalsContact C-N 3.35Å; G46-Q49 PolarHBondContact O-N 2.99Å; G46-L50 PolarHBondContact O-N 2.91Å; G46-G330 WeakPolarHBondContact CA-O 3.43Å; G46-G330 VanDerWaalsContact O-CA 3.31Å; G46-G330 WeakPolarHBondContact O-CA 3.19Å; G46-N333 VanDerWaalsContact CA-CB 3.49Å |
| 47 | V | 79.7 | Confident | 73.3 | Confident | 39 Ų | 39 | 28 Ų | 28 | 24% | 0.236 | 15% | 0.149 | C | C | . | . | H | α-helix | trans | -60.3 | -47.1 | 173.3 | 168.3 | 0 | 0 | 0 | 0 | 110.2 | L43 Q49 L50 F51 I334 | L43-V47 HydrophobicContact CD2-CG2 3.96Å; L43-V47 WeakPolarHBondContact O-CB 3.46Å; L43-V47 WeakPolarHBondContact O-CG2 3.42Å; L43-V47 PolarHBondContact O-N 3.42Å; V47-Q49 PolarHBondContact O-N 3.02Å; V47-L50 WeakPolarHBondContact O-CA 3.32Å; V47-L50 VanDerWaalsContact O-CB 3.26Å; V47-L50 WeakPolarHBondContact O-CB 3.3Å; V47-L50 PolarHBondContact O-N 3.34Å; V47-F51 HydrophobicContact CG1-CD2 3.6Å; V47-F51 HydrophobicContact CG1-CE2 3.66Å; V47-F51 VanDerWaalsContact O-CD2 3.24Å; V47-F51 WeakPolarHBondContact O-CD2 3.41Å; V47-F51 PolarHBondContact O-N 2.91Å; V47-I334 HydrophobicContact CG2-CD1 3.87Å; V47-I334 HydrophobicContact CG2-CG1 4.13Å |
| 48 | S | 76.7 | Confident | 72.8 | Confident | 2 Ų | 2 | 36 Ų | 36 | 1% | 0.014 | 18% | 0.178 | C | C | . | . | H | α-helix | trans | -63.8 | -39.1 | 179.1 | 59.9 | 0 | 0 | 0 | 0 | 111.6 | T44 Y45 G46 L50 F51 Y52 G96 G100 | T44-S48 WeakPolarHBondContact O-CB 3.27Å; T44-S48 PolarHBondContact O-N 2.87Å; T44-S48 PolarHBondContact O-OG 3.17Å; Y45-S48 VanDerWaalsContact C-OG 3.25Å; Y45-S48 WeakPolarHBondContact CA-OG 3.45Å; Y45-S48 PolarHBondContact O-OG 3.31Å; G46-S48 VanDerWaalsContact C-N 3.35Å; S48-L50 PolarHBondContact O-N 3.3Å; S48-F51 PolarHBondContact O-N 2.8Å; S48-Y52 VanDerWaalsContact O-CB 3.24Å; S48-Y52 WeakPolarHBondContact O-CB 3.32Å; S48-Y52 WeakPolarHBondContact O-CD2 3.45Å; S48-Y52 PolarHBondContact O-N 3.04Å; S48-G96 PolarHBondContact OG-O 3.33Å; S48-G100 WeakPolarHBondContact OG-CA 3.3Å |
| 49 | Q | 73.6 | Confident | 72.5 | Confident | 1 Ų | 1 | 39.3 Ų | 39.3 | 1% | 0.005 | 20% | 0.2 | C | C | . | . | H | α-helix | trans | -58.3 | -34.2 | 171.8 | -75.6 | -169.3 | -11.4 | 0 | 0 | 113.3 | Y45 G46 V47 V104 R107 G329 N333 | Y45-Q49 HydrophobicContact CE1-CG 4.5Å; Y45-Q49 VanDerWaalsContact CZ-NE2 3.33Å; Y45-Q49 WeakPolarHBondContact O-CG 3.36Å; Y45-Q49 PolarHBondContact O-N 3.48Å; Y45-Q49 PolarHBondContact OH-NE2 2.88Å; Y45-Q49 VanDerWaalsContact OH-NE2 3.16Å; G46-Q49 PolarHBondContact O-N 2.99Å; V47-Q49 PolarHBondContact O-N 3.02Å; Q49-V104 HydrophobicContact CB-CG2 4.04Å; Q49-V104 HydrophobicContact CG-CG2 3.87Å; Q49-R107 VanDerWaalsContact CD-NH2 3.25Å; Q49-G329 PolarHBondContact OE1-O 2.83Å; Q49-N333 PolarHBondContact OE1-ND2 3.49Å; Q49-N333 VanDerWaalsContact OE1-ND2 3.15Å |
| 50 | L | 72 | Confident | 71.9 | Confident | 46 Ų | 46 | 39.3 Ų | 39.3 | 24% | 0.241 | 20% | 0.2 | C | C | . | . | H | α-helix | trans | -71.7 | -42.8 | 178.3 | -162.8 | 76.3 | 0 | 0 | 0 | 112.5 | G46 V47 S48 P54 Y189 | G46-L50 PolarHBondContact O-N 2.91Å; V47-L50 WeakPolarHBondContact O-CA 3.32Å; V47-L50 VanDerWaalsContact O-CB 3.26Å; V47-L50 WeakPolarHBondContact O-CB 3.3Å; V47-L50 PolarHBondContact O-N 3.34Å; S48-L50 PolarHBondContact O-N 3.3Å; L50-P54 VanDerWaalsContact O-CD 3.25Å; L50-P54 WeakPolarHBondContact O-CD 3.39Å; L50-Y189 HydrophobicContact CD1-CE1 3.46Å; L50-Y189 VanDerWaalsContact CD1-CE1 3.46Å; L50-Y189 WeakPolarHBondContact CD1-OH 3.43Å |
| 51 | F | 75.1 | Confident | 71.3 | Confident | 126 Ų | 126 | 39 Ų | 39 | 55% | 0.553 | 20% | 0.195 | S | C | * | . | H | α-helix | trans | -83.2 | -37.9 | -177.5 | -76.8 | -77.2 | 0 | 0 | 0 | 113.1 | V47 S48 G53 P54 I55 | V47-F51 HydrophobicContact CG1-CD2 3.6Å; V47-F51 HydrophobicContact CG1-CE2 3.66Å; V47-F51 VanDerWaalsContact O-CD2 3.24Å; V47-F51 WeakPolarHBondContact O-CD2 3.41Å; V47-F51 PolarHBondContact O-N 2.91Å; S48-F51 PolarHBondContact O-N 2.8Å; F51-G53 PolarHBondContact O-N 2.9Å; F51-P54 VanDerWaalsContact O-CD 3.32Å; F51-P54 WeakPolarHBondContact O-CD 3.21Å; F51-I55 HydrophobicContact CB-CD1 4.18Å; F51-I55 WeakPolarHBondContact O-CD1 3.37Å; F51-I55 WeakPolarHBondContact O-CG1 3.14Å; F51-I55 PolarHBondContact O-N 3Å |
| 52 | Y | 69.7 | Low | 70.8 | Confident | 24 Ų | 24 | 43.2 Ų | 43.2 | 9% | 0.094 | 21% | 0.211 | C | C | . | . | H | α-helix | trans | -73.8 | -23.8 | -174.8 | -78.7 | -65.5 | 0 | 0 | 0 | 114.1 | S48 I55 S56 V64 M97 V101 | S48-Y52 VanDerWaalsContact O-CB 3.24Å; S48-Y52 WeakPolarHBondContact O-CB 3.32Å; S48-Y52 WeakPolarHBondContact O-CD2 3.45Å; S48-Y52 PolarHBondContact O-N 3.04Å; Y52-I55 PolarHBondContact O-N 3.34Å; Y52-S56 WeakPolarHBondContact O-CA 3.1Å; Y52-S56 WeakPolarHBondContact O-CB 3.45Å; Y52-S56 PolarHBondContact O-N 2.75Å; Y52-V64 HydrophobicContact CD1-CG1 3.37Å; Y52-V64 HydrophobicContact CE1-CG1 3.75Å; Y52-V64 HydrophobicContact CG-CG1 4.37Å; Y52-M97 HydrophobicContact CE2-CG 4.12Å; Y52-M97 WeakPolarHBondContact CE2-O 3.44Å; Y52-V101 HydrophobicContact CD1-CG2 3.64Å; Y52-V101 HydrophobicContact CD2-CG2 3.5Å; Y52-V101 HydrophobicContact CE1-CG2 3.44Å; Y52-V101 VanDerWaalsContact CE1-CG2 3.44Å; Y52-V101 HydrophobicContact CE2-CG2 3.36Å; Y52-V101 HydrophobicContact CG-CG2 3.66Å |
| 53 | G | 65.4 | Low | 70.7 | Confident | 13 Ų | 13 | 45.3 Ų | 45.3 | 13% | 0.134 | 22% | 0.224 | C | C | . | . | H | α-helix | trans | -56.1 | -60.6 | 171.9 | 0 | 0 | 0 | 0 | 0 | 111.5 | F51 I55 S56 D57 | F51-G53 PolarHBondContact O-N 2.9Å; G53-I55 VanDerWaalsContact C-N 3.34Å; G53-I55 PolarHBondContact O-N 3.44Å; G53-S56 WeakPolarHBondContact O-CB 3.01Å; G53-S56 PolarHBondContact O-N 3.2Å; G53-D57 PolarHBondContact O-N 2.75Å |
| 54 | P | 63.8 | Low | 70.5 | Confident | 29 Ų | 29 | 42.2 Ų | 42.2 | 19% | 0.188 | 21% | 0.209 | C | C | . | . | H | α-helix | trans | -58.7 | -39.5 | 175.8 | -27.8 | 35.6 | 0 | 0 | 0 | 114.8 | L50 F51 R58 L185 | L50-P54 VanDerWaalsContact O-CD 3.25Å; L50-P54 WeakPolarHBondContact O-CD 3.39Å; F51-P54 VanDerWaalsContact O-CD 3.32Å; F51-P54 WeakPolarHBondContact O-CD 3.21Å; P54-R58 WeakPolarHBondContact O-CG 3.4Å; P54-R58 PolarHBondContact O-N 3.08Å; P54-L185 HydrophobicContact CB-CD1 3.41Å; P54-L185 VanDerWaalsContact CB-CD1 3.41Å; P54-L185 HydrophobicContact CG-CD1 3.36Å; P54-L185 HydrophobicContact CG-CD2 4.19Å; P54-L185 HydrophobicContact CG-CG 4.32Å |
| 55 | I | 68.1 | Low | 70 | Confident | 66 Ų | 66 | 41.5 Ų | 41.5 | 34% | 0.338 | 20% | 0.204 | S | C | . | . | H | α-helix | trans | -70.2 | -40.9 | -178.1 | -66.1 | 168.3 | 0 | 0 | 0 | 110.3 | F51 Y52 G53 D57 R58 V59 V64 | F51-I55 HydrophobicContact CB-CD1 4.18Å; F51-I55 WeakPolarHBondContact O-CD1 3.37Å; F51-I55 WeakPolarHBondContact O-CG1 3.14Å; F51-I55 PolarHBondContact O-N 3Å; Y52-I55 PolarHBondContact O-N 3.34Å; G53-I55 VanDerWaalsContact C-N 3.34Å; G53-I55 PolarHBondContact O-N 3.44Å; I55-D57 VanDerWaalsContact C-N 3.31Å; I55-D57 PolarHBondContact O-N 3.18Å; I55-R58 PolarHBondContact O-N 3.05Å; I55-V59 HydrophobicContact CG2-CB 4.45Å; I55-V59 HydrophobicContact CG2-CG2 3.93Å; I55-V59 WeakPolarHBondContact O-CB 3.45Å; I55-V59 PolarHBondContact O-N 2.82Å; I55-V64 HydrophobicContact CG2-CG2 3.81Å |
| 56 | S | 62.8 | Low | 69.9 | Low | 4 Ų | 4 | 43.2 Ų | 43.2 | 3% | 0.028 | 21% | 0.214 | C | C | . | . | H | α-helix | trans | -56.9 | -42.6 | 175.2 | 165.6 | 0 | 0 | 0 | 0 | 112 | Y52 G53 G60 M105 | Y52-S56 WeakPolarHBondContact O-CA 3.1Å; Y52-S56 WeakPolarHBondContact O-CB 3.45Å; Y52-S56 PolarHBondContact O-N 2.75Å; G53-S56 WeakPolarHBondContact O-CB 3.01Å; G53-S56 PolarHBondContact O-N 3.2Å; S56-G60 CarbonylContact O-C 3.53Å; S56-G60 PolarHBondContact O-N 2.99Å; S56-M105 WeakPolarHBondContact OG-CE 3.12Å |
| 57 | D | 63.1 | Low | 70.2 | Confident | 84 Ų | 84 | 46.8 Ų | 46.8 | 45% | 0.449 | 24% | 0.236 | S | C | . | . | H | α-helix | trans | -73.5 | -29.2 | 179.5 | -72.7 | -26.2 | 0 | 0 | 0 | 112.9 | G53 I55 | G53-D57 PolarHBondContact O-N 2.75Å; I55-D57 VanDerWaalsContact C-N 3.31Å; I55-D57 PolarHBondContact O-N 3.18Å |
| 58 | R | 63.3 | Low | 70.2 | Confident | 176 Ų | 176 | 45 Ų | 45 | 66% | 0.664 | 23% | 0.225 | S | C | * | . | H | α-helix | trans | -87 | -46.4 | -179 | -74.8 | -169.7 | 179.4 | -174.8 | 2.6 | 114.4 | P54 I55 | P54-R58 WeakPolarHBondContact O-CG 3.4Å; P54-R58 PolarHBondContact O-N 3.08Å; I55-R58 PolarHBondContact O-N 3.05Å |
| 59 | V | 65 | Low | 70.2 | Confident | 87 Ų | 87 | 45.2 Ų | 45.2 | 53% | 0.527 | 23% | 0.226 | S | C | . | . | H | α-helix | trans | -89.7 | -18.4 | -170.2 | -175.4 | 0 | 0 | 0 | 0 | 111.2 | I55 P63 V64 | I55-V59 HydrophobicContact CG2-CB 4.45Å; I55-V59 HydrophobicContact CG2-CG2 3.93Å; I55-V59 WeakPolarHBondContact O-CB 3.45Å; I55-V59 PolarHBondContact O-N 2.82Å; V59-P63 HydrophobicContact CG1-CB 4.41Å; V59-P63 HydrophobicContact CG1-CG 3.92Å; V59-P63 WeakPolarHBondContact O-CG 3.26Å; V59-V64 HydrophobicContact CB-CG2 4.04Å; V59-V64 HydrophobicContact CG1-CG2 4.35Å |
| 60 | G | 62.4 | Low | 70.7 | Confident | 2 Ų | 2 | 47.3 Ų | 47.3 | 2% | 0.021 | 24% | 0.241 | C | C | . | . | trans | 96.9 | 149.6 | -171.4 | 0 | 0 | 0 | 0 | 0 | 111 | S56 P63 V64 | S56-G60 CarbonylContact O-C 3.53Å; S56-G60 PolarHBondContact O-N 2.99Å; G60-P63 WeakPolarHBondContact O-CD 3.33Å; G60-P63 WeakPolarHBondContact O-CG 2.88Å; G60-V64 VanDerWaalsContact O-CG2 3.26Å; G60-V64 WeakPolarHBondContact O-CG2 2.85Å | ||
| 61 | R | 64.9 | Low | 71.3 | Confident | 12 Ų | 12 | 47.1 Ų | 47.1 | 5% | 0.045 | 24% | 0.24 | C | C | . | . | H | α-helix | trans | -72.1 | -37.8 | -168.9 | -62.5 | -176.7 | 172.9 | -172.4 | -4.6 | 113 | I65 M105 T108 D112 | R61-I65 WeakPolarHBondContact O-CD1 3.34Å; R61-I65 VanDerWaalsContact O-CG1 3.25Å; R61-I65 WeakPolarHBondContact O-CG1 3.21Å; R61-I65 PolarHBondContact O-N 3.12Å; R61-I65 VanDerWaalsContact O-N 3.08Å; R61-M105 VanDerWaalsContact CA-CE 3.5Å; R61-M105 HydrophobicContact CB-CE 3.56Å; R61-M105 HydrophobicContact CB-SD 4.04Å; R61-M105 HydrophobicContact CG-CE 3.84Å; R61-M105 HydrophobicContact CG-SD 4.05Å; R61-M105 WeakPolarHBondContact O-CE 3.47Å; R61-T108 PolarHBondContact NH1-O 3.37Å; R61-D112 IonicContact CZ-OD1 3.83Å; R61-D112 IonicContact CZ-OD2 3.84Å; R61-D112 IonicContact NE-OD2 3.47Å; R61-D112 VanDerWaalsContact NH1-CB 3.33Å; R61-D112 IonicContact NH1-OD1 2.69Å; R61-D112 PolarHBondContact NH1-OD1 3.22Å; R61-D112 IonicContact NH1-OD2 2.98Å; R61-D112 PolarHBondContact NH1-OD2 3.2Å; R61-D112 IonicContact NH2-OD1 2.9Å; R61-D112 PolarHBondContact NH2-OD1 2.85Å; R61-D112 IonicContact NH2-OD2 3.65Å; R61-D112 PolarHBondContact NH2-OD2 2.92Å |
| 62 | R | 69 | Low | 71.6 | Confident | 88 Ų | 88 | 41.3 Ų | 41.3 | 33% | 0.332 | 21% | 0.214 | S | C | . | . | H | α-helix | trans | -65.2 | -52.5 | -176.6 | -172 | -178 | -178.4 | -164.2 | 3.5 | 113.8 | V64 I65 L66 A169 E174 | R62-V64 VanDerWaalsContact C-N 3.26Å; R62-V64 PolarHBondContact O-N 2.95Å; R62-I65 PolarHBondContact O-N 2.69Å; R62-L66 HydrophobicContact CG-CD1 4.2Å; R62-L66 WeakPolarHBondContact O-CG 3.27Å; R62-L66 PolarHBondContact O-N 3.32Å; R62-A169 PolarHBondContact NH2-O 3.46Å; R62-E174 WeakPolarHBondContact CD-OE2 3.49Å; R62-E174 IonicContact NH1-OE2 2.89Å |
| 63 | P | 73.4 | Confident | 72.2 | Confident | 45 Ų | 45 | 42.5 Ų | 42.5 | 29% | 0.292 | 22% | 0.221 | S | C | . | . | H | α-helix | trans | -62.3 | -36.8 | 179.6 | 22.8 | -33.9 | 0 | 0 | 0 | 111.8 | V59 G60 I65 L66 V67 E174 | V59-P63 HydrophobicContact CG1-CB 4.41Å; V59-P63 HydrophobicContact CG1-CG 3.92Å; V59-P63 WeakPolarHBondContact O-CG 3.26Å; G60-P63 WeakPolarHBondContact O-CD 3.33Å; G60-P63 WeakPolarHBondContact O-CG 2.88Å; P63-I65 PolarHBondContact O-N 3.28Å; P63-L66 PolarHBondContact O-N 2.78Å; P63-V67 WeakPolarHBondContact O-CB 3.26Å; P63-V67 VanDerWaalsContact O-CG2 3.23Å; P63-V67 WeakPolarHBondContact O-CG2 2.99Å; P63-V67 PolarHBondContact O-N 3.39Å; P63-E174 WeakPolarHBondContact CD-OE1 3.1Å |
| 64 | V | 75.2 | Confident | 73.2 | Confident | 6 Ų | 6 | 47.1 Ų | 47.1 | 4% | 0.036 | 24% | 0.242 | C | C | . | . | H | α-helix | trans | -64.8 | -41.9 | 178.9 | 176.5 | 0 | 0 | 0 | 0 | 111.5 | Y52 I55 V59 G60 R62 G68 V101 M105 | Y52-V64 HydrophobicContact CD1-CG1 3.37Å; Y52-V64 HydrophobicContact CE1-CG1 3.75Å; Y52-V64 HydrophobicContact CG-CG1 4.37Å; I55-V64 HydrophobicContact CG2-CG2 3.81Å; V59-V64 HydrophobicContact CB-CG2 4.04Å; V59-V64 HydrophobicContact CG1-CG2 4.35Å; G60-V64 VanDerWaalsContact O-CG2 3.26Å; G60-V64 WeakPolarHBondContact O-CG2 2.85Å; R62-V64 VanDerWaalsContact C-N 3.26Å; R62-V64 PolarHBondContact O-N 2.95Å; V64-G68 PolarHBondContact O-N 3.02Å; V64-V101 HydrophobicContact CG1-CG1 3.88Å; V64-V101 HydrophobicContact CG1-CG2 4.37Å; V64-M105 HydrophobicContact CB-CE 4.39Å; V64-M105 HydrophobicContact CG1-CE 4.38Å |
| 65 | I | 72.7 | Confident | 74.1 | Confident | 3 Ų | 3 | 45.8 Ų | 45.8 | 2% | 0.015 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -62.8 | -48.4 | 174.6 | -71 | 163.4 | 0 | 0 | 0 | 111.1 | R61 R62 P63 V67 G68 M69 V101 M105 L109 M168 M172 | R61-I65 WeakPolarHBondContact O-CD1 3.34Å; R61-I65 VanDerWaalsContact O-CG1 3.25Å; R61-I65 WeakPolarHBondContact O-CG1 3.21Å; R61-I65 PolarHBondContact O-N 3.12Å; R61-I65 VanDerWaalsContact O-N 3.08Å; R62-I65 PolarHBondContact O-N 2.69Å; P63-I65 PolarHBondContact O-N 3.28Å; I65-V67 VanDerWaalsContact C-N 3.34Å; I65-V67 PolarHBondContact O-N 3.48Å; I65-G68 PolarHBondContact O-N 2.83Å; I65-M69 HydrophobicContact CG2-CE 3.65Å; I65-M69 HydrophobicContact CG2-CG 4.29Å; I65-M69 HydrophobicContact CG2-SD 3.5Å; I65-M69 VanDerWaalsContact CG2-SD 3.5Å; I65-M69 WeakPolarHBondContact O-CB 3.26Å; I65-M69 VanDerWaalsContact O-CG 3.27Å; I65-M69 WeakPolarHBondContact O-CG 3.43Å; I65-M69 PolarHBondContact O-N 3.33Å; I65-V101 HydrophobicContact CB-CG1 4.47Å; I65-V101 HydrophobicContact CG1-CG1 3.94Å; I65-M105 HydrophobicContact CD1-CB 4.41Å; I65-M105 HydrophobicContact CD1-CE 4.05Å; I65-M105 HydrophobicContact CD1-CG 3.87Å; I65-M105 HydrophobicContact CD1-SD 4.16Å; I65-M105 HydrophobicContact CG1-CE 3.89Å; I65-M105 HydrophobicContact CG1-CG 3.78Å; I65-M105 HydrophobicContact CG1-SD 4.42Å; I65-L109 HydrophobicContact CD1-CD1 4.37Å; I65-M168 HydrophobicContact CG2-SD 3.89Å; I65-M172 HydrophobicContact CD1-CE 3.9Å; I65-M172 HydrophobicContact CD1-SD 3.81Å |
| 66 | L | 76.7 | Confident | 74.7 | Confident | 55 Ų | 55 | 42.6 Ų | 42.6 | 29% | 0.288 | 22% | 0.217 | S | C | . | . | H | α-helix | trans | -63.5 | -41.3 | -178.5 | -67.8 | 174.8 | 0 | 0 | 0 | 111.9 | R62 P63 S70 T165 A169 | R62-L66 HydrophobicContact CG-CD1 4.2Å; R62-L66 WeakPolarHBondContact O-CG 3.27Å; R62-L66 PolarHBondContact O-N 3.32Å; P63-L66 PolarHBondContact O-N 2.78Å; L66-S70 VanDerWaalsContact O-CB 3.32Å; L66-S70 WeakPolarHBondContact O-CB 3.36Å; L66-S70 PolarHBondContact O-N 2.82Å; L66-S70 PolarHBondContact O-OG 2.8Å; L66-T165 HydrophobicContact CD2-CG2 3.87Å; L66-A169 HydrophobicContact CD2-CB 4Å |
| 67 | V | 82.2 | Confident | 75.7 | Confident | 75 Ų | 75 | 46.9 Ų | 46.9 | 46% | 0.455 | 24% | 0.239 | S | C | . | . | H | α-helix | trans | -64.1 | -49.1 | 175.2 | 172.2 | 0 | 0 | 0 | 0 | 110.4 | P63 I65 M69 S70 I71 | P63-V67 WeakPolarHBondContact O-CB 3.26Å; P63-V67 VanDerWaalsContact O-CG2 3.23Å; P63-V67 WeakPolarHBondContact O-CG2 2.99Å; P63-V67 PolarHBondContact O-N 3.39Å; I65-V67 VanDerWaalsContact C-N 3.34Å; I65-V67 PolarHBondContact O-N 3.48Å; V67-M69 VanDerWaalsContact C-N 3.33Å; V67-M69 PolarHBondContact O-N 3.46Å; V67-S70 WeakPolarHBondContact CA-OG 3.39Å; V67-S70 PolarHBondContact O-N 3.13Å; V67-S70 VanDerWaalsContact O-N 3.14Å; V67-S70 PolarHBondContact O-OG 3.14Å; V67-I71 HydrophobicContact CG1-CD1 3.79Å; V67-I71 HydrophobicContact CG1-CG1 4.41Å; V67-I71 VanDerWaalsContact O-CG1 3.32Å; V67-I71 WeakPolarHBondContact O-CG1 3.25Å; V67-I71 PolarHBondContact O-N 3.35Å |
| 68 | G | 79.7 | Confident | 76.6 | Confident | 0 Ų | 0 | 45.3 Ų | 45.3 | 0% | 0 | 23% | 0.232 | C | C | . | . | H | α-helix | trans | -58.3 | -43.6 | 178.3 | 0 | 0 | 0 | 0 | 0 | 113.1 | V64 I65 I71 F72 G98 | V64-G68 PolarHBondContact O-N 3.02Å; I65-G68 PolarHBondContact O-N 2.83Å; G68-I71 PolarHBondContact O-N 2.88Å; G68-F72 PolarHBondContact O-N 3.37Å; G68-G98 WeakPolarHBondContact O-CA 3.49Å |
| 69 | M | 77.2 | Confident | 77.3 | Confident | 8 Ų | 8 | 36.9 Ų | 36.9 | 4% | 0.039 | 20% | 0.201 | C | C | . | . | H | α-helix | trans | -66.7 | -39 | 175.5 | -72.9 | 169.3 | 162.1 | 0 | 0 | 112.6 | L5 I65 V67 I71 F72 M73 V164 T165 M168 | L5-M69 HydrophobicContact CD1-CE 3.19Å; L5-M69 HydrophobicContact CD1-CG 4.48Å; L5-M69 HydrophobicContact CD2-CE 3.84Å; L5-M69 HydrophobicContact CG-CE 4.05Å; I65-M69 HydrophobicContact CG2-CE 3.65Å; I65-M69 HydrophobicContact CG2-CG 4.29Å; I65-M69 HydrophobicContact CG2-SD 3.5Å; I65-M69 VanDerWaalsContact CG2-SD 3.5Å; I65-M69 WeakPolarHBondContact O-CB 3.26Å; I65-M69 VanDerWaalsContact O-CG 3.27Å; I65-M69 WeakPolarHBondContact O-CG 3.43Å; I65-M69 PolarHBondContact O-N 3.33Å; V67-M69 VanDerWaalsContact C-N 3.33Å; V67-M69 PolarHBondContact O-N 3.46Å; M69-I71 VanDerWaalsContact C-N 3.35Å; M69-F72 WeakPolarHBondContact O-CB 3.16Å; M69-F72 PolarHBondContact O-N 2.88Å; M69-M73 WeakPolarHBondContact O-CG 3.34Å; M69-M73 PolarHBondContact O-N 3.45Å; M69-V164 HydrophobicContact CE-CG1 3.78Å; M69-T165 HydrophobicContact CB-CG2 4.03Å; M69-T165 WeakPolarHBondContact CB-OG1 3.29Å; M69-T165 VanDerWaalsContact SD-CA 3.57Å; M69-T165 HydrophobicContact SD-CG2 3.76Å; M69-T165 PolarHBondContact SD-OG1 2.88Å; M69-M168 HydrophobicContact CE-CG 4.35Å; M69-M168 HydrophobicContact CE-SD 3.55Å; M69-M168 VanDerWaalsContact CE-SD 3.55Å |
| 70 | S | 83.4 | Confident | 77.7 | Confident | 45 Ų | 45 | 33.4 Ų | 33.4 | 32% | 0.315 | 18% | 0.179 | S | C | . | . | H | α-helix | trans | -64.6 | -40.4 | 176.1 | 71.3 | 0 | 0 | 0 | 0 | 112 | L66 V67 F72 M73 L74 | L66-S70 VanDerWaalsContact O-CB 3.32Å; L66-S70 WeakPolarHBondContact O-CB 3.36Å; L66-S70 PolarHBondContact O-N 2.82Å; L66-S70 PolarHBondContact O-OG 2.8Å; V67-S70 WeakPolarHBondContact CA-OG 3.39Å; V67-S70 PolarHBondContact O-N 3.13Å; V67-S70 VanDerWaalsContact O-N 3.14Å; V67-S70 PolarHBondContact O-OG 3.14Å; S70-F72 VanDerWaalsContact C-N 3.33Å; S70-M73 PolarHBondContact O-N 2.9Å; S70-L74 WeakPolarHBondContact O-CB 3.19Å; S70-L74 WeakPolarHBondContact O-CG 3.49Å; S70-L74 PolarHBondContact O-N 3.25Å |
| 71 | I | 85.2 | Confident | 78.4 | Confident | 42 Ų | 42 | 37.6 Ų | 37.6 | 22% | 0.215 | 21% | 0.205 | C | C | . | . | H | α-helix | trans | -62.3 | -44.2 | 173.6 | -66.7 | 166.9 | 0 | 0 | 0 | 109.6 | V67 G68 M69 L74 A75 M94 | V67-I71 HydrophobicContact CG1-CD1 3.79Å; V67-I71 HydrophobicContact CG1-CG1 4.41Å; V67-I71 VanDerWaalsContact O-CG1 3.32Å; V67-I71 WeakPolarHBondContact O-CG1 3.25Å; V67-I71 PolarHBondContact O-N 3.35Å; G68-I71 PolarHBondContact O-N 2.88Å; M69-I71 VanDerWaalsContact C-N 3.35Å; I71-L74 PolarHBondContact O-N 2.95Å; I71-A75 WeakPolarHBondContact O-CB 3.34Å; I71-A75 PolarHBondContact O-N 2.82Å; I71-M94 HydrophobicContact CG2-CB 4.27Å; I71-M94 WeakPolarHBondContact CG2-O 3.42Å |
| 72 | F | 81.4 | Confident | 78.8 | Confident | 4 Ų | 4 | 37.8 Ų | 37.8 | 2% | 0.018 | 21% | 0.207 | C | C | . | . | H | α-helix | trans | -59.3 | -49.9 | 175.7 | -176.6 | -94.1 | 0 | 0 | 0 | 111.8 | V8 A12 G68 M69 S70 L74 A75 T76 Q95 T99 L157 C161 | V8-F72 HydrophobicContact CG1-CE1 4.42Å; A12-F72 HydrophobicContact CB-CE2 4.15Å; A12-F72 HydrophobicContact CB-CZ 4.13Å; G68-F72 PolarHBondContact O-N 3.37Å; M69-F72 WeakPolarHBondContact O-CB 3.16Å; M69-F72 PolarHBondContact O-N 2.88Å; S70-F72 VanDerWaalsContact C-N 3.33Å; F72-L74 PolarHBondContact O-N 3.42Å; F72-A75 PolarHBondContact O-N 2.99Å; F72-T76 WeakPolarHBondContact O-CB 3.41Å; F72-T76 PolarHBondContact O-N 3.4Å; F72-T76 PolarHBondContact O-OG1 2.91Å; F72-Q95 HydrophobicContact CD2-CB 3.97Å; F72-Q95 HydrophobicContact CD2-CG 4.02Å; F72-Q95 HydrophobicContact CE2-CB 4.03Å; F72-Q95 HydrophobicContact CE2-CG 4.04Å; F72-T99 HydrophobicContact CD2-CG2 3.4Å; F72-T99 VanDerWaalsContact CD2-CG2 3.4Å; F72-T99 HydrophobicContact CE2-CG2 3.35Å; F72-T99 HydrophobicContact CG-CG2 4.44Å; F72-T99 HydrophobicContact CZ-CG2 4.36Å; F72-L157 HydrophobicContact CE1-CB 4.47Å; F72-L157 HydrophobicContact CZ-CB 4.45Å; F72-C161 HydrophobicContact CD1-CB 3.79Å; F72-C161 WeakPolarHBondContact CD1-SG 3.28Å; F72-C161 HydrophobicContact CE1-CB 3.85Å |
| 73 | M | 82.1 | Confident | 78.7 | Confident | 48 Ų | 48 | 38.7 Ų | 38.7 | 24% | 0.236 | 23% | 0.227 | C | C | . | . | H | α-helix | trans | -60.4 | -44.4 | 179.2 | -72.2 | -174 | -67.1 | 0 | 0 | 112.4 | M69 S70 T76 L77 C161 A162 T165 | M69-M73 WeakPolarHBondContact O-CG 3.34Å; M69-M73 PolarHBondContact O-N 3.45Å; S70-M73 PolarHBondContact O-N 2.9Å; M73-T76 PolarHBondContact O-N 3.02Å; M73-L77 WeakPolarHBondContact O-CB 3.37Å; M73-L77 PolarHBondContact O-N 3.26Å; M73-C161 HydrophobicContact CG-CB 4.4Å; M73-A162 HydrophobicContact SD-CB 3.93Å; M73-T165 HydrophobicContact CE-CG2 4.27Å |
| 74 | L | 86.1 | Confident | 78.9 | Confident | 110 Ų | 110 | 39.1 Ų | 39.1 | 58% | 0.576 | 23% | 0.231 | S | C | * | . | H | α-helix | trans | -63.1 | -44.5 | 176.4 | -75 | 169.3 | 0 | 0 | 0 | 111.2 | S70 I71 F72 L77 V78 | S70-L74 WeakPolarHBondContact O-CB 3.19Å; S70-L74 WeakPolarHBondContact O-CG 3.49Å; S70-L74 PolarHBondContact O-N 3.25Å; I71-L74 PolarHBondContact O-N 2.95Å; F72-L74 PolarHBondContact O-N 3.42Å; L74-L77 WeakPolarHBondContact O-CB 3.16Å; L74-L77 PolarHBondContact O-N 3.3Å; L74-V78 VanDerWaalsContact O-CG2 3.3Å; L74-V78 WeakPolarHBondContact O-CG2 3.11Å; L74-V78 PolarHBondContact O-N 2.82Å |
| 75 | A | 83.3 | Confident | 78.8 | Confident | 1 Ų | 1 | 40.3 Ų | 40.3 | 1% | 0.008 | 24% | 0.237 | C | C | . | . | H | α-helix | trans | -66.7 | -39.6 | -179.8 | 0 | 0 | 0 | 0 | 0 | 112.2 | I71 F72 V78 A79 A91 M94 Q95 | I71-A75 WeakPolarHBondContact O-CB 3.34Å; I71-A75 PolarHBondContact O-N 2.82Å; F72-A75 PolarHBondContact O-N 2.99Å; A75-V78 PolarHBondContact O-N 3.08Å; A75-A79 WeakPolarHBondContact O-CB 3.43Å; A75-A79 PolarHBondContact O-N 3.32Å; A75-A91 WeakPolarHBondContact CB-O 3.38Å; A75-M94 HydrophobicContact CB-CB 3.45Å; A75-M94 VanDerWaalsContact CB-CB 3.45Å; A75-Q95 HydrophobicContact CB-CB 4.47Å; A75-Q95 HydrophobicContact CB-CG 3.61Å |
| 76 | T | 79.6 | Confident | 79.1 | Confident | 0 Ų | 0 | 45.1 Ų | 45.1 | 0% | 0 | 27% | 0.267 | C | S | . | . | H | α-helix | trans | -64.1 | -40.9 | 172.2 | -60.8 | 0 | 0 | 0 | 0 | 111.3 | F72 M73 A79 V80 Q95 Y154 L158 | F72-T76 WeakPolarHBondContact O-CB 3.41Å; F72-T76 PolarHBondContact O-N 3.4Å; F72-T76 PolarHBondContact O-OG1 2.91Å; M73-T76 PolarHBondContact O-N 3.02Å; T76-A79 PolarHBondContact O-N 2.79Å; T76-V80 VanDerWaalsContact O-CG2 3.24Å; T76-V80 WeakPolarHBondContact O-CG2 3.42Å; T76-V80 PolarHBondContact O-N 2.82Å; T76-Q95 PolarHBondContact OG1-OE1 3.31Å; T76-Y154 HydrophobicContact CG2-CD1 3.99Å; T76-Y154 HydrophobicContact CG2-CG 4.46Å; T76-Y154 WeakPolarHBondContact CG2-O 3.12Å; T76-L158 HydrophobicContact CG2-CB 3.85Å; T76-L158 HydrophobicContact CG2-CD1 4.15Å; T76-L158 HydrophobicContact CG2-CG 4.46Å |
| 77 | L | 83.1 | Confident | 79.3 | Confident | 93 Ų | 93 | 45.3 Ų | 45.3 | 49% | 0.487 | 27% | 0.27 | S | S | . | . | H | α-helix | trans | -62.5 | -44.6 | 175.7 | -168.9 | 68.7 | 0 | 0 | 0 | 111.3 | M73 L74 V80 T81 L158 | M73-L77 WeakPolarHBondContact O-CB 3.37Å; M73-L77 PolarHBondContact O-N 3.26Å; L74-L77 WeakPolarHBondContact O-CB 3.16Å; L74-L77 PolarHBondContact O-N 3.3Å; L77-V80 PolarHBondContact O-N 3.45Å; L77-T81 PolarHBondContact O-N 3.13Å; L77-T81 VanDerWaalsContact O-N 3.08Å; L77-T81 PolarHBondContact O-OG1 3.18Å; L77-L158 HydrophobicContact CB-CD1 4.24Å; L77-L158 HydrophobicContact CD1-CD1 4.24Å |
| 78 | V | 83.4 | Confident | 79.1 | Confident | 51 Ų | 51 | 41.9 Ų | 41.9 | 31% | 0.309 | 25% | 0.249 | S | C | . | . | H | α-helix | trans | -61.6 | -43.7 | 174.5 | 173.4 | 0 | 0 | 0 | 0 | 110.9 | L74 A75 V80 T81 T82 V87 A91 | L74-V78 VanDerWaalsContact O-CG2 3.3Å; L74-V78 WeakPolarHBondContact O-CG2 3.11Å; L74-V78 PolarHBondContact O-N 2.82Å; A75-V78 PolarHBondContact O-N 3.08Å; V78-V80 VanDerWaalsContact C-N 3.32Å; V78-V80 PolarHBondContact O-N 3.34Å; V78-T81 PolarHBondContact O-N 3.17Å; V78-T81 PolarHBondContact O-OG1 2.72Å; V78-T81 VanDerWaalsContact O-OG1 3.14Å; V78-T82 WeakPolarHBondContact O-CB 3.43Å; V78-T82 PolarHBondContact O-N 3.4Å; V78-T82 VanDerWaalsContact O-N 3.11Å; V78-T82 PolarHBondContact O-OG1 2.84Å; V78-V87 HydrophobicContact CG1-CG1 3.86Å; V78-A91 HydrophobicContact CB-CB 4.44Å; V78-A91 HydrophobicContact CG1-CB 4.14Å |
| 79 | A | 76.9 | Confident | 79.2 | Confident | 0 Ų | 0 | 44 Ų | 44 | 0% | 0 | 26% | 0.26 | C | S | . | . | H | α-helix | trans | -60.8 | -40.7 | 177.3 | 0 | 0 | 0 | 0 | 0 | 111.8 | A75 T76 T81 T82 L88 A91 Y154 | A75-A79 WeakPolarHBondContact O-CB 3.43Å; A75-A79 PolarHBondContact O-N 3.32Å; T76-A79 PolarHBondContact O-N 2.79Å; A79-T81 PolarHBondContact O-N 3.36Å; A79-T82 PolarHBondContact O-N 3.22Å; A79-L88 HydrophobicContact CB-CD1 4Å; A79-A91 HydrophobicContact CB-CB 3.93Å; A79-Y154 HydrophobicContact CB-CD1 4.14Å; A79-Y154 HydrophobicContact CB-CE1 3.83Å |
| 80 | V | 74.9 | Confident | 79.5 | Confident | 13 Ų | 13 | 45.8 Ų | 45.8 | 8% | 0.079 | 28% | 0.277 | C | S | . | . | H | α-helix | trans | -65.6 | -37.6 | 176.9 | 174.2 | 0 | 0 | 0 | 0 | 111.2 | T76 L77 V78 R151 Y154 | T76-V80 VanDerWaalsContact O-CG2 3.24Å; T76-V80 WeakPolarHBondContact O-CG2 3.42Å; T76-V80 PolarHBondContact O-N 2.82Å; L77-V80 PolarHBondContact O-N 3.45Å; V78-V80 VanDerWaalsContact C-N 3.32Å; V78-V80 PolarHBondContact O-N 3.34Å; V80-R151 HydrophobicContact CG1-CB 4.44Å; V80-R151 PolarHBondContact O-NE 3.44Å; V80-R151 PolarHBondContact O-NH2 2.96Å; V80-Y154 HydrophobicContact CG2-CG 4.23Å |
| 81 | T | 76.2 | Confident | 79.5 | Confident | 90 Ų | 90 | 43.7 Ų | 43.7 | 55% | 0.552 | 26% | 0.262 | S | S | * | . | H | α-helix | trans | -86 | -7.6 | -176.5 | 54.8 | 0 | 0 | 0 | 0 | 114.4 | L77 V78 A79 | L77-T81 PolarHBondContact O-N 3.13Å; L77-T81 VanDerWaalsContact O-N 3.08Å; L77-T81 PolarHBondContact O-OG1 3.18Å; V78-T81 PolarHBondContact O-N 3.17Å; V78-T81 PolarHBondContact O-OG1 2.72Å; V78-T81 VanDerWaalsContact O-OG1 3.14Å; A79-T81 PolarHBondContact O-N 3.36Å |
| 82 | T | 74.1 | Confident | 79.3 | Confident | 16 Ų | 16 | 41.7 Ų | 41.7 | 10% | 0.098 | 25% | 0.251 | C | S | . | . | trans | -93.4 | 135.6 | -167.9 | -73.4 | 0 | 0 | 0 | 0 | 112.8 | V78 A79 S84 V87 L88 | V78-T82 WeakPolarHBondContact O-CB 3.43Å; V78-T82 PolarHBondContact O-N 3.4Å; V78-T82 VanDerWaalsContact O-N 3.11Å; V78-T82 PolarHBondContact O-OG1 2.84Å; A79-T82 PolarHBondContact O-N 3.22Å; T82-S84 VanDerWaalsContact CG2-N 3.32Å; T82-S84 WeakPolarHBondContact CG2-O 2.96Å; T82-V87 HydrophobicContact CG2-CB 3.46Å; T82-V87 VanDerWaalsContact CG2-CB 3.46Å; T82-V87 HydrophobicContact CG2-CG1 3.58Å; T82-V87 WeakPolarHBondContact OG1-CG1 3.37Å; T82-L88 HydrophobicContact CG2-CB 4.5Å | ||
| 83 | S | 67.2 | Low | 79.4 | Confident | 108 Ų | 108 | 42.6 Ų | 42.6 | 76% | 0.755 | 26% | 0.26 | S | S | * | . | trans | -113.8 | 21.8 | 172 | -53.7 | 0 | 0 | 0 | 0 | 112.8 | L27 | L27-S83 WeakPolarHBondContact CD2-O 3.29Š| ||
| 84 | S | 76.9 | Confident | 79.6 | Confident | 54 Ų | 54 | 44.2 Ų | 44.2 | 38% | 0.378 | 27% | 0.268 | S | S | . | . | trans | -128.3 | 130.2 | 179.2 | 178.1 | 0 | 0 | 0 | 0 | 111.5 | T82 T86 V87 L88 | T82-S84 VanDerWaalsContact CG2-N 3.32Å; T82-S84 WeakPolarHBondContact CG2-O 2.96Å; S84-T86 VanDerWaalsContact C-N 3.3Å; S84-T86 PolarHBondContact O-N 2.95Å; S84-V87 PolarHBondContact O-N 2.8Å; S84-L88 PolarHBondContact O-N 3.33Å | ||
| 85 | L | 72.9 | Confident | 79.3 | Confident | 30 Ų | 30 | 39 Ų | 39 | 16% | 0.157 | 24% | 0.24 | C | C | . | . | H | α-helix | trans | -58.2 | -40.7 | -179.7 | -178.1 | 106.6 | 0 | 0 | 0 | 111.8 | V29 A33 V34 V87 L88 I89 | V29-L85 HydrophobicContact CB-CD1 4.33Å; V29-L85 HydrophobicContact CG1-CB 4.23Å; V29-L85 HydrophobicContact CG1-CD1 4.42Å; V29-L85 HydrophobicContact CG2-CD1 3.74Å; A33-L85 HydrophobicContact CB-CD1 3.89Å; A33-L85 HydrophobicContact CB-CD2 3.75Å; A33-L85 HydrophobicContact CB-CG 4.5Å; V34-L85 HydrophobicContact CG2-CD1 4.37Å; L85-V87 VanDerWaalsContact C-N 3.31Å; L85-V87 PolarHBondContact O-N 3.48Å; L85-L88 WeakPolarHBondContact O-CB 2.83Å; L85-L88 PolarHBondContact O-N 2.85Å; L85-L88 VanDerWaalsContact O-N 3.16Å; L85-I89 HydrophobicContact CD2-CD1 3.7Å; L85-I89 HydrophobicContact CG-CD1 3.96Å; L85-I89 HydrophobicContact CG-CG1 4.38Å; L85-I89 VanDerWaalsContact O-CG1 3.3Å; L85-I89 WeakPolarHBondContact O-CG1 3.42Å; L85-I89 PolarHBondContact O-N 3.2Å |
| 86 | T | 79.3 | Confident | 79.1 | Confident | 104 Ų | 104 | 38.9 Ų | 38.9 | 64% | 0.638 | 24% | 0.24 | S | C | * | . | H | α-helix | trans | -62.4 | -40.9 | -179.3 | -48.2 | 0 | 0 | 0 | 0 | 111.7 | S84 I89 A90 | S84-T86 VanDerWaalsContact C-N 3.3Å; S84-T86 PolarHBondContact O-N 2.95Å; T86-I89 PolarHBondContact O-N 3.27Å; T86-A90 PolarHBondContact O-N 2.81Å |
| 87 | V | 81.1 | Confident | 79.2 | Confident | 60 Ų | 60 | 42.4 Ų | 42.4 | 36% | 0.364 | 26% | 0.257 | S | S | . | . | H | α-helix | trans | -73.5 | -32.9 | 178 | 179.1 | 0 | 0 | 0 | 0 | 110.2 | V78 T82 S84 L85 A90 A91 | V78-V87 HydrophobicContact CG1-CG1 3.86Å; T82-V87 HydrophobicContact CG2-CB 3.46Å; T82-V87 VanDerWaalsContact CG2-CB 3.46Å; T82-V87 HydrophobicContact CG2-CG1 3.58Å; T82-V87 WeakPolarHBondContact OG1-CG1 3.37Å; S84-V87 PolarHBondContact O-N 2.8Å; L85-V87 VanDerWaalsContact C-N 3.31Å; L85-V87 PolarHBondContact O-N 3.48Å; V87-A90 PolarHBondContact O-N 3.2Å; V87-A91 VanDerWaalsContact O-CB 3.27Å; V87-A91 WeakPolarHBondContact O-CB 3.44Å; V87-A91 PolarHBondContact O-N 2.75Å |
| 88 | L | 78.2 | Confident | 79 | Confident | 2 Ų | 2 | 38.2 Ų | 38.2 | 1% | 0.01 | 24% | 0.237 | C | C | . | . | H | α-helix | trans | -65.2 | -42.8 | 172.6 | -171.9 | 70 | 0 | 0 | 0 | 111.7 | M23 L27 V37 A79 T82 S84 L85 A90 A91 S92 | M23-L88 HydrophobicContact SD-CD2 3.68Å; L27-L88 HydrophobicContact CD1-CD2 4Å; V37-L88 HydrophobicContact CG2-CD2 4.26Å; A79-L88 HydrophobicContact CB-CD1 4Å; T82-L88 HydrophobicContact CG2-CB 4.5Å; S84-L88 PolarHBondContact O-N 3.33Å; L85-L88 WeakPolarHBondContact O-CB 2.83Å; L85-L88 PolarHBondContact O-N 2.85Å; L85-L88 VanDerWaalsContact O-N 3.16Å; L88-A90 VanDerWaalsContact C-N 3.33Å; L88-A90 PolarHBondContact O-N 3.34Å; L88-A91 PolarHBondContact O-N 3.44Å; L88-S92 WeakPolarHBondContact O-CB 3.38Å; L88-S92 PolarHBondContact O-N 3.44Å; L88-S92 PolarHBondContact O-OG 2.84Å; L88-S92 VanDerWaalsContact O-OG 3.13Å |
| 89 | I | 79.9 | Confident | 78.6 | Confident | 44 Ų | 44 | 36.4 Ų | 36.4 | 23% | 0.226 | 23% | 0.225 | C | C | . | . | H | α-helix | trans | -60.6 | -45 | 173.9 | -68.1 | 166.6 | 0 | 0 | 0 | 110 | V37 A40 L85 T86 S92 A93 | V37-I89 HydrophobicContact CG2-CG1 3.71Å; A40-I89 HydrophobicContact CB-CG2 3.73Å; L85-I89 HydrophobicContact CD2-CD1 3.7Å; L85-I89 HydrophobicContact CG-CD1 3.96Å; L85-I89 HydrophobicContact CG-CG1 4.38Å; L85-I89 VanDerWaalsContact O-CG1 3.3Å; L85-I89 WeakPolarHBondContact O-CG1 3.42Å; L85-I89 PolarHBondContact O-N 3.2Å; T86-I89 PolarHBondContact O-N 3.27Å; I89-S92 PolarHBondContact O-N 3.46Å; I89-A93 VanDerWaalsContact O-CB 3.3Å; I89-A93 WeakPolarHBondContact O-CB 3.34Å; I89-A93 PolarHBondContact O-N 3.27Å |
| 90 | A | 84.6 | Confident | 78.4 | Confident | 47 Ų | 47 | 36.4 Ų | 36.4 | 39% | 0.388 | 23% | 0.225 | S | C | . | . | H | α-helix | trans | -63.8 | -41.2 | 176.7 | 0 | 0 | 0 | 0 | 0 | 112.1 | T86 V87 L88 A93 M94 | T86-A90 PolarHBondContact O-N 2.81Å; V87-A90 PolarHBondContact O-N 3.2Å; L88-A90 VanDerWaalsContact C-N 3.33Å; L88-A90 PolarHBondContact O-N 3.34Å; A90-A93 WeakPolarHBondContact O-CB 3.19Å; A90-A93 PolarHBondContact O-N 2.98Å; A90-M94 WeakPolarHBondContact O-CG 3.3Å; A90-M94 PolarHBondContact O-N 3.26Å |
| 91 | A | 83.7 | Confident | 78.3 | Confident | 0 Ų | 0 | 36 Ų | 36 | 0% | 0 | 22% | 0.223 | C | C | . | . | H | α-helix | trans | -64.7 | -40.8 | 175.1 | 0 | 0 | 0 | 0 | 0 | 111.6 | A75 V78 A79 V87 L88 M94 Q95 | A75-A91 WeakPolarHBondContact CB-O 3.38Å; V78-A91 HydrophobicContact CB-CB 4.44Å; V78-A91 HydrophobicContact CG1-CB 4.14Å; A79-A91 HydrophobicContact CB-CB 3.93Å; V87-A91 VanDerWaalsContact O-CB 3.27Å; V87-A91 WeakPolarHBondContact O-CB 3.44Å; V87-A91 PolarHBondContact O-N 2.75Å; L88-A91 PolarHBondContact O-N 3.44Å; A91-M94 PolarHBondContact O-N 3.48Å; A91-Q95 WeakPolarHBondContact O-CG 3.41Å; A91-Q95 PolarHBondContact O-N 3.04Å; A91-Q95 PolarHBondContact O-NE2 3.36Å |
| 92 | S | 80.1 | Confident | 78 | Confident | 0 Ų | 0 | 31.9 Ų | 31.9 | 0% | 0 | 20% | 0.198 | C | C | . | . | H | α-helix | trans | -70.4 | -34.2 | 176.3 | -66.7 | 0 | 0 | 0 | 0 | 112.7 | V37 L88 I89 M94 Q95 G96 | V37-S92 WeakPolarHBondContact CG1-OG 3.46Å; L88-S92 WeakPolarHBondContact O-CB 3.38Å; L88-S92 PolarHBondContact O-N 3.44Å; L88-S92 PolarHBondContact O-OG 2.84Å; L88-S92 VanDerWaalsContact O-OG 3.13Å; I89-S92 PolarHBondContact O-N 3.46Å; S92-M94 VanDerWaalsContact C-N 3.33Å; S92-Q95 PolarHBondContact O-N 2.7Å; S92-G96 PolarHBondContact O-N 3.37Å |
| 93 | A | 83.6 | Confident | 77.7 | Confident | 24 Ų | 24 | 31.3 Ų | 31.3 | 20% | 0.198 | 20% | 0.196 | C | C | . | . | H | α-helix | trans | -61.2 | -42.4 | 168.9 | 0 | 0 | 0 | 0 | 0 | 111.3 | A40 T44 I89 A90 G96 M97 | A40-A93 HydrophobicContact CB-CB 4.36Å; T44-A93 WeakPolarHBondContact CB-O 3.4Å; T44-A93 HydrophobicContact CG2-CB 3.59Å; T44-A93 VanDerWaalsContact CG2-O 3.29Å; T44-A93 WeakPolarHBondContact CG2-O 3.17Å; T44-A93 WeakPolarHBondContact OG1-CA 3.45Å; T44-A93 PolarHBondContact OG1-O 3.44Å; I89-A93 VanDerWaalsContact O-CB 3.3Å; I89-A93 WeakPolarHBondContact O-CB 3.34Å; I89-A93 PolarHBondContact O-N 3.27Å; A90-A93 WeakPolarHBondContact O-CB 3.19Å; A90-A93 PolarHBondContact O-N 2.98Å; A93-G96 PolarHBondContact O-N 2.86Å; A93-M97 PolarHBondContact O-N 2.84Å; A93-M97 VanDerWaalsContact O-N 3.09Å |
| 94 | M | 85.6 | Confident | 77.6 | Confident | 81 Ų | 81 | 26.6 Ų | 26.6 | 40% | 0.399 | 16% | 0.163 | S | C | . | . | H | α-helix | trans | -68 | -38.6 | 174.3 | -71.2 | -171.6 | -73.8 | 0 | 0 | 112.2 | I71 A75 A90 A91 S92 M97 G98 | I71-M94 HydrophobicContact CG2-CB 4.27Å; I71-M94 WeakPolarHBondContact CG2-O 3.42Å; A75-M94 HydrophobicContact CB-CB 3.45Å; A75-M94 VanDerWaalsContact CB-CB 3.45Å; A90-M94 WeakPolarHBondContact O-CG 3.3Å; A90-M94 PolarHBondContact O-N 3.26Å; A91-M94 PolarHBondContact O-N 3.48Å; S92-M94 VanDerWaalsContact C-N 3.33Å; M94-M97 PolarHBondContact O-N 3.47Å; M94-G98 PolarHBondContact O-N 3.29Å |
| 95 | Q | 80.3 | Confident | 77.1 | Confident | 0 Ų | 0 | 24 Ų | 24 | 0% | 0 | 15% | 0.145 | C | C | . | . | H | α-helix | trans | -61.2 | -46.2 | 174.5 | -76.3 | 172.5 | 90.9 | 0 | 0 | 111.3 | Y16 Y41 F72 A75 T76 A91 S92 M97 G98 T99 | Y16-Q95 PolarHBondContact OH-OE1 3.01Å; Y41-Q95 HydrophobicContact CD2-CB 4.24Å; Y41-Q95 HydrophobicContact CE2-CB 4.17Å; F72-Q95 HydrophobicContact CD2-CB 3.97Å; F72-Q95 HydrophobicContact CD2-CG 4.02Å; F72-Q95 HydrophobicContact CE2-CB 4.03Å; F72-Q95 HydrophobicContact CE2-CG 4.04Å; A75-Q95 HydrophobicContact CB-CB 4.47Å; A75-Q95 HydrophobicContact CB-CG 3.61Å; T76-Q95 PolarHBondContact OG1-OE1 3.31Å; A91-Q95 WeakPolarHBondContact O-CG 3.41Å; A91-Q95 PolarHBondContact O-N 3.04Å; A91-Q95 PolarHBondContact O-NE2 3.36Å; S92-Q95 PolarHBondContact O-N 2.7Å; Q95-M97 VanDerWaalsContact C-N 3.27Å; Q95-M97 PolarHBondContact O-N 3.37Å; Q95-G98 PolarHBondContact O-N 2.89Å; Q95-T99 WeakPolarHBondContact O-CG2 3.23Å; Q95-T99 PolarHBondContact O-N 2.9Å; Q95-T99 PolarHBondContact O-OG1 3.03Å |
| 96 | G | 79.3 | Confident | 76.6 | Confident | 0 Ų | 0 | 23 Ų | 23 | 0% | 0 | 14% | 0.14 | C | C | . | . | H | α-helix | trans | -61.1 | -37 | 176.9 | 0 | 0 | 0 | 0 | 0 | 112.4 | T44 Y45 S48 S92 A93 T99 G100 | T44-G96 WeakPolarHBondContact OG1-CA 3.29Å; Y45-G96 WeakPolarHBondContact CA-O 3.1Å; S48-G96 PolarHBondContact OG-O 3.33Å; S92-G96 PolarHBondContact O-N 3.37Å; A93-G96 PolarHBondContact O-N 2.86Å; G96-T99 PolarHBondContact O-OG1 3.27Å; G96-G100 PolarHBondContact O-N 2.93Å; G96-G100 VanDerWaalsContact O-N 3.07Å |
| 97 | M | 82.6 | Confident | 75.8 | Confident | 74 Ų | 74 | 23.8 Ų | 23.8 | 37% | 0.365 | 13% | 0.131 | S | C | . | . | H | α-helix | trans | -64.5 | -39.6 | 172.6 | -170.4 | 176 | -77.5 | 0 | 0 | 112.3 | Y52 A93 M94 Q95 | Y52-M97 HydrophobicContact CE2-CG 4.12Å; Y52-M97 WeakPolarHBondContact CE2-O 3.44Å; A93-M97 PolarHBondContact O-N 2.84Å; A93-M97 VanDerWaalsContact O-N 3.09Å; M94-M97 PolarHBondContact O-N 3.47Å; Q95-M97 VanDerWaalsContact C-N 3.27Å; Q95-M97 PolarHBondContact O-N 3.37Å |
| 98 | G | 78.8 | Confident | 75 | Confident | 5 Ų | 5 | 22.5 Ų | 22.5 | 5% | 0.052 | 12% | 0.124 | C | C | . | . | H | α-helix | trans | -69.9 | -44.5 | 177.5 | 0 | 0 | 0 | 0 | 0 | 113.6 | G68 M94 Q95 G100 V101 | G68-G98 WeakPolarHBondContact O-CA 3.49Å; M94-G98 PolarHBondContact O-N 3.29Å; Q95-G98 PolarHBondContact O-N 2.89Å; G98-G100 VanDerWaalsContact C-N 3.31Å; G98-G100 PolarHBondContact O-N 3.09Å; G98-V101 PolarHBondContact O-N 3.5Å |
| 99 | T | 75 | Confident | 74.4 | Confident | 12 Ų | 12 | 22.4 Ų | 22.4 | 7% | 0.074 | 12% | 0.124 | C | C | . | . | H | α-helix | trans | -70.4 | -27.2 | -179.7 | 56.3 | 0 | 0 | 0 | 0 | 112.8 | Y41 Y45 F72 Q95 G96 V101 G102 G103 | Y41-T99 HydrophobicContact CE2-CG2 4.34Å; Y41-T99 WeakPolarHBondContact OH-CB 3.3Å; Y41-T99 WeakPolarHBondContact OH-CG2 3.45Å; Y41-T99 PolarHBondContact OH-OG1 3.36Å; Y45-T99 WeakPolarHBondContact CD2-OG1 3.39Å; F72-T99 HydrophobicContact CD2-CG2 3.4Å; F72-T99 VanDerWaalsContact CD2-CG2 3.4Å; F72-T99 HydrophobicContact CE2-CG2 3.35Å; F72-T99 HydrophobicContact CG-CG2 4.44Å; F72-T99 HydrophobicContact CZ-CG2 4.36Å; Q95-T99 WeakPolarHBondContact O-CG2 3.23Å; Q95-T99 PolarHBondContact O-N 2.9Å; Q95-T99 PolarHBondContact O-OG1 3.03Å; G96-T99 PolarHBondContact O-OG1 3.27Å; T99-V101 PolarHBondContact O-N 3.5Å; T99-G102 WeakPolarHBondContact O-CA 3.29Å; T99-G102 PolarHBondContact O-N 3.24Å; T99-G103 PolarHBondContact O-N 3.34Å |
| 100 | G | 73.2 | Confident | 73.6 | Confident | 0 Ų | 0 | 20.4 Ų | 20.4 | 0% | 0 | 11% | 0.113 | C | C | . | . | H | α-helix | trans | -54.2 | -36 | 175.3 | 0 | 0 | 0 | 0 | 0 | 114 | Y45 S48 G96 G98 G102 G103 V104 | Y45-G100 VanDerWaalsContact CD2-CA 3.42Å; Y45-G100 VanDerWaalsContact CE2-CA 3.43Å; S48-G100 WeakPolarHBondContact OG-CA 3.3Å; G96-G100 PolarHBondContact O-N 2.93Å; G96-G100 VanDerWaalsContact O-N 3.07Å; G98-G100 VanDerWaalsContact C-N 3.31Å; G98-G100 PolarHBondContact O-N 3.09Å; G100-G102 VanDerWaalsContact C-N 3.32Å; G100-G102 PolarHBondContact O-N 3.08Å; G100-G103 PolarHBondContact O-N 3.3Å; G100-V104 WeakPolarHBondContact O-CG2 3.43Å; G100-V104 PolarHBondContact O-N 2.94Å |
| 101 | V | 71.7 | Confident | 72.5 | Confident | 4 Ų | 4 | 25.4 Ų | 25.4 | 2% | 0.024 | 12% | 0.122 | C | C | . | . | H | α-helix | trans | -60.6 | -44.3 | 174.7 | -175.7 | 0 | 0 | 0 | 0 | 111 | Y52 V64 I65 G98 T99 G103 V104 M105 | Y52-V101 HydrophobicContact CD1-CG2 3.64Å; Y52-V101 HydrophobicContact CD2-CG2 3.5Å; Y52-V101 HydrophobicContact CE1-CG2 3.44Å; Y52-V101 VanDerWaalsContact CE1-CG2 3.44Å; Y52-V101 HydrophobicContact CE2-CG2 3.36Å; Y52-V101 HydrophobicContact CG-CG2 3.66Å; V64-V101 HydrophobicContact CG1-CG1 3.88Å; V64-V101 HydrophobicContact CG1-CG2 4.37Å; I65-V101 HydrophobicContact CB-CG1 4.47Å; I65-V101 HydrophobicContact CG1-CG1 3.94Å; G98-V101 PolarHBondContact O-N 3.5Å; T99-V101 PolarHBondContact O-N 3.5Å; V101-G103 VanDerWaalsContact C-N 3.34Å; V101-G103 PolarHBondContact O-N 3.03Å; V101-V104 PolarHBondContact O-N 3.26Å; V101-M105 HydrophobicContact CG1-CG 4.11Å; V101-M105 VanDerWaalsContact O-CB 3.28Å; V101-M105 WeakPolarHBondContact O-CB 3.4Å; V101-M105 WeakPolarHBondContact O-CG 3.41Å; V101-M105 PolarHBondContact O-N 3.05Å |
| 102 | G | 69.5 | Low | 71.5 | Confident | 4 Ų | 4 | 28.8 Ų | 28.8 | 4% | 0.041 | 14% | 0.14 | C | C | . | . | H | α-helix | trans | -59.6 | -44.5 | 177.9 | 0 | 0 | 0 | 0 | 0 | 111.9 | T99 G100 M105 A106 | T99-G102 WeakPolarHBondContact O-CA 3.29Å; T99-G102 PolarHBondContact O-N 3.24Å; G100-G102 VanDerWaalsContact C-N 3.32Å; G100-G102 PolarHBondContact O-N 3.08Å; G102-M105 PolarHBondContact O-N 3.01Å; G102-A106 WeakPolarHBondContact O-CB 3.25Å; G102-A106 PolarHBondContact O-N 3.07Å |
| 103 | G | 67.4 | Low | 70.7 | Confident | 5 Ų | 5 | 33.2 Ų | 33.2 | 5% | 0.052 | 16% | 0.163 | C | C | . | . | H | α-helix | trans | -66.6 | -38.4 | 179.3 | 0 | 0 | 0 | 0 | 0 | 114.3 | T99 G100 V101 A106 | T99-G103 PolarHBondContact O-N 3.34Å; G100-G103 PolarHBondContact O-N 3.3Å; V101-G103 VanDerWaalsContact C-N 3.34Å; V101-G103 PolarHBondContact O-N 3.03Å; G103-A106 WeakPolarHBondContact O-CB 3.27Å |
| 104 | V | 66.9 | Low | 69.5 | Low | 8 Ų | 8 | 36.6 Ų | 36.6 | 5% | 0.048 | 17% | 0.172 | C | C | . | . | H | α-helix | trans | -67.1 | -48.3 | 173.8 | 177.2 | 0 | 0 | 0 | 0 | 110.2 | Q49 G100 V101 A106 R107 T108 | Q49-V104 HydrophobicContact CB-CG2 4.04Å; Q49-V104 HydrophobicContact CG-CG2 3.87Å; G100-V104 WeakPolarHBondContact O-CG2 3.43Å; G100-V104 PolarHBondContact O-N 2.94Å; V101-V104 PolarHBondContact O-N 3.26Å; V104-A106 VanDerWaalsContact C-N 3.29Å; V104-A106 PolarHBondContact O-N 3.44Å; V104-R107 PolarHBondContact O-N 3.44Å; V104-T108 HydrophobicContact CG1-CG2 4.22Å; V104-T108 PolarHBondContact O-N 2.87Å; V104-T108 VanDerWaalsContact O-N 3.15Å; V104-T108 PolarHBondContact O-OG1 3.28Å |
| 105 | M | 65.4 | Low | 68.3 | Low | 1 Ų | 1 | 40.9 Ų | 40.9 | 1% | 0.005 | 19% | 0.191 | C | C | . | . | H | α-helix | trans | -65.2 | -32.2 | -177.1 | -70.8 | -63.5 | -169.3 | 0 | 0 | 113.1 | S56 R61 V64 I65 V101 G102 R107 T108 L109 | S56-M105 WeakPolarHBondContact OG-CE 3.12Å; R61-M105 VanDerWaalsContact CA-CE 3.5Å; R61-M105 HydrophobicContact CB-CE 3.56Å; R61-M105 HydrophobicContact CB-SD 4.04Å; R61-M105 HydrophobicContact CG-CE 3.84Å; R61-M105 HydrophobicContact CG-SD 4.05Å; R61-M105 WeakPolarHBondContact O-CE 3.47Å; V64-M105 HydrophobicContact CB-CE 4.39Å; V64-M105 HydrophobicContact CG1-CE 4.38Å; I65-M105 HydrophobicContact CD1-CB 4.41Å; I65-M105 HydrophobicContact CD1-CE 4.05Å; I65-M105 HydrophobicContact CD1-CG 3.87Å; I65-M105 HydrophobicContact CD1-SD 4.16Å; I65-M105 HydrophobicContact CG1-CE 3.89Å; I65-M105 HydrophobicContact CG1-CG 3.78Å; I65-M105 HydrophobicContact CG1-SD 4.42Å; V101-M105 HydrophobicContact CG1-CG 4.11Å; V101-M105 VanDerWaalsContact O-CB 3.28Å; V101-M105 WeakPolarHBondContact O-CB 3.4Å; V101-M105 WeakPolarHBondContact O-CG 3.41Å; V101-M105 PolarHBondContact O-N 3.05Å; G102-M105 PolarHBondContact O-N 3.01Å; M105-R107 PolarHBondContact O-N 3.37Å; M105-R107 VanDerWaalsContact O-N 3.15Å; M105-T108 WeakPolarHBondContact CA-OG1 3.43Å; M105-T108 PolarHBondContact O-N 3.28Å; M105-L109 HydrophobicContact CB-CD1 3.87Å; M105-L109 HydrophobicContact CG-CD1 4.48Å; M105-L109 WeakPolarHBondContact O-CB 3.35Å; M105-L109 PolarHBondContact O-N 3.32Å; M105-L109 HydrophobicContact SD-CD1 4.23Å; M105-L109 HydrophobicContact SD-CG 4.41Å |
| 106 | A | 63.3 | Low | 67.3 | Low | 7 Ų | 7 | 51 Ų | 51 | 6% | 0.058 | 23% | 0.229 | C | C | . | . | H | α-helix | trans | -51 | -35.4 | 171 | 0 | 0 | 0 | 0 | 0 | 113.2 | V6 G102 G103 V104 P110 | V6-A106 HydrophobicContact CB-CB 4.48Å; V6-A106 HydrophobicContact CG1-CB 4.41Å; V6-A106 HydrophobicContact CG2-CB 3.26Å; G102-A106 WeakPolarHBondContact O-CB 3.25Å; G102-A106 PolarHBondContact O-N 3.07Å; G103-A106 WeakPolarHBondContact O-CB 3.27Å; V104-A106 VanDerWaalsContact C-N 3.29Å; V104-A106 PolarHBondContact O-N 3.44Å; A106-P110 WeakPolarHBondContact O-CD 3.43Å; A106-P110 WeakPolarHBondContact O-CG 3.38Å |
| 107 | R | 61.9 | Low | 66.4 | Low | 121 Ų | 121 | 55.9 Ų | 55.9 | 46% | 0.457 | 26% | 0.259 | S | S | . | . | H | α-helix | trans | -96.5 | -30.3 | -173.3 | -64.5 | -173.1 | -73.6 | -138.9 | 2.4 | 111.9 | Q49 V104 M105 | Q49-R107 VanDerWaalsContact CD-NH2 3.25Å; V104-R107 PolarHBondContact O-N 3.44Å; M105-R107 PolarHBondContact O-N 3.37Å; M105-R107 VanDerWaalsContact O-N 3.15Å |
| 108 | T | 63.9 | Low | 65.5 | Low | 33 Ų | 33 | 58.4 Ų | 58.4 | 20% | 0.202 | 27% | 0.27 | C | S | . | . | H | α-helix | trans | -87.5 | -37.3 | -177.7 | 58.4 | 0 | 0 | 0 | 0 | 113.2 | R61 V104 M105 R111 D112 | R61-T108 PolarHBondContact NH1-O 3.37Å; V104-T108 HydrophobicContact CG1-CG2 4.22Å; V104-T108 PolarHBondContact O-N 2.87Å; V104-T108 VanDerWaalsContact O-N 3.15Å; V104-T108 PolarHBondContact O-OG1 3.28Å; M105-T108 WeakPolarHBondContact CA-OG1 3.43Å; M105-T108 PolarHBondContact O-N 3.28Å; T108-R111 WeakPolarHBondContact O-CB 3.21Å; T108-R111 PolarHBondContact O-N 2.86Å; T108-D112 PolarHBondContact O-N 2.98Å; T108-D112 VanDerWaalsContact O-N 3.15Å; T108-D112 VanDerWaalsContact O-OD1 3.14Å |
| 109 | L | 65.1 | Low | 64.7 | Low | 1 Ų | 1 | 60.1 Ų | 60.1 | 1% | 0.005 | 28% | 0.278 | C | S | . | . | H | α-helix | trans | -68.7 | -42.8 | -176.3 | -75.3 | 162.5 | 0 | 0 | 0 | 114.7 | L2 I65 M105 R111 D112 L113 M172 | L2-L109 HydrophobicContact CD1-CB 3.67Å; L2-L109 HydrophobicContact CD1-CD1 4.14Å; L2-L109 HydrophobicContact CD2-CB 4.33Å; L2-L109 HydrophobicContact CD2-CD1 3.33Å; L2-L109 HydrophobicContact CD2-CG 4.46Å; L2-L109 HydrophobicContact CG-CD1 4.34Å; I65-L109 HydrophobicContact CD1-CD1 4.37Å; M105-L109 HydrophobicContact CB-CD1 3.87Å; M105-L109 HydrophobicContact CG-CD1 4.48Å; M105-L109 WeakPolarHBondContact O-CB 3.35Å; M105-L109 PolarHBondContact O-N 3.32Å; M105-L109 HydrophobicContact SD-CD1 4.23Å; M105-L109 HydrophobicContact SD-CG 4.41Å; L109-R111 PolarHBondContact O-N 3.2Å; L109-D112 PolarHBondContact O-N 2.74Å; L109-L113 HydrophobicContact CD2-CD1 4.06Å; L109-L113 VanDerWaalsContact O-CD1 3.32Å; L109-L113 WeakPolarHBondContact O-CD1 3.47Å; L109-L113 PolarHBondContact O-N 3.21Å; L109-M172 HydrophobicContact CD1-CE 3.43Å; L109-M172 VanDerWaalsContact CD1-CE 3.43Å; L109-M172 HydrophobicContact CD2-CE 3.35Å; L109-M172 HydrophobicContact CG-CE 4.06Å |
| 110 | P | 63.4 | Low | 64 | Low | 2 Ų | 2 | 67.7 Ų | 67.7 | 1% | 0.013 | 31% | 0.305 | C | S | . | . | H | α-helix | trans | -65.5 | -27.3 | 176.3 | -18.2 | 32.1 | 0 | 0 | 0 | 111.9 | A106 Y114 A122 L126 | A106-P110 WeakPolarHBondContact O-CD 3.43Å; A106-P110 WeakPolarHBondContact O-CG 3.38Å; P110-Y114 WeakPolarHBondContact O-CB 3.49Å; P110-Y114 PolarHBondContact O-N 3.39Å; P110-A122 HydrophobicContact CB-CB 4.33Å; P110-L126 HydrophobicContact CB-CD1 3.9Å; P110-L126 HydrophobicContact CG-CD1 3.12Å |
| 111 | R | 61 | Low | 63.6 | Low | 152 Ų | 152 | 73.6 Ų | 73.6 | 57% | 0.574 | 33% | 0.332 | S | S | * | . | H | α-helix | trans | -70.6 | -34.2 | 175.9 | -175.1 | 179.2 | 175.2 | 178.5 | -1.6 | 112.6 | T108 L109 L119 | T108-R111 WeakPolarHBondContact O-CB 3.21Å; T108-R111 PolarHBondContact O-N 2.86Å; L109-R111 PolarHBondContact O-N 3.2Å; R111-L119 HydrophobicContact CB-CD1 4.35Å; R111-L119 HydrophobicContact CG-CD1 4.38Å |
| 112 | D | 63.5 | Low | 63.2 | Low | 70 Ų | 70 | 74 Ų | 74 | 37% | 0.374 | 34% | 0.336 | S | S | . | . | H | α-helix | trans | -86.7 | -32.8 | -179.4 | -79.7 | 44.6 | 0 | 0 | 0 | 113.5 | R61 T108 L109 | R61-D112 IonicContact CZ-OD1 3.83Å; R61-D112 IonicContact CZ-OD2 3.84Å; R61-D112 IonicContact NE-OD2 3.47Å; R61-D112 VanDerWaalsContact NH1-CB 3.33Å; R61-D112 IonicContact NH1-OD1 2.69Å; R61-D112 PolarHBondContact NH1-OD1 3.22Å; R61-D112 IonicContact NH1-OD2 2.98Å; R61-D112 PolarHBondContact NH1-OD2 3.2Å; R61-D112 IonicContact NH2-OD1 2.9Å; R61-D112 PolarHBondContact NH2-OD1 2.85Å; R61-D112 IonicContact NH2-OD2 3.65Å; R61-D112 PolarHBondContact NH2-OD2 2.92Å; T108-D112 PolarHBondContact O-N 2.98Å; T108-D112 VanDerWaalsContact O-N 3.15Å; T108-D112 VanDerWaalsContact O-OD1 3.14Å; L109-D112 PolarHBondContact O-N 2.74Å |
| 113 | L | 62.5 | Low | 63 | Low | 94 Ų | 94 | 76.4 Ų | 76.4 | 49% | 0.492 | 35% | 0.348 | S | S | . | . | H | α-helix | trans | -85.7 | -24.6 | -176.6 | -90 | 87.3 | 0 | 0 | 0 | 113.9 | L109 T175 | L109-L113 HydrophobicContact CD2-CD1 4.06Å; L109-L113 VanDerWaalsContact O-CD1 3.32Å; L109-L113 WeakPolarHBondContact O-CD1 3.47Å; L109-L113 PolarHBondContact O-N 3.21Å; L113-T175 HydrophobicContact CD1-CG2 4.36Å |
| 114 | Y | 60.3 | Low | 62.8 | Low | 94 Ų | 94 | 78.9 Ų | 78.9 | 37% | 0.369 | 37% | 0.365 | S | S | . | . | trans | -126.5 | 131.7 | -170 | -60.6 | -73.3 | 0 | 0 | 0 | 111.9 | P110 Q118 L119 A122 | P110-Y114 WeakPolarHBondContact O-CB 3.49Å; P110-Y114 PolarHBondContact O-N 3.39Å; Y114-Q118 HydrophobicContact CD1-CB 3.64Å; Y114-Q118 HydrophobicContact CG-CB 4.11Å; Y114-L119 WeakPolarHBondContact O-CD1 3.47Å; Y114-A122 HydrophobicContact CD2-CB 3.69Å; Y114-A122 HydrophobicContact CE2-CB 3.84Å; Y114-A122 HydrophobicContact CG-CB 4.31Å | ||
| 115 | E | 59.1 | Low | 62.8 | Low | 172 Ų | 172 | 82.6 Ų | 82.6 | 80% | 0.804 | 38% | 0.384 | S | S | * | . | trans | -88.1 | 136.3 | 170.2 | -74.2 | -167.9 | 155 | 0 | 0 | 111.8 | T117 Q118 | E115-T117 PolarHBondContact O-N 2.87Å; E115-Q118 PolarHBondContact O-N 3.45Å | ||
| 116 | R | 59.7 | Low | 62.9 | Low | 213 Ų | 213 | 83.1 Ų | 83.1 | 80% | 0.804 | 39% | 0.386 | S | S | * | . | H | α-helix | trans | 34.1 | -75.5 | 170.3 | -64 | -171.8 | 179 | -146.1 | 0.2 | 117.2 | R120 | R116-R120 PolarHBondContact O-N 3.26Å |
| 117 | T | 59.9 | Low | 63 | Low | 102 Ų | 102 | 87.2 Ų | 87.2 | 63% | 0.626 | 41% | 0.407 | S | S | * | . | H | α-helix | trans | -77.8 | -41.7 | -172.8 | -35.8 | 0 | 0 | 0 | 0 | 111.7 | E115 L119 R120 H121 | E115-T117 PolarHBondContact O-N 2.87Å; T117-L119 VanDerWaalsContact C-N 3.3Å; T117-R120 PolarHBondContact O-N 2.95Å; T117-H121 PolarHBondContact O-N 3.18Å |
| 118 | Q | 63 | Low | 63.2 | Low | 126 Ų | 126 | 86.8 Ų | 86.8 | 59% | 0.589 | 41% | 0.412 | S | S | * | . | H | α-helix | trans | -71.4 | -31.1 | 175.3 | -68.6 | -177.3 | -4.3 | 0 | 0 | 111.1 | Y114 E115 R120 H121 A122 | Y114-Q118 HydrophobicContact CD1-CB 3.64Å; Y114-Q118 HydrophobicContact CG-CB 4.11Å; E115-Q118 PolarHBondContact O-N 3.45Å; Q118-R120 PolarHBondContact O-N 3.33Å; Q118-H121 PolarHBondContact O-N 2.96Å; Q118-A122 WeakPolarHBondContact O-CB 3.45Å; Q118-A122 PolarHBondContact O-N 3.3Å |
| 119 | L | 63.8 | Low | 63.3 | Low | 42 Ų | 42 | 85.8 Ų | 85.8 | 22% | 0.22 | 41% | 0.408 | C | S | . | . | H | α-helix | trans | -62.3 | -42 | 174.8 | -176.4 | 150.2 | 0 | 0 | 0 | 111.9 | R111 Y114 T117 H121 A122 N123 | R111-L119 HydrophobicContact CB-CD1 4.35Å; R111-L119 HydrophobicContact CG-CD1 4.38Å; Y114-L119 WeakPolarHBondContact O-CD1 3.47Å; T117-L119 VanDerWaalsContact C-N 3.3Å; L119-H121 VanDerWaalsContact C-N 3.35Å; L119-A122 PolarHBondContact O-N 2.85Å; L119-N123 WeakPolarHBondContact CD2-ND2 3.39Å; L119-N123 VanDerWaalsContact O-CB 3.26Å; L119-N123 WeakPolarHBondContact O-CB 3.42Å; L119-N123 PolarHBondContact O-N 3.21Å; L119-N123 PolarHBondContact O-ND2 2.85Å |
| 120 | R | 60.5 | Low | 63.3 | Low | 171 Ų | 171 | 87.9 Ų | 87.9 | 65% | 0.645 | 42% | 0.419 | S | S | * | . | H | α-helix | trans | -61.9 | -43.2 | 174.4 | -79.4 | -169.8 | -71.7 | -120.1 | 0.7 | 111.8 | R116 T117 Q118 S124 | R116-R120 PolarHBondContact O-N 3.26Å; T117-R120 PolarHBondContact O-N 2.95Å; Q118-R120 PolarHBondContact O-N 3.33Å; R120-S124 WeakPolarHBondContact O-CB 3.46Å; R120-S124 PolarHBondContact O-N 2.95Å |
| 121 | H | 63.6 | Low | 63.4 | Low | 123 Ų | 123 | 91.2 Ų | 91.2 | 57% | 0.569 | 44% | 0.436 | S | S | * | . | H | α-helix | trans | -66.3 | -46 | 178.2 | -170.4 | 68.1 | 0 | 0 | 0 | 111.8 | T117 Q118 L119 N123 S124 L125 | T117-H121 PolarHBondContact O-N 3.18Å; Q118-H121 PolarHBondContact O-N 2.96Å; L119-H121 VanDerWaalsContact C-N 3.35Å; H121-N123 PolarHBondContact O-N 2.94Å; H121-S124 PolarHBondContact O-N 3.04Å; H121-L125 WeakPolarHBondContact O-CG 3.42Å; H121-L125 PolarHBondContact O-N 3.05Å |
| 122 | A | 63 | Low | 63.7 | Low | 14 Ų | 14 | 87.5 Ų | 87.5 | 12% | 0.116 | 43% | 0.43 | C | S | . | . | H | α-helix | trans | -60.9 | -44.4 | 176.2 | 0 | 0 | 0 | 0 | 0 | 112 | P110 Y114 Q118 L119 S124 L125 L126 | P110-A122 HydrophobicContact CB-CB 4.33Å; Y114-A122 HydrophobicContact CD2-CB 3.69Å; Y114-A122 HydrophobicContact CE2-CB 3.84Å; Y114-A122 HydrophobicContact CG-CB 4.31Å; Q118-A122 WeakPolarHBondContact O-CB 3.45Å; Q118-A122 PolarHBondContact O-N 3.3Å; L119-A122 PolarHBondContact O-N 2.85Å; A122-S124 VanDerWaalsContact C-N 3.34Å; A122-S124 PolarHBondContact O-N 3.44Å; A122-L125 PolarHBondContact O-N 3.17Å; A122-L126 WeakPolarHBondContact O-CB 2.98Å; A122-L126 WeakPolarHBondContact O-CD1 3.28Å; A122-L126 VanDerWaalsContact O-CG 3.28Å; A122-L126 WeakPolarHBondContact O-CG 3.39Å; A122-L126 PolarHBondContact O-N 3.42Å |
| 123 | N | 64.9 | Low | 63.9 | Low | 54 Ų | 54 | 84.4 Ų | 84.4 | 29% | 0.289 | 41% | 0.414 | S | S | . | . | H | α-helix | trans | -65.3 | -36.6 | 175.3 | -81.9 | -33.9 | 0 | 0 | 0 | 112.5 | L119 H121 L126 N127 | L119-N123 WeakPolarHBondContact CD2-ND2 3.39Å; L119-N123 VanDerWaalsContact O-CB 3.26Å; L119-N123 WeakPolarHBondContact O-CB 3.42Å; L119-N123 PolarHBondContact O-N 3.21Å; L119-N123 PolarHBondContact O-ND2 2.85Å; H121-N123 PolarHBondContact O-N 2.94Å; N123-L126 PolarHBondContact O-N 3.11Å; N123-N127 WeakPolarHBondContact O-CB 3.27Å; N123-N127 PolarHBondContact O-N 3.29Å; N123-N127 PolarHBondContact O-ND2 3.17Å |
| 124 | S | 63.6 | Low | 63.9 | Low | 57 Ų | 57 | 81.3 Ų | 81.3 | 40% | 0.399 | 40% | 0.399 | S | S | . | . | H | α-helix | trans | -64.1 | -45.2 | 174.9 | -176.6 | 0 | 0 | 0 | 0 | 111.3 | R120 H121 A122 L126 N127 M128 | R120-S124 WeakPolarHBondContact O-CB 3.46Å; R120-S124 PolarHBondContact O-N 2.95Å; H121-S124 PolarHBondContact O-N 3.04Å; A122-S124 VanDerWaalsContact C-N 3.34Å; A122-S124 PolarHBondContact O-N 3.44Å; S124-L126 VanDerWaalsContact C-N 3.34Å; S124-L126 PolarHBondContact O-N 2.97Å; S124-N127 PolarHBondContact O-N 3.42Å; S124-M128 WeakPolarHBondContact O-CB 3.4Å; S124-M128 WeakPolarHBondContact O-CG 3.43Å; S124-M128 PolarHBondContact O-N 3.43Å |
| 125 | L | 68.3 | Low | 64.2 | Low | 85 Ų | 85 | 79.4 Ų | 79.4 | 45% | 0.445 | 40% | 0.395 | S | S | . | . | H | α-helix | trans | -63.1 | -39.5 | 175.3 | -73.1 | 170.2 | 0 | 0 | 0 | 112.2 | H121 A122 M128 G129 | H121-L125 WeakPolarHBondContact O-CG 3.42Å; H121-L125 PolarHBondContact O-N 3.05Å; A122-L125 PolarHBondContact O-N 3.17Å; L125-M128 PolarHBondContact O-N 3.14Å; L125-G129 PolarHBondContact O-N 3.32Å |
| 126 | L | 67.3 | Low | 64.6 | Low | 12 Ų | 12 | 74.7 Ų | 74.7 | 6% | 0.063 | 38% | 0.375 | C | S | . | . | H | α-helix | trans | -64.4 | -46.8 | 175.1 | -76.3 | 159.4 | 0 | 0 | 0 | 111.9 | L2 V3 P110 A122 N123 S124 M128 G129 I130 | L2-L126 HydrophobicContact CB-CD2 4.07Å; V3-L126 HydrophobicContact CB-CD2 4.32Å; V3-L126 HydrophobicContact CG2-CD2 3.57Å; V3-L126 HydrophobicContact CG2-CG 4.1Å; P110-L126 HydrophobicContact CB-CD1 3.9Å; P110-L126 HydrophobicContact CG-CD1 3.12Å; A122-L126 WeakPolarHBondContact O-CB 2.98Å; A122-L126 WeakPolarHBondContact O-CD1 3.28Å; A122-L126 VanDerWaalsContact O-CG 3.28Å; A122-L126 WeakPolarHBondContact O-CG 3.39Å; A122-L126 PolarHBondContact O-N 3.42Å; N123-L126 PolarHBondContact O-N 3.11Å; S124-L126 VanDerWaalsContact C-N 3.34Å; S124-L126 PolarHBondContact O-N 2.97Å; L126-M128 VanDerWaalsContact C-N 3.33Å; L126-M128 PolarHBondContact O-N 2.71Å; L126-G129 PolarHBondContact O-N 3.27Å; L126-I130 WeakPolarHBondContact O-CB 3.48Å; L126-I130 VanDerWaalsContact O-CG1 3.23Å; L126-I130 WeakPolarHBondContact O-CG1 3.1Å; L126-I130 PolarHBondContact O-N 2.93Å |
| 127 | N | 64.1 | Low | 65 | Low | 94 Ų | 94 | 64.6 Ų | 64.6 | 50% | 0.503 | 34% | 0.338 | S | S | . | . | H | α-helix | trans | -62.2 | -41.8 | 175.9 | -78.1 | -23 | 0 | 0 | 0 | 111.4 | N123 S124 G129 I130 L131 | N123-N127 WeakPolarHBondContact O-CB 3.27Å; N123-N127 PolarHBondContact O-N 3.29Å; N123-N127 PolarHBondContact O-ND2 3.17Å; S124-N127 PolarHBondContact O-N 3.42Å; N127-G129 VanDerWaalsContact C-N 3.33Å; N127-G129 PolarHBondContact O-N 2.74Å; N127-I130 PolarHBondContact O-N 3.44Å; N127-L131 WeakPolarHBondContact O-CB 2.94Å; N127-L131 WeakPolarHBondContact O-CD1 3.47Å; N127-L131 VanDerWaalsContact O-CG 3.22Å; N127-L131 WeakPolarHBondContact O-CG 3.17Å; N127-L131 PolarHBondContact O-N 3.2Å |
| 128 | M | 66.3 | Low | 65.3 | Low | 111 Ų | 111 | 60 Ų | 60 | 55% | 0.547 | 31% | 0.309 | S | S | . | . | H | α-helix | trans | -57.8 | -46.3 | 173.6 | -78.9 | 177.8 | 155.9 | 0 | 0 | 111.4 | S124 L125 L126 L131 V132 | S124-M128 WeakPolarHBondContact O-CB 3.4Å; S124-M128 WeakPolarHBondContact O-CG 3.43Å; S124-M128 PolarHBondContact O-N 3.43Å; L125-M128 PolarHBondContact O-N 3.14Å; L126-M128 VanDerWaalsContact C-N 3.33Å; L126-M128 PolarHBondContact O-N 2.71Å; M128-L131 PolarHBondContact O-N 2.8Å; M128-V132 WeakPolarHBondContact O-CB 3.38Å; M128-V132 VanDerWaalsContact O-CG2 3.23Å; M128-V132 WeakPolarHBondContact O-CG2 3.12Å; M128-V132 PolarHBondContact O-N 3.38Å |
| 129 | G | 67.2 | Low | 65.5 | Low | 12 Ų | 12 | 57.8 Ų | 57.8 | 12% | 0.124 | 30% | 0.301 | C | S | . | . | H | α-helix | trans | -65.6 | -41.6 | 177.3 | 0 | 0 | 0 | 0 | 0 | 113.3 | L125 L126 N127 L131 V132 S133 | L125-G129 PolarHBondContact O-N 3.32Å; L126-G129 PolarHBondContact O-N 3.27Å; N127-G129 VanDerWaalsContact C-N 3.33Å; N127-G129 PolarHBondContact O-N 2.74Å; G129-L131 PolarHBondContact O-N 3.18Å; G129-V132 PolarHBondContact O-N 3.5Å; G129-S133 WeakPolarHBondContact O-CB 3.47Å; G129-S133 PolarHBondContact O-N 2.76Å; G129-S133 PolarHBondContact O-OG 3Å |
| 130 | I | 65.1 | Low | 65.8 | Low | 46 Ų | 46 | 57.8 Ų | 57.8 | 24% | 0.236 | 30% | 0.301 | C | S | . | . | H | α-helix | trans | -62.3 | -33.3 | 174.7 | -68.3 | 166 | 0 | 0 | 0 | 111.1 | V6 L126 N127 P134 | V6-I130 HydrophobicContact CB-CG1 4.33Å; V6-I130 HydrophobicContact CG1-CD1 3.84Å; V6-I130 HydrophobicContact CG1-CG1 3.58Å; L126-I130 WeakPolarHBondContact O-CB 3.48Å; L126-I130 VanDerWaalsContact O-CG1 3.23Å; L126-I130 WeakPolarHBondContact O-CG1 3.1Å; L126-I130 PolarHBondContact O-N 2.93Å; N127-I130 PolarHBondContact O-N 3.44Å; I130-P134 WeakPolarHBondContact O-CD 3.13Å; I130-P134 WeakPolarHBondContact O-CG 3.48Å |
| 131 | L | 64.1 | Low | 66 | Low | 72 Ų | 72 | 49.6 Ų | 49.6 | 38% | 0.377 | 27% | 0.27 | S | S | . | . | H | α-helix | trans | -75 | -40.5 | 176 | -75.6 | 161.2 | 0 | 0 | 0 | 111.9 | N127 M128 G129 S133 P134 L135 F246 | N127-L131 WeakPolarHBondContact O-CB 2.94Å; N127-L131 WeakPolarHBondContact O-CD1 3.47Å; N127-L131 VanDerWaalsContact O-CG 3.22Å; N127-L131 WeakPolarHBondContact O-CG 3.17Å; N127-L131 PolarHBondContact O-N 3.2Å; M128-L131 PolarHBondContact O-N 2.8Å; G129-L131 PolarHBondContact O-N 3.18Å; L131-S133 VanDerWaalsContact C-N 3.32Å; L131-P134 WeakPolarHBondContact O-CD 3.21Å; L131-L135 WeakPolarHBondContact O-CD1 3.15Å; L131-F246 HydrophobicContact CD1-CD2 4.48Å |
| 132 | V | 67 | Low | 66 | Low | 73 Ų | 73 | 44 Ų | 44 | 44% | 0.442 | 25% | 0.245 | S | C | . | . | H | α-helix | trans | -72 | -28.1 | 179.5 | 172.3 | 0 | 0 | 0 | 0 | 111.8 | M128 G129 L135 L136 | M128-V132 WeakPolarHBondContact O-CB 3.38Å; M128-V132 VanDerWaalsContact O-CG2 3.23Å; M128-V132 WeakPolarHBondContact O-CG2 3.12Å; M128-V132 PolarHBondContact O-N 3.38Å; G129-V132 PolarHBondContact O-N 3.5Å; V132-L135 WeakPolarHBondContact O-CB 3.5Å; V132-L135 PolarHBondContact O-N 2.79Å; V132-L136 HydrophobicContact CG1-CD1 3.7Å; V132-L136 HydrophobicContact CG1-CG 4.01Å; V132-L136 PolarHBondContact O-N 2.6Å |
| 133 | S | 67.6 | Low | 66.3 | Low | 5 Ų | 5 | 48 Ų | 48 | 4% | 0.035 | 26% | 0.264 | C | S | . | . | H | α-helix | trans | -63.3 | -48.7 | -175.2 | -58.1 | 0 | 0 | 0 | 0 | 113.1 | A7 G129 L131 L135 L136 A137 | A7-S133 WeakPolarHBondContact CA-OG 2.83Å; A7-S133 WeakPolarHBondContact CB-OG 3.33Å; G129-S133 WeakPolarHBondContact O-CB 3.47Å; G129-S133 PolarHBondContact O-N 2.76Å; G129-S133 PolarHBondContact O-OG 3Å; L131-S133 VanDerWaalsContact C-N 3.32Å; S133-L135 PolarHBondContact O-N 3.37Å; S133-L136 PolarHBondContact O-N 3.29Å; S133-A137 VanDerWaalsContact O-CB 3.29Å; S133-A137 WeakPolarHBondContact O-CB 3Å; S133-A137 PolarHBondContact O-N 3.24Å |
| 134 | P | 63.6 | Low | 66.4 | Low | 29 Ų | 29 | 47 Ų | 47 | 19% | 0.188 | 26% | 0.258 | C | S | . | . | H | α-helix | trans | -63.8 | -19 | 170.3 | -22.8 | 32.5 | 0 | 0 | 0 | 114.9 | T14 I130 L131 P138 | T14-P134 HydrophobicContact CG2-CB 4.3Å; I130-P134 WeakPolarHBondContact O-CD 3.13Å; I130-P134 WeakPolarHBondContact O-CG 3.48Å; L131-P134 WeakPolarHBondContact O-CD 3.21Å; P134-P138 WeakPolarHBondContact O-CD 3.44Å; P134-P138 WeakPolarHBondContact O-CG 3.44Å |
| 135 | L | 66.9 | Low | 66.4 | Low | 54 Ų | 54 | 44.9 Ų | 44.9 | 28% | 0.283 | 24% | 0.243 | S | C | . | . | H | α-helix | trans | -75.9 | -44.3 | 171.4 | -84.7 | 88.8 | 0 | 0 | 0 | 110.8 | L131 V132 S133 I239 I242 | L131-L135 WeakPolarHBondContact O-CD1 3.15Å; V132-L135 WeakPolarHBondContact O-CB 3.5Å; V132-L135 PolarHBondContact O-N 2.79Å; S133-L135 PolarHBondContact O-N 3.37Å; L135-I239 HydrophobicContact CD2-CG1 4.39Å; L135-I239 HydrophobicContact CD2-CG2 4.06Å; L135-I239 HydrophobicContact CG-CG1 4.22Å; L135-I242 HydrophobicContact CD1-CB 4.4Å; L135-I242 HydrophobicContact CD1-CD1 3.38Å; L135-I242 HydrophobicContact CD1-CG1 4.45Å; L135-I242 HydrophobicContact CD1-CG2 3.91Å; L135-I242 HydrophobicContact CG-CD1 3.74Å |
| 136 | L | 68.2 | Low | 66.2 | Low | 73 Ų | 73 | 45.2 Ų | 45.2 | 38% | 0.382 | 25% | 0.248 | S | C | . | . | H | α-helix | trans | -74.3 | -30.8 | -178.7 | -70.8 | 176.1 | 0 | 0 | 0 | 111.9 | M11 V132 S133 L139 I140 | M11-L136 HydrophobicContact CE-CB 3.86Å; M11-L136 HydrophobicContact CE-CD1 4.24Å; V132-L136 HydrophobicContact CG1-CD1 3.7Å; V132-L136 HydrophobicContact CG1-CG 4.01Å; V132-L136 PolarHBondContact O-N 2.6Å; S133-L136 PolarHBondContact O-N 3.29Å; L136-L139 PolarHBondContact O-N 3.31Å; L136-I140 HydrophobicContact CB-CD1 4.15Å; L136-I140 VanDerWaalsContact O-CB 3.29Å; L136-I140 WeakPolarHBondContact O-CB 3.46Å; L136-I140 VanDerWaalsContact O-CG1 3.22Å; L136-I140 WeakPolarHBondContact O-CG1 3.05Å; L136-I140 PolarHBondContact O-N 3.27Å |
| 137 | A | 66.7 | Low | 66 | Low | 2 Ų | 2 | 51.4 Ų | 51.4 | 2% | 0.017 | 28% | 0.279 | C | S | . | . | H | α-helix | trans | -66.6 | -48.5 | -172 | 0 | 0 | 0 | 0 | 0 | 114.3 | M11 T14 S133 L139 G141 | M11-A137 HydrophobicContact CB-CB 3.96Å; M11-A137 HydrophobicContact CG-CB 3.76Å; T14-A137 WeakPolarHBondContact OG1-CB 3.46Å; S133-A137 VanDerWaalsContact O-CB 3.29Å; S133-A137 WeakPolarHBondContact O-CB 3Å; S133-A137 PolarHBondContact O-N 3.24Å; A137-L139 VanDerWaalsContact C-N 3.33Å; A137-G141 WeakPolarHBondContact O-CA 3.46Å; A137-G141 PolarHBondContact O-N 3.36Å |
| 138 | P | 65.5 | Low | 66 | Low | 4 Ų | 4 | 56.2 Ų | 56.2 | 3% | 0.026 | 29% | 0.29 | C | S | . | . | H | α-helix | trans | -65.4 | -39.2 | 173.3 | -21.5 | 35.5 | 0 | 0 | 0 | 111 | P134 I140 G141 G142 S235 F238 | P134-P138 WeakPolarHBondContact O-CD 3.44Å; P134-P138 WeakPolarHBondContact O-CG 3.44Å; P138-I140 PolarHBondContact O-N 2.9Å; P138-G141 CarbonylContact O-C 3.47Å; P138-G141 PolarHBondContact O-N 3.07Å; P138-G142 PolarHBondContact O-N 3.15Å; P138-S235 WeakPolarHBondContact CB-OG 3.42Å; P138-S235 PolarHBondContact O-OG 2.9Å; P138-F238 HydrophobicContact CG-CB 4.31Å |
| 139 | L | 67.9 | Low | 66 | Low | 80 Ų | 80 | 56 Ų | 56 | 42% | 0.419 | 29% | 0.291 | S | S | . | . | H | α-helix | trans | -61.2 | -48.1 | 180 | -170.7 | 144.2 | 0 | 0 | 0 | 111.7 | L136 A137 L143 | L136-L139 PolarHBondContact O-N 3.31Å; A137-L139 VanDerWaalsContact C-N 3.33Å; L139-L143 HydrophobicContact CD2-CD1 3.75Å; L139-L143 HydrophobicContact CG-CD1 4.47Å; L139-L143 WeakPolarHBondContact O-CB 3.42Å; L139-L143 WeakPolarHBondContact O-CD1 3.15Å; L139-L143 WeakPolarHBondContact O-CG 3.43Å; L139-L143 PolarHBondContact O-N 3.47Å |
| 140 | I | 69.8 | Low | 65.9 | Low | 42 Ų | 42 | 56.1 Ų | 56.1 | 22% | 0.215 | 29% | 0.288 | C | S | . | . | H | α-helix | trans | -67.5 | -41.3 | 174 | -67.5 | 169.4 | 0 | 0 | 0 | 110.3 | L136 P138 L143 L144 F156 | L136-I140 HydrophobicContact CB-CD1 4.15Å; L136-I140 VanDerWaalsContact O-CB 3.29Å; L136-I140 WeakPolarHBondContact O-CB 3.46Å; L136-I140 VanDerWaalsContact O-CG1 3.22Å; L136-I140 WeakPolarHBondContact O-CG1 3.05Å; L136-I140 PolarHBondContact O-N 3.27Å; P138-I140 PolarHBondContact O-N 2.9Å; I140-L143 PolarHBondContact O-N 2.87Å; I140-L144 HydrophobicContact CG2-CD1 3.47Å; I140-L144 VanDerWaalsContact CG2-CD1 3.47Å; I140-L144 HydrophobicContact CG2-CG 4.12Å; I140-L144 WeakPolarHBondContact O-CB 3.26Å; I140-L144 VanDerWaalsContact O-CG 3.3Å; I140-L144 WeakPolarHBondContact O-CG 3.15Å; I140-L144 PolarHBondContact O-N 3.02Å; I140-F156 HydrophobicContact CD1-CE1 4.49Å; I140-F156 HydrophobicContact CG2-CD1 4.2Å; I140-F156 HydrophobicContact CG2-CE1 3.93Å; I140-F156 HydrophobicContact CG2-CZ 4.49Å |
| 141 | G | 64.7 | Low | 66.1 | Low | 0 Ų | 0 | 59.2 Ų | 59.2 | 0% | 0 | 30% | 0.297 | C | S | . | . | H | α-helix | trans | -56.4 | -54.2 | 177.8 | 0 | 0 | 0 | 0 | 0 | 112.1 | A137 P138 L143 L144 D145 | A137-G141 WeakPolarHBondContact O-CA 3.46Å; A137-G141 PolarHBondContact O-N 3.36Å; P138-G141 CarbonylContact O-C 3.47Å; P138-G141 PolarHBondContact O-N 3.07Å; G141-L143 VanDerWaalsContact C-N 3.35Å; G141-L143 PolarHBondContact O-N 3.33Å; G141-L144 PolarHBondContact O-N 2.87Å; G141-D145 WeakPolarHBondContact O-CB 3.24Å; G141-D145 PolarHBondContact O-N 3.31Å |
| 142 | G | 64.3 | Low | 66.3 | Low | 4 Ų | 4 | 56.4 Ų | 56.4 | 4% | 0.041 | 28% | 0.284 | C | S | . | . | H | α-helix | trans | -67 | -32.3 | 178.5 | 0 | 0 | 0 | 0 | 0 | 114 | P138 T146 S231 | P138-G142 PolarHBondContact O-N 3.15Å; G142-T146 WeakPolarHBondContact O-CB 3.44Å; G142-T146 VanDerWaalsContact O-CG2 3.25Å; G142-T146 WeakPolarHBondContact O-CG2 3.33Å; G142-T146 PolarHBondContact O-N 3.4Å; G142-T146 PolarHBondContact O-OG1 2.92Å; G142-S231 WeakPolarHBondContact CA-OG 3.46Å |
| 143 | L | 69.2 | Low | 66.4 | Low | 99 Ų | 99 | 53 Ų | 53 | 52% | 0.518 | 26% | 0.263 | S | S | . | . | H | α-helix | trans | -68 | -42 | 172.9 | -83.7 | 161.1 | 0 | 0 | 0 | 112.2 | L139 I140 G141 T146 M147 | L139-L143 HydrophobicContact CD2-CD1 3.75Å; L139-L143 HydrophobicContact CG-CD1 4.47Å; L139-L143 WeakPolarHBondContact O-CB 3.42Å; L139-L143 WeakPolarHBondContact O-CD1 3.15Å; L139-L143 WeakPolarHBondContact O-CG 3.43Å; L139-L143 PolarHBondContact O-N 3.47Å; I140-L143 PolarHBondContact O-N 2.87Å; G141-L143 VanDerWaalsContact C-N 3.35Å; G141-L143 PolarHBondContact O-N 3.33Å; L143-T146 PolarHBondContact O-OG1 3.18Å; L143-M147 WeakPolarHBondContact O-CG 3.21Å |
| 144 | L | 66.9 | Low | 66.4 | Low | 32 Ų | 32 | 53 Ų | 53 | 17% | 0.168 | 26% | 0.262 | C | S | . | . | H | α-helix | trans | -71.8 | -39.7 | 178.7 | -75.3 | 170.1 | 0 | 0 | 0 | 111.9 | I140 G141 M147 W148 A152 C153 F156 | I140-L144 HydrophobicContact CG2-CD1 3.47Å; I140-L144 VanDerWaalsContact CG2-CD1 3.47Å; I140-L144 HydrophobicContact CG2-CG 4.12Å; I140-L144 WeakPolarHBondContact O-CB 3.26Å; I140-L144 VanDerWaalsContact O-CG 3.3Å; I140-L144 WeakPolarHBondContact O-CG 3.15Å; I140-L144 PolarHBondContact O-N 3.02Å; G141-L144 PolarHBondContact O-N 2.87Å; L144-M147 PolarHBondContact O-N 2.78Å; L144-W148 PolarHBondContact O-N 2.7Å; L144-A152 HydrophobicContact CD2-CB 4.41Å; L144-C153 VanDerWaalsContact CB-SG 3.59Å; L144-F156 HydrophobicContact CD1-CB 3.91Å; L144-F156 HydrophobicContact CD1-CD1 4.14Å; L144-F156 HydrophobicContact CD1-CG 4.02Å |
| 145 | D | 63.6 | Low | 66.9 | Low | 14 Ų | 14 | 55.8 Ų | 55.8 | 8% | 0.075 | 28% | 0.275 | C | S | . | . | H | α-helix | trans | -63 | -42.9 | -179.9 | -159.8 | 42.4 | 0 | 0 | 0 | 111.1 | G141 M147 N149 W150 | G141-D145 WeakPolarHBondContact O-CB 3.24Å; G141-D145 PolarHBondContact O-N 3.31Å; D145-M147 VanDerWaalsContact C-N 3.31Å; D145-M147 PolarHBondContact O-N 3.21Å; D145-N149 PolarHBondContact O-N 2.81Å; D145-W150 PolarHBondContact OD1-N 3.3Å |
| 146 | T | 64.5 | Low | 67.3 | Low | 91 Ų | 91 | 56.9 Ų | 56.9 | 56% | 0.558 | 28% | 0.278 | S | S | * | . | H | α-helix | trans | -67.9 | -24.6 | 177.8 | 49.9 | 0 | 0 | 0 | 0 | 114.6 | G142 L143 | G142-T146 WeakPolarHBondContact O-CB 3.44Å; G142-T146 VanDerWaalsContact O-CG2 3.25Å; G142-T146 WeakPolarHBondContact O-CG2 3.33Å; G142-T146 PolarHBondContact O-N 3.4Å; G142-T146 PolarHBondContact O-OG1 2.92Å; L143-T146 PolarHBondContact O-OG1 3.18Å |
| 147 | M | 63.5 | Low | 67.4 | Low | 143 Ų | 143 | 53.5 Ų | 53.5 | 70% | 0.704 | 26% | 0.26 | S | S | * | . | H | α-helix | trans | -101.3 | -38.5 | -175.3 | -67.7 | -71.4 | 111 | 0 | 0 | 113.6 | L143 L144 D145 | L143-M147 WeakPolarHBondContact O-CG 3.21Å; L144-M147 PolarHBondContact O-N 2.78Å; D145-M147 VanDerWaalsContact C-N 3.31Å; D145-M147 PolarHBondContact O-N 3.21Å |
| 148 | W | 63 | Low | 67.8 | Low | 195 Ų | 195 | 55.1 Ų | 55.1 | 74% | 0.739 | 27% | 0.268 | S | S | * | . | H | α-helix | trans | -137.6 | 17 | -169.4 | -81.8 | -26.8 | 0 | 0 | 0 | 115.8 | L144 A152 | L144-W148 PolarHBondContact O-N 2.7Å; W148-A152 HydrophobicContact CB-CB 3.5Å; W148-A152 VanDerWaalsContact CB-CB 3.5Å |
| 149 | N | 66.1 | Low | 68.4 | Low | 107 Ų | 107 | 59.5 Ų | 59.5 | 57% | 0.572 | 30% | 0.295 | S | S | * | . | trans | 63 | 163.6 | -175.3 | -57.1 | -71.5 | 0 | 0 | 0 | 113.5 | D145 R151 A152 | D145-N149 PolarHBondContact O-N 2.81Å; N149-R151 PolarHBondContact O-N 3.5Å; N149-A152 WeakPolarHBondContact O-CB 3.35Å; N149-A152 PolarHBondContact O-N 2.87Å | ||
| 150 | W | 66.1 | Low | 68.7 | Low | 14 Ų | 14 | 58 Ų | 58 | 5% | 0.053 | 29% | 0.287 | C | S | . | . | H | α-helix | trans | -44.1 | -26.9 | -179.3 | 66.2 | -92.4 | 0 | 0 | 0 | 116.6 | A19 M23 D26 D145 A152 C153 Y154 | A19-W150 HydrophobicContact CB-CB 3.9Å; M23-W150 HydrophobicContact CG-CB 4.36Å; M23-W150 HydrophobicContact CG-CD2 3.85Å; M23-W150 HydrophobicContact CG-CE3 3.98Å; M23-W150 HydrophobicContact CG-CG 4.04Å; M23-W150 HydrophobicContact SD-CE3 4.15Å; M23-W150 HydrophobicContact SD-CZ3 4.48Å; D26-W150 PolarHBondContact OD2-NE1 3.21Å; D145-W150 PolarHBondContact OD1-N 3.3Å; W150-A152 VanDerWaalsContact C-N 3.32Å; W150-A152 PolarHBondContact O-N 2.8Å; W150-C153 WeakPolarHBondContact O-CB 3.33Å; W150-C153 PolarHBondContact O-N 2.98Å; W150-Y154 AromaticContact CE3-CD2 3.78Å; W150-Y154 HydrophobicContact CE3-CD2 3.78Å; W150-Y154 AromaticContact CE3-CE2 3.68Å; W150-Y154 HydrophobicContact CE3-CE2 3.68Å; W150-Y154 HydrophobicContact CZ3-CD2 4.03Å; W150-Y154 AromaticContact CZ3-CE2 3.89Å; W150-Y154 HydrophobicContact CZ3-CE2 3.89Å; W150-Y154 WeakPolarHBondContact O-CD2 3.07Å |
| 151 | R | 68.7 | Low | 68.8 | Low | 111 Ų | 111 | 56.2 Ų | 56.2 | 42% | 0.419 | 28% | 0.278 | S | S | . | . | H | α-helix | trans | -68.1 | -29.2 | 178.3 | -62.6 | 176.2 | 84.5 | 166.9 | 1.7 | 112.8 | V80 N149 C153 Y154 L155 | V80-R151 HydrophobicContact CG1-CB 4.44Å; V80-R151 PolarHBondContact O-NE 3.44Å; V80-R151 PolarHBondContact O-NH2 2.96Å; N149-R151 PolarHBondContact O-N 3.5Å; R151-C153 VanDerWaalsContact C-N 3.33Å; R151-C153 PolarHBondContact O-N 3.4Å; R151-Y154 PolarHBondContact O-N 2.8Å; R151-L155 PolarHBondContact O-N 2.88Å |
| 152 | A | 69.2 | Low | 69.4 | Low | 12 Ų | 12 | 57.9 Ų | 57.9 | 10% | 0.099 | 29% | 0.292 | C | S | . | . | H | α-helix | trans | -66.4 | -35.3 | 177.1 | 0 | 0 | 0 | 0 | 0 | 112.3 | L144 W148 N149 W150 Y154 L155 F156 | L144-A152 HydrophobicContact CD2-CB 4.41Å; W148-A152 HydrophobicContact CB-CB 3.5Å; W148-A152 VanDerWaalsContact CB-CB 3.5Å; N149-A152 WeakPolarHBondContact O-CB 3.35Å; N149-A152 PolarHBondContact O-N 2.87Å; W150-A152 VanDerWaalsContact C-N 3.32Å; W150-A152 PolarHBondContact O-N 2.8Å; A152-Y154 VanDerWaalsContact C-N 3.35Å; A152-Y154 PolarHBondContact O-N 3.5Å; A152-L155 PolarHBondContact O-N 2.75Å; A152-F156 WeakPolarHBondContact O-CB 3.38Å; A152-F156 PolarHBondContact O-N 2.97Å |
| 153 | C | 68.3 | Low | 70 | Confident | 3 Ų | 3 | 59.5 Ų | 59.5 | 2% | 0.02 | 31% | 0.309 | C | S | . | . | H | α-helix | trans | -58.6 | -47.6 | 174 | -65.8 | 0 | 0 | 0 | 0 | 111.1 | I15 L144 W150 R151 F156 L157 | I15-C153 HydrophobicContact CD1-CB 3.68Å; I15-C153 HydrophobicContact CG1-CB 3.97Å; L144-C153 VanDerWaalsContact CB-SG 3.59Å; W150-C153 WeakPolarHBondContact O-CB 3.33Å; W150-C153 PolarHBondContact O-N 2.98Å; R151-C153 VanDerWaalsContact C-N 3.33Å; R151-C153 PolarHBondContact O-N 3.4Å; C153-F156 PolarHBondContact O-N 3.39Å; C153-L157 VanDerWaalsContact O-CD1 3.24Å; C153-L157 WeakPolarHBondContact O-CD1 3.46Å; C153-L157 WeakPolarHBondContact O-CG 3.35Å; C153-L157 PolarHBondContact O-N 3.5Å |
| 154 | Y | 68.9 | Low | 70.1 | Confident | 3 Ų | 3 | 55 Ų | 55 | 1% | 0.012 | 29% | 0.286 | C | S | . | . | H | α-helix | trans | -66.1 | -41.8 | 176.9 | -77.1 | -77.5 | 0 | 0 | 0 | 112.8 | Y16 M23 T76 A79 V80 W150 R151 A152 F156 L157 L158 | Y16-Y154 HydrophobicContact CD1-CE1 4.17Å; Y16-Y154 AromaticContact CD1-CZ 3.79Å; Y16-Y154 VanDerWaalsContact CD1-OH 3.32Å; Y16-Y154 WeakPolarHBondContact CD1-OH 3.36Å; Y16-Y154 HydrophobicContact CE1-CD1 4.24Å; Y16-Y154 AromaticContact CE1-CE1 3.31Å; Y16-Y154 HydrophobicContact CE1-CE1 3.31Å; Y16-Y154 HydrophobicContact CE1-CE2 4.42Å; Y16-Y154 AromaticContact CE1-CZ 3.4Å; Y16-Y154 VanDerWaalsContact CE1-CZ 3.4Å; Y16-Y154 WeakPolarHBondContact CE1-OH 3.43Å; M23-Y154 HydrophobicContact CE-CE2 3.88Å; M23-Y154 HydrophobicContact SD-CE2 4.25Å; T76-Y154 HydrophobicContact CG2-CD1 3.99Å; T76-Y154 HydrophobicContact CG2-CG 4.46Å; T76-Y154 WeakPolarHBondContact CG2-O 3.12Å; A79-Y154 HydrophobicContact CB-CD1 4.14Å; A79-Y154 HydrophobicContact CB-CE1 3.83Å; V80-Y154 HydrophobicContact CG2-CG 4.23Å; W150-Y154 AromaticContact CE3-CD2 3.78Å; W150-Y154 HydrophobicContact CE3-CD2 3.78Å; W150-Y154 AromaticContact CE3-CE2 3.68Å; W150-Y154 HydrophobicContact CE3-CE2 3.68Å; W150-Y154 HydrophobicContact CZ3-CD2 4.03Å; W150-Y154 AromaticContact CZ3-CE2 3.89Å; W150-Y154 HydrophobicContact CZ3-CE2 3.89Å; W150-Y154 WeakPolarHBondContact O-CD2 3.07Å; R151-Y154 PolarHBondContact O-N 2.8Å; A152-Y154 VanDerWaalsContact C-N 3.35Å; A152-Y154 PolarHBondContact O-N 3.5Å; Y154-F156 VanDerWaalsContact C-N 3.33Å; Y154-F156 PolarHBondContact O-N 2.88Å; Y154-L157 PolarHBondContact O-N 3.49Å; Y154-L158 WeakPolarHBondContact O-CB 3.22Å; Y154-L158 PolarHBondContact O-N 3.27Å |
| 155 | L | 73.5 | Confident | 70.3 | Confident | 88 Ų | 88 | 54.3 Ų | 54.3 | 46% | 0.461 | 28% | 0.282 | S | S | . | . | H | α-helix | trans | -62.4 | -41.1 | 175.2 | -86.5 | 167.8 | 0 | 0 | 0 | 112.1 | R151 A152 L158 V159 | R151-L155 PolarHBondContact O-N 2.88Å; A152-L155 PolarHBondContact O-N 2.75Å; L155-L158 WeakPolarHBondContact O-CB 3.16Å; L155-L158 PolarHBondContact O-N 2.76Å; L155-V159 WeakPolarHBondContact O-CG2 3.28Å; L155-V159 PolarHBondContact O-N 3.13Å |
| 156 | F | 74.6 | Confident | 70.9 | Confident | 77 Ų | 77 | 59.8 Ų | 59.8 | 34% | 0.338 | 31% | 0.306 | S | S | . | . | H | α-helix | trans | -61.7 | -44.3 | 176 | -179.8 | -105.2 | 0 | 0 | 0 | 111.7 | I140 L144 A152 C153 Y154 L158 V159 L160 | I140-F156 HydrophobicContact CD1-CE1 4.49Å; I140-F156 HydrophobicContact CG2-CD1 4.2Å; I140-F156 HydrophobicContact CG2-CE1 3.93Å; I140-F156 HydrophobicContact CG2-CZ 4.49Å; L144-F156 HydrophobicContact CD1-CB 3.91Å; L144-F156 HydrophobicContact CD1-CD1 4.14Å; L144-F156 HydrophobicContact CD1-CG 4.02Å; A152-F156 WeakPolarHBondContact O-CB 3.38Å; A152-F156 PolarHBondContact O-N 2.97Å; C153-F156 PolarHBondContact O-N 3.39Å; Y154-F156 VanDerWaalsContact C-N 3.33Å; Y154-F156 PolarHBondContact O-N 2.88Å; F156-L158 VanDerWaalsContact C-N 3.33Å; F156-L158 PolarHBondContact O-N 3.23Å; F156-V159 PolarHBondContact O-N 3.25Å; F156-L160 HydrophobicContact CD1-CD1 3.83Å; F156-L160 HydrophobicContact CD1-CG 4.48Å; F156-L160 HydrophobicContact CE1-CD1 3.24Å; F156-L160 HydrophobicContact CE1-CG 4.09Å; F156-L160 HydrophobicContact CE2-CD1 4.33Å; F156-L160 HydrophobicContact CE2-CG 4.38Å; F156-L160 HydrophobicContact CZ-CD1 3.54Å; F156-L160 HydrophobicContact CZ-CG 4.04Å; F156-L160 WeakPolarHBondContact O-CB 3.43Å; F156-L160 PolarHBondContact O-N 3.29Å |
| 157 | L | 70.7 | Confident | 71.2 | Confident | 2 Ų | 2 | 56.9 Ų | 56.9 | 1% | 0.01 | 29% | 0.289 | C | S | . | . | H | α-helix | trans | -61.8 | -40 | 173.6 | -74.5 | 150.3 | 0 | 0 | 0 | 112.2 | V8 M11 A12 I15 F72 C153 Y154 C161 | V8-L157 HydrophobicContact CG1-CD2 4.21Å; M11-L157 HydrophobicContact CB-CD2 4.34Å; A12-L157 HydrophobicContact CB-CD2 3.99Å; I15-L157 HydrophobicContact CD1-CD1 4.34Å; I15-L157 HydrophobicContact CG2-CD1 3.49Å; I15-L157 VanDerWaalsContact CG2-CD1 3.49Å; F72-L157 HydrophobicContact CE1-CB 4.47Å; F72-L157 HydrophobicContact CZ-CB 4.45Å; C153-L157 VanDerWaalsContact O-CD1 3.24Å; C153-L157 WeakPolarHBondContact O-CD1 3.46Å; C153-L157 WeakPolarHBondContact O-CG 3.35Å; C153-L157 PolarHBondContact O-N 3.5Å; Y154-L157 PolarHBondContact O-N 3.49Å; L157-C161 WeakPolarHBondContact O-CB 3.46Å; L157-C161 PolarHBondContact O-N 3Å |
| 158 | L | 74.3 | Confident | 71.4 | Confident | 36 Ų | 36 | 50.7 Ų | 50.7 | 19% | 0.188 | 26% | 0.259 | C | S | . | . | H | α-helix | trans | -63.1 | -46.9 | 176.8 | -169.1 | 155 | 0 | 0 | 0 | 110.5 | T76 L77 Y154 L155 F156 C161 A162 | T76-L158 HydrophobicContact CG2-CB 3.85Å; T76-L158 HydrophobicContact CG2-CD1 4.15Å; T76-L158 HydrophobicContact CG2-CG 4.46Å; L77-L158 HydrophobicContact CB-CD1 4.24Å; L77-L158 HydrophobicContact CD1-CD1 4.24Å; Y154-L158 WeakPolarHBondContact O-CB 3.22Å; Y154-L158 PolarHBondContact O-N 3.27Å; L155-L158 WeakPolarHBondContact O-CB 3.16Å; L155-L158 PolarHBondContact O-N 2.76Å; F156-L158 VanDerWaalsContact C-N 3.33Å; F156-L158 PolarHBondContact O-N 3.23Å; L158-C161 PolarHBondContact O-N 3.45Å; L158-A162 VanDerWaalsContact O-CB 3.25Å; L158-A162 WeakPolarHBondContact O-CB 3.27Å; L158-A162 PolarHBondContact O-N 3.45Å |
| 159 | V | 79.1 | Confident | 71.6 | Confident | 96 Ų | 96 | 42.9 Ų | 42.9 | 58% | 0.582 | 24% | 0.236 | S | C | * | . | H | α-helix | trans | -64.4 | -44.4 | 179 | 172.5 | 0 | 0 | 0 | 0 | 111.1 | L155 F156 A162 G163 | L155-V159 WeakPolarHBondContact O-CG2 3.28Å; L155-V159 PolarHBondContact O-N 3.13Å; F156-V159 PolarHBondContact O-N 3.25Å; V159-A162 PolarHBondContact O-N 3.07Å; V159-G163 PolarHBondContact O-N 3.16Å |
| 160 | L | 74 | Confident | 71.6 | Confident | 48 Ų | 48 | 47 Ų | 47 | 25% | 0.251 | 24% | 0.244 | S | C | . | . | H | α-helix | trans | -61.6 | -46.8 | 174.5 | -81.4 | 179.9 | 0 | 0 | 0 | 111.5 | V8 F156 A162 G163 V164 | V8-L160 HydrophobicContact CG2-CB 4.06Å; V8-L160 HydrophobicContact CG2-CD1 4.4Å; F156-L160 HydrophobicContact CD1-CD1 3.83Å; F156-L160 HydrophobicContact CD1-CG 4.48Å; F156-L160 HydrophobicContact CE1-CD1 3.24Å; F156-L160 HydrophobicContact CE1-CG 4.09Å; F156-L160 HydrophobicContact CE2-CD1 4.33Å; F156-L160 HydrophobicContact CE2-CG 4.38Å; F156-L160 HydrophobicContact CZ-CD1 3.54Å; F156-L160 HydrophobicContact CZ-CG 4.04Å; F156-L160 WeakPolarHBondContact O-CB 3.43Å; F156-L160 PolarHBondContact O-N 3.29Å; L160-A162 PolarHBondContact O-N 3.3Å; L160-G163 PolarHBondContact O-N 3.28Å; L160-V164 VanDerWaalsContact O-CG2 3.28Å; L160-V164 WeakPolarHBondContact O-CG2 3.46Å; L160-V164 PolarHBondContact O-N 3.15Å |
| 161 | C | 71.7 | Confident | 71.4 | Confident | 5 Ų | 5 | 55.2 Ų | 55.2 | 3% | 0.034 | 27% | 0.274 | C | S | . | . | H | α-helix | trans | -62.4 | -44 | 178.6 | -170.5 | 0 | 0 | 0 | 0 | 110.9 | V8 F72 M73 L157 L158 G163 V164 T165 | V8-C161 HydrophobicContact CG1-CB 4.44Å; F72-C161 HydrophobicContact CD1-CB 3.79Å; F72-C161 WeakPolarHBondContact CD1-SG 3.28Å; F72-C161 HydrophobicContact CE1-CB 3.85Å; M73-C161 HydrophobicContact CG-CB 4.4Å; L157-C161 WeakPolarHBondContact O-CB 3.46Å; L157-C161 PolarHBondContact O-N 3Å; L158-C161 PolarHBondContact O-N 3.45Å; C161-G163 PolarHBondContact O-N 2.92Å; C161-V164 PolarHBondContact O-N 2.97Å; C161-T165 VanDerWaalsContact O-CB 3.28Å; C161-T165 WeakPolarHBondContact O-CB 3.16Å; C161-T165 PolarHBondContact O-N 3.42Å; C161-T165 PolarHBondContact O-OG1 3.4Å |
| 162 | A | 76.8 | Confident | 70.8 | Confident | 35 Ų | 35 | 51.2 Ų | 51.2 | 29% | 0.289 | 26% | 0.261 | S | S | . | . | H | α-helix | trans | -60.9 | -44 | 176.2 | 0 | 0 | 0 | 0 | 0 | 111.6 | M73 L158 V159 L160 T165 F166 | M73-A162 HydrophobicContact SD-CB 3.93Å; L158-A162 VanDerWaalsContact O-CB 3.25Å; L158-A162 WeakPolarHBondContact O-CB 3.27Å; L158-A162 PolarHBondContact O-N 3.45Å; V159-A162 PolarHBondContact O-N 3.07Å; L160-A162 PolarHBondContact O-N 3.3Å; A162-T165 PolarHBondContact O-N 3.46Å; A162-F166 VanDerWaalsContact O-CB 3.28Å; A162-F166 WeakPolarHBondContact O-CB 3.36Å; A162-F166 PolarHBondContact O-N 3.36Å |
| 163 | G | 78.5 | Confident | 70.1 | Confident | 38 Ų | 38 | 55.2 Ų | 55.2 | 39% | 0.392 | 29% | 0.286 | S | S | . | . | H | α-helix | trans | -63.4 | -41 | 176.6 | 0 | 0 | 0 | 0 | 0 | 113.2 | V159 L160 C161 S167 | V159-G163 PolarHBondContact O-N 3.16Å; L160-G163 PolarHBondContact O-N 3.28Å; C161-G163 PolarHBondContact O-N 2.92Å; G163-S167 WeakPolarHBondContact O-CB 3.28Å; G163-S167 PolarHBondContact O-N 2.97Å; G163-S167 PolarHBondContact O-OG 3.47Å |
| 164 | V | 71.2 | Confident | 69.4 | Low | 6 Ų | 6 | 59.8 Ų | 59.8 | 4% | 0.036 | 31% | 0.307 | C | S | . | . | H | α-helix | trans | -69.4 | -42.3 | 175.5 | 176.7 | 0 | 0 | 0 | 0 | 110.8 | L4 L5 M69 L160 C161 F166 S167 M168 | L4-V164 HydrophobicContact CB-CG2 4.12Å; L4-V164 HydrophobicContact CD2-CG2 3.88Å; L5-V164 HydrophobicContact CB-CG1 4.16Å; L5-V164 HydrophobicContact CD1-CG1 4.32Å; M69-V164 HydrophobicContact CE-CG1 3.78Å; L160-V164 VanDerWaalsContact O-CG2 3.28Å; L160-V164 WeakPolarHBondContact O-CG2 3.46Å; L160-V164 PolarHBondContact O-N 3.15Å; C161-V164 PolarHBondContact O-N 2.97Å; V164-F166 VanDerWaalsContact C-N 3.35Å; V164-F166 PolarHBondContact O-N 3.15Å; V164-S167 PolarHBondContact O-N 2.86Å; V164-M168 HydrophobicContact CG1-CG 4.26Å; V164-M168 HydrophobicContact CG1-SD 4.38Å; V164-M168 WeakPolarHBondContact O-CB 3.32Å; V164-M168 WeakPolarHBondContact O-CG 3.37Å; V164-M168 PolarHBondContact O-N 3.26Å |
| 165 | T | 70.4 | Confident | 68.7 | Low | 16 Ų | 16 | 61.8 Ų | 61.8 | 10% | 0.098 | 32% | 0.32 | C | S | . | . | H | α-helix | trans | -59.9 | -46.8 | 176.8 | -54.6 | 0 | 0 | 0 | 0 | 110.5 | L66 M69 M73 C161 A162 M168 A169 | L66-T165 HydrophobicContact CD2-CG2 3.87Å; M69-T165 HydrophobicContact CB-CG2 4.03Å; M69-T165 WeakPolarHBondContact CB-OG1 3.29Å; M69-T165 VanDerWaalsContact SD-CA 3.57Å; M69-T165 HydrophobicContact SD-CG2 3.76Å; M69-T165 PolarHBondContact SD-OG1 2.88Å; M73-T165 HydrophobicContact CE-CG2 4.27Å; C161-T165 VanDerWaalsContact O-CB 3.28Å; C161-T165 WeakPolarHBondContact O-CB 3.16Å; C161-T165 PolarHBondContact O-N 3.42Å; C161-T165 PolarHBondContact O-OG1 3.4Å; A162-T165 PolarHBondContact O-N 3.46Å; T165-M168 PolarHBondContact O-N 2.96Å; T165-A169 VanDerWaalsContact O-CB 3.26Å; T165-A169 WeakPolarHBondContact O-CB 3.4Å; T165-A169 PolarHBondContact O-N 2.95Å |
| 166 | F | 76.2 | Confident | 67.4 | Low | 130 Ų | 130 | 64.9 Ų | 64.9 | 57% | 0.57 | 33% | 0.325 | S | S | * | . | H | α-helix | trans | -64.2 | -43 | 178.1 | -171 | -98.8 | 0 | 0 | 0 | 111.9 | A162 V164 A169 R170 | A162-F166 VanDerWaalsContact O-CB 3.28Å; A162-F166 WeakPolarHBondContact O-CB 3.36Å; A162-F166 PolarHBondContact O-N 3.36Å; V164-F166 VanDerWaalsContact C-N 3.35Å; V164-F166 PolarHBondContact O-N 3.15Å; F166-A169 PolarHBondContact O-N 3.41Å; F166-R170 PolarHBondContact O-N 3.04Å; F166-R170 VanDerWaalsContact O-N 3.17Å |
| 167 | S | 70.3 | Confident | 66.2 | Low | 29 Ų | 29 | 64.5 Ų | 64.5 | 20% | 0.203 | 33% | 0.33 | C | S | . | . | H | α-helix | trans | -64.2 | -42.4 | 175.2 | -73.9 | 0 | 0 | 0 | 0 | 112.4 | G163 V164 R170 W171 | G163-S167 WeakPolarHBondContact O-CB 3.28Å; G163-S167 PolarHBondContact O-N 2.97Å; G163-S167 PolarHBondContact O-OG 3.47Å; V164-S167 PolarHBondContact O-N 2.86Å; S167-R170 PolarHBondContact O-N 2.96Å; S167-W171 WeakPolarHBondContact O-CB 3.32Å; S167-W171 PolarHBondContact O-N 2.99Å |
| 168 | M | 67.3 | Low | 65.2 | Low | 13 Ų | 13 | 70.6 Ų | 70.6 | 6% | 0.064 | 37% | 0.368 | C | S | . | . | H | α-helix | trans | -68.9 | -38.1 | 177.7 | -74 | -159.9 | 118.7 | 0 | 0 | 112 | L2 L5 I65 M69 V164 T165 R170 M172 | L2-M168 HydrophobicContact CD2-CE 3.61Å; L2-M168 HydrophobicContact CG-CE 4.35Å; L5-M168 HydrophobicContact CD2-CE 4.34Å; L5-M168 HydrophobicContact CD2-SD 3.9Å; I65-M168 HydrophobicContact CG2-SD 3.89Å; M69-M168 HydrophobicContact CE-CG 4.35Å; M69-M168 HydrophobicContact CE-SD 3.55Å; M69-M168 VanDerWaalsContact CE-SD 3.55Å; V164-M168 HydrophobicContact CG1-CG 4.26Å; V164-M168 HydrophobicContact CG1-SD 4.38Å; V164-M168 WeakPolarHBondContact O-CB 3.32Å; V164-M168 WeakPolarHBondContact O-CG 3.37Å; V164-M168 PolarHBondContact O-N 3.26Å; T165-M168 PolarHBondContact O-N 2.96Å; M168-R170 PolarHBondContact O-N 3.36Å; M168-M172 HydrophobicContact CE-SD 4.03Å; M168-M172 WeakPolarHBondContact O-CB 3.34Å; M168-M172 PolarHBondContact O-N 2.8Å; M168-M172 VanDerWaalsContact O-N 3.13Å |
| 169 | A | 66.9 | Low | 63.9 | Low | 32 Ų | 32 | 75.8 Ų | 75.8 | 26% | 0.264 | 40% | 0.396 | S | S | . | . | H | α-helix | trans | -59.9 | -35 | 175 | 0 | 0 | 0 | 0 | 0 | 111.8 | R62 L66 T165 F166 | R62-A169 PolarHBondContact NH2-O 3.46Å; L66-A169 HydrophobicContact CD2-CB 4Å; T165-A169 VanDerWaalsContact O-CB 3.26Å; T165-A169 WeakPolarHBondContact O-CB 3.4Å; T165-A169 PolarHBondContact O-N 2.95Å; F166-A169 PolarHBondContact O-N 3.41Å |
| 170 | R | 67.8 | Low | 62.5 | Low | 194 Ų | 194 | 73.4 Ų | 73.4 | 73% | 0.732 | 39% | 0.386 | S | S | * | . | H | α-helix | trans | -84.2 | -38.3 | 178.9 | -96.5 | -164.6 | 170.6 | 158.4 | 0.2 | 115.1 | F166 S167 M168 | F166-R170 PolarHBondContact O-N 3.04Å; F166-R170 VanDerWaalsContact O-N 3.17Å; S167-R170 PolarHBondContact O-N 2.96Å; M168-R170 PolarHBondContact O-N 3.36Å |
| 171 | W | 61.7 | Low | 61.3 | Low | 185 Ų | 185 | 75.9 Ų | 75.9 | 70% | 0.701 | 41% | 0.405 | S | S | * | . | H | α-helix | trans | -105.6 | -6.2 | -168.6 | -80.5 | -45.1 | 0 | 0 | 0 | 116 | M1 S167 P173 | M1-W171 HydrophobicContact CE-CE3 4.03Å; M1-W171 HydrophobicContact CE-CZ3 3.62Å; S167-W171 WeakPolarHBondContact O-CB 3.32Å; S167-W171 PolarHBondContact O-N 2.99Å; W171-P173 WeakPolarHBondContact O-CD 3.33Å |
| 172 | M | 55.9 | Low | 60.3 | Low | 27 Ų | 27 | 86.9 Ų | 86.9 | 13% | 0.133 | 45% | 0.446 | C | S | . | . | trans | -94.1 | 102.7 | -176.3 | -158 | 170.2 | -176.5 | 0 | 0 | 111.6 | I65 L109 M168 | I65-M172 HydrophobicContact CD1-CE 3.9Å; I65-M172 HydrophobicContact CD1-SD 3.81Å; L109-M172 HydrophobicContact CD1-CE 3.43Å; L109-M172 VanDerWaalsContact CD1-CE 3.43Å; L109-M172 HydrophobicContact CD2-CE 3.35Å; L109-M172 HydrophobicContact CG-CE 4.06Å; M168-M172 HydrophobicContact CE-SD 4.03Å; M168-M172 WeakPolarHBondContact O-CB 3.34Å; M168-M172 PolarHBondContact O-N 2.8Å; M168-M172 VanDerWaalsContact O-N 3.13Å | ||
| 173 | P | 53.4 | Low | 59.1 | Low | 96 Ų | 96 | 89 Ų | 89 | 62% | 0.623 | 46% | 0.455 | S | S | * | . | trans | -64 | 145.9 | 166.2 | 26 | -32.1 | 0 | 0 | 0 | 109.8 | W171 T175 | W171-P173 WeakPolarHBondContact O-CD 3.33Å; P173-T175 PolarHBondContact O-N 3.1Å | ||
| 174 | E | 54.7 | Low | 58 | Low | 99 Ų | 99 | 97 Ų | 97 | 46% | 0.463 | 47% | 0.473 | S | S | . | . | trans | -64.6 | 88.9 | -178 | -153.8 | 87.3 | -147.1 | 0 | 0 | 110.1 | R62 P63 R176 | R62-E174 WeakPolarHBondContact CD-OE2 3.49Å; R62-E174 IonicContact NH1-OE2 2.89Å; P63-E174 WeakPolarHBondContact CD-OE1 3.1Å; E174-R176 PolarHBondContact O-N 3.21Å | ||
| 175 | T | 53.7 | Low | 57.5 | Low | 46 Ų | 46 | 98.2 Ų | 98.2 | 28% | 0.282 | 48% | 0.48 | S | S | . | . | trans | -80.1 | 65.5 | 175.6 | 42.4 | 0 | 0 | 0 | 0 | 110.3 | L113 P173 P177 | L113-T175 HydrophobicContact CD1-CG2 4.36Å; P173-T175 PolarHBondContact O-N 3.1Å; T175-P177 WeakPolarHBondContact O-CD 3.36Å | ||
| 176 | R | 46.7 | Very low | 57.1 | Low | 152 Ų | 152 | 104.3 Ų | 104.3 | 57% | 0.574 | 51% | 0.511 | S | S | * | . | trans | -90.3 | 111.9 | 168.4 | -172.7 | 177.6 | -179.4 | -178.4 | 0.7 | 108.3 | E174 V178 | E174-R176 PolarHBondContact O-N 3.21Å; R176-V178 PolarHBondContact O-N 2.85Å | ||
| 177 | P | 49.4 | Very low | 56.5 | Low | 69 Ų | 69 | 101.7 Ų | 101.7 | 45% | 0.448 | 51% | 0.506 | S | S | . | . | trans | -62.8 | 120.3 | 159.3 | -12.4 | 27.4 | 0 | 0 | 0 | 107.1 | T175 D179 | T175-P177 WeakPolarHBondContact O-CD 3.36Å; P177-D179 PolarHBondContact O-N 3.47Å; P177-D179 VanDerWaalsContact O-N 3.11Å | ||
| 178 | V | 49.3 | Very low | 56.2 | Low | 131 Ų | 131 | 101.3 Ų | 101.3 | 79% | 0.794 | 50% | 0.503 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -63.2 | -16.7 | -177.8 | 178.8 | 0 | 0 | 0 | 0 | 111.6 | R176 | R176-V178 PolarHBondContact O-N 2.85Š|
| 179 | D | 46.9 | Very low | 56.2 | Low | 145 Ų | 145 | 102.5 Ų | 102.5 | 78% | 0.775 | 51% | 0.507 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -113.4 | 33.3 | -173.4 | -64.9 | -51.6 | 0 | 0 | 0 | 115.1 | P177 P181 | P177-D179 PolarHBondContact O-N 3.47Å; P177-D179 VanDerWaalsContact O-N 3.11Å; D179-P181 WeakPolarHBondContact O-CD 3.28Å |
| 180 | A | 49.5 | Very low | 56.3 | Low | 45 Ų | 45 | 109.2 Ų | 109.2 | 37% | 0.372 | 53% | 0.53 | S | S | . | . | trans | -62.8 | 111.2 | 176.1 | 0 | 0 | 0 | 0 | 0 | 110.5 | R182 | A180-R182 PolarHBondContact O-N 3.3Š| ||
| 181 | P | 49.5 | Very low | 56.3 | Low | 101 Ų | 101 | 103.8 Ų | 103.8 | 66% | 0.656 | 52% | 0.519 | S | S | * | . | trans | -64 | 134.3 | -176.6 | 25.8 | -32.2 | 0 | 0 | 0 | 109.1 | D179 T183 | D179-P181 WeakPolarHBondContact O-CD 3.28Å; P181-T183 HydrophobicContact CB-CG2 4.46Å; P181-T183 HydrophobicContact CG-CG2 4.43Å; P181-T183 PolarHBondContact O-N 3.18Å | ||
| 182 | R | 49.4 | Very low | 56.5 | Low | 235 Ų | 235 | 95 Ų | 95 | 89% | 0.887 | 49% | 0.486 | S | S | * | . | trans | -67.9 | 65.2 | 172.5 | -64.6 | 178.8 | 180 | 179.1 | 0.5 | 110 | A180 R184 | A180-R182 PolarHBondContact O-N 3.3Å; R182-R184 PolarHBondContact O-N 2.95Å | ||
| 183 | T | 51.6 | Low | 57.1 | Low | 79 Ų | 79 | 98.4 Ų | 98.4 | 49% | 0.485 | 50% | 0.5 | S | S | . | . | trans | -65.1 | 127.8 | 175.4 | 40.2 | 0 | 0 | 0 | 0 | 108.6 | P181 L185 | P181-T183 HydrophobicContact CB-CG2 4.46Å; P181-T183 HydrophobicContact CG-CG2 4.43Å; P181-T183 PolarHBondContact O-N 3.18Å; T183-L185 PolarHBondContact O-N 3.36Å | ||
| 184 | R | 56.4 | Low | 57.6 | Low | 207 Ų | 207 | 96.9 Ų | 96.9 | 78% | 0.781 | 50% | 0.501 | S | S | * | . | trans | -68.8 | 84.2 | 174.7 | -80.5 | -177.7 | -173.7 | 167.9 | 2.6 | 108.5 | R182 L186 T187 S188 | R182-R184 PolarHBondContact O-N 2.95Å; R184-L186 PolarHBondContact O-N 3.36Å; R184-T187 WeakPolarHBondContact CB-OG1 3.43Å; R184-T187 WeakPolarHBondContact O-CA 3.29Å; R184-T187 WeakPolarHBondContact O-CB 3.48Å; R184-T187 PolarHBondContact O-N 2.96Å; R184-S188 PolarHBondContact O-N 3.44Å; R184-S188 VanDerWaalsContact O-N 3.1Å | ||
| 185 | L | 61.1 | Low | 58.4 | Low | 32 Ų | 32 | 95 Ų | 95 | 17% | 0.168 | 49% | 0.494 | C | S | . | . | H | α-helix | trans | -51.1 | -40.1 | 180 | -72.1 | 148 | 0 | 0 | 0 | 112.2 | P54 T183 T187 S188 Y189 T323 | P54-L185 HydrophobicContact CB-CD1 3.41Å; P54-L185 VanDerWaalsContact CB-CD1 3.41Å; P54-L185 HydrophobicContact CG-CD1 3.36Å; P54-L185 HydrophobicContact CG-CD2 4.19Å; P54-L185 HydrophobicContact CG-CG 4.32Å; T183-L185 PolarHBondContact O-N 3.36Å; L185-T187 VanDerWaalsContact C-N 3.25Å; L185-T187 PolarHBondContact O-N 3.44Å; L185-S188 CarbonylContact O-C 3.4Å; L185-S188 WeakPolarHBondContact O-CA 3.37Å; L185-S188 WeakPolarHBondContact O-CB 3.28Å; L185-S188 PolarHBondContact O-N 2.86Å; L185-S188 VanDerWaalsContact O-N 3.12Å; L185-Y189 HydrophobicContact CB-CD2 4.2Å; L185-Y189 HydrophobicContact CB-CE2 4.08Å; L185-Y189 HydrophobicContact CD2-CE2 4.39Å; L185-Y189 WeakPolarHBondContact O-CB 3.23Å; L185-Y189 WeakPolarHBondContact O-CD2 3.48Å; L185-Y189 PolarHBondContact O-N 3.49Å; L185-T323 HydrophobicContact CD2-CG2 3.53Å |
| 186 | L | 61.2 | Low | 59 | Low | 144 Ų | 144 | 95.9 Ų | 95.9 | 75% | 0.754 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -60.4 | -35.3 | 176.6 | -84 | 82.9 | 0 | 0 | 0 | 112.9 | R184 K190 | R184-L186 PolarHBondContact O-N 3.36Å; L186-K190 WeakPolarHBondContact O-CB 3.22Å; L186-K190 PolarHBondContact O-N 2.85Å |
| 187 | T | 64.2 | Low | 60 | Low | 75 Ų | 75 | 89.4 Ų | 89.4 | 46% | 0.46 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -70.2 | -44.5 | 175 | -48.5 | 0 | 0 | 0 | 0 | 109.9 | R184 L185 Y189 K190 T191 | R184-T187 WeakPolarHBondContact CB-OG1 3.43Å; R184-T187 WeakPolarHBondContact O-CA 3.29Å; R184-T187 WeakPolarHBondContact O-CB 3.48Å; R184-T187 PolarHBondContact O-N 2.96Å; L185-T187 VanDerWaalsContact C-N 3.25Å; L185-T187 PolarHBondContact O-N 3.44Å; T187-Y189 PolarHBondContact O-N 3.4Å; T187-K190 PolarHBondContact O-N 3.3Å; T187-T191 PolarHBondContact O-N 3.47Å; T187-T191 PolarHBondContact O-OG1 2.85Å |
| 188 | S | 64 | Low | 60.9 | Low | 21 Ų | 21 | 86.2 Ų | 86.2 | 15% | 0.147 | 46% | 0.462 | C | S | . | . | H | α-helix | trans | -58.7 | -44.8 | 173.7 | -62.5 | 0 | 0 | 0 | 0 | 113 | R184 L185 T191 L192 | R184-S188 PolarHBondContact O-N 3.44Å; R184-S188 VanDerWaalsContact O-N 3.1Å; L185-S188 CarbonylContact O-C 3.4Å; L185-S188 WeakPolarHBondContact O-CA 3.37Å; L185-S188 WeakPolarHBondContact O-CB 3.28Å; L185-S188 PolarHBondContact O-N 2.86Å; L185-S188 VanDerWaalsContact O-N 3.12Å; S188-T191 PolarHBondContact O-N 3.23Å; S188-L192 WeakPolarHBondContact O-CB 3.34Å; S188-L192 WeakPolarHBondContact O-CD1 3.38Å; S188-L192 VanDerWaalsContact O-CG 3.24Å; S188-L192 WeakPolarHBondContact O-CG 3.23Å; S188-L192 PolarHBondContact O-N 3.28Å |
| 189 | Y | 66.8 | Low | 61.9 | Low | 38 Ų | 38 | 82 Ų | 82 | 15% | 0.149 | 44% | 0.435 | C | S | . | . | H | α-helix | trans | -60.3 | -47.3 | 174 | -80.1 | -70.9 | 0 | 0 | 0 | 110.7 | L50 L185 T187 T191 L192 F193 L327 | L50-Y189 HydrophobicContact CD1-CE1 3.46Å; L50-Y189 VanDerWaalsContact CD1-CE1 3.46Å; L50-Y189 WeakPolarHBondContact CD1-OH 3.43Å; L185-Y189 HydrophobicContact CB-CD2 4.2Å; L185-Y189 HydrophobicContact CB-CE2 4.08Å; L185-Y189 HydrophobicContact CD2-CE2 4.39Å; L185-Y189 WeakPolarHBondContact O-CB 3.23Å; L185-Y189 WeakPolarHBondContact O-CD2 3.48Å; L185-Y189 PolarHBondContact O-N 3.49Å; T187-Y189 PolarHBondContact O-N 3.4Å; Y189-T191 VanDerWaalsContact C-N 3.35Å; Y189-T191 PolarHBondContact O-N 3.09Å; Y189-L192 PolarHBondContact O-N 2.9Å; Y189-F193 HydrophobicContact CD1-CE2 4.42Å; Y189-F193 WeakPolarHBondContact O-CB 3.44Å; Y189-F193 VanDerWaalsContact O-CD2 3.29Å; Y189-F193 WeakPolarHBondContact O-CD2 3.32Å; Y189-F193 PolarHBondContact O-N 3.25Å; Y189-L327 HydrophobicContact CD1-CB 4.43Å; Y189-L327 HydrophobicContact CD1-CD1 3.27Å; Y189-L327 HydrophobicContact CD1-CG 3.8Å; Y189-L327 HydrophobicContact CE1-CB 3.75Å; Y189-L327 HydrophobicContact CE1-CD1 3.48Å; Y189-L327 VanDerWaalsContact CE1-CD1 3.48Å; Y189-L327 HydrophobicContact CE1-CG 3.53Å; Y189-L327 HydrophobicContact CG-CD1 4.42Å |
| 190 | K | 68.7 | Low | 63 | Low | 172 Ų | 172 | 75.6 Ų | 75.6 | 75% | 0.748 | 40% | 0.401 | S | S | * | . | H | α-helix | trans | -60 | -42.4 | 176.3 | -88.1 | -171.2 | 172.6 | -175.3 | 0 | 112.6 | L186 T187 G194 | L186-K190 WeakPolarHBondContact O-CB 3.22Å; L186-K190 PolarHBondContact O-N 2.85Å; T187-K190 PolarHBondContact O-N 3.3Å; K190-G194 PolarHBondContact O-N 3.37Å |
| 191 | T | 67.2 | Low | 63.8 | Low | 81 Ų | 81 | 74.2 Ų | 74.2 | 50% | 0.497 | 39% | 0.387 | S | S | . | . | H | α-helix | trans | -65.9 | -39.8 | 178 | -51.8 | 0 | 0 | 0 | 0 | 111.6 | T187 S188 Y189 G194 | T187-T191 PolarHBondContact O-N 3.47Å; T187-T191 PolarHBondContact O-OG1 2.85Å; S188-T191 PolarHBondContact O-N 3.23Å; Y189-T191 VanDerWaalsContact C-N 3.35Å; Y189-T191 PolarHBondContact O-N 3.09Å; T191-G194 PolarHBondContact O-N 3.39Å |
| 192 | L | 67.2 | Low | 64.8 | Low | 1 Ų | 1 | 69.7 Ų | 69.7 | 1% | 0.005 | 36% | 0.357 | C | S | . | . | H | α-helix | trans | -66.9 | -48.2 | 177.1 | -73.2 | 163.7 | 0 | 0 | 0 | 111.6 | S188 Y189 G194 N195 F198 F317 A324 L327 | S188-L192 WeakPolarHBondContact O-CB 3.34Å; S188-L192 WeakPolarHBondContact O-CD1 3.38Å; S188-L192 VanDerWaalsContact O-CG 3.24Å; S188-L192 WeakPolarHBondContact O-CG 3.23Å; S188-L192 PolarHBondContact O-N 3.28Å; Y189-L192 PolarHBondContact O-N 2.9Å; L192-G194 PolarHBondContact O-N 2.98Å; L192-N195 PolarHBondContact O-N 3.16Å; L192-N195 VanDerWaalsContact O-N 3.13Å; L192-F198 HydrophobicContact CB-CD1 4.12Å; L192-F198 HydrophobicContact CB-CE1 4.06Å; L192-F198 HydrophobicContact CD2-CD1 4.37Å; L192-F198 HydrophobicContact CD2-CD2 4.08Å; L192-F198 HydrophobicContact CD2-CE1 4.31Å; L192-F198 HydrophobicContact CD2-CE2 4.02Å; L192-F198 HydrophobicContact CD2-CG 4.25Å; L192-F198 HydrophobicContact CD2-CZ 4.13Å; L192-F317 HydrophobicContact CD2-CD1 4.35Å; L192-F317 HydrophobicContact CD2-CD2 3.72Å; L192-F317 HydrophobicContact CD2-CE1 4.41Å; L192-F317 HydrophobicContact CD2-CE2 3.8Å; L192-F317 HydrophobicContact CD2-CG 4.01Å; L192-F317 HydrophobicContact CD2-CZ 4.13Å; L192-A324 HydrophobicContact CD2-CB 4.42Å; L192-L327 HydrophobicContact CB-CD1 3.91Å; L192-L327 HydrophobicContact CD1-CD1 3.61Å; L192-L327 HydrophobicContact CG-CD1 4.37Å |
| 193 | F | 67.9 | Low | 65.9 | Low | 98 Ų | 98 | 62.6 Ų | 62.6 | 43% | 0.43 | 34% | 0.336 | S | S | . | . | H | α-helix | trans | -65.6 | -23 | 175.9 | -86.7 | -73.5 | 0 | 0 | 0 | 113.3 | Y189 N195 N199 L327 L331 | Y189-F193 HydrophobicContact CD1-CE2 4.42Å; Y189-F193 WeakPolarHBondContact O-CB 3.44Å; Y189-F193 VanDerWaalsContact O-CD2 3.29Å; Y189-F193 WeakPolarHBondContact O-CD2 3.32Å; Y189-F193 PolarHBondContact O-N 3.25Å; F193-N195 VanDerWaalsContact C-N 3.3Å; F193-N199 PolarHBondContact O-ND2 3.5Å; F193-L327 HydrophobicContact CE2-CD1 4.44Å; F193-L331 HydrophobicContact CE1-CD1 3.94Å; F193-L331 HydrophobicContact CE2-CD1 4.17Å; F193-L331 HydrophobicContact CZ-CD1 3.36Å; F193-L331 HydrophobicContact CZ-CD2 4.44Å |
| 194 | G | 64.3 | Low | 66.7 | Low | 63 Ų | 63 | 58.9 Ų | 58.9 | 65% | 0.649 | 31% | 0.313 | S | S | * | . | H | α-helix | trans | -73.1 | -19.4 | 174.3 | 0 | 0 | 0 | 0 | 0 | 113.9 | K190 T191 L192 | K190-G194 PolarHBondContact O-N 3.37Å; T191-G194 PolarHBondContact O-N 3.39Å; L192-G194 PolarHBondContact O-N 2.98Å |
| 195 | N | 70.8 | Confident | 67.4 | Low | 59 Ų | 59 | 49.1 Ų | 49.1 | 32% | 0.316 | 28% | 0.276 | S | S | . | . | trans | -92.1 | 110 | -179.9 | -168.2 | -15.7 | 0 | 0 | 0 | 111.1 | L192 F193 G197 F198 N199 F317 | L192-N195 PolarHBondContact O-N 3.16Å; L192-N195 VanDerWaalsContact O-N 3.13Å; F193-N195 VanDerWaalsContact C-N 3.3Å; N195-G197 PolarHBondContact O-N 3.18Å; N195-G197 VanDerWaalsContact O-N 3.15Å; N195-G197 PolarHBondContact OD1-N 3.21Å; N195-F198 HydrophobicContact CB-CB 4.27Å; N195-F198 PolarHBondContact O-N 3.26Å; N195-F198 VanDerWaalsContact O-N 3.11Å; N195-N199 PolarHBondContact O-N 3.04Å; N195-N199 VanDerWaalsContact O-N 3.15Å; N195-F317 HydrophobicContact CB-CE2 4.5Å; N195-F317 HydrophobicContact CB-CZ 4.06Å; N195-F317 WeakPolarHBondContact ND2-CZ 3.19Å | ||
| 196 | S | 66.9 | Low | 67.8 | Low | 66 Ų | 66 | 48.7 Ų | 48.7 | 46% | 0.462 | 27% | 0.274 | S | S | . | . | H | α-helix | trans | -57.2 | -29.8 | 177.8 | -45.8 | 0 | 0 | 0 | 0 | 113.3 | C200 | S196-C200 WeakPolarHBondContact O-CB 3.37Å; S196-C200 PolarHBondContact O-N 3.21Å |
| 197 | G | 68.1 | Low | 68.2 | Low | 15 Ų | 15 | 42 Ų | 42 | 16% | 0.155 | 24% | 0.24 | C | C | . | . | H | α-helix | trans | -67.4 | -42.7 | 177.4 | 0 | 0 | 0 | 0 | 0 | 112.3 | N195 C200 Y201 | N195-G197 PolarHBondContact O-N 3.18Å; N195-G197 VanDerWaalsContact O-N 3.15Å; N195-G197 PolarHBondContact OD1-N 3.21Å; G197-C200 WeakPolarHBondContact O-CB 3.5Å; G197-C200 PolarHBondContact O-N 3.4Å; G197-Y201 WeakPolarHBondContact O-CD2 2.93Å; G197-Y201 PolarHBondContact O-N 3.47Å; G197-Y201 VanDerWaalsContact O-N 3.11Å |
| 198 | F | 68.4 | Low | 68.4 | Low | 2 Ų | 2 | 38.5 Ų | 38.5 | 1% | 0.009 | 22% | 0.219 | C | C | . | . | H | α-helix | trans | -67.2 | -45.4 | 177.7 | -178 | -95.7 | 0 | 0 | 0 | 111.6 | L192 N195 C200 Y201 L202 A313 F317 A324 L327 V328 | L192-F198 HydrophobicContact CB-CD1 4.12Å; L192-F198 HydrophobicContact CB-CE1 4.06Å; L192-F198 HydrophobicContact CD2-CD1 4.37Å; L192-F198 HydrophobicContact CD2-CD2 4.08Å; L192-F198 HydrophobicContact CD2-CE1 4.31Å; L192-F198 HydrophobicContact CD2-CE2 4.02Å; L192-F198 HydrophobicContact CD2-CG 4.25Å; L192-F198 HydrophobicContact CD2-CZ 4.13Å; N195-F198 HydrophobicContact CB-CB 4.27Å; N195-F198 PolarHBondContact O-N 3.26Å; N195-F198 VanDerWaalsContact O-N 3.11Å; F198-C200 PolarHBondContact O-N 3.22Å; F198-Y201 PolarHBondContact O-N 3.46Å; F198-L202 WeakPolarHBondContact O-CB 3.32Å; F198-L202 PolarHBondContact O-N 3.05Å; F198-A313 HydrophobicContact CD2-CB 4.12Å; F198-A313 HydrophobicContact CE2-CB 4.06Å; F198-F317 HydrophobicContact CB-CE2 4.13Å; F198-F317 HydrophobicContact CD2-CD2 4.3Å; F198-F317 HydrophobicContact CD2-CE2 4.25Å; F198-F317 HydrophobicContact CG-CE2 4.42Å; F198-A324 HydrophobicContact CE2-CB 4.06Å; F198-A324 HydrophobicContact CZ-CB 4.44Å; F198-L327 HydrophobicContact CE1-CD1 3.99Å; F198-L327 HydrophobicContact CE1-CD2 3.49Å; F198-L327 VanDerWaalsContact CE1-CD2 3.49Å; F198-L327 HydrophobicContact CE1-CG 4.34Å; F198-L327 HydrophobicContact CZ-CD1 4.29Å; F198-L327 HydrophobicContact CZ-CD2 3.79Å; F198-L327 HydrophobicContact CZ-CG 4.47Å; F198-V328 HydrophobicContact CE2-CG2 3.94Å; F198-V328 HydrophobicContact CZ-CG2 3.77Å |
| 199 | N | 70 | Confident | 68.7 | Low | 42 Ų | 42 | 39 Ų | 39 | 23% | 0.225 | 22% | 0.22 | C | C | . | . | H | α-helix | trans | -60.2 | -37 | 176.3 | -71.3 | -14.6 | 0 | 0 | 0 | 112 | F193 N195 L202 L203 | F193-N199 PolarHBondContact O-ND2 3.5Å; N195-N199 PolarHBondContact O-N 3.04Å; N195-N199 VanDerWaalsContact O-N 3.15Å; N199-L202 PolarHBondContact O-N 3.44Å; N199-L203 WeakPolarHBondContact O-CB 3.25Å; N199-L203 VanDerWaalsContact O-CG 3.23Å; N199-L203 WeakPolarHBondContact O-CG 3.26Å; N199-L203 PolarHBondContact O-N 3.26Å |
| 200 | C | 69.1 | Low | 68.7 | Low | 11 Ų | 11 | 37.2 Ų | 37.2 | 7% | 0.074 | 21% | 0.213 | C | C | . | . | H | α-helix | trans | -66 | -49.3 | 178 | 176.4 | 0 | 0 | 0 | 0 | 112.2 | S196 G197 F198 L202 L203 M204 C368 L372 | S196-C200 WeakPolarHBondContact O-CB 3.37Å; S196-C200 PolarHBondContact O-N 3.21Å; G197-C200 WeakPolarHBondContact O-CB 3.5Å; G197-C200 PolarHBondContact O-N 3.4Å; F198-C200 PolarHBondContact O-N 3.22Å; C200-L202 VanDerWaalsContact C-N 3.29Å; C200-L202 PolarHBondContact O-N 3.04Å; C200-L203 PolarHBondContact O-N 3.36Å; C200-M204 WeakPolarHBondContact O-CG 3.38Å; C200-M204 PolarHBondContact O-N 2.8Å; C200-M204 VanDerWaalsContact O-N 3.11Å; C200-M204 WeakPolarHBondContact SG-CE 3.5Å; C200-C368 PolarHBondContact SG-O 3.38Å; C200-L372 HydrophobicContact CB-CD1 3.99Å |
| 201 | Y | 68.1 | Low | 68.5 | Low | 16 Ų | 16 | 29 Ų | 29 | 6% | 0.063 | 18% | 0.177 | C | C | . | . | H | α-helix | trans | -61.2 | -40.3 | 174.2 | -77.4 | -63 | 0 | 0 | 0 | 112.2 | G197 F198 M204 L205 F259 M263 A309 L372 | G197-Y201 WeakPolarHBondContact O-CD2 2.93Å; G197-Y201 PolarHBondContact O-N 3.47Å; G197-Y201 VanDerWaalsContact O-N 3.11Å; F198-Y201 PolarHBondContact O-N 3.46Å; Y201-M204 PolarHBondContact O-N 2.78Å; Y201-L205 PolarHBondContact O-N 3.27Å; Y201-F259 HydrophobicContact CE1-CE1 4.16Å; Y201-F259 HydrophobicContact CE1-CZ 4.23Å; Y201-F259 WeakPolarHBondContact OH-CE1 3.17Å; Y201-M263 HydrophobicContact CE1-CE 4.39Å; Y201-M263 HydrophobicContact CE1-SD 4.08Å; Y201-A309 HydrophobicContact CD1-CB 4.28Å; Y201-L372 HydrophobicContact CD1-CD2 4.31Å; Y201-L372 HydrophobicContact CD2-CD2 4.38Å; Y201-L372 HydrophobicContact CE1-CD2 3.71Å; Y201-L372 HydrophobicContact CE2-CD2 3.81Å; Y201-L372 VanDerWaalsContact CZ-CD2 3.43Å |
| 202 | L | 70.4 | Confident | 68.6 | Low | 7 Ų | 7 | 26 Ų | 26 | 4% | 0.037 | 16% | 0.158 | C | C | . | . | H | α-helix | trans | -61.4 | -46 | 176.7 | -179.2 | 77.7 | 0 | 0 | 0 | 111.7 | F198 N199 C200 M204 L205 I206 L327 V328 L331 | F198-L202 WeakPolarHBondContact O-CB 3.32Å; F198-L202 PolarHBondContact O-N 3.05Å; N199-L202 PolarHBondContact O-N 3.44Å; C200-L202 VanDerWaalsContact C-N 3.29Å; C200-L202 PolarHBondContact O-N 3.04Å; L202-M204 VanDerWaalsContact C-N 3.3Å; L202-M204 PolarHBondContact O-N 3.24Å; L202-L205 WeakPolarHBondContact O-CB 3.24Å; L202-L205 PolarHBondContact O-N 3.11Å; L202-I206 HydrophobicContact CD2-CD1 4.22Å; L202-I206 HydrophobicContact CG-CD1 3.87Å; L202-I206 VanDerWaalsContact O-CG1 3.26Å; L202-I206 WeakPolarHBondContact O-CG1 3.35Å; L202-I206 PolarHBondContact O-N 3.24Å; L202-L327 HydrophobicContact CD1-CD2 4.14Å; L202-L327 HydrophobicContact CD2-CD2 4.14Å; L202-V328 HydrophobicContact CD1-CB 4.19Å; L202-V328 HydrophobicContact CD1-CG1 4.5Å; L202-V328 HydrophobicContact CD1-CG2 3.95Å; L202-L331 HydrophobicContact CD1-CB 4.03Å; L202-L331 HydrophobicContact CD1-CD1 4.47Å; L202-L331 HydrophobicContact CD2-CB 4.07Å; L202-L331 HydrophobicContact CD2-CD1 3.39Å; L202-L331 HydrophobicContact CD2-CG 4.37Å; L202-L331 HydrophobicContact CG-CB 4.39Å; L202-L331 HydrophobicContact CG-CD1 4.47Å |
| 203 | L | 71.3 | Confident | 68.6 | Low | 86 Ų | 86 | 26 Ų | 26 | 45% | 0.45 | 16% | 0.158 | S | C | . | . | H | α-helix | trans | -62.7 | -37 | 178 | -77.9 | 167.2 | 0 | 0 | 0 | 112.1 | N199 C200 I206 G207 C368 | N199-L203 WeakPolarHBondContact O-CB 3.25Å; N199-L203 VanDerWaalsContact O-CG 3.23Å; N199-L203 WeakPolarHBondContact O-CG 3.26Å; N199-L203 PolarHBondContact O-N 3.26Å; C200-L203 PolarHBondContact O-N 3.36Å; L203-I206 HydrophobicContact CD2-CD1 4.33Å; L203-I206 PolarHBondContact O-N 3.21Å; L203-G207 PolarHBondContact O-N 2.99Å; L203-C368 HydrophobicContact CB-CB 4.43Å |
| 204 | M | 68.3 | Low | 68.5 | Low | 1 Ų | 1 | 21.8 Ų | 21.8 | 1% | 0.005 | 14% | 0.141 | C | C | . | . | H | α-helix | trans | -65.2 | -41.9 | 173.2 | -67.3 | -175.6 | -145.6 | 0 | 0 | 112.4 | C200 Y201 L202 I206 G207 G208 M263 L305 I365 C368 W369 L372 | C200-M204 WeakPolarHBondContact O-CG 3.38Å; C200-M204 PolarHBondContact O-N 2.8Å; C200-M204 VanDerWaalsContact O-N 3.11Å; C200-M204 WeakPolarHBondContact SG-CE 3.5Å; Y201-M204 PolarHBondContact O-N 2.78Å; L202-M204 VanDerWaalsContact C-N 3.3Å; L202-M204 PolarHBondContact O-N 3.24Å; M204-I206 VanDerWaalsContact C-N 3.33Å; M204-G207 PolarHBondContact O-N 2.87Å; M204-G208 PolarHBondContact O-N 3.34Å; M204-M263 HydrophobicContact SD-SD 4.21Å; M204-L305 HydrophobicContact CB-CD2 4.39Å; M204-I365 HydrophobicContact CG-CG2 4.14Å; M204-C368 HydrophobicContact CE-CB 4.37Å; M204-C368 HydrophobicContact CG-CB 4.29Å; M204-W369 VanDerWaalsContact CE-CA 3.44Å; M204-W369 HydrophobicContact CE-CB 3.39Å; M204-W369 VanDerWaalsContact CE-CD1 3.5Å; M204-W369 HydrophobicContact CE-CG 3.69Å; M204-W369 HydrophobicContact SD-CB 4.11Å; M204-W369 HydrophobicContact SD-CG 4.32Å; M204-L372 HydrophobicContact CE-CD2 4.5Å |
| 205 | L | 70.8 | Confident | 68.6 | Low | 1 Ų | 1 | 19.1 Ų | 19.1 | 1% | 0.005 | 11% | 0.112 | C | C | . | . | H | α-helix | trans | -64.4 | -39.8 | 176.2 | -81.8 | 163.9 | 0 | 0 | 0 | 111.8 | Y201 L202 L209 L305 F306 A309 V328 Q332 | Y201-L205 PolarHBondContact O-N 3.27Å; L202-L205 WeakPolarHBondContact O-CB 3.24Å; L202-L205 PolarHBondContact O-N 3.11Å; L205-L209 PolarHBondContact O-N 3.44Å; L205-L305 HydrophobicContact CD2-CD2 4.19Å; L205-L305 HydrophobicContact CG-CD2 4.46Å; L205-F306 HydrophobicContact CD2-CD1 3.86Å; L205-F306 HydrophobicContact CD2-CE1 4.48Å; L205-A309 HydrophobicContact CD1-CB 3.78Å; L205-A309 HydrophobicContact CD2-CB 3.82Å; L205-A309 HydrophobicContact CG-CB 3.53Å; L205-V328 HydrophobicContact CD1-CG1 3.61Å; L205-Q332 PolarHBondContact O-NE2 2.86Å |
| 206 | I | 71.2 | Confident | 68.5 | Low | 23 Ų | 23 | 17.4 Ų | 17.4 | 12% | 0.118 | 10% | 0.102 | C | C | . | . | H | α-helix | trans | -60 | -52.9 | 172.3 | -70.6 | 160 | 0 | 0 | 0 | 109.7 | L202 L203 M204 G208 L209 A210 L331 Q332 L339 | L202-I206 HydrophobicContact CD2-CD1 4.22Å; L202-I206 HydrophobicContact CG-CD1 3.87Å; L202-I206 VanDerWaalsContact O-CG1 3.26Å; L202-I206 WeakPolarHBondContact O-CG1 3.35Å; L202-I206 PolarHBondContact O-N 3.24Å; L203-I206 HydrophobicContact CD2-CD1 4.33Å; L203-I206 PolarHBondContact O-N 3.21Å; M204-I206 VanDerWaalsContact C-N 3.33Å; I206-G208 PolarHBondContact O-N 3.35Å; I206-L209 PolarHBondContact O-N 2.91Å; I206-A210 WeakPolarHBondContact O-CB 3.49Å; I206-A210 PolarHBondContact O-N 3.44Å; I206-L331 HydrophobicContact CD1-CB 4.38Å; I206-Q332 HydrophobicContact CG1-CB 4.46Å; I206-L339 HydrophobicContact CG2-CD1 4.23Å |
| 207 | G | 68.3 | Low | 68.3 | Low | 4 Ų | 4 | 14.3 Ų | 14.3 | 4% | 0.041 | 8% | 0.08 | C | C | . | . | H | α-helix | trans | -62 | -40.1 | -178.3 | 0 | 0 | 0 | 0 | 0 | 113.1 | L203 M204 G211 | L203-G207 PolarHBondContact O-N 2.99Å; M204-G207 PolarHBondContact O-N 2.87Å; G207-G211 PolarHBondContact O-N 3.22Å |
| 208 | G | 68.5 | Low | 68 | Low | 1 Ų | 1 | 13.6 Ų | 13.6 | 1% | 0.01 | 7% | 0.073 | C | C | . | . | H | α-helix | trans | -64.7 | -51.5 | 177.1 | 0 | 0 | 0 | 0 | 0 | 112.5 | M204 I206 A210 G211 I212 | M204-G208 PolarHBondContact O-N 3.34Å; I206-G208 PolarHBondContact O-N 3.35Å; G208-A210 VanDerWaalsContact C-N 3.35Å; G208-G211 PolarHBondContact O-N 2.83Å; G208-I212 PolarHBondContact O-N 2.81Å; G208-I212 VanDerWaalsContact O-N 3.11Å |
| 209 | L | 70.1 | Confident | 67.8 | Low | 32 Ų | 32 | 13.6 Ų | 13.6 | 17% | 0.168 | 7% | 0.073 | C | C | . | . | H | α-helix | trans | -67.6 | -37.2 | 177.6 | -168.2 | 73.3 | 0 | 0 | 0 | 111.6 | L205 I206 G211 I212 A213 F306 Q332 | L205-L209 PolarHBondContact O-N 3.44Å; I206-L209 PolarHBondContact O-N 2.91Å; L209-G211 VanDerWaalsContact C-N 3.33Å; L209-G211 PolarHBondContact O-N 2.89Å; L209-I212 PolarHBondContact O-N 3.24Å; L209-A213 VanDerWaalsContact O-CB 3.27Å; L209-A213 WeakPolarHBondContact O-CB 3.2Å; L209-A213 PolarHBondContact O-N 2.81Å; L209-F306 HydrophobicContact CB-CE1 4.1Å; L209-F306 HydrophobicContact CB-CZ 3.89Å; L209-F306 HydrophobicContact CD1-CE1 3.91Å; L209-F306 HydrophobicContact CD1-CZ 3.55Å; L209-F306 HydrophobicContact CG-CZ 4.33Å; L209-Q332 HydrophobicContact CB-CG 3.6Å; L209-Q332 HydrophobicContact CD2-CG 3.47Å; L209-Q332 VanDerWaalsContact CD2-CG 3.47Å; L209-Q332 HydrophobicContact CG-CG 4.13Å |
| 210 | A | 67.1 | Low | 67.4 | Low | 0 Ų | 0 | 11.9 Ų | 11.9 | 0% | 0 | 7% | 0.065 | C | C | . | . | H | α-helix | trans | -63.1 | -39.1 | 175.9 | 0 | 0 | 0 | 0 | 0 | 112.2 | I206 G208 A213 A214 L339 M361 | I206-A210 WeakPolarHBondContact O-CB 3.49Å; I206-A210 PolarHBondContact O-N 3.44Å; G208-A210 VanDerWaalsContact C-N 3.35Å; A210-A213 PolarHBondContact O-N 2.92Å; A210-A214 WeakPolarHBondContact O-CB 3.33Å; A210-A214 PolarHBondContact O-N 2.81Å; A210-L339 HydrophobicContact CB-CB 3.84Å; A210-L339 HydrophobicContact CB-CD1 3.32Å; A210-L339 HydrophobicContact CB-CG 4.18Å; A210-M361 HydrophobicContact CB-SD 4.42Å |
| 211 | G | 65.2 | Low | 67 | Low | 0 Ų | 0 | 11.6 Ų | 11.6 | 0% | 0 | 6% | 0.063 | C | C | . | . | H | α-helix | trans | -64.7 | -39.7 | 173.7 | 0 | 0 | 0 | 0 | 0 | 112.4 | G207 G208 L209 F215 | G207-G211 PolarHBondContact O-N 3.22Å; G208-G211 PolarHBondContact O-N 2.83Å; L209-G211 VanDerWaalsContact C-N 3.33Å; L209-G211 PolarHBondContact O-N 2.89Å; G211-F215 VanDerWaalsContact O-CB 3.28Å; G211-F215 WeakPolarHBondContact O-CB 3.48Å; G211-F215 PolarHBondContact O-N 3.49Å |
| 212 | I | 69.6 | Low | 66.8 | Low | 17 Ų | 17 | 11.3 Ų | 11.3 | 9% | 0.087 | 6% | 0.063 | C | C | . | . | H | α-helix | trans | -62.5 | -54 | 172.7 | -65.4 | -179.5 | 0 | 0 | 0 | 109.1 | G208 L209 A214 F215 E216 F298 F299 A302 F306 | G208-I212 PolarHBondContact O-N 2.81Å; G208-I212 VanDerWaalsContact O-N 3.11Å; L209-I212 PolarHBondContact O-N 3.24Å; I212-A214 VanDerWaalsContact C-N 3.35Å; I212-A214 PolarHBondContact O-N 3.34Å; I212-F215 CarbonylContact O-C 3.55Å; I212-F215 WeakPolarHBondContact O-CA 3.18Å; I212-F215 WeakPolarHBondContact O-CB 3.48Å; I212-F215 PolarHBondContact O-N 2.69Å; I212-E216 HydrophobicContact CG2-CG 4.06Å; I212-E216 WeakPolarHBondContact O-CG 3.34Å; I212-E216 PolarHBondContact O-N 3.34Å; I212-F298 HydrophobicContact CG1-CD1 4.16Å; I212-F298 HydrophobicContact CG1-CE1 3.69Å; I212-F299 HydrophobicContact CD1-CE1 4.47Å; I212-F299 HydrophobicContact CG2-CE1 4.17Å; I212-F299 HydrophobicContact CG2-CE2 4.45Å; I212-F299 HydrophobicContact CG2-CZ 3.78Å; I212-A302 HydrophobicContact CD1-CB 3.83Å; I212-A302 HydrophobicContact CG1-CB 4.27Å; I212-F306 HydrophobicContact CD1-CE2 3.62Å; I212-F306 HydrophobicContact CD1-CZ 4.03Å |
| 213 | A | 66.1 | Low | 66.5 | Low | 3 Ų | 3 | 11.3 Ų | 11.3 | 3% | 0.025 | 6% | 0.063 | C | C | . | . | H | α-helix | trans | -56.7 | -46.5 | -178.4 | 0 | 0 | 0 | 0 | 0 | 111.9 | M38 L209 A210 F215 E216 A217 | M38-A213 HydrophobicContact CE-CB 3.61Å; M38-A213 VanDerWaalsContact CE-O 3.27Å; M38-A213 WeakPolarHBondContact CE-O 3.28Å; L209-A213 VanDerWaalsContact O-CB 3.27Å; L209-A213 WeakPolarHBondContact O-CB 3.2Å; L209-A213 PolarHBondContact O-N 2.81Å; A210-A213 PolarHBondContact O-N 2.92Å; A213-F215 VanDerWaalsContact C-N 3.32Å; A213-F215 PolarHBondContact O-N 2.89Å; A213-E216 PolarHBondContact O-N 3.39Å; A213-A217 WeakPolarHBondContact O-CB 3.31Å; A213-A217 PolarHBondContact O-N 2.75Å |
| 214 | A | 65.8 | Low | 65.9 | Low | 8 Ų | 8 | 8 Ų | 8 | 7% | 0.066 | 5% | 0.049 | C | C | . | . | H | α-helix | trans | -62.5 | -40.5 | 175.9 | 0 | 0 | 0 | 0 | 0 | 111.6 | A210 I212 A217 C218 | A210-A214 WeakPolarHBondContact O-CB 3.33Å; A210-A214 PolarHBondContact O-N 2.81Å; I212-A214 VanDerWaalsContact C-N 3.35Å; I212-A214 PolarHBondContact O-N 3.34Å; A214-A217 PolarHBondContact O-N 3.15Å; A214-C218 VanDerWaalsContact O-CB 3.29Å; A214-C218 WeakPolarHBondContact O-CB 3.34Å; A214-C218 PolarHBondContact O-N 3.29Å; A214-C218 PolarHBondContact O-SG 3.46Å |
| 215 | F | 67.3 | Low | 65.4 | Low | 7 Ų | 7 | 9.4 Ų | 9.4 | 3% | 0.031 | 6% | 0.061 | C | C | . | . | H | α-helix | trans | -62.7 | -45.4 | 173.7 | -179.5 | -93.5 | 0 | 0 | 0 | 111.7 | G211 I212 A213 C218 S219 M277 L291 A295 F299 M358 | G211-F215 VanDerWaalsContact O-CB 3.28Å; G211-F215 WeakPolarHBondContact O-CB 3.48Å; G211-F215 PolarHBondContact O-N 3.49Å; I212-F215 CarbonylContact O-C 3.55Å; I212-F215 WeakPolarHBondContact O-CA 3.18Å; I212-F215 WeakPolarHBondContact O-CB 3.48Å; I212-F215 PolarHBondContact O-N 2.69Å; A213-F215 VanDerWaalsContact C-N 3.32Å; A213-F215 PolarHBondContact O-N 2.89Å; F215-C218 PolarHBondContact O-N 2.98Å; F215-S219 WeakPolarHBondContact O-CA 2.98Å; F215-S219 WeakPolarHBondContact O-CB 3.31Å; F215-S219 PolarHBondContact O-N 2.97Å; F215-S219 PolarHBondContact O-OG 3.47Å; F215-M277 HydrophobicContact CD2-CE 3.77Å; F215-M277 HydrophobicContact CE2-CE 3.72Å; F215-L291 HydrophobicContact CE2-CD2 3.7Å; F215-L291 HydrophobicContact CE2-CG 4.32Å; F215-L291 HydrophobicContact CZ-CD2 3.9Å; F215-A295 HydrophobicContact CD1-CB 4.41Å; F215-A295 HydrophobicContact CD2-CB 4.27Å; F215-A295 HydrophobicContact CE1-CB 3.66Å; F215-A295 HydrophobicContact CE2-CB 3.49Å; F215-A295 VanDerWaalsContact CE2-CB 3.49Å; F215-A295 HydrophobicContact CZ-CB 3.14Å; F215-F299 AromaticContact CD1-CE2 3.94Å; F215-F299 HydrophobicContact CD1-CE2 3.94Å; F215-F299 HydrophobicContact CE1-CE2 4.31Å; F215-M358 HydrophobicContact CB-CE 4.49Å; F215-M358 HydrophobicContact CB-SD 4.38Å; F215-M358 HydrophobicContact CD2-SD 4.26Å |
| 216 | E | 67.5 | Low | 64.7 | Low | 24 Ų | 24 | 13.1 Ų | 13.1 | 11% | 0.112 | 8% | 0.084 | C | C | . | . | H | α-helix | trans | -61.6 | -44.6 | 176.5 | -63.3 | -169.4 | 155.9 | 0 | 0 | 111.8 | I17 I212 A213 C218 S219 G220 F238 | I17-E216 HydrophobicContact CD1-CB 3.97Å; I212-E216 HydrophobicContact CG2-CG 4.06Å; I212-E216 WeakPolarHBondContact O-CG 3.34Å; I212-E216 PolarHBondContact O-N 3.34Å; A213-E216 PolarHBondContact O-N 3.39Å; E216-C218 VanDerWaalsContact C-N 3.32Å; E216-C218 PolarHBondContact O-N 3.15Å; E216-S219 PolarHBondContact O-OG 3.05Å; E216-G220 PolarHBondContact O-N 3.35Å; E216-F238 HydrophobicContact CB-CE1 4.14Å; E216-F238 HydrophobicContact CB-CZ 4.43Å; E216-F238 HydrophobicContact CG-CE1 3.95Å |
| 217 | A | 63.6 | Low | 64.1 | Low | 0 Ų | 0 | 15.1 Ų | 15.1 | 0% | 0 | 9% | 0.094 | C | C | . | . | H | α-helix | trans | -61.9 | -41.5 | 179 | 0 | 0 | 0 | 0 | 0 | 112 | Q35 M38 A213 A214 V221 | Q35-A217 HydrophobicContact CG-CB 4.45Å; M38-A217 HydrophobicContact CE-CB 4.04Å; M38-A217 HydrophobicContact SD-CB 3.65Å; A213-A217 WeakPolarHBondContact O-CB 3.31Å; A213-A217 PolarHBondContact O-N 2.75Å; A214-A217 PolarHBondContact O-N 3.15Å; A217-V221 WeakPolarHBondContact O-CG2 3.36Å |
| 218 | C | 62.4 | Low | 63.6 | Low | 1 Ų | 1 | 17.9 Ų | 17.9 | 1% | 0.007 | 12% | 0.123 | C | C | . | . | H | α-helix | trans | -89.6 | -29.7 | -174.8 | -61.5 | 0 | 0 | 0 | 0 | 112.9 | A214 F215 E216 G220 V221 L222 Q348 L354 | A214-C218 VanDerWaalsContact O-CB 3.29Å; A214-C218 WeakPolarHBondContact O-CB 3.34Å; A214-C218 PolarHBondContact O-N 3.29Å; A214-C218 PolarHBondContact O-SG 3.46Å; F215-C218 PolarHBondContact O-N 2.98Å; E216-C218 VanDerWaalsContact C-N 3.32Å; E216-C218 PolarHBondContact O-N 3.15Å; C218-G220 VanDerWaalsContact C-N 3.32Å; C218-V221 PolarHBondContact O-N 2.97Å; C218-L222 VanDerWaalsContact O-CB 3.27Å; C218-L222 WeakPolarHBondContact O-CB 3.35Å; C218-L222 VanDerWaalsContact O-CG 3.28Å; C218-L222 WeakPolarHBondContact O-CG 3.27Å; C218-L222 PolarHBondContact O-N 3.09Å; C218-Q348 PolarHBondContact SG-NE2 3.11Å; C218-L354 HydrophobicContact CB-CD1 3.56Å; C218-L354 HydrophobicContact CB-CD2 3.3Å; C218-L354 HydrophobicContact CB-CG 3.87Å; C218-L354 WeakPolarHBondContact SG-CD2 3.41Å |
| 219 | S | 63.3 | Low | 63.2 | Low | 2 Ų | 2 | 20.3 Ų | 20.3 | 1% | 0.014 | 14% | 0.135 | C | C | . | . | H | α-helix | trans | -64.8 | -39.9 | 173.2 | 67.6 | 0 | 0 | 0 | 0 | 110.5 | F215 E216 V221 M223 F238 | F215-S219 WeakPolarHBondContact O-CA 2.98Å; F215-S219 WeakPolarHBondContact O-CB 3.31Å; F215-S219 PolarHBondContact O-N 2.97Å; F215-S219 PolarHBondContact O-OG 3.47Å; E216-S219 PolarHBondContact O-OG 3.05Å; S219-V221 PolarHBondContact O-N 2.79Å; S219-M223 WeakPolarHBondContact O-CB 3.42Å; S219-M223 WeakPolarHBondContact O-CG 3.43Å; S219-M223 PolarHBondContact O-N 3.26Å; S219-F238 WeakPolarHBondContact OG-CZ 3.19Å |
| 220 | G | 62.3 | Low | 62.8 | Low | 6 Ų | 6 | 21.9 Ų | 21.9 | 6% | 0.062 | 15% | 0.149 | C | C | . | . | H | α-helix | trans | -57.5 | -49.1 | 172.9 | 0 | 0 | 0 | 0 | 0 | 112.4 | E216 C218 G224 | E216-G220 PolarHBondContact O-N 3.35Å; C218-G220 VanDerWaalsContact C-N 3.32Å; G220-G224 PolarHBondContact O-N 2.82Å |
| 221 | V | 60.8 | Low | 62.5 | Low | 5 Ų | 5 | 22.8 Ų | 22.8 | 3% | 0.03 | 16% | 0.155 | C | C | . | . | H | α-helix | trans | -67.6 | -49.5 | 179.1 | 174.5 | 0 | 0 | 0 | 0 | 111.8 | I20 E31 A217 C218 S219 M223 G224 A225 | I20-V221 HydrophobicContact CG2-CG2 4.15Å; E31-V221 HydrophobicContact CB-CG1 4.29Å; E31-V221 VanDerWaalsContact OE2-CG1 3.26Å; E31-V221 WeakPolarHBondContact OE2-CG1 3.43Å; A217-V221 WeakPolarHBondContact O-CG2 3.36Å; C218-V221 PolarHBondContact O-N 2.97Å; S219-V221 PolarHBondContact O-N 2.79Å; V221-M223 PolarHBondContact O-N 3.42Å; V221-G224 PolarHBondContact O-N 3.02Å; V221-A225 HydrophobicContact CG1-CB 4.33Å; V221-A225 WeakPolarHBondContact O-CA 3.21Å; V221-A225 WeakPolarHBondContact O-CB 3.43Å; V221-A225 PolarHBondContact O-N 2.98Å |
| 222 | L | 63.1 | Low | 62.3 | Low | 10 Ų | 10 | 28.9 Ų | 28.9 | 5% | 0.052 | 19% | 0.185 | C | C | . | . | I | π-helix | trans | -64.6 | -41.1 | -178.2 | -74 | 176.6 | 0 | 0 | 0 | 112.7 | C218 V226 L227 L291 L354 | C218-L222 VanDerWaalsContact O-CB 3.27Å; C218-L222 WeakPolarHBondContact O-CB 3.35Å; C218-L222 VanDerWaalsContact O-CG 3.28Å; C218-L222 WeakPolarHBondContact O-CG 3.27Å; C218-L222 PolarHBondContact O-N 3.09Å; L222-V226 HydrophobicContact CD2-CG2 3.94Å; L222-V226 WeakPolarHBondContact O-CB 3.29Å; L222-V226 PolarHBondContact O-N 3.18Å; L222-L227 PolarHBondContact O-N 3.15Å; L222-L291 HydrophobicContact CD1-CD1 3.93Å; L222-L354 HydrophobicContact CD1-CD1 3.3Å; L222-L354 HydrophobicContact CG-CD1 4.29Å |
| 223 | M | 63.1 | Low | 62.2 | Low | 6 Ų | 6 | 30.4 Ų | 30.4 | 3% | 0.03 | 20% | 0.195 | C | C | . | . | I | π-helix | trans | -74.1 | -38.1 | 179.8 | -62.9 | 178 | -178.4 | 0 | 0 | 111.7 | S219 V221 L227 L229 V234 L237 L291 | S219-M223 WeakPolarHBondContact O-CB 3.42Å; S219-M223 WeakPolarHBondContact O-CG 3.43Å; S219-M223 PolarHBondContact O-N 3.26Å; V221-M223 PolarHBondContact O-N 3.42Å; M223-L227 HydrophobicContact CG-CD1 4.47Å; M223-L229 HydrophobicContact CB-CD1 4.49Å; M223-L229 WeakPolarHBondContact O-CB 3.28Å; M223-L229 PolarHBondContact O-N 3.29Å; M223-V234 HydrophobicContact CB-CG2 3.65Å; M223-V234 HydrophobicContact SD-CG1 4.28Å; M223-V234 HydrophobicContact SD-CG2 4.47Å; M223-L237 HydrophobicContact CE-CB 3.98Å; M223-L237 HydrophobicContact CE-CD1 3.75Å; M223-L237 HydrophobicContact CE-CG 4.43Å; M223-L237 HydrophobicContact CG-CD1 4.49Å; M223-L237 HydrophobicContact SD-CB 4Å; M223-L237 HydrophobicContact SD-CD1 3.5Å; M223-L237 WeakPolarHBondContact SD-CD1 3.27Å; M223-L237 HydrophobicContact SD-CG 4.4Å; M223-L291 HydrophobicContact CE-CD2 4.13Å |
| 224 | G | 59.3 | Low | 62 | Low | 16 Ų | 16 | 30.5 Ų | 30.5 | 17% | 0.165 | 20% | 0.196 | C | C | . | . | I | π-helix | trans | -77.9 | -51.1 | 179.3 | 0 | 0 | 0 | 0 | 0 | 113.8 | G220 V221 | G220-G224 PolarHBondContact O-N 2.82Å; V221-G224 PolarHBondContact O-N 3.02Å |
| 225 | A | 58.2 | Low | 61.9 | Low | 31 Ų | 31 | 30.3 Ų | 30.3 | 26% | 0.256 | 19% | 0.194 | S | C | . | . | I | π-helix | trans | -84.9 | -45 | -172.1 | 0 | 0 | 0 | 0 | 0 | 113.7 | E31 V221 | E31-A225 VanDerWaalsContact CD-CB 3.43Å; E31-A225 WeakPolarHBondContact OE1-CB 3.15Å; E31-A225 VanDerWaalsContact OE2-CB 3.27Å; E31-A225 WeakPolarHBondContact OE2-CB 3.46Å; V221-A225 HydrophobicContact CG1-CB 4.33Å; V221-A225 WeakPolarHBondContact O-CA 3.21Å; V221-A225 WeakPolarHBondContact O-CB 3.43Å; V221-A225 PolarHBondContact O-N 2.98Å |
| 226 | V | 55.7 | Low | 61.9 | Low | 80 Ų | 80 | 34.9 Ų | 34.9 | 49% | 0.485 | 22% | 0.218 | S | C | . | . | I | π-helix | trans | -90.9 | -41.9 | -171.9 | -172.7 | 0 | 0 | 0 | 0 | 111.8 | L222 M286 | L222-V226 HydrophobicContact CD2-CG2 3.94Å; L222-V226 WeakPolarHBondContact O-CB 3.29Å; L222-V226 PolarHBondContact O-N 3.18Å; V226-M286 HydrophobicContact CB-CE 4.14Å; V226-M286 HydrophobicContact CG1-CE 3.43Å; V226-M286 VanDerWaalsContact CG1-CE 3.43Å; V226-M286 HydrophobicContact CG1-SD 4.09Å |
| 227 | L | 58 | Low | 61.9 | Low | 65 Ų | 65 | 34.9 Ų | 34.9 | 34% | 0.34 | 22% | 0.218 | S | C | . | . | S | Bend | trans | -89.3 | -9.7 | -179.6 | -68.7 | 163.2 | 0 | 0 | 0 | 113.2 | L222 M223 L229 V288 | L222-L227 PolarHBondContact O-N 3.15Å; M223-L227 HydrophobicContact CG-CD1 4.47Å; L227-L229 HydrophobicContact CB-CD1 3.56Å; L227-L229 HydrophobicContact CB-CG 3.76Å; L227-L229 HydrophobicContact CD1-CD1 3.87Å; L227-L229 HydrophobicContact CG-CD1 4.28Å; L227-L229 PolarHBondContact O-N 3.31Å; L227-L229 VanDerWaalsContact O-N 3.08Å; L227-V288 HydrophobicContact CD1-CG2 3.93Å |
| 228 | G | 59.2 | Low | 62 | Low | 62 Ų | 62 | 35.9 Ų | 35.9 | 64% | 0.639 | 22% | 0.223 | S | C | * | . | trans | 58 | 21.7 | -178.9 | 0 | 0 | 0 | 0 | 0 | 113.5 | ||||
| 229 | L | 59.3 | Low | 62.3 | Low | 51 Ų | 51 | 38.5 Ų | 38.5 | 27% | 0.267 | 24% | 0.236 | S | C | . | . | trans | -75.5 | 139.4 | -174.1 | -70.4 | 162 | 0 | 0 | 0 | 109.5 | M223 L227 T233 V288 | M223-L229 HydrophobicContact CB-CD1 4.49Å; M223-L229 WeakPolarHBondContact O-CB 3.28Å; M223-L229 PolarHBondContact O-N 3.29Å; L227-L229 HydrophobicContact CB-CD1 3.56Å; L227-L229 HydrophobicContact CB-CG 3.76Å; L227-L229 HydrophobicContact CD1-CD1 3.87Å; L227-L229 HydrophobicContact CG-CD1 4.28Å; L227-L229 PolarHBondContact O-N 3.31Å; L227-L229 VanDerWaalsContact O-N 3.08Å; L229-T233 HydrophobicContact CB-CG2 4.46Å; L229-T233 HydrophobicContact CD2-CG2 4.14Å; L229-V288 HydrophobicContact CD1-CG2 3.82Å | ||
| 230 | S | 61.7 | Low | 62.6 | Low | 66 Ų | 66 | 42.5 Ų | 42.5 | 46% | 0.462 | 26% | 0.257 | S | S | . | . | trans | -56.3 | 147.5 | 177.6 | 79.4 | 0 | 0 | 0 | 0 | 111 | M232 T233 V234 | S230-M232 PolarHBondContact O-N 3.35Å; S230-T233 WeakPolarHBondContact O-CB 3.44Å; S230-T233 PolarHBondContact O-N 2.8Å; S230-T233 PolarHBondContact OG-N 3.48Å; S230-T233 PolarHBondContact OG-OG1 3.41Å; S230-T233 VanDerWaalsContact OG-OG1 3.12Å; S230-V234 PolarHBondContact O-N 3.24Å | ||
| 231 | S | 60.7 | Low | 62.8 | Low | 19 Ų | 19 | 42.3 Ų | 42.3 | 13% | 0.133 | 26% | 0.255 | C | S | . | . | H | α-helix | trans | -53.8 | -26 | 176.3 | -174.3 | 0 | 0 | 0 | 0 | 113 | P18 G142 S235 | P18-S231 WeakPolarHBondContact CB-OG 3.12Å; G142-S231 WeakPolarHBondContact CA-OG 3.46Å; S231-S235 WeakPolarHBondContact O-CB 3.44Å; S231-S235 PolarHBondContact O-N 3.11Å; S231-S235 PolarHBondContact O-OG 2.9Å |
| 232 | M | 62.1 | Low | 63.3 | Low | 127 Ų | 127 | 43.5 Ų | 43.5 | 63% | 0.626 | 26% | 0.26 | S | S | * | . | H | α-helix | trans | -67.8 | -40.3 | 175 | -165.9 | -179.3 | -160.3 | 0 | 0 | 111.9 | S230 S235 I236 | S230-M232 PolarHBondContact O-N 3.35Å; M232-S235 WeakPolarHBondContact O-CB 3.43Å; M232-S235 PolarHBondContact O-N 3.4Å; M232-I236 HydrophobicContact CG-CD1 4.19Å; M232-I236 VanDerWaalsContact O-CG1 3.3Å; M232-I236 WeakPolarHBondContact O-CG1 3.14Å; M232-I236 PolarHBondContact O-N 2.85Å |
| 233 | T | 65.8 | Low | 63.7 | Low | 49 Ų | 49 | 46 Ų | 46 | 30% | 0.301 | 28% | 0.277 | S | S | . | . | H | α-helix | trans | -67.3 | -42.9 | 177.2 | -47.3 | 0 | 0 | 0 | 0 | 110.8 | L229 S230 S235 I236 L237 | L229-T233 HydrophobicContact CB-CG2 4.46Å; L229-T233 HydrophobicContact CD2-CG2 4.14Å; S230-T233 WeakPolarHBondContact O-CB 3.44Å; S230-T233 PolarHBondContact O-N 2.8Å; S230-T233 PolarHBondContact OG-N 3.48Å; S230-T233 PolarHBondContact OG-OG1 3.41Å; S230-T233 VanDerWaalsContact OG-OG1 3.12Å; T233-S235 VanDerWaalsContact C-N 3.26Å; T233-S235 PolarHBondContact O-N 2.89Å; T233-I236 PolarHBondContact O-N 2.81Å; T233-L237 HydrophobicContact CG2-CD1 3.95Å; T233-L237 HydrophobicContact CG2-CG 4.38Å; T233-L237 WeakPolarHBondContact O-CB 3.47Å; T233-L237 WeakPolarHBondContact O-CG 3.47Å; T233-L237 PolarHBondContact O-N 3.06Å |
| 234 | V | 63 | Low | 64.1 | Low | 5 Ų | 5 | 46.7 Ų | 46.7 | 3% | 0.03 | 28% | 0.284 | C | S | . | . | H | α-helix | trans | -54.9 | -47 | 172.7 | -178.2 | 0 | 0 | 0 | 0 | 110.1 | M223 S230 I236 L237 F238 | M223-V234 HydrophobicContact CB-CG2 3.65Å; M223-V234 HydrophobicContact SD-CG1 4.28Å; M223-V234 HydrophobicContact SD-CG2 4.47Å; S230-V234 PolarHBondContact O-N 3.24Å; V234-I236 PolarHBondContact O-N 3.33Å; V234-L237 PolarHBondContact O-N 3.32Å; V234-F238 HydrophobicContact CG1-CD2 3.75Å; V234-F238 HydrophobicContact CG1-CE2 3.54Å; V234-F238 WeakPolarHBondContact O-CD2 3.48Å; V234-F238 PolarHBondContact O-N 3.45Å |
| 235 | S | 63.3 | Low | 64.5 | Low | 5 Ų | 5 | 46.9 Ų | 46.9 | 4% | 0.035 | 28% | 0.284 | C | S | . | . | H | α-helix | trans | -63.3 | -42.3 | 180 | -57.2 | 0 | 0 | 0 | 0 | 113.3 | P138 S231 M232 T233 L237 F238 I239 | P138-S235 WeakPolarHBondContact CB-OG 3.42Å; P138-S235 PolarHBondContact O-OG 2.9Å; S231-S235 WeakPolarHBondContact O-CB 3.44Å; S231-S235 PolarHBondContact O-N 3.11Å; S231-S235 PolarHBondContact O-OG 2.9Å; M232-S235 WeakPolarHBondContact O-CB 3.43Å; M232-S235 PolarHBondContact O-N 3.4Å; T233-S235 VanDerWaalsContact C-N 3.26Å; T233-S235 PolarHBondContact O-N 2.89Å; S235-L237 VanDerWaalsContact C-N 3.31Å; S235-F238 PolarHBondContact O-N 3.11Å; S235-I239 WeakPolarHBondContact O-CG1 3.3Å; S235-I239 PolarHBondContact O-N 3.41Å |
| 236 | I | 67.9 | Low | 65 | Low | 103 Ų | 103 | 51.2 Ų | 51.2 | 53% | 0.528 | 30% | 0.297 | S | S | . | . | H | α-helix | trans | -64.7 | -39.8 | 175.2 | -68.1 | 164.4 | 0 | 0 | 0 | 110.4 | M232 T233 V234 F238 I239 | M232-I236 HydrophobicContact CG-CD1 4.19Å; M232-I236 VanDerWaalsContact O-CG1 3.3Å; M232-I236 WeakPolarHBondContact O-CG1 3.14Å; M232-I236 PolarHBondContact O-N 2.85Å; T233-I236 PolarHBondContact O-N 2.81Å; V234-I236 PolarHBondContact O-N 3.33Å; I236-F238 VanDerWaalsContact C-N 3.33Å; I236-F238 PolarHBondContact O-N 3.41Å; I236-I239 WeakPolarHBondContact O-CB 3.35Å; I236-I239 PolarHBondContact O-N 3.28Å; I236-I239 VanDerWaalsContact O-N 3.15Å |
| 237 | L | 66.9 | Low | 65.9 | Low | 23 Ų | 23 | 53.7 Ų | 53.7 | 12% | 0.12 | 30% | 0.302 | C | S | . | . | H | α-helix | trans | -67.6 | -32 | 178 | -69 | 168.3 | 0 | 0 | 0 | 112.1 | M223 T233 V234 S235 I239 L240 P241 V288 L292 | M223-L237 HydrophobicContact CE-CB 3.98Å; M223-L237 HydrophobicContact CE-CD1 3.75Å; M223-L237 HydrophobicContact CE-CG 4.43Å; M223-L237 HydrophobicContact CG-CD1 4.49Å; M223-L237 HydrophobicContact SD-CB 4Å; M223-L237 HydrophobicContact SD-CD1 3.5Å; M223-L237 WeakPolarHBondContact SD-CD1 3.27Å; M223-L237 HydrophobicContact SD-CG 4.4Å; T233-L237 HydrophobicContact CG2-CD1 3.95Å; T233-L237 HydrophobicContact CG2-CG 4.38Å; T233-L237 WeakPolarHBondContact O-CB 3.47Å; T233-L237 WeakPolarHBondContact O-CG 3.47Å; T233-L237 PolarHBondContact O-N 3.06Å; V234-L237 PolarHBondContact O-N 3.32Å; S235-L237 VanDerWaalsContact C-N 3.31Å; L237-I239 VanDerWaalsContact C-N 3.26Å; L237-I239 PolarHBondContact O-N 3.48Å; L237-L240 PolarHBondContact O-N 3.24Å; L237-P241 WeakPolarHBondContact O-CD 3.5Å; L237-V288 HydrophobicContact CD1-CG1 3.56Å; L237-V288 HydrophobicContact CD2-CG1 3.62Å; L237-V288 HydrophobicContact CG-CG1 4.27Å; L237-L292 HydrophobicContact CB-CD1 4.31Å; L237-L292 HydrophobicContact CD2-CD1 4.09Å; L237-L292 HydrophobicContact CD2-CD2 3.5Å; L237-L292 VanDerWaalsContact CD2-CD2 3.5Å; L237-L292 HydrophobicContact CD2-CG 4.43Å |
| 238 | F | 65 | Low | 66.3 | Low | 22 Ų | 22 | 50.6 Ų | 50.6 | 10% | 0.096 | 29% | 0.285 | C | S | . | . | H | α-helix | trans | -65.9 | -25.8 | 171.8 | -90.8 | -74.4 | 0 | 0 | 0 | 113.7 | I17 P138 E216 S219 V234 S235 I236 P241 I242 | I17-F238 HydrophobicContact CD1-CE1 4.14Å; I17-F238 HydrophobicContact CD1-CZ 3.86Å; I17-F238 HydrophobicContact CG2-CE2 3.82Å; I17-F238 HydrophobicContact CG2-CZ 3.8Å; P138-F238 HydrophobicContact CG-CB 4.31Å; E216-F238 HydrophobicContact CB-CE1 4.14Å; E216-F238 HydrophobicContact CB-CZ 4.43Å; E216-F238 HydrophobicContact CG-CE1 3.95Å; S219-F238 WeakPolarHBondContact OG-CZ 3.19Å; V234-F238 HydrophobicContact CG1-CD2 3.75Å; V234-F238 HydrophobicContact CG1-CE2 3.54Å; V234-F238 WeakPolarHBondContact O-CD2 3.48Å; V234-F238 PolarHBondContact O-N 3.45Å; S235-F238 PolarHBondContact O-N 3.11Å; I236-F238 VanDerWaalsContact C-N 3.33Å; I236-F238 PolarHBondContact O-N 3.41Å; F238-P241 WeakPolarHBondContact O-CD 3.3Å; F238-I242 WeakPolarHBondContact O-CD1 3.32Å; F238-I242 WeakPolarHBondContact O-CG1 3.49Å |
| 239 | I | 68.7 | Low | 66.6 | Low | 55 Ų | 55 | 49.6 Ų | 49.6 | 28% | 0.282 | 27% | 0.271 | S | S | . | . | H | α-helix | trans | -74.3 | -29.5 | 178.2 | -65.3 | 162.7 | 0 | 0 | 0 | 110.9 | L135 S235 I236 L237 I242 P243 | L135-I239 HydrophobicContact CD2-CG1 4.39Å; L135-I239 HydrophobicContact CD2-CG2 4.06Å; L135-I239 HydrophobicContact CG-CG1 4.22Å; S235-I239 WeakPolarHBondContact O-CG1 3.3Å; S235-I239 PolarHBondContact O-N 3.41Å; I236-I239 WeakPolarHBondContact O-CB 3.35Å; I236-I239 PolarHBondContact O-N 3.28Å; I236-I239 VanDerWaalsContact O-N 3.15Å; L237-I239 VanDerWaalsContact C-N 3.26Å; L237-I239 PolarHBondContact O-N 3.48Å; I239-I242 PolarHBondContact O-N 3.23Å; I239-P243 WeakPolarHBondContact O-CD 3.35Å |
| 240 | L | 70.3 | Confident | 67.2 | Low | 87 Ų | 87 | 53.7 Ų | 53.7 | 46% | 0.455 | 28% | 0.283 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -66.7 | -37.6 | -172.9 | -158.9 | 76.1 | 0 | 0 | 0 | 115 | L237 I242 P243 W289 L292 | L237-L240 PolarHBondContact O-N 3.24Å; L240-I242 VanDerWaalsContact C-N 3.32Å; L240-I242 PolarHBondContact O-N 3.5Å; L240-P243 WeakPolarHBondContact O-CD 3.35Å; L240-W289 HydrophobicContact CD2-CZ3 4.39Å; L240-L292 HydrophobicContact CB-CD1 4.43Å; L240-L292 HydrophobicContact CB-CD2 4.23Å; L240-L292 HydrophobicContact CB-CG 4.45Å; L240-L292 HydrophobicContact CD2-CD2 3.14Å; L240-L292 HydrophobicContact CD2-CG 3.68Å; L240-L292 HydrophobicContact CG-CD2 4.26Å |
| 241 | P | 67 | Low | 67.5 | Low | 2 Ų | 2 | 53 Ų | 53 | 1% | 0.013 | 27% | 0.272 | C | S | . | . | H | α-helix | trans | -72.1 | -19.8 | 175.9 | -22.3 | 33.5 | 0 | 0 | 0 | 114.6 | L237 F238 A244 A245 L292 A295 F299 | L237-P241 WeakPolarHBondContact O-CD 3.5Å; F238-P241 WeakPolarHBondContact O-CD 3.3Å; P241-A244 VanDerWaalsContact O-CB 3.31Å; P241-A244 WeakPolarHBondContact O-CB 3.26Å; P241-A244 PolarHBondContact O-N 2.82Å; P241-A244 VanDerWaalsContact O-N 3.11Å; P241-A245 PolarHBondContact O-N 3.47Å; P241-L292 HydrophobicContact CG-CD1 4.37Å; P241-A295 HydrophobicContact CG-CB 4.47Å; P241-F299 HydrophobicContact CB-CB 4.01Å; P241-F299 HydrophobicContact CB-CD1 3.99Å; P241-F299 HydrophobicContact CB-CD2 3.52Å; P241-F299 HydrophobicContact CB-CE1 4.32Å; P241-F299 HydrophobicContact CB-CE2 3.88Å; P241-F299 HydrophobicContact CB-CG 3.57Å; P241-F299 HydrophobicContact CB-CZ 4.26Å; P241-F299 HydrophobicContact CG-CD2 4.38Å; P241-F299 HydrophobicContact CG-CE2 4.43Å |
| 242 | I | 70.7 | Confident | 67.6 | Low | 30 Ų | 30 | 52.9 Ų | 52.9 | 15% | 0.154 | 27% | 0.272 | C | S | . | . | H | α-helix | trans | -68.9 | -42.9 | -173.9 | -56.3 | 173.1 | 0 | 0 | 0 | 112.5 | L135 F238 I239 L240 A244 A245 F246 | L135-I242 HydrophobicContact CD1-CB 4.4Å; L135-I242 HydrophobicContact CD1-CD1 3.38Å; L135-I242 HydrophobicContact CD1-CG1 4.45Å; L135-I242 HydrophobicContact CD1-CG2 3.91Å; L135-I242 HydrophobicContact CG-CD1 3.74Å; F238-I242 WeakPolarHBondContact O-CD1 3.32Å; F238-I242 WeakPolarHBondContact O-CG1 3.49Å; I239-I242 PolarHBondContact O-N 3.23Å; L240-I242 VanDerWaalsContact C-N 3.32Å; L240-I242 PolarHBondContact O-N 3.5Å; I242-A244 PolarHBondContact O-N 3.2Å; I242-A245 PolarHBondContact O-N 2.86Å; I242-F246 PolarHBondContact O-N 3.02Å |
| 243 | P | 71.4 | Confident | 67.4 | Low | 63 Ų | 63 | 49.8 Ų | 49.8 | 41% | 0.409 | 27% | 0.272 | S | S | . | . | H | α-helix | trans | -53.1 | -42.1 | 167.1 | -25.9 | 30.5 | 0 | 0 | 0 | 112.3 | I239 L240 A245 F246 F247 | I239-P243 WeakPolarHBondContact O-CD 3.35Å; L240-P243 WeakPolarHBondContact O-CD 3.35Å; P243-A245 PolarHBondContact O-N 3.49Å; P243-F246 WeakPolarHBondContact O-CB 3.45Å; P243-F246 PolarHBondContact O-N 3.45Å; P243-F246 VanDerWaalsContact O-N 3.14Å; P243-F247 VanDerWaalsContact O-CD2 3.24Å; P243-F247 WeakPolarHBondContact O-CD2 3.49Å; P243-F247 PolarHBondContact O-N 2.8Å |
| 244 | A | 71.2 | Confident | 67.4 | Low | 19 Ų | 19 | 53.8 Ų | 53.8 | 16% | 0.157 | 28% | 0.282 | C | S | . | . | H | α-helix | trans | -62.8 | -42 | 179.1 | 0 | 0 | 0 | 0 | 0 | 111.6 | P241 I242 F246 F247 G248 A296 F300 | P241-A244 VanDerWaalsContact O-CB 3.31Å; P241-A244 WeakPolarHBondContact O-CB 3.26Å; P241-A244 PolarHBondContact O-N 2.82Å; P241-A244 VanDerWaalsContact O-N 3.11Å; I242-A244 PolarHBondContact O-N 3.2Å; A244-F246 VanDerWaalsContact C-N 3.35Å; A244-F246 PolarHBondContact O-N 3.19Å; A244-F247 PolarHBondContact O-N 3.32Å; A244-G248 PolarHBondContact O-N 2.9Å; A244-A296 HydrophobicContact CB-CB 4.07Å; A244-A296 WeakPolarHBondContact CB-O 3.4Å; A244-F300 HydrophobicContact CB-CB 4.4Å; A244-F300 VanDerWaalsContact O-CD2 3.32Å; A244-F300 WeakPolarHBondContact O-CD2 3.34Å |
| 245 | A | 68.4 | Low | 66.7 | Low | 20 Ų | 20 | 59.1 Ų | 59.1 | 17% | 0.165 | 32% | 0.316 | C | S | . | . | H | α-helix | trans | -63.5 | -38.7 | 172.6 | 0 | 0 | 0 | 0 | 0 | 112.8 | P241 I242 P243 G248 A249 F299 | P241-A245 PolarHBondContact O-N 3.47Å; I242-A245 PolarHBondContact O-N 2.86Å; P243-A245 PolarHBondContact O-N 3.49Å; A245-G248 PolarHBondContact O-N 3.36Å; A245-A249 WeakPolarHBondContact O-CB 3.31Å; A245-A249 PolarHBondContact O-N 3.44Å; A245-F299 WeakPolarHBondContact CA-O 3.46Å; A245-F299 HydrophobicContact CB-CB 4.25Å; A245-F299 HydrophobicContact CB-CD1 4.05Å |
| 246 | F | 69.4 | Low | 66 | Low | 123 Ų | 123 | 67 Ų | 67 | 54% | 0.539 | 36% | 0.358 | S | S | . | . | H | α-helix | trans | -65.2 | -44.1 | 176.9 | -165.3 | -94 | 0 | 0 | 0 | 111.7 | L131 I242 P243 A244 G248 A249 W250 | L131-F246 HydrophobicContact CD1-CD2 4.48Å; I242-F246 PolarHBondContact O-N 3.02Å; P243-F246 WeakPolarHBondContact O-CB 3.45Å; P243-F246 PolarHBondContact O-N 3.45Å; P243-F246 VanDerWaalsContact O-N 3.14Å; A244-F246 VanDerWaalsContact C-N 3.35Å; A244-F246 PolarHBondContact O-N 3.19Å; F246-G248 VanDerWaalsContact C-N 3.32Å; F246-G248 PolarHBondContact O-N 3.11Å; F246-A249 PolarHBondContact O-N 3.34Å; F246-W250 VanDerWaalsContact O-CB 3.31Å; F246-W250 WeakPolarHBondContact O-CB 3.3Å; F246-W250 PolarHBondContact O-N 3.43Å |
| 247 | F | 73.5 | Confident | 65.4 | Low | 132 Ų | 132 | 66.4 Ų | 66.4 | 58% | 0.579 | 35% | 0.351 | S | S | * | . | H | α-helix | trans | -62.2 | -39.8 | 173.1 | -88.2 | -77.5 | 0 | 0 | 0 | 111.6 | P243 A244 W250 F251 F300 | P243-F247 VanDerWaalsContact O-CD2 3.24Å; P243-F247 WeakPolarHBondContact O-CD2 3.49Å; P243-F247 PolarHBondContact O-N 2.8Å; A244-F247 PolarHBondContact O-N 3.32Å; F247-W250 PolarHBondContact O-N 3.44Å; F247-F251 VanDerWaalsContact O-CB 3.24Å; F247-F251 WeakPolarHBondContact O-CB 3.41Å; F247-F251 PolarHBondContact O-N 3.29Å; F247-F300 HydrophobicContact CB-CD2 4.2Å; F247-F300 HydrophobicContact CB-CE2 4Å |
| 248 | G | 66.9 | Low | 65.1 | Low | 0 Ų | 0 | 75 Ų | 75 | 0% | 0 | 38% | 0.382 | C | S | . | . | H | α-helix | trans | -61.4 | -49.8 | 174.1 | 0 | 0 | 0 | 0 | 0 | 112.3 | A244 A245 F246 W250 F251 A252 M304 | A244-G248 PolarHBondContact O-N 2.9Å; A245-G248 PolarHBondContact O-N 3.36Å; F246-G248 VanDerWaalsContact C-N 3.32Å; F246-G248 PolarHBondContact O-N 3.11Å; G248-W250 PolarHBondContact O-N 2.83Å; G248-F251 PolarHBondContact O-N 3.09Å; G248-A252 PolarHBondContact O-N 2.89Å; G248-M304 WeakPolarHBondContact O-CG 3.45Å |
| 249 | A | 66.3 | Low | 64.9 | Low | 40 Ų | 40 | 76.5 Ų | 76.5 | 33% | 0.331 | 39% | 0.389 | S | S | . | . | H | α-helix | trans | -62.8 | -41.5 | 177.7 | 0 | 0 | 0 | 0 | 0 | 112.3 | A245 F246 F251 A252 G253 G303 | A245-A249 WeakPolarHBondContact O-CB 3.31Å; A245-A249 PolarHBondContact O-N 3.44Å; F246-A249 PolarHBondContact O-N 3.34Å; A249-F251 VanDerWaalsContact C-N 3.35Å; A249-A252 PolarHBondContact O-N 2.89Å; A249-G253 PolarHBondContact O-N 3.14Å; A249-G253 VanDerWaalsContact O-N 3.07Å; A249-G303 WeakPolarHBondContact CA-O 3.24Å |
| 250 | W | 71.7 | Confident | 64.5 | Low | 138 Ų | 138 | 75.8 Ų | 75.8 | 52% | 0.523 | 39% | 0.389 | S | S | . | . | H | α-helix | trans | -64.2 | -39.4 | 175.4 | -176 | 82.2 | 0 | 0 | 0 | 112.1 | F246 F247 G248 A252 G253 | F246-W250 VanDerWaalsContact O-CB 3.31Å; F246-W250 WeakPolarHBondContact O-CB 3.3Å; F246-W250 PolarHBondContact O-N 3.43Å; F247-W250 PolarHBondContact O-N 3.44Å; G248-W250 PolarHBondContact O-N 2.83Å; W250-A252 VanDerWaalsContact C-N 3.35Å; W250-G253 PolarHBondContact O-N 3.02Å |
| 251 | F | 67.9 | Low | 64.1 | Low | 52 Ų | 52 | 74.4 Ų | 74.4 | 23% | 0.228 | 38% | 0.384 | C | S | . | . | H | α-helix | trans | -68 | -34.4 | 176.5 | -164.5 | -96.1 | 0 | 0 | 0 | 112.4 | F247 G248 A249 G253 R254 K257 F300 M304 | F247-F251 VanDerWaalsContact O-CB 3.24Å; F247-F251 WeakPolarHBondContact O-CB 3.41Å; F247-F251 PolarHBondContact O-N 3.29Å; G248-F251 PolarHBondContact O-N 3.09Å; A249-F251 VanDerWaalsContact C-N 3.35Å; F251-G253 VanDerWaalsContact C-N 3.34Å; F251-R254 PolarHBondContact O-N 3.41Å; F251-K257 HydrophobicContact CE1-CD 4.35Å; F251-F300 HydrophobicContact CB-CZ 4.47Å; F251-M304 HydrophobicContact CD1-CE 3.71Å; F251-M304 HydrophobicContact CD1-SD 4.13Å; F251-M304 HydrophobicContact CE1-CE 4.1Å |
| 252 | A | 63 | Low | 64 | Low | 16 Ų | 16 | 74.5 Ų | 74.5 | 13% | 0.132 | 39% | 0.385 | C | S | . | . | H | α-helix | trans | -67.7 | -31.9 | 172.4 | 0 | 0 | 0 | 0 | 0 | 113.2 | G248 A249 W250 R254 L262 M304 L308 | G248-A252 PolarHBondContact O-N 2.89Å; A249-A252 PolarHBondContact O-N 2.89Å; W250-A252 VanDerWaalsContact C-N 3.35Å; A252-R254 VanDerWaalsContact C-N 3.27Å; A252-R254 PolarHBondContact O-N 2.84Å; A252-L262 HydrophobicContact CB-CD2 3.74Å; A252-M304 HydrophobicContact CB-CB 4.29Å; A252-M304 HydrophobicContact CB-CG 4.33Å; A252-L308 HydrophobicContact CB-CG 4.49Å |
| 253 | G | 57.6 | Low | 63.6 | Low | 61 Ų | 61 | 73.3 Ų | 73.3 | 63% | 0.629 | 38% | 0.378 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -77.4 | -1.7 | 177.9 | 0 | 0 | 0 | 0 | 0 | 115.4 | A249 W250 F251 P255 | A249-G253 PolarHBondContact O-N 3.14Å; A249-G253 VanDerWaalsContact O-N 3.07Å; W250-G253 PolarHBondContact O-N 3.02Å; F251-G253 VanDerWaalsContact C-N 3.34Å; G253-P255 WeakPolarHBondContact O-CD 3.33Å |
| 254 | R | 64.3 | Low | 63.3 | Low | 134 Ų | 134 | 75 Ų | 75 | 51% | 0.506 | 38% | 0.377 | S | S | . | . | trans | -72.7 | 120.8 | -175.5 | -111.1 | -178.5 | 171.9 | 171.7 | -4 | 111.6 | F251 A252 N256 | F251-R254 PolarHBondContact O-N 3.41Å; A252-R254 VanDerWaalsContact C-N 3.27Å; A252-R254 PolarHBondContact O-N 2.84Å; R254-N256 PolarHBondContact O-N 3.49Å | ||
| 255 | P | 48.4 | Very low | 63.1 | Low | 116 Ų | 116 | 77.7 Ų | 77.7 | 75% | 0.753 | 39% | 0.386 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -74 | 96.6 | 179.5 | 28.8 | -31.3 | 0 | 0 | 0 | 109.4 | G253 | G253-P255 WeakPolarHBondContact O-CD 3.33Š|
| 256 | N | 49.6 | Very low | 62.9 | Low | 170 Ų | 170 | 76.8 Ų | 76.8 | 91% | 0.909 | 38% | 0.378 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 161.3 | 4.8 | 161.8 | -91.9 | -14.8 | 0 | 0 | 0 | 114.3 | R254 | R254-N256 PolarHBondContact O-N 3.49Š|
| 257 | K | 55.1 | Low | 62.7 | Low | 91 Ų | 91 | 71 Ų | 71 | 40% | 0.396 | 35% | 0.353 | S | S | . | . | S | Bend | trans | -102.4 | 134 | 177.3 | -72.2 | -165.4 | 170.7 | -170.8 | 0 | 111.8 | F251 F259 L262 | F251-K257 HydrophobicContact CE1-CD 4.35Å; K257-F259 PolarHBondContact O-N 2.89Å; K257-L262 HydrophobicContact CB-CD1 3.79Å; K257-L262 HydrophobicContact CD-CD1 4.03Å |
| 258 | R | 59.9 | Low | 62.5 | Low | 204 Ų | 204 | 68.6 Ų | 68.6 | 77% | 0.77 | 35% | 0.345 | S | S | * | . | trans | -59.5 | 129.4 | 176.4 | -69.7 | -175.9 | 176.1 | -175.8 | -1.5 | 109.5 | S260 T261 L262 | R258-S260 PolarHBondContact O-N 3.33Å; R258-S260 VanDerWaalsContact O-N 3.12Å; R258-T261 HydrophobicContact CB-CG2 4.22Å; R258-T261 PolarHBondContact O-N 3.14Å; R258-T261 PolarHBondContact O-OG1 2.94Å; R258-L262 PolarHBondContact O-N 2.91Å; R258-L262 VanDerWaalsContact O-N 3.11Å | ||
| 259 | F | 62.3 | Low | 62.5 | Low | 53 Ų | 53 | 69.8 Ų | 69.8 | 23% | 0.232 | 35% | 0.353 | C | S | . | . | H | α-helix | trans | -47.8 | -42.9 | 178.9 | -176.6 | -93 | 0 | 0 | 0 | 112.5 | Y201 K257 L262 M263 L308 M376 | Y201-F259 HydrophobicContact CE1-CE1 4.16Å; Y201-F259 HydrophobicContact CE1-CZ 4.23Å; Y201-F259 WeakPolarHBondContact OH-CE1 3.17Å; K257-F259 PolarHBondContact O-N 2.89Å; F259-L262 PolarHBondContact O-N 3.37Å; F259-M263 HydrophobicContact CD1-CE 4.35Å; F259-M263 HydrophobicContact CE1-CE 3.96Å; F259-M263 WeakPolarHBondContact O-CB 3.44Å; F259-M263 PolarHBondContact O-N 3.32Å; F259-L308 HydrophobicContact CD2-CD2 3.7Å; F259-L308 HydrophobicContact CE2-CB 4.06Å; F259-L308 HydrophobicContact CE2-CD2 3.71Å; F259-L308 HydrophobicContact CE2-CG 4.49Å; F259-L308 WeakPolarHBondContact CE2-O 3.29Å; F259-L308 HydrophobicContact CZ-CB 4.4Å; F259-L308 WeakPolarHBondContact CZ-O 3.43Å; F259-M376 HydrophobicContact CD1-CE 4.48Å |
| 260 | S | 59.9 | Low | 62.5 | Low | 40 Ų | 40 | 67.9 Ų | 67.9 | 28% | 0.28 | 34% | 0.338 | S | S | . | . | H | α-helix | trans | -66.1 | -38.5 | 178.2 | -175.6 | 0 | 0 | 0 | 0 | 113.9 | R258 W264 | R258-S260 PolarHBondContact O-N 3.33Å; R258-S260 VanDerWaalsContact O-N 3.12Å; S260-W264 PolarHBondContact O-N 3.06Å |
| 261 | T | 62 | Low | 62.3 | Low | 59 Ų | 59 | 63.5 Ų | 63.5 | 36% | 0.362 | 32% | 0.324 | S | S | . | . | H | α-helix | trans | -74.8 | -32.2 | 179.4 | 58.3 | 0 | 0 | 0 | 0 | 112.2 | R258 W264 Q265 | R258-T261 HydrophobicContact CB-CG2 4.22Å; R258-T261 PolarHBondContact O-N 3.14Å; R258-T261 PolarHBondContact O-OG1 2.94Å; T261-W264 PolarHBondContact O-N 2.91Å; T261-Q265 WeakPolarHBondContact O-CG 3.49Å; T261-Q265 PolarHBondContact O-N 3.37Å |
| 262 | L | 64.1 | Low | 62.4 | Low | 4 Ų | 4 | 65 Ų | 65 | 2% | 0.021 | 33% | 0.334 | C | S | . | . | H | α-helix | trans | -72.9 | -34.8 | 177.4 | -151 | 142.4 | 0 | 0 | 0 | 111.4 | A252 K257 R258 F259 Q265 S266 M304 L308 | A252-L262 HydrophobicContact CB-CD2 3.74Å; K257-L262 HydrophobicContact CB-CD1 3.79Å; K257-L262 HydrophobicContact CD-CD1 4.03Å; R258-L262 PolarHBondContact O-N 2.91Å; R258-L262 VanDerWaalsContact O-N 3.11Å; F259-L262 PolarHBondContact O-N 3.37Å; L262-Q265 PolarHBondContact O-N 2.86Å; L262-S266 PolarHBondContact O-N 3.48Å; L262-S266 PolarHBondContact O-OG 2.79Å; L262-M304 HydrophobicContact CD2-CB 4.25Å; L262-M304 HydrophobicContact CD2-CE 3.36Å; L262-M304 HydrophobicContact CD2-CG 4.5Å; L262-M304 HydrophobicContact CG-CE 3.64Å; L262-L308 HydrophobicContact CB-CD1 4.21Å; L262-L308 HydrophobicContact CD2-CD1 3.15Å; L262-L308 HydrophobicContact CD2-CD2 4.12Å; L262-L308 HydrophobicContact CD2-CG 3.95Å; L262-L308 HydrophobicContact CG-CD1 4.26Å |
| 263 | M | 63.3 | Low | 62.5 | Low | 5 Ų | 5 | 64.2 Ų | 64.2 | 3% | 0.025 | 33% | 0.328 | C | S | . | . | H | α-helix | trans | -64.7 | -37.8 | 167.8 | -170.2 | 163.6 | 42.8 | 0 | 0 | 111.3 | Y201 M204 F259 Q265 S266 V267 W369 L372 | Y201-M263 HydrophobicContact CE1-CE 4.39Å; Y201-M263 HydrophobicContact CE1-SD 4.08Å; M204-M263 HydrophobicContact SD-SD 4.21Å; F259-M263 HydrophobicContact CD1-CE 4.35Å; F259-M263 HydrophobicContact CE1-CE 3.96Å; F259-M263 WeakPolarHBondContact O-CB 3.44Å; F259-M263 PolarHBondContact O-N 3.32Å; M263-Q265 VanDerWaalsContact C-N 3.34Å; M263-Q265 PolarHBondContact O-N 3.49Å; M263-S266 PolarHBondContact O-N 2.81Å; M263-V267 HydrophobicContact CG-CG2 4.36Å; M263-V267 VanDerWaalsContact O-CG2 3.3Å; M263-V267 WeakPolarHBondContact O-CG2 2.97Å; M263-V267 PolarHBondContact O-N 3.5Å; M263-W369 VanDerWaalsContact C-CH2 3.47Å; M263-W369 HydrophobicContact CB-CH2 4.09Å; M263-W369 HydrophobicContact CB-CZ2 3.84Å; M263-W369 HydrophobicContact CE-CZ2 3.67Å; M263-W369 HydrophobicContact CG-CD2 4.29Å; M263-W369 HydrophobicContact CG-CH2 4.04Å; M263-W369 HydrophobicContact CG-CZ2 3.71Å; M263-W369 HydrophobicContact SD-CZ2 4.28Å; M263-L372 HydrophobicContact CE-CD2 4.48Å |
| 264 | W | 64.4 | Low | 62.8 | Low | 99 Ų | 99 | 61.4 Ų | 61.4 | 38% | 0.375 | 30% | 0.298 | S | S | . | . | H | α-helix | trans | -63.5 | -44 | 177.4 | -88.5 | 102.5 | 0 | 0 | 0 | 110.4 | S260 T261 S266 V267 I268 W369 A373 | S260-W264 PolarHBondContact O-N 3.06Å; T261-W264 PolarHBondContact O-N 2.91Å; W264-S266 VanDerWaalsContact C-N 3.34Å; W264-S266 PolarHBondContact O-N 3.44Å; W264-V267 PolarHBondContact O-N 2.87Å; W264-I268 HydrophobicContact CB-CD1 4.4Å; W264-I268 HydrophobicContact CE3-CD1 4.21Å; W264-I268 HydrophobicContact CE3-CG1 4.39Å; W264-I268 VanDerWaalsContact O-CB 3.24Å; W264-I268 WeakPolarHBondContact O-CB 3.17Å; W264-I268 WeakPolarHBondContact O-CD1 3.24Å; W264-I268 WeakPolarHBondContact O-CG1 3.45Å; W264-I268 PolarHBondContact O-N 3.42Å; W264-W369 HydrophobicContact CB-CH2 3.44Å; W264-W369 VanDerWaalsContact CB-CH2 3.44Å; W264-W369 HydrophobicContact CB-CZ3 3.84Å; W264-W369 AromaticContact CD1-CH2 3.04Å; W264-W369 AromaticContact CD1-CZ2 3.59Å; W264-W369 AromaticContact CD1-CZ3 3.86Å; W264-W369 AromaticContact CD2-CE3 3.97Å; W264-W369 HydrophobicContact CD2-CE3 3.97Å; W264-W369 AromaticContact CD2-CH2 3.05Å; W264-W369 HydrophobicContact CD2-CH2 3.05Å; W264-W369 HydrophobicContact CD2-CZ2 4.08Å; W264-W369 AromaticContact CD2-CZ3 2.94Å; W264-W369 HydrophobicContact CD2-CZ3 2.94Å; W264-W369 AromaticContact CE2-CE3 3.95Å; W264-W369 AromaticContact CE2-CH2 3.16Å; W264-W369 AromaticContact CE2-CZ2 3.75Å; W264-W369 AromaticContact CE2-CZ3 3.24Å; W264-W369 AromaticContact CE3-CE3 3.94Å; W264-W369 HydrophobicContact CE3-CE3 3.94Å; W264-W369 AromaticContact CE3-CH2 3.79Å; W264-W369 HydrophobicContact CE3-CH2 3.79Å; W264-W369 AromaticContact CE3-CZ3 3.12Å; W264-W369 HydrophobicContact CE3-CZ3 3.12Å; W264-W369 AromaticContact CG-CH2 2.91Å; W264-W369 HydrophobicContact CG-CH2 2.91Å; W264-W369 AromaticContact CG-CZ2 3.92Å; W264-W369 HydrophobicContact CG-CZ2 3.92Å; W264-W369 AromaticContact CG-CZ3 3.34Å; W264-W369 HydrophobicContact CG-CZ3 3.34Å; W264-W369 AromaticContact CH2-CE3 3.86Å; W264-W369 HydrophobicContact CH2-CE3 3.86Å; W264-W369 AromaticContact CH2-CZ3 3.8Å; W264-W369 HydrophobicContact CH2-CZ3 3.8Å; W264-W369 HydrophobicContact CZ2-CD2 4.45Å; W264-W369 AromaticContact CZ2-CE3 3.91Å; W264-W369 HydrophobicContact CZ2-CE3 3.91Å; W264-W369 AromaticContact CZ2-CH2 3.94Å; W264-W369 HydrophobicContact CZ2-CH2 3.94Å; W264-W369 HydrophobicContact CZ2-CZ2 4.35Å; W264-W369 AromaticContact CZ2-CZ3 3.67Å; W264-W369 HydrophobicContact CZ2-CZ3 3.67Å; W264-W369 AromaticContact CZ3-CE3 3.87Å; W264-W369 HydrophobicContact CZ3-CE3 3.87Å; W264-W369 HydrophobicContact CZ3-CH2 4.45Å; W264-W369 AromaticContact CZ3-CZ3 3.55Å; W264-W369 HydrophobicContact CZ3-CZ3 3.55Å; W264-W369 AromaticContact NE1-CH2 3.17Å; W264-W369 AromaticContact NE1-CZ2 3.47Å; W264-W369 AromaticContact NE1-CZ3 3.8Å; W264-A373 HydrophobicContact CZ2-CB 3.83Å |
| 265 | Q | 66.6 | Low | 62.9 | Low | 75 Ų | 75 | 59.6 Ų | 59.6 | 35% | 0.35 | 30% | 0.298 | S | S | . | . | H | α-helix | trans | -61.6 | -42.4 | 176.4 | -71.4 | 167.1 | 8.1 | 0 | 0 | 111.6 | T261 L262 M263 C269 M304 | T261-Q265 WeakPolarHBondContact O-CG 3.49Å; T261-Q265 PolarHBondContact O-N 3.37Å; L262-Q265 PolarHBondContact O-N 2.86Å; M263-Q265 VanDerWaalsContact C-N 3.34Å; M263-Q265 PolarHBondContact O-N 3.49Å; Q265-C269 VanDerWaalsContact O-CB 3.29Å; Q265-C269 WeakPolarHBondContact O-CB 3.1Å; Q265-C269 PolarHBondContact O-N 2.8Å; Q265-C269 PolarHBondContact O-SG 3.41Å; Q265-M304 HydrophobicContact CB-CE 4.15Å |
| 266 | S | 64.2 | Low | 63.7 | Low | 0 Ų | 0 | 57 Ų | 57 | 0% | 0 | 28% | 0.278 | C | S | . | . | H | α-helix | trans | -65.2 | -47 | 179.8 | -51.7 | 0 | 0 | 0 | 0 | 112.2 | L262 M263 W264 C269 C270 M304 | L262-S266 PolarHBondContact O-N 3.48Å; L262-S266 PolarHBondContact O-OG 2.79Å; M263-S266 PolarHBondContact O-N 2.81Å; W264-S266 VanDerWaalsContact C-N 3.34Å; W264-S266 PolarHBondContact O-N 3.44Å; S266-C269 PolarHBondContact O-N 2.92Å; S266-C270 PolarHBondContact O-N 2.83Å; S266-C270 PolarHBondContact O-SG 3.33Å; S266-M304 WeakPolarHBondContact OG-CB 3.18Å |
| 267 | V | 65.9 | Low | 64.3 | Low | 2 Ų | 2 | 49.7 Ų | 49.7 | 1% | 0.012 | 24% | 0.238 | C | C | . | . | H | α-helix | trans | -65.1 | -45.3 | 178.9 | 174.7 | 0 | 0 | 0 | 0 | 110.2 | M263 W264 C269 C270 L271 I365 V366 W369 | M263-V267 HydrophobicContact CG-CG2 4.36Å; M263-V267 VanDerWaalsContact O-CG2 3.3Å; M263-V267 WeakPolarHBondContact O-CG2 2.97Å; M263-V267 PolarHBondContact O-N 3.5Å; W264-V267 PolarHBondContact O-N 2.87Å; V267-C269 VanDerWaalsContact C-N 3.35Å; V267-C269 PolarHBondContact O-N 3.33Å; V267-C270 PolarHBondContact O-N 2.85Å; V267-L271 WeakPolarHBondContact O-CB 3.32Å; V267-L271 PolarHBondContact O-N 3.46Å; V267-I365 HydrophobicContact CB-CG2 4.49Å; V267-I365 HydrophobicContact CG1-CG2 4.21Å; V267-I365 HydrophobicContact CG2-CG2 3.81Å; V267-V366 HydrophobicContact CG1-CB 4.4Å; V267-V366 HydrophobicContact CG1-CG2 3.43Å; V267-V366 VanDerWaalsContact CG1-CG2 3.43Å; V267-W369 HydrophobicContact CB-CE3 3.99Å; V267-W369 HydrophobicContact CB-CZ3 3.96Å; V267-W369 HydrophobicContact CG1-CE3 4.01Å; V267-W369 HydrophobicContact CG1-CZ3 4.33Å; V267-W369 HydrophobicContact CG2-CD2 4.28Å; V267-W369 HydrophobicContact CG2-CE3 3.69Å; V267-W369 HydrophobicContact CG2-CZ3 3.9Å |
| 268 | I | 69 | Low | 64.6 | Low | 82 Ų | 82 | 50.1 Ų | 50.1 | 42% | 0.421 | 24% | 0.238 | S | C | . | . | H | α-helix | trans | -63.1 | -40.9 | 177.3 | -68.4 | 166.7 | 0 | 0 | 0 | 110.8 | W264 L271 L272 | W264-I268 HydrophobicContact CB-CD1 4.4Å; W264-I268 HydrophobicContact CE3-CD1 4.21Å; W264-I268 HydrophobicContact CE3-CG1 4.39Å; W264-I268 VanDerWaalsContact O-CB 3.24Å; W264-I268 WeakPolarHBondContact O-CB 3.17Å; W264-I268 WeakPolarHBondContact O-CD1 3.24Å; W264-I268 WeakPolarHBondContact O-CG1 3.45Å; W264-I268 PolarHBondContact O-N 3.42Å; I268-L271 PolarHBondContact O-N 2.83Å; I268-L272 HydrophobicContact CG2-CD1 3.81Å; I268-L272 HydrophobicContact CG2-CG 4.3Å; I268-L272 VanDerWaalsContact O-CB 3.26Å; I268-L272 WeakPolarHBondContact O-CB 3.2Å; I268-L272 WeakPolarHBondContact O-CG 3.39Å; I268-L272 PolarHBondContact O-N 3.11Å |
| 269 | C | 67.9 | Low | 64.7 | Low | 24 Ų | 24 | 45.2 Ų | 45.2 | 16% | 0.162 | 23% | 0.226 | C | C | . | . | H | α-helix | trans | -62.9 | -40.7 | 174.1 | -77.7 | 0 | 0 | 0 | 0 | 112.1 | Q265 S266 V267 A273 | Q265-C269 VanDerWaalsContact O-CB 3.29Å; Q265-C269 WeakPolarHBondContact O-CB 3.1Å; Q265-C269 PolarHBondContact O-N 2.8Å; Q265-C269 PolarHBondContact O-SG 3.41Å; S266-C269 PolarHBondContact O-N 2.92Å; V267-C269 VanDerWaalsContact C-N 3.35Å; V267-C269 PolarHBondContact O-N 3.33Å; C269-A273 VanDerWaalsContact O-CB 3.29Å; C269-A273 WeakPolarHBondContact O-CB 2.94Å; C269-A273 PolarHBondContact O-N 2.91Å |
| 270 | C | 66 | Low | 64.5 | Low | 1 Ų | 1 | 43.1 Ų | 43.1 | 1% | 0.007 | 22% | 0.217 | C | C | . | . | H | α-helix | trans | -65.9 | -40.9 | 175.3 | -65.8 | 0 | 0 | 0 | 0 | 111.8 | S266 V267 A273 G274 F298 | S266-C270 PolarHBondContact O-N 2.83Å; S266-C270 PolarHBondContact O-SG 3.33Å; V267-C270 PolarHBondContact O-N 2.85Å; C270-A273 PolarHBondContact O-N 3.48Å; C270-G274 PolarHBondContact O-N 2.86Å; C270-F298 HydrophobicContact CB-CD2 4.34Å; C270-F298 HydrophobicContact CB-CE2 4.21Å |
| 271 | L | 67.6 | Low | 64.5 | Low | 46 Ų | 46 | 44.1 Ų | 44.1 | 24% | 0.241 | 22% | 0.219 | C | C | . | . | H | α-helix | trans | -64.9 | -45.7 | 176 | -120.3 | 176.2 | 0 | 0 | 0 | 111.6 | V267 I268 A273 G274 L275 V366 | V267-L271 WeakPolarHBondContact O-CB 3.32Å; V267-L271 PolarHBondContact O-N 3.46Å; I268-L271 PolarHBondContact O-N 2.83Å; L271-A273 VanDerWaalsContact C-N 3.31Å; L271-A273 PolarHBondContact O-N 3.31Å; L271-G274 PolarHBondContact O-N 2.85Å; L271-L275 HydrophobicContact CD2-CD1 4.33Å; L271-L275 PolarHBondContact O-N 2.91Å; L271-V366 HydrophobicContact CD1-CB 4.47Å; L271-V366 HydrophobicContact CD1-CG2 3.27Å; L271-V366 HydrophobicContact CG-CG2 3.77Å |
| 272 | L | 69.7 | Low | 64.2 | Low | 83 Ų | 83 | 51.4 Ų | 51.4 | 44% | 0.435 | 24% | 0.24 | S | C | . | . | H | α-helix | trans | -61.7 | -40.7 | 175.3 | -84.9 | 168.2 | 0 | 0 | 0 | 110.8 | I268 L275 L276 L297 | I268-L272 HydrophobicContact CG2-CD1 3.81Å; I268-L272 HydrophobicContact CG2-CG 4.3Å; I268-L272 VanDerWaalsContact O-CB 3.26Å; I268-L272 WeakPolarHBondContact O-CB 3.2Å; I268-L272 WeakPolarHBondContact O-CG 3.39Å; I268-L272 PolarHBondContact O-N 3.11Å; L272-L275 PolarHBondContact O-N 3.36Å; L272-L276 HydrophobicContact CB-CD1 4.5Å; L272-L276 WeakPolarHBondContact O-CB 3.05Å; L272-L276 WeakPolarHBondContact O-CD1 3.23Å; L272-L276 VanDerWaalsContact O-CG 3.24Å; L272-L276 WeakPolarHBondContact O-CG 3.29Å; L272-L276 PolarHBondContact O-N 3.29Å; L272-L297 HydrophobicContact CB-CD2 3.92Å |
| 273 | A | 65.4 | Low | 63.8 | Low | 0 Ų | 0 | 59.2 Ų | 59.2 | 0% | 0 | 28% | 0.275 | C | S | . | . | H | α-helix | trans | -63 | -42.6 | 175.6 | 0 | 0 | 0 | 0 | 0 | 111.7 | C269 C270 L271 L276 M277 L297 F298 | C269-A273 VanDerWaalsContact O-CB 3.29Å; C269-A273 WeakPolarHBondContact O-CB 2.94Å; C269-A273 PolarHBondContact O-N 2.91Å; C270-A273 PolarHBondContact O-N 3.48Å; L271-A273 VanDerWaalsContact C-N 3.31Å; L271-A273 PolarHBondContact O-N 3.31Å; A273-L276 PolarHBondContact O-N 3.07Å; A273-M277 WeakPolarHBondContact O-CG 3.4Å; A273-M277 PolarHBondContact O-N 2.86Å; A273-M277 VanDerWaalsContact O-N 3.09Å; A273-L297 HydrophobicContact CB-CB 4.12Å; A273-L297 HydrophobicContact CB-CD2 4.12Å; A273-L297 HydrophobicContact CB-CG 4.26Å; A273-F298 HydrophobicContact CB-CB 3.8Å; A273-F298 HydrophobicContact CB-CD2 4.22Å |
| 274 | G | 63.9 | Low | 63.5 | Low | 1 Ų | 1 | 62.1 Ų | 62.1 | 1% | 0.01 | 31% | 0.306 | C | S | . | . | H | α-helix | trans | -61.7 | -44 | 173.8 | 0 | 0 | 0 | 0 | 0 | 112.6 | C270 L271 M277 W278 T359 | C270-G274 PolarHBondContact O-N 2.86Å; L271-G274 PolarHBondContact O-N 2.85Å; G274-M277 WeakPolarHBondContact O-CB 3.27Å; G274-M277 PolarHBondContact O-N 2.96Å; G274-W278 VanDerWaalsContact O-CD1 3.27Å; G274-T359 VanDerWaalsContact C-CG2 3.47Å; G274-T359 WeakPolarHBondContact O-CG2 3.48Å |
| 275 | L | 66.4 | Low | 63 | Low | 96 Ų | 96 | 61.6 Ų | 61.6 | 50% | 0.503 | 31% | 0.313 | S | S | . | . | H | α-helix | trans | -67.6 | -40.6 | 176.5 | -78 | 164.4 | 0 | 0 | 0 | 112.5 | L271 L272 M277 W278 | L271-L275 HydrophobicContact CD2-CD1 4.33Å; L271-L275 PolarHBondContact O-N 2.91Å; L272-L275 PolarHBondContact O-N 3.36Å; L275-M277 PolarHBondContact O-N 3.27Å; L275-W278 WeakPolarHBondContact O-CB 3.26Å; L275-W278 PolarHBondContact O-N 2.97Å |
| 276 | L | 64.1 | Low | 62.5 | Low | 62 Ų | 62 | 61.8 Ų | 61.8 | 33% | 0.325 | 32% | 0.315 | S | S | . | . | H | α-helix | trans | -64.5 | -20.5 | 175.6 | -81.2 | 158.5 | 0 | 0 | 0 | 112.2 | L272 A273 I279 P280 P294 L297 | L272-L276 HydrophobicContact CB-CD1 4.5Å; L272-L276 WeakPolarHBondContact O-CB 3.05Å; L272-L276 WeakPolarHBondContact O-CD1 3.23Å; L272-L276 VanDerWaalsContact O-CG 3.24Å; L272-L276 WeakPolarHBondContact O-CG 3.29Å; L272-L276 PolarHBondContact O-N 3.29Å; A273-L276 PolarHBondContact O-N 3.07Å; L276-I279 HydrophobicContact CD2-CD1 3.9Å; L276-P280 WeakPolarHBondContact O-CD 3.3Å; L276-P294 HydrophobicContact CB-CB 4.29Å; L276-P294 HydrophobicContact CB-CG 4.16Å; L276-L297 HydrophobicContact CD1-CD2 3.46Å; L276-L297 VanDerWaalsContact CD1-CD2 3.46Å |
| 277 | M | 62.6 | Low | 62.3 | Low | 16 Ų | 16 | 65.7 Ų | 65.7 | 8% | 0.079 | 34% | 0.336 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -81.5 | -13.2 | 170.8 | -79.4 | -168.5 | 139.9 | 0 | 0 | 114.5 | F215 A273 G274 L275 P280 L291 P294 M358 | F215-M277 HydrophobicContact CD2-CE 3.77Å; F215-M277 HydrophobicContact CE2-CE 3.72Å; A273-M277 WeakPolarHBondContact O-CG 3.4Å; A273-M277 PolarHBondContact O-N 2.86Å; A273-M277 VanDerWaalsContact O-N 3.09Å; G274-M277 WeakPolarHBondContact O-CB 3.27Å; G274-M277 PolarHBondContact O-N 2.96Å; L275-M277 PolarHBondContact O-N 3.27Å; M277-P280 VanDerWaalsContact C-CD 3.45Å; M277-P280 VanDerWaalsContact O-CD 3.32Å; M277-P280 WeakPolarHBondContact O-CD 3.19Å; M277-L291 HydrophobicContact CE-CG 4.44Å; M277-P294 HydrophobicContact CE-CB 4.47Å; M277-P294 HydrophobicContact CG-CB 3.47Å; M277-P294 VanDerWaalsContact CG-CB 3.47Å; M277-P294 HydrophobicContact CG-CG 3.93Å; M277-M358 HydrophobicContact CE-SD 3.8Å; M277-M358 HydrophobicContact SD-CB 4.36Å; M277-M358 HydrophobicContact SD-CE 4.02Å; M277-M358 HydrophobicContact SD-CG 4.27Å; M277-M358 HydrophobicContact SD-SD 3.18Å |
| 278 | W | 60.7 | Low | 62.1 | Low | 101 Ų | 101 | 67 Ų | 67 | 38% | 0.383 | 34% | 0.344 | S | S | . | . | H | α-helix | trans | -82.6 | -29.8 | 172.7 | -79.9 | 50.5 | 0 | 0 | 0 | 112.3 | G274 L275 P280 D281 W282 G355 L356 T359 | G274-W278 VanDerWaalsContact O-CD1 3.27Å; L275-W278 WeakPolarHBondContact O-CB 3.26Å; L275-W278 PolarHBondContact O-N 2.97Å; W278-P280 VanDerWaalsContact C-CD 3.43Å; W278-D281 PolarHBondContact O-N 3.24Å; W278-W282 PolarHBondContact O-N 3.44Å; W278-G355 PolarHBondContact NE1-O 2.94Å; W278-L356 HydrophobicContact CZ2-CB 4.39Å; W278-L356 HydrophobicContact CZ2-CG 4.43Å; W278-T359 PolarHBondContact NE1-OG1 2.95Å |
| 279 | I | 62.7 | Low | 61.8 | Low | 101 Ų | 101 | 71.1 Ų | 71.1 | 52% | 0.518 | 35% | 0.354 | S | S | . | . | H | α-helix | trans | -57.6 | -41.7 | 179.8 | -52.7 | -178.1 | 0 | 0 | 0 | 113.3 | L276 F283 | L276-I279 HydrophobicContact CD2-CD1 3.9Å; I279-F283 PolarHBondContact O-N 3.25Å |
| 280 | P | 59 | Low | 61.6 | Low | 8 Ų | 8 | 72.6 Ų | 72.6 | 5% | 0.052 | 36% | 0.362 | C | S | . | . | H | α-helix | trans | -74.5 | -32.2 | -178.9 | -14.9 | 32.8 | 0 | 0 | 0 | 112.4 | L276 M277 W278 W282 F283 G284 T290 | L276-P280 WeakPolarHBondContact O-CD 3.3Å; M277-P280 VanDerWaalsContact C-CD 3.45Å; M277-P280 VanDerWaalsContact O-CD 3.32Å; M277-P280 WeakPolarHBondContact O-CD 3.19Å; W278-P280 VanDerWaalsContact C-CD 3.43Å; P280-W282 VanDerWaalsContact C-N 3.28Å; P280-W282 PolarHBondContact O-N 2.92Å; P280-F283 PolarHBondContact O-N 2.77Å; P280-G284 PolarHBondContact O-N 2.99Å; P280-T290 HydrophobicContact CB-CG2 3.69Å; P280-T290 HydrophobicContact CG-CG2 3.34Å |
| 281 | D | 58.6 | Low | 61.5 | Low | 61 Ų | 61 | 73.5 Ų | 73.5 | 33% | 0.326 | 37% | 0.367 | S | S | . | . | H | α-helix | trans | -63.4 | -37.1 | 176.8 | -169 | 58 | 0 | 0 | 0 | 110.9 | W278 Q351 G352 | W278-D281 PolarHBondContact O-N 3.24Å; D281-Q351 HydrophobicContact CB-CB 4.3Å; D281-Q351 WeakPolarHBondContact OD1-CB 3.4Å; D281-G352 VanDerWaalsContact CG-N 3.27Å; D281-G352 PolarHBondContact OD1-N 3.04Å; D281-G352 VanDerWaalsContact OD2-CA 3.3Å; D281-G352 WeakPolarHBondContact OD2-CA 3.26Å |
| 282 | W | 56.6 | Low | 61.5 | Low | 213 Ų | 213 | 71.6 Ų | 71.6 | 81% | 0.807 | 36% | 0.357 | S | S | * | . | H | α-helix | trans | -72.5 | -29.9 | 176.1 | -84.4 | 46.9 | 0 | 0 | 0 | 114 | W278 P280 | W278-W282 PolarHBondContact O-N 3.44Å; P280-W282 VanDerWaalsContact C-N 3.28Å; P280-W282 PolarHBondContact O-N 2.92Å |
| 283 | F | 56 | Low | 61.4 | Low | 168 Ų | 168 | 71.8 Ų | 71.8 | 74% | 0.737 | 36% | 0.361 | S | S | * | . | H | α-helix | trans | -87.1 | -11.4 | -178.8 | -113.9 | -94.8 | 0 | 0 | 0 | 113.5 | I279 P280 V285 | I279-F283 PolarHBondContact O-N 3.25Å; P280-F283 PolarHBondContact O-N 2.77Å; F283-V285 PolarHBondContact O-N 3.09Å |
| 284 | G | 56.3 | Low | 61.5 | Low | 66 Ų | 66 | 72 Ų | 72 | 68% | 0.68 | 36% | 0.363 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 64 | 8.2 | 178.8 | 0 | 0 | 0 | 0 | 0 | 114.9 | P280 | P280-G284 PolarHBondContact O-N 2.99Š|
| 285 | V | 53.5 | Low | 61.7 | Low | 87 Ų | 87 | 72 Ų | 72 | 53% | 0.527 | 36% | 0.362 | S | S | . | . | trans | -100.7 | 96 | 179.4 | -175.4 | 0 | 0 | 0 | 0 | 108.9 | F283 N287 | F283-V285 PolarHBondContact O-N 3.09Å; V285-N287 PolarHBondContact O-N 3.43Å | ||
| 286 | M | 56 | Low | 61.9 | Low | 79 Ų | 79 | 68.7 Ų | 68.7 | 39% | 0.389 | 35% | 0.349 | S | S | . | . | trans | -71.4 | 92.7 | 171.7 | -72.7 | -176.1 | 61.1 | 0 | 0 | 110.1 | V226 | V226-M286 HydrophobicContact CB-CE 4.14Å; V226-M286 HydrophobicContact CG1-CE 3.43Å; V226-M286 VanDerWaalsContact CG1-CE 3.43Å; V226-M286 HydrophobicContact CG1-SD 4.09Å | ||
| 287 | N | 60.8 | Low | 62.3 | Low | 83 Ų | 83 | 68 Ų | 68 | 44% | 0.444 | 35% | 0.346 | S | S | . | . | trans | -114.5 | 136.5 | 171.8 | -153.2 | -26.4 | 0 | 0 | 0 | 110.2 | V285 W289 T290 L291 | V285-N287 PolarHBondContact O-N 3.43Å; N287-W289 PolarHBondContact O-N 3.29Å; N287-T290 PolarHBondContact O-N 2.75Å; N287-T290 PolarHBondContact O-OG1 3.24Å; N287-L291 PolarHBondContact O-N 3.33Å | ||
| 288 | V | 61.8 | Low | 62.6 | Low | 29 Ų | 29 | 67.3 Ų | 67.3 | 18% | 0.176 | 34% | 0.342 | C | S | . | . | H | α-helix | trans | -53.6 | -40.3 | -176.8 | 174.8 | 0 | 0 | 0 | 0 | 111.1 | L227 L229 L237 T290 L291 L292 | L227-V288 HydrophobicContact CD1-CG2 3.93Å; L229-V288 HydrophobicContact CD1-CG2 3.82Å; L237-V288 HydrophobicContact CD1-CG1 3.56Å; L237-V288 HydrophobicContact CD2-CG1 3.62Å; L237-V288 HydrophobicContact CG-CG1 4.27Å; V288-T290 VanDerWaalsContact C-N 3.31Å; V288-T290 PolarHBondContact O-N 2.98Å; V288-L291 WeakPolarHBondContact O-CB 3.41Å; V288-L291 PolarHBondContact O-N 2.88Å; V288-L291 VanDerWaalsContact O-N 3.16Å; V288-L292 WeakPolarHBondContact O-CB 3.14Å; V288-L292 PolarHBondContact O-N 3.27Å; V288-L292 VanDerWaalsContact O-N 3.09Å |
| 289 | W | 62.3 | Low | 63.1 | Low | 169 Ų | 169 | 63.4 Ų | 63.4 | 64% | 0.64 | 33% | 0.328 | S | S | * | . | H | α-helix | trans | -63.2 | -34.9 | 179.1 | -71.6 | 100.3 | 0 | 0 | 0 | 113.3 | L240 N287 L291 L292 V293 | L240-W289 HydrophobicContact CD2-CZ3 4.39Å; N287-W289 PolarHBondContact O-N 3.29Å; W289-L291 PolarHBondContact O-N 3.07Å; W289-L292 HydrophobicContact CE3-CD2 4.46Å; W289-L292 HydrophobicContact CZ3-CD2 4.48Å; W289-L292 PolarHBondContact O-N 3.43Å; W289-V293 WeakPolarHBondContact O-CG2 3.39Å; W289-V293 PolarHBondContact O-N 2.86Å |
| 290 | T | 63.2 | Low | 63.5 | Low | 54 Ų | 54 | 61.2 Ų | 61.2 | 33% | 0.331 | 32% | 0.315 | S | S | . | . | H | α-helix | trans | -72.6 | -19.3 | 178.9 | -20.7 | 0 | 0 | 0 | 0 | 112.5 | P280 N287 V288 P294 | P280-T290 HydrophobicContact CB-CG2 3.69Å; P280-T290 HydrophobicContact CG-CG2 3.34Å; N287-T290 PolarHBondContact O-N 2.75Å; N287-T290 PolarHBondContact O-OG1 3.24Å; V288-T290 VanDerWaalsContact C-N 3.31Å; V288-T290 PolarHBondContact O-N 2.98Å; T290-P294 WeakPolarHBondContact O-CD 3.05Å; T290-P294 WeakPolarHBondContact O-CG 3.12Å |
| 291 | L | 64.5 | Low | 63.9 | Low | 20 Ų | 20 | 60.8 Ų | 60.8 | 11% | 0.105 | 31% | 0.312 | C | S | . | . | H | α-helix | trans | -84.9 | -34.5 | 170.9 | -147.1 | 113.2 | 0 | 0 | 0 | 111.5 | F215 L222 M223 M277 N287 V288 W289 A295 | F215-L291 HydrophobicContact CE2-CD2 3.7Å; F215-L291 HydrophobicContact CE2-CG 4.32Å; F215-L291 HydrophobicContact CZ-CD2 3.9Å; L222-L291 HydrophobicContact CD1-CD1 3.93Å; M223-L291 HydrophobicContact CE-CD2 4.13Å; M277-L291 HydrophobicContact CE-CG 4.44Å; N287-L291 PolarHBondContact O-N 3.33Å; V288-L291 WeakPolarHBondContact O-CB 3.41Å; V288-L291 PolarHBondContact O-N 2.88Å; V288-L291 VanDerWaalsContact O-N 3.16Å; W289-L291 PolarHBondContact O-N 3.07Å; L291-A295 WeakPolarHBondContact O-CB 3.49Å; L291-A295 PolarHBondContact O-N 2.76Å |
| 292 | L | 66.6 | Low | 64.4 | Low | 6 Ų | 6 | 57.9 Ų | 57.9 | 3% | 0.031 | 30% | 0.297 | C | S | . | . | H | α-helix | trans | -79.9 | -33.7 | -171.9 | -154.8 | 64.5 | 0 | 0 | 0 | 113.3 | L237 L240 P241 V288 W289 A295 A296 | L237-L292 HydrophobicContact CB-CD1 4.31Å; L237-L292 HydrophobicContact CD2-CD1 4.09Å; L237-L292 HydrophobicContact CD2-CD2 3.5Å; L237-L292 VanDerWaalsContact CD2-CD2 3.5Å; L237-L292 HydrophobicContact CD2-CG 4.43Å; L240-L292 HydrophobicContact CB-CD1 4.43Å; L240-L292 HydrophobicContact CB-CD2 4.23Å; L240-L292 HydrophobicContact CB-CG 4.45Å; L240-L292 HydrophobicContact CD2-CD2 3.14Å; L240-L292 HydrophobicContact CD2-CG 3.68Å; L240-L292 HydrophobicContact CG-CD2 4.26Å; P241-L292 HydrophobicContact CG-CD1 4.37Å; V288-L292 WeakPolarHBondContact O-CB 3.14Å; V288-L292 PolarHBondContact O-N 3.27Å; V288-L292 VanDerWaalsContact O-N 3.09Å; W289-L292 HydrophobicContact CE3-CD2 4.46Å; W289-L292 HydrophobicContact CZ3-CD2 4.48Å; W289-L292 PolarHBondContact O-N 3.43Å; L292-A295 WeakPolarHBondContact O-CB 3.27Å; L292-A295 PolarHBondContact O-N 3.16Å; L292-A296 WeakPolarHBondContact O-CB 3.49Å; L292-A296 PolarHBondContact O-N 3.43Å |
| 293 | V | 68.9 | Low | 64.9 | Low | 87 Ų | 87 | 48.2 Ų | 48.2 | 53% | 0.527 | 26% | 0.263 | S | S | . | . | H | α-helix | trans | -66.4 | -49.3 | 177 | 171.6 | 0 | 0 | 0 | 0 | 112 | W289 A295 A296 L297 | W289-V293 WeakPolarHBondContact O-CG2 3.39Å; W289-V293 PolarHBondContact O-N 2.86Å; V293-A295 VanDerWaalsContact C-N 3.29Å; V293-A295 PolarHBondContact O-N 3.45Å; V293-A296 PolarHBondContact O-N 2.98Å; V293-L297 PolarHBondContact O-N 3.45Å; V293-L297 VanDerWaalsContact O-N 3.09Å |
| 294 | P | 67.5 | Low | 65.5 | Low | 5 Ų | 5 | 40.3 Ų | 40.3 | 3% | 0.032 | 23% | 0.228 | C | C | . | . | H | α-helix | trans | -63.7 | -35.2 | 173.6 | -20.3 | 32 | 0 | 0 | 0 | 112.4 | L276 M277 T290 L297 F298 | L276-P294 HydrophobicContact CB-CB 4.29Å; L276-P294 HydrophobicContact CB-CG 4.16Å; M277-P294 HydrophobicContact CE-CB 4.47Å; M277-P294 HydrophobicContact CG-CB 3.47Å; M277-P294 VanDerWaalsContact CG-CB 3.47Å; M277-P294 HydrophobicContact CG-CG 3.93Å; T290-P294 WeakPolarHBondContact O-CD 3.05Å; T290-P294 WeakPolarHBondContact O-CG 3.12Å; P294-L297 PolarHBondContact O-N 3.49Å; P294-F298 WeakPolarHBondContact O-CB 3.42Å; P294-F298 PolarHBondContact O-N 3.29Å |
| 295 | A | 68.2 | Low | 66.1 | Low | 0 Ų | 0 | 37.4 Ų | 37.4 | 0% | 0 | 20% | 0.197 | C | C | . | . | H | α-helix | trans | -61.4 | -48.8 | 174.8 | 0 | 0 | 0 | 0 | 0 | 111.7 | F215 P241 L291 L292 V293 L297 F298 F299 | F215-A295 HydrophobicContact CD1-CB 4.41Å; F215-A295 HydrophobicContact CD2-CB 4.27Å; F215-A295 HydrophobicContact CE1-CB 3.66Å; F215-A295 HydrophobicContact CE2-CB 3.49Å; F215-A295 VanDerWaalsContact CE2-CB 3.49Å; F215-A295 HydrophobicContact CZ-CB 3.14Å; P241-A295 HydrophobicContact CG-CB 4.47Å; L291-A295 WeakPolarHBondContact O-CB 3.49Å; L291-A295 PolarHBondContact O-N 2.76Å; L292-A295 WeakPolarHBondContact O-CB 3.27Å; L292-A295 PolarHBondContact O-N 3.16Å; V293-A295 VanDerWaalsContact C-N 3.29Å; V293-A295 PolarHBondContact O-N 3.45Å; A295-L297 VanDerWaalsContact C-N 3.26Å; A295-L297 PolarHBondContact O-N 2.88Å; A295-F298 PolarHBondContact O-N 2.81Å; A295-F298 VanDerWaalsContact O-N 3.14Å; A295-F299 WeakPolarHBondContact O-CB 3.43Å; A295-F299 VanDerWaalsContact O-CD2 3.3Å; A295-F299 WeakPolarHBondContact O-CD2 3.46Å; A295-F299 PolarHBondContact O-N 3.39Å |
| 296 | A | 71.1 | Confident | 66.8 | Low | 27 Ų | 27 | 35.6 Ų | 35.6 | 22% | 0.223 | 18% | 0.182 | C | C | . | . | H | α-helix | trans | -58.9 | -39.3 | 176.5 | 0 | 0 | 0 | 0 | 0 | 111.7 | A244 L292 V293 F300 | A244-A296 HydrophobicContact CB-CB 4.07Å; A244-A296 WeakPolarHBondContact CB-O 3.4Å; L292-A296 WeakPolarHBondContact O-CB 3.49Å; L292-A296 PolarHBondContact O-N 3.43Å; V293-A296 PolarHBondContact O-N 2.98Å; A296-F300 VanDerWaalsContact O-CB 3.3Å; A296-F300 WeakPolarHBondContact O-CB 3.29Å; A296-F300 PolarHBondContact O-N 2.86Å |
| 297 | L | 72.3 | Confident | 67.3 | Low | 49 Ų | 49 | 34.5 Ų | 34.5 | 26% | 0.257 | 18% | 0.181 | S | C | . | . | H | α-helix | trans | -67.3 | -39.8 | 176 | -166.4 | 71 | 0 | 0 | 0 | 112.4 | L272 A273 L276 V293 P294 A295 F300 G301 | L272-L297 HydrophobicContact CB-CD2 3.92Å; A273-L297 HydrophobicContact CB-CB 4.12Å; A273-L297 HydrophobicContact CB-CD2 4.12Å; A273-L297 HydrophobicContact CB-CG 4.26Å; L276-L297 HydrophobicContact CD1-CD2 3.46Å; L276-L297 VanDerWaalsContact CD1-CD2 3.46Å; V293-L297 PolarHBondContact O-N 3.45Å; V293-L297 VanDerWaalsContact O-N 3.09Å; P294-L297 PolarHBondContact O-N 3.49Å; A295-L297 VanDerWaalsContact C-N 3.26Å; A295-L297 PolarHBondContact O-N 2.88Å; L297-F300 PolarHBondContact O-N 2.94Å; L297-G301 PolarHBondContact O-N 3.24Å |
| 298 | F | 69 | Low | 67.6 | Low | 0 Ų | 0 | 31.5 Ų | 31.5 | 0% | 0 | 17% | 0.165 | C | C | . | . | H | α-helix | trans | -66.3 | -45.2 | 175.4 | -170.5 | -95.8 | 0 | 0 | 0 | 111.5 | I212 C270 A273 P294 A295 F300 G301 A302 M358 | I212-F298 HydrophobicContact CG1-CD1 4.16Å; I212-F298 HydrophobicContact CG1-CE1 3.69Å; C270-F298 HydrophobicContact CB-CD2 4.34Å; C270-F298 HydrophobicContact CB-CE2 4.21Å; A273-F298 HydrophobicContact CB-CB 3.8Å; A273-F298 HydrophobicContact CB-CD2 4.22Å; P294-F298 WeakPolarHBondContact O-CB 3.42Å; P294-F298 PolarHBondContact O-N 3.29Å; A295-F298 PolarHBondContact O-N 2.81Å; A295-F298 VanDerWaalsContact O-N 3.14Å; F298-F300 VanDerWaalsContact C-N 3.31Å; F298-F300 PolarHBondContact O-N 3.33Å; F298-G301 PolarHBondContact O-N 3.07Å; F298-A302 HydrophobicContact CE1-CB 4.44Å; F298-A302 VanDerWaalsContact O-CB 3.27Å; F298-A302 WeakPolarHBondContact O-CB 3.47Å; F298-A302 PolarHBondContact O-N 3.49Å; F298-M358 HydrophobicContact CB-CE 4.11Å; F298-M358 HydrophobicContact CD1-CE 3.95Å; F298-M358 HydrophobicContact CD2-CE 3.64Å; F298-M358 HydrophobicContact CE1-CE 4.3Å; F298-M358 HydrophobicContact CE2-CE 4.03Å; F298-M358 HydrophobicContact CG-CE 3.6Å; F298-M358 HydrophobicContact CZ-CE 4.36Å |
| 299 | F | 70 | Confident | 67.9 | Low | 20 Ų | 20 | 30.2 Ų | 30.2 | 9% | 0.088 | 16% | 0.157 | C | C | . | . | H | α-helix | trans | -63.5 | -36.1 | 175.4 | -90.8 | -98.5 | 0 | 0 | 0 | 112 | I212 F215 P241 A245 A295 G303 | I212-F299 HydrophobicContact CD1-CE1 4.47Å; I212-F299 HydrophobicContact CG2-CE1 4.17Å; I212-F299 HydrophobicContact CG2-CE2 4.45Å; I212-F299 HydrophobicContact CG2-CZ 3.78Å; F215-F299 AromaticContact CD1-CE2 3.94Å; F215-F299 HydrophobicContact CD1-CE2 3.94Å; F215-F299 HydrophobicContact CE1-CE2 4.31Å; P241-F299 HydrophobicContact CB-CB 4.01Å; P241-F299 HydrophobicContact CB-CD1 3.99Å; P241-F299 HydrophobicContact CB-CD2 3.52Å; P241-F299 HydrophobicContact CB-CE1 4.32Å; P241-F299 HydrophobicContact CB-CE2 3.88Å; P241-F299 HydrophobicContact CB-CG 3.57Å; P241-F299 HydrophobicContact CB-CZ 4.26Å; P241-F299 HydrophobicContact CG-CD2 4.38Å; P241-F299 HydrophobicContact CG-CE2 4.43Å; A245-F299 WeakPolarHBondContact CA-O 3.46Å; A245-F299 HydrophobicContact CB-CB 4.25Å; A245-F299 HydrophobicContact CB-CD1 4.05Å; A295-F299 WeakPolarHBondContact O-CB 3.43Å; A295-F299 VanDerWaalsContact O-CD2 3.3Å; A295-F299 WeakPolarHBondContact O-CD2 3.46Å; A295-F299 PolarHBondContact O-N 3.39Å; F299-G303 WeakPolarHBondContact O-CA 3.35Å; F299-G303 PolarHBondContact O-N 3.17Å |
| 300 | F | 71.2 | Confident | 68.1 | Low | 54 Ų | 54 | 24.3 Ų | 24.3 | 24% | 0.237 | 14% | 0.14 | C | C | . | . | H | α-helix | trans | -63.1 | -48.4 | 172.4 | -174.6 | -93.5 | 0 | 0 | 0 | 111.4 | A244 F247 F251 A296 L297 F298 G303 M304 | A244-F300 HydrophobicContact CB-CB 4.4Å; A244-F300 VanDerWaalsContact O-CD2 3.32Å; A244-F300 WeakPolarHBondContact O-CD2 3.34Å; F247-F300 HydrophobicContact CB-CD2 4.2Å; F247-F300 HydrophobicContact CB-CE2 4Å; F251-F300 HydrophobicContact CB-CZ 4.47Å; A296-F300 VanDerWaalsContact O-CB 3.3Å; A296-F300 WeakPolarHBondContact O-CB 3.29Å; A296-F300 PolarHBondContact O-N 2.86Å; L297-F300 PolarHBondContact O-N 2.94Å; F298-F300 VanDerWaalsContact C-N 3.31Å; F298-F300 PolarHBondContact O-N 3.33Å; F300-G303 PolarHBondContact O-N 3.1Å; F300-M304 HydrophobicContact CD1-SD 3.97Å; F300-M304 HydrophobicContact CE1-SD 3.47Å; F300-M304 WeakPolarHBondContact CE1-SD 3.38Å; F300-M304 HydrophobicContact CZ-SD 4.03Å; F300-M304 WeakPolarHBondContact O-CG 3.48Å; F300-M304 PolarHBondContact O-N 2.87Å; F300-M304 VanDerWaalsContact O-N 3.16Å |
| 301 | G | 68.4 | Low | 68.3 | Low | 0 Ų | 0 | 24.6 Ų | 24.6 | 0% | 0 | 14% | 0.144 | C | C | . | . | H | α-helix | trans | -64.2 | -43.6 | 177 | 0 | 0 | 0 | 0 | 0 | 113.1 | L297 F298 M304 L305 | L297-G301 PolarHBondContact O-N 3.24Å; F298-G301 PolarHBondContact O-N 3.07Å; G301-M304 PolarHBondContact O-N 2.89Å; G301-L305 WeakPolarHBondContact O-CB 3.32Å; G301-L305 PolarHBondContact O-N 2.75Å |
| 302 | A | 68.2 | Low | 68.3 | Low | 0 Ų | 0 | 23.8 Ų | 23.8 | 0% | 0 | 14% | 0.14 | C | C | . | . | H | α-helix | trans | -66.6 | -42.2 | 177.2 | 0 | 0 | 0 | 0 | 0 | 111.2 | I212 F298 M304 L305 F306 | I212-A302 HydrophobicContact CD1-CB 3.83Å; I212-A302 HydrophobicContact CG1-CB 4.27Å; F298-A302 HydrophobicContact CE1-CB 4.44Å; F298-A302 VanDerWaalsContact O-CB 3.27Å; F298-A302 WeakPolarHBondContact O-CB 3.47Å; F298-A302 PolarHBondContact O-N 3.49Å; A302-M304 PolarHBondContact O-N 3.31Å; A302-L305 PolarHBondContact O-N 2.82Å; A302-F306 HydrophobicContact CB-CD2 4.39Å; A302-F306 HydrophobicContact CB-CE2 4Å; A302-F306 WeakPolarHBondContact O-CD2 3.43Å; A302-F306 PolarHBondContact O-N 2.73Å |
| 303 | G | 67.3 | Low | 68.2 | Low | 9 Ų | 9 | 23.5 Ų | 23.5 | 9% | 0.093 | 14% | 0.139 | C | C | . | . | H | α-helix | trans | -58.6 | -32.7 | 175.5 | 0 | 0 | 0 | 0 | 0 | 113.3 | A249 F299 F300 P307 | A249-G303 WeakPolarHBondContact CA-O 3.24Å; F299-G303 WeakPolarHBondContact O-CA 3.35Å; F299-G303 PolarHBondContact O-N 3.17Å; F300-G303 PolarHBondContact O-N 3.1Å; G303-P307 WeakPolarHBondContact O-CD 3.49Å |
| 304 | M | 68.2 | Low | 67.9 | Low | 2 Ų | 2 | 22.4 Ų | 22.4 | 1% | 0.01 | 13% | 0.129 | C | C | . | . | H | α-helix | trans | -74.9 | -39.8 | 169.7 | -68.1 | 172.1 | 66.2 | 0 | 0 | 112.4 | G248 F251 A252 L262 Q265 S266 F300 G301 A302 P307 L308 | G248-M304 WeakPolarHBondContact O-CG 3.45Å; F251-M304 HydrophobicContact CD1-CE 3.71Å; F251-M304 HydrophobicContact CD1-SD 4.13Å; F251-M304 HydrophobicContact CE1-CE 4.1Å; A252-M304 HydrophobicContact CB-CB 4.29Å; A252-M304 HydrophobicContact CB-CG 4.33Å; L262-M304 HydrophobicContact CD2-CB 4.25Å; L262-M304 HydrophobicContact CD2-CE 3.36Å; L262-M304 HydrophobicContact CD2-CG 4.5Å; L262-M304 HydrophobicContact CG-CE 3.64Å; Q265-M304 HydrophobicContact CB-CE 4.15Å; S266-M304 WeakPolarHBondContact OG-CB 3.18Å; F300-M304 HydrophobicContact CD1-SD 3.97Å; F300-M304 HydrophobicContact CE1-SD 3.47Å; F300-M304 WeakPolarHBondContact CE1-SD 3.38Å; F300-M304 HydrophobicContact CZ-SD 4.03Å; F300-M304 WeakPolarHBondContact O-CG 3.48Å; F300-M304 PolarHBondContact O-N 2.87Å; F300-M304 VanDerWaalsContact O-N 3.16Å; G301-M304 PolarHBondContact O-N 2.89Å; A302-M304 PolarHBondContact O-N 3.31Å; M304-P307 WeakPolarHBondContact O-CD 3.5Å; M304-L308 VanDerWaalsContact O-CD1 3.29Å; M304-L308 WeakPolarHBondContact O-CD1 3.24Å; M304-L308 VanDerWaalsContact O-CG 3.25Å; M304-L308 WeakPolarHBondContact O-CG 3.31Å |
| 305 | L | 69.5 | Low | 67.9 | Low | 5 Ų | 5 | 28.5 Ų | 28.5 | 3% | 0.026 | 16% | 0.157 | C | C | . | . | H | α-helix | trans | -69.3 | -40.2 | -175.1 | -167.6 | 150 | 0 | 0 | 0 | 113 | M204 L205 G301 A302 L308 A309 I365 | M204-L305 HydrophobicContact CB-CD2 4.39Å; L205-L305 HydrophobicContact CD2-CD2 4.19Å; L205-L305 HydrophobicContact CG-CD2 4.46Å; G301-L305 WeakPolarHBondContact O-CB 3.32Å; G301-L305 PolarHBondContact O-N 2.75Å; A302-L305 PolarHBondContact O-N 2.82Å; L305-L308 PolarHBondContact O-N 3.48Å; L305-A309 HydrophobicContact CD2-CB 3.97Å; L305-A309 VanDerWaalsContact O-CB 3.23Å; L305-A309 WeakPolarHBondContact O-CB 3.17Å; L305-A309 PolarHBondContact O-N 3.12Å; L305-I365 HydrophobicContact CD1-CG2 4.24Å |
| 306 | F | 67.9 | Low | 67.6 | Low | 49 Ų | 49 | 31.9 Ų | 31.9 | 22% | 0.215 | 18% | 0.179 | C | C | . | . | H | α-helix | trans | -58.4 | -53.6 | -175.8 | -79.6 | -82.2 | 0 | 0 | 0 | 113.5 | L205 L209 I212 A302 T310 | L205-F306 HydrophobicContact CD2-CD1 3.86Å; L205-F306 HydrophobicContact CD2-CE1 4.48Å; L209-F306 HydrophobicContact CB-CE1 4.1Å; L209-F306 HydrophobicContact CB-CZ 3.89Å; L209-F306 HydrophobicContact CD1-CE1 3.91Å; L209-F306 HydrophobicContact CD1-CZ 3.55Å; L209-F306 HydrophobicContact CG-CZ 4.33Å; I212-F306 HydrophobicContact CD1-CE2 3.62Å; I212-F306 HydrophobicContact CD1-CZ 4.03Å; A302-F306 HydrophobicContact CB-CD2 4.39Å; A302-F306 HydrophobicContact CB-CE2 4Å; A302-F306 WeakPolarHBondContact O-CD2 3.43Å; A302-F306 PolarHBondContact O-N 2.73Å; F306-T310 VanDerWaalsContact O-CB 3.24Å; F306-T310 WeakPolarHBondContact O-CB 3.23Å; F306-T310 PolarHBondContact O-N 2.78Å; F306-T310 PolarHBondContact O-OG1 3.09Å |
| 307 | P | 66.2 | Low | 67.3 | Low | 57 Ų | 57 | 32.1 Ų | 32.1 | 37% | 0.37 | 18% | 0.175 | S | C | . | . | H | α-helix | trans | -66.1 | -40.2 | -179.7 | -20.4 | 34 | 0 | 0 | 0 | 112.1 | G303 M304 S311 | G303-P307 WeakPolarHBondContact O-CD 3.49Å; M304-P307 WeakPolarHBondContact O-CD 3.5Å; P307-S311 VanDerWaalsContact O-CB 3.29Å; P307-S311 WeakPolarHBondContact O-CB 3.01Å; P307-S311 PolarHBondContact O-N 2.8Å; P307-S311 PolarHBondContact O-OG 2.86Å |
| 308 | L | 67.1 | Low | 66.6 | Low | 19 Ų | 19 | 34.8 Ų | 34.8 | 10% | 0.099 | 20% | 0.195 | C | C | . | . | H | α-helix | trans | -65.2 | -52.3 | -179.6 | -72 | 173.6 | 0 | 0 | 0 | 112.2 | A252 F259 L262 M304 L305 T310 S311 G312 | A252-L308 HydrophobicContact CB-CG 4.49Å; F259-L308 HydrophobicContact CD2-CD2 3.7Å; F259-L308 HydrophobicContact CE2-CB 4.06Å; F259-L308 HydrophobicContact CE2-CD2 3.71Å; F259-L308 HydrophobicContact CE2-CG 4.49Å; F259-L308 WeakPolarHBondContact CE2-O 3.29Å; F259-L308 HydrophobicContact CZ-CB 4.4Å; F259-L308 WeakPolarHBondContact CZ-O 3.43Å; L262-L308 HydrophobicContact CB-CD1 4.21Å; L262-L308 HydrophobicContact CD2-CD1 3.15Å; L262-L308 HydrophobicContact CD2-CD2 4.12Å; L262-L308 HydrophobicContact CD2-CG 3.95Å; L262-L308 HydrophobicContact CG-CD1 4.26Å; M304-L308 VanDerWaalsContact O-CD1 3.29Å; M304-L308 WeakPolarHBondContact O-CD1 3.24Å; M304-L308 VanDerWaalsContact O-CG 3.25Å; M304-L308 WeakPolarHBondContact O-CG 3.31Å; L305-L308 PolarHBondContact O-N 3.48Å; L308-T310 VanDerWaalsContact C-N 3.32Å; L308-T310 PolarHBondContact O-N 3.46Å; L308-S311 PolarHBondContact O-N 2.91Å; L308-G312 PolarHBondContact O-N 3.29Å |
| 309 | A | 67.5 | Low | 66.1 | Low | 2 Ų | 2 | 44.6 Ų | 44.6 | 2% | 0.017 | 24% | 0.238 | C | C | . | . | H | α-helix | trans | -69.4 | -33.2 | -177.3 | 0 | 0 | 0 | 0 | 0 | 111.4 | Y201 L205 L305 A313 | Y201-A309 HydrophobicContact CD1-CB 4.28Å; L205-A309 HydrophobicContact CD1-CB 3.78Å; L205-A309 HydrophobicContact CD2-CB 3.82Å; L205-A309 HydrophobicContact CG-CB 3.53Å; L305-A309 HydrophobicContact CD2-CB 3.97Å; L305-A309 VanDerWaalsContact O-CB 3.23Å; L305-A309 WeakPolarHBondContact O-CB 3.17Å; L305-A309 PolarHBondContact O-N 3.12Å; A309-A313 WeakPolarHBondContact O-CB 3.44Å; A309-A313 PolarHBondContact O-N 3.29Å |
| 310 | T | 66.8 | Low | 65.7 | Low | 46 Ų | 46 | 45.9 Ų | 45.9 | 28% | 0.282 | 25% | 0.246 | S | C | . | . | H | α-helix | trans | -65.6 | -42.9 | 172.3 | -55.4 | 0 | 0 | 0 | 0 | 110.9 | F306 L308 A313 M314 | F306-T310 VanDerWaalsContact O-CB 3.24Å; F306-T310 WeakPolarHBondContact O-CB 3.23Å; F306-T310 PolarHBondContact O-N 2.78Å; F306-T310 PolarHBondContact O-OG1 3.09Å; L308-T310 VanDerWaalsContact C-N 3.32Å; L308-T310 PolarHBondContact O-N 3.46Å; T310-A313 PolarHBondContact O-N 3.04Å; T310-M314 HydrophobicContact CG2-CE 3.93Å; T310-M314 HydrophobicContact CG2-SD 4.34Å; T310-M314 WeakPolarHBondContact O-CB 3.37Å; T310-M314 VanDerWaalsContact O-CG 3.31Å; T310-M314 WeakPolarHBondContact O-CG 3.46Å; T310-M314 PolarHBondContact O-N 3.07Å; T310-M314 VanDerWaalsContact O-N 3.12Å |
| 311 | S | 66.9 | Low | 65.1 | Low | 60 Ų | 60 | 44.5 Ų | 44.5 | 42% | 0.42 | 24% | 0.244 | S | C | . | . | H | α-helix | trans | -66.6 | -46.4 | 178 | -56.2 | 0 | 0 | 0 | 0 | 111.3 | P307 L308 A313 M314 E315 | P307-S311 VanDerWaalsContact O-CB 3.29Å; P307-S311 WeakPolarHBondContact O-CB 3.01Å; P307-S311 PolarHBondContact O-N 2.8Å; P307-S311 PolarHBondContact O-OG 2.86Å; L308-S311 PolarHBondContact O-N 2.91Å; S311-A313 VanDerWaalsContact C-N 3.29Å; S311-A313 PolarHBondContact O-N 3.18Å; S311-M314 CarbonylContact O-C 3.59Å; S311-M314 PolarHBondContact O-N 3.42Å; S311-E315 WeakPolarHBondContact O-CG 3.19Å; S311-E315 PolarHBondContact O-N 3.47Å |
| 312 | G | 65.3 | Low | 64.8 | Low | 2 Ų | 2 | 46.4 Ų | 46.4 | 2% | 0.021 | 27% | 0.265 | C | S | . | . | H | α-helix | trans | -64.5 | -29.7 | 176.6 | 0 | 0 | 0 | 0 | 0 | 113.7 | L308 M314 P316 | L308-G312 PolarHBondContact O-N 3.29Å; G312-M314 VanDerWaalsContact C-N 3.35Å; G312-P316 WeakPolarHBondContact O-CD 3.32Å |
| 313 | A | 64.8 | Low | 64.6 | Low | 1 Ų | 1 | 47.7 Ų | 47.7 | 1% | 0.008 | 27% | 0.272 | C | S | . | . | H | α-helix | trans | -73 | -27 | 171.5 | 0 | 0 | 0 | 0 | 0 | 112.9 | F198 A309 T310 S311 V328 | F198-A313 HydrophobicContact CD2-CB 4.12Å; F198-A313 HydrophobicContact CE2-CB 4.06Å; A309-A313 WeakPolarHBondContact O-CB 3.44Å; A309-A313 PolarHBondContact O-N 3.29Å; T310-A313 PolarHBondContact O-N 3.04Å; S311-A313 VanDerWaalsContact C-N 3.29Å; S311-A313 PolarHBondContact O-N 3.18Å; A313-V328 HydrophobicContact CB-CG2 4.27Å |
| 314 | M | 63.4 | Low | 64.4 | Low | 64 Ų | 64 | 47.3 Ų | 47.3 | 32% | 0.315 | 27% | 0.268 | S | S | . | . | H | α-helix | trans | -92.5 | -31.8 | -178.3 | -72.7 | -170.9 | -179.4 | 0 | 0 | 114.2 | T310 S311 G312 F317 | T310-M314 HydrophobicContact CG2-CE 3.93Å; T310-M314 HydrophobicContact CG2-SD 4.34Å; T310-M314 WeakPolarHBondContact O-CB 3.37Å; T310-M314 VanDerWaalsContact O-CG 3.31Å; T310-M314 WeakPolarHBondContact O-CG 3.46Å; T310-M314 PolarHBondContact O-N 3.07Å; T310-M314 VanDerWaalsContact O-N 3.12Å; S311-M314 CarbonylContact O-C 3.59Å; S311-M314 PolarHBondContact O-N 3.42Å; G312-M314 VanDerWaalsContact C-N 3.35Å; M314-F317 CarbonylContact O-C 3.42Å; M314-F317 PolarHBondContact O-N 2.89Å |
| 315 | E | 65.9 | Low | 64.3 | Low | 133 Ų | 133 | 48 Ų | 48 | 62% | 0.621 | 28% | 0.276 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -46.5 | -47.9 | 177.7 | -85.1 | 174.7 | 172.5 | 0 | 0 | 114.2 | S311 F317 | S311-E315 WeakPolarHBondContact O-CG 3.19Å; S311-E315 PolarHBondContact O-N 3.47Å; E315-F317 VanDerWaalsContact C-N 3.28Å; E315-F317 PolarHBondContact O-N 3.42Å |
| 316 | P | 63.1 | Low | 64.1 | Low | 71 Ų | 71 | 48.6 Ų | 48.6 | 46% | 0.461 | 28% | 0.281 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -76.3 | -10.8 | -179.8 | 26.7 | -32.3 | 0 | 0 | 0 | 114.3 | G312 | G312-P316 WeakPolarHBondContact O-CD 3.32Š|
| 317 | F | 63.8 | Low | 64.2 | Low | 31 Ų | 31 | 46.2 Ų | 46.2 | 14% | 0.136 | 27% | 0.271 | C | S | . | . | trans | -132.3 | 59.5 | -173.7 | -60.8 | -70 | 0 | 0 | 0 | 114.7 | L192 N195 F198 M314 E315 F319 L320 A321 | L192-F317 HydrophobicContact CD2-CD1 4.35Å; L192-F317 HydrophobicContact CD2-CD2 3.72Å; L192-F317 HydrophobicContact CD2-CE1 4.41Å; L192-F317 HydrophobicContact CD2-CE2 3.8Å; L192-F317 HydrophobicContact CD2-CG 4.01Å; L192-F317 HydrophobicContact CD2-CZ 4.13Å; N195-F317 HydrophobicContact CB-CE2 4.5Å; N195-F317 HydrophobicContact CB-CZ 4.06Å; N195-F317 WeakPolarHBondContact ND2-CZ 3.19Å; F198-F317 HydrophobicContact CB-CE2 4.13Å; F198-F317 HydrophobicContact CD2-CD2 4.3Å; F198-F317 HydrophobicContact CD2-CE2 4.25Å; F198-F317 HydrophobicContact CG-CE2 4.42Å; M314-F317 CarbonylContact O-C 3.42Å; M314-F317 PolarHBondContact O-N 2.89Å; E315-F317 VanDerWaalsContact C-N 3.28Å; E315-F317 PolarHBondContact O-N 3.42Å; F317-F319 VanDerWaalsContact C-N 3.26Å; F317-F319 PolarHBondContact O-N 3.11Å; F317-L320 HydrophobicContact CB-CB 4.27Å; F317-L320 CarbonylContact O-C 3.52Å; F317-L320 PolarHBondContact O-N 3.34Å; F317-L320 VanDerWaalsContact O-N 3.08Å; F317-A321 PolarHBondContact O-N 3.44Å; F317-A321 VanDerWaalsContact O-N 3.09Å | ||
| 318 | P | 58.4 | Low | 64.4 | Low | 105 Ų | 105 | 43.9 Ų | 43.9 | 68% | 0.682 | 26% | 0.256 | S | S | * | . | G | 310 helix | trans | -57.8 | -38.1 | 179.2 | -20.8 | 31.2 | 0 | 0 | 0 | 113 | L320 | P318-L320 VanDerWaalsContact C-N 3.29Å; P318-L320 PolarHBondContact O-N 2.78Å |
| 319 | F | 57.3 | Low | 64.5 | Low | 206 Ų | 206 | 43.1 Ų | 43.1 | 90% | 0.904 | 25% | 0.252 | S | S | * | . | G | 310 helix | trans | -72.2 | -20.8 | -178.5 | -123 | -87.6 | 0 | 0 | 0 | 113.4 | F317 | F317-F319 VanDerWaalsContact C-N 3.26Å; F317-F319 PolarHBondContact O-N 3.11Å |
| 320 | L | 61.6 | Low | 64.6 | Low | 47 Ų | 47 | 43 Ų | 43 | 25% | 0.246 | 25% | 0.251 | C | S | . | . | G | 310 helix | trans | -115.4 | 14.3 | -177.7 | -75.4 | 91.6 | 0 | 0 | 0 | 112.5 | F317 P318 G322 T323 A324 | F317-L320 HydrophobicContact CB-CB 4.27Å; F317-L320 CarbonylContact O-C 3.52Å; F317-L320 PolarHBondContact O-N 3.34Å; F317-L320 VanDerWaalsContact O-N 3.08Å; P318-L320 VanDerWaalsContact C-N 3.29Å; P318-L320 PolarHBondContact O-N 2.78Å; L320-G322 PolarHBondContact O-N 2.69Å; L320-G322 VanDerWaalsContact O-N 3.07Å; L320-T323 WeakPolarHBondContact CB-OG1 3.31Å; L320-T323 PolarHBondContact O-N 3.12Å; L320-T323 PolarHBondContact O-OG1 3.05Å; L320-A324 WeakPolarHBondContact O-CB 3.36Å; L320-A324 PolarHBondContact O-N 3.28Å |
| 321 | A | 59.9 | Low | 65 | Low | 25 Ų | 25 | 42.5 Ų | 42.5 | 21% | 0.207 | 25% | 0.246 | C | C | . | . | H | α-helix | trans | -54.4 | -35.2 | -172.6 | 0 | 0 | 0 | 0 | 0 | 114 | F317 G325 | F317-A321 PolarHBondContact O-N 3.44Å; F317-A321 VanDerWaalsContact O-N 3.09Å; A321-G325 PolarHBondContact O-N 2.91Å |
| 322 | G | 60.8 | Low | 65.3 | Low | 41 Ų | 41 | 40.6 Ų | 40.6 | 42% | 0.423 | 23% | 0.231 | S | C | . | . | H | α-helix | trans | -66.4 | -49.1 | 176.3 | 0 | 0 | 0 | 0 | 0 | 112.8 | L320 G325 A326 | L320-G322 PolarHBondContact O-N 2.69Å; L320-G322 VanDerWaalsContact O-N 3.07Å; G322-G325 PolarHBondContact O-N 3.43Å; G322-A326 PolarHBondContact O-N 3.32Å |
| 323 | T | 64.4 | Low | 65.8 | Low | 27 Ų | 27 | 41 Ų | 41 | 17% | 0.166 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -67.1 | -37.9 | 176.3 | 47.8 | 0 | 0 | 0 | 0 | 112.1 | L185 L320 A326 L327 | L185-T323 HydrophobicContact CD2-CG2 3.53Å; L320-T323 WeakPolarHBondContact CB-OG1 3.31Å; L320-T323 PolarHBondContact O-N 3.12Å; L320-T323 PolarHBondContact O-OG1 3.05Å; T323-A326 PolarHBondContact O-N 3.47Å; T323-L327 WeakPolarHBondContact O-CB 3.31Å; T323-L327 PolarHBondContact O-N 2.75Å |
| 324 | A | 64.5 | Low | 66.3 | Low | 1 Ų | 1 | 42.9 Ų | 42.9 | 1% | 0.008 | 24% | 0.242 | C | C | . | . | H | α-helix | trans | -63.5 | -45.5 | 176.1 | 0 | 0 | 0 | 0 | 0 | 110.7 | L192 F198 L320 L327 V328 | L192-A324 HydrophobicContact CD2-CB 4.42Å; F198-A324 HydrophobicContact CE2-CB 4.06Å; F198-A324 HydrophobicContact CZ-CB 4.44Å; L320-A324 WeakPolarHBondContact O-CB 3.36Å; L320-A324 PolarHBondContact O-N 3.28Å; A324-L327 PolarHBondContact O-N 2.93Å; A324-V328 VanDerWaalsContact O-CB 3.32Å; A324-V328 WeakPolarHBondContact O-CB 3.21Å; A324-V328 WeakPolarHBondContact O-CG2 3.47Å; A324-V328 PolarHBondContact O-N 2.95Å |
| 325 | G | 65.1 | Low | 66.6 | Low | 16 Ų | 16 | 40.5 Ų | 40.5 | 17% | 0.165 | 23% | 0.234 | C | C | . | . | H | α-helix | trans | -64.4 | -40.7 | 177 | 0 | 0 | 0 | 0 | 0 | 113.5 | A321 G322 V328 G329 | A321-G325 PolarHBondContact O-N 2.91Å; G322-G325 PolarHBondContact O-N 3.43Å; G325-V328 PolarHBondContact O-N 3.02Å; G325-G329 PolarHBondContact O-N 2.91Å |
| 326 | A | 65.8 | Low | 66.8 | Low | 17 Ų | 17 | 34.1 Ų | 34.1 | 14% | 0.14 | 20% | 0.204 | C | C | . | . | H | α-helix | trans | -66.5 | -40.6 | 175.8 | 0 | 0 | 0 | 0 | 0 | 112 | G322 T323 G330 | G322-A326 PolarHBondContact O-N 3.32Å; T323-A326 PolarHBondContact O-N 3.47Å; A326-G330 PolarHBondContact O-N 3.48Å |
| 327 | L | 70 | Confident | 67 | Low | 0 Ų | 0 | 30.8 Ų | 30.8 | 0% | 0 | 18% | 0.182 | C | C | . | . | H | α-helix | trans | -64.8 | -47.6 | 175.1 | -169.7 | 171.4 | 0 | 0 | 0 | 110.3 | Y189 L192 F193 F198 L202 T323 A324 G329 G330 L331 | Y189-L327 HydrophobicContact CD1-CB 4.43Å; Y189-L327 HydrophobicContact CD1-CD1 3.27Å; Y189-L327 HydrophobicContact CD1-CG 3.8Å; Y189-L327 HydrophobicContact CE1-CB 3.75Å; Y189-L327 HydrophobicContact CE1-CD1 3.48Å; Y189-L327 VanDerWaalsContact CE1-CD1 3.48Å; Y189-L327 HydrophobicContact CE1-CG 3.53Å; Y189-L327 HydrophobicContact CG-CD1 4.42Å; L192-L327 HydrophobicContact CB-CD1 3.91Å; L192-L327 HydrophobicContact CD1-CD1 3.61Å; L192-L327 HydrophobicContact CG-CD1 4.37Å; F193-L327 HydrophobicContact CE2-CD1 4.44Å; F198-L327 HydrophobicContact CE1-CD1 3.99Å; F198-L327 HydrophobicContact CE1-CD2 3.49Å; F198-L327 VanDerWaalsContact CE1-CD2 3.49Å; F198-L327 HydrophobicContact CE1-CG 4.34Å; F198-L327 HydrophobicContact CZ-CD1 4.29Å; F198-L327 HydrophobicContact CZ-CD2 3.79Å; F198-L327 HydrophobicContact CZ-CG 4.47Å; L202-L327 HydrophobicContact CD1-CD2 4.14Å; L202-L327 HydrophobicContact CD2-CD2 4.14Å; T323-L327 WeakPolarHBondContact O-CB 3.31Å; T323-L327 PolarHBondContact O-N 2.75Å; A324-L327 PolarHBondContact O-N 2.93Å; L327-G329 PolarHBondContact O-N 3.36Å; L327-G330 PolarHBondContact O-N 2.7Å; L327-L331 HydrophobicContact CD2-CD1 3.25Å; L327-L331 HydrophobicContact CD2-CG 4.06Å; L327-L331 HydrophobicContact CG-CD1 4.08Å; L327-L331 WeakPolarHBondContact O-CB 3.31Å; L327-L331 PolarHBondContact O-N 3.18Å |
| 328 | V | 69.4 | Low | 67.4 | Low | 8 Ų | 8 | 32.8 Ų | 32.8 | 5% | 0.048 | 20% | 0.197 | C | C | . | . | H | α-helix | trans | -56.2 | -53.1 | 176.6 | 166.9 | 0 | 0 | 0 | 0 | 110.4 | F198 L202 L205 A313 A324 G325 Q332 | F198-V328 HydrophobicContact CE2-CG2 3.94Å; F198-V328 HydrophobicContact CZ-CG2 3.77Å; L202-V328 HydrophobicContact CD1-CB 4.19Å; L202-V328 HydrophobicContact CD1-CG1 4.5Å; L202-V328 HydrophobicContact CD1-CG2 3.95Å; L205-V328 HydrophobicContact CD1-CG1 3.61Å; A313-V328 HydrophobicContact CB-CG2 4.27Å; A324-V328 VanDerWaalsContact O-CB 3.32Å; A324-V328 WeakPolarHBondContact O-CB 3.21Å; A324-V328 WeakPolarHBondContact O-CG2 3.47Å; A324-V328 PolarHBondContact O-N 2.95Å; G325-V328 PolarHBondContact O-N 3.02Å; V328-Q332 WeakPolarHBondContact O-CB 3.48Å; V328-Q332 PolarHBondContact O-N 3.23Å |
| 329 | G | 69.3 | Low | 67.8 | Low | 2 Ų | 2 | 29.4 Ų | 29.4 | 2% | 0.021 | 17% | 0.173 | C | C | . | . | H | α-helix | trans | -62.6 | -45.5 | 177.8 | 0 | 0 | 0 | 0 | 0 | 112.8 | Q49 G325 L327 Q332 N333 | Q49-G329 PolarHBondContact OE1-O 2.83Å; G325-G329 PolarHBondContact O-N 2.91Å; L327-G329 PolarHBondContact O-N 3.36Å; G329-Q332 PolarHBondContact O-N 3.41Å; G329-N333 WeakPolarHBondContact O-CB 3.24Å; G329-N333 PolarHBondContact O-N 2.98Å; G329-N333 PolarHBondContact O-ND2 3.34Å |
| 330 | G | 71.2 | Confident | 68.2 | Low | 0 Ų | 0 | 19.6 Ų | 19.6 | 0% | 0 | 13% | 0.13 | C | C | . | . | H | α-helix | trans | -63.1 | -50.9 | -177.6 | 0 | 0 | 0 | 0 | 0 | 112.4 | G46 A326 L327 N333 I334 | G46-G330 WeakPolarHBondContact CA-O 3.43Å; G46-G330 VanDerWaalsContact O-CA 3.31Å; G46-G330 WeakPolarHBondContact O-CA 3.19Å; A326-G330 PolarHBondContact O-N 3.48Å; L327-G330 PolarHBondContact O-N 2.7Å; G330-N333 PolarHBondContact O-N 3.33Å; G330-I334 VanDerWaalsContact O-CG1 3.31Å; G330-I334 WeakPolarHBondContact O-CG1 3.2Å; G330-I334 PolarHBondContact O-N 3.39Å |
| 331 | L | 73.8 | Confident | 68.4 | Low | 35 Ų | 35 | 19 Ų | 19 | 18% | 0.183 | 13% | 0.13 | C | C | . | . | H | α-helix | trans | -70.7 | -33.5 | 178.9 | -72.7 | 177.3 | 0 | 0 | 0 | 112.4 | F193 L202 I206 L327 N333 I334 G335 | F193-L331 HydrophobicContact CE1-CD1 3.94Å; F193-L331 HydrophobicContact CE2-CD1 4.17Å; F193-L331 HydrophobicContact CZ-CD1 3.36Å; F193-L331 HydrophobicContact CZ-CD2 4.44Å; L202-L331 HydrophobicContact CD1-CB 4.03Å; L202-L331 HydrophobicContact CD1-CD1 4.47Å; L202-L331 HydrophobicContact CD2-CB 4.07Å; L202-L331 HydrophobicContact CD2-CD1 3.39Å; L202-L331 HydrophobicContact CD2-CG 4.37Å; L202-L331 HydrophobicContact CG-CB 4.39Å; L202-L331 HydrophobicContact CG-CD1 4.47Å; I206-L331 HydrophobicContact CD1-CB 4.38Å; L327-L331 HydrophobicContact CD2-CD1 3.25Å; L327-L331 HydrophobicContact CD2-CG 4.06Å; L327-L331 HydrophobicContact CG-CD1 4.08Å; L327-L331 WeakPolarHBondContact O-CB 3.31Å; L327-L331 PolarHBondContact O-N 3.18Å; L331-N333 VanDerWaalsContact C-N 3.34Å; L331-N333 PolarHBondContact O-N 3.2Å; L331-I334 HydrophobicContact CD2-CD1 4.45Å; L331-I334 PolarHBondContact O-N 2.77Å; L331-G335 PolarHBondContact O-N 3.27Å |
| 332 | Q | 74.7 | Confident | 68.8 | Low | 21 Ų | 21 | 22.2 Ų | 22.2 | 10% | 0.098 | 14% | 0.143 | C | C | . | . | H | α-helix | trans | -59.5 | -44.1 | 171.8 | -179.8 | -179.6 | 61 | 0 | 0 | 112 | L205 I206 L209 V328 G329 S336 | L205-Q332 PolarHBondContact O-NE2 2.86Å; I206-Q332 HydrophobicContact CG1-CB 4.46Å; L209-Q332 HydrophobicContact CB-CG 3.6Å; L209-Q332 HydrophobicContact CD2-CG 3.47Å; L209-Q332 VanDerWaalsContact CD2-CG 3.47Å; L209-Q332 HydrophobicContact CG-CG 4.13Å; V328-Q332 WeakPolarHBondContact O-CB 3.48Å; V328-Q332 PolarHBondContact O-N 3.23Å; G329-Q332 PolarHBondContact O-N 3.41Å; Q332-S336 WeakPolarHBondContact O-CB 3.23Å; Q332-S336 PolarHBondContact O-N 2.96Å; Q332-S336 PolarHBondContact O-OG 3.47Å |
| 333 | N | 74.4 | Confident | 68.8 | Low | 11 Ų | 11 | 20.3 Ų | 20.3 | 6% | 0.059 | 12% | 0.123 | C | C | . | . | H | α-helix | trans | -72.8 | -38.7 | 178.1 | -74.3 | -59.1 | 0 | 0 | 0 | 112.5 | Y45 G46 Q49 G329 G330 L331 S336 G337 | Y45-N333 HydrophobicContact CD1-CB 3.99Å; Y45-N333 VanDerWaalsContact CD1-CG 3.49Å; Y45-N333 WeakPolarHBondContact CE1-ND2 3.43Å; G46-N333 VanDerWaalsContact CA-CB 3.49Å; Q49-N333 PolarHBondContact OE1-ND2 3.49Å; Q49-N333 VanDerWaalsContact OE1-ND2 3.15Å; G329-N333 WeakPolarHBondContact O-CB 3.24Å; G329-N333 PolarHBondContact O-N 2.98Å; G329-N333 PolarHBondContact O-ND2 3.34Å; G330-N333 PolarHBondContact O-N 3.33Å; L331-N333 VanDerWaalsContact C-N 3.34Å; L331-N333 PolarHBondContact O-N 3.2Å; N333-S336 VanDerWaalsContact CA-OG 3.28Å; N333-S336 WeakPolarHBondContact CA-OG 3.45Å; N333-S336 PolarHBondContact O-OG 3.39Å; N333-G337 PolarHBondContact O-N 2.78Å |
| 334 | I | 74.9 | Confident | 68.5 | Low | 39 Ų | 39 | 19.8 Ų | 19.8 | 20% | 0.2 | 12% | 0.121 | C | C | . | . | H | α-helix | trans | -61.6 | -47.7 | 172.8 | -71 | 169.1 | 0 | 0 | 0 | 110.2 | V47 G330 L331 G337 V338 | V47-I334 HydrophobicContact CG2-CD1 3.87Å; V47-I334 HydrophobicContact CG2-CG1 4.13Å; G330-I334 VanDerWaalsContact O-CG1 3.31Å; G330-I334 WeakPolarHBondContact O-CG1 3.2Å; G330-I334 PolarHBondContact O-N 3.39Å; L331-I334 HydrophobicContact CD2-CD1 4.45Å; L331-I334 PolarHBondContact O-N 2.77Å; I334-G337 PolarHBondContact O-N 3.37Å; I334-V338 HydrophobicContact CG2-CG2 4.37Å; I334-V338 WeakPolarHBondContact O-CG2 3.25Å; I334-V338 PolarHBondContact O-N 2.88Å |
| 335 | G | 70.6 | Confident | 68.3 | Low | 14 Ų | 14 | 27.6 Ų | 27.6 | 14% | 0.144 | 16% | 0.16 | C | C | . | . | H | α-helix | trans | -62.9 | -44.6 | -179.3 | 0 | 0 | 0 | 0 | 0 | 112.1 | L331 V338 L339 | L331-G335 PolarHBondContact O-N 3.27Å; G335-V338 PolarHBondContact O-N 3.33Å; G335-L339 VanDerWaalsContact O-CB 3.27Å; G335-L339 WeakPolarHBondContact O-CB 3.21Å; G335-L339 WeakPolarHBondContact O-CD1 3.29Å; G335-L339 WeakPolarHBondContact O-CG 3.06Å; G335-L339 PolarHBondContact O-N 2.87Å |
| 336 | S | 70.1 | Confident | 68 | Low | 0 Ų | 0 | 29.9 Ų | 29.9 | 0% | 0 | 17% | 0.168 | C | C | . | . | H | α-helix | trans | -64.7 | -36.7 | 173.5 | 51.7 | 0 | 0 | 0 | 0 | 113.1 | L42 Q332 N333 L339 A340 | L42-S336 VanDerWaalsContact CD2-OG 3.28Å; L42-S336 WeakPolarHBondContact CD2-OG 3.29Å; Q332-S336 WeakPolarHBondContact O-CB 3.23Å; Q332-S336 PolarHBondContact O-N 2.96Å; Q332-S336 PolarHBondContact O-OG 3.47Å; N333-S336 VanDerWaalsContact CA-OG 3.28Å; N333-S336 WeakPolarHBondContact CA-OG 3.45Å; N333-S336 PolarHBondContact O-OG 3.39Å; S336-L339 PolarHBondContact O-N 3.43Å; S336-A340 WeakPolarHBondContact O-CB 3.08Å; S336-A340 PolarHBondContact O-N 2.94Å |
| 337 | G | 67.5 | Low | 67.3 | Low | 0 Ų | 0 | 32.5 Ų | 32.5 | 0% | 0 | 18% | 0.183 | C | C | . | . | H | α-helix | trans | -66.6 | -42 | 174.8 | 0 | 0 | 0 | 0 | 0 | 113.6 | G39 N333 I334 S341 | G39-G337 WeakPolarHBondContact CA-O 3.4Å; N333-G337 PolarHBondContact O-N 2.78Å; I334-G337 PolarHBondContact O-N 3.37Å; G337-S341 WeakPolarHBondContact O-CB 3.45Å; G337-S341 PolarHBondContact O-N 3.48Å; G337-S341 PolarHBondContact O-OG 3.27Å |
| 338 | V | 72.1 | Confident | 66.4 | Low | 74 Ų | 74 | 34.3 Ų | 34.3 | 45% | 0.448 | 19% | 0.192 | S | C | . | . | H | α-helix | trans | -65.6 | -44.1 | 174.9 | 172.4 | 0 | 0 | 0 | 0 | 110.5 | L43 I334 G335 S341 L342 | L43-V338 HydrophobicContact CD1-CG2 4.43Å; I334-V338 HydrophobicContact CG2-CG2 4.37Å; I334-V338 WeakPolarHBondContact O-CG2 3.25Å; I334-V338 PolarHBondContact O-N 2.88Å; G335-V338 PolarHBondContact O-N 3.33Å; V338-S341 WeakPolarHBondContact O-CB 3.12Å; V338-S341 PolarHBondContact O-N 3.3Å; V338-L342 WeakPolarHBondContact O-CB 3.29Å; V338-L342 PolarHBondContact O-N 3.27Å |
| 339 | L | 67.3 | Low | 65.4 | Low | 33 Ų | 33 | 40 Ų | 40 | 17% | 0.173 | 23% | 0.227 | C | C | . | . | H | α-helix | trans | -68.6 | -38.4 | 179.2 | -78.7 | 158.2 | 0 | 0 | 0 | 112.4 | I206 A210 G335 S336 S341 L342 S343 M361 | I206-L339 HydrophobicContact CG2-CD1 4.23Å; A210-L339 HydrophobicContact CB-CB 3.84Å; A210-L339 HydrophobicContact CB-CD1 3.32Å; A210-L339 HydrophobicContact CB-CG 4.18Å; G335-L339 VanDerWaalsContact O-CB 3.27Å; G335-L339 WeakPolarHBondContact O-CB 3.21Å; G335-L339 WeakPolarHBondContact O-CD1 3.29Å; G335-L339 WeakPolarHBondContact O-CG 3.06Å; G335-L339 PolarHBondContact O-N 2.87Å; S336-L339 PolarHBondContact O-N 3.43Å; L339-S341 VanDerWaalsContact C-N 3.31Å; L339-S341 PolarHBondContact O-N 2.86Å; L339-L342 PolarHBondContact O-N 2.82Å; L339-S343 PolarHBondContact O-N 3.22Å; L339-S343 PolarHBondContact O-OG 2.99Å; L339-M361 HydrophobicContact CD1-CE 4.35Å; L339-M361 HydrophobicContact CD1-SD 3.69Å; L339-M361 HydrophobicContact CD2-CE 3.35Å; L339-M361 HydrophobicContact CD2-SD 3.77Å; L339-M361 HydrophobicContact CG-CE 4.48Å; L339-M361 HydrophobicContact CG-SD 4.33Å |
| 340 | A | 64.8 | Low | 64.5 | Low | 0 Ų | 0 | 41.5 Ų | 41.5 | 0% | 0 | 24% | 0.243 | C | C | . | . | H | α-helix | trans | -64.4 | -35.9 | 172.1 | 0 | 0 | 0 | 0 | 0 | 112 | M38 S336 S343 A344 | M38-A340 HydrophobicContact CE-CB 3.66Å; S336-A340 WeakPolarHBondContact O-CB 3.08Å; S336-A340 PolarHBondContact O-N 2.94Å; A340-S343 VanDerWaalsContact C-OG 3.31Å; A340-S343 VanDerWaalsContact CA-OG 3.29Å; A340-S343 WeakPolarHBondContact CA-OG 3.47Å; A340-S343 PolarHBondContact O-OG 2.95Å; A340-A344 PolarHBondContact O-N 3.39Å |
| 341 | S | 66.3 | Low | 63.6 | Low | 35 Ų | 35 | 42.8 Ų | 42.8 | 25% | 0.245 | 25% | 0.249 | C | C | . | . | H | α-helix | trans | -69.4 | -37.8 | 172.8 | -55.1 | 0 | 0 | 0 | 0 | 111.6 | G39 G337 V338 L339 A344 M345 | G39-S341 WeakPolarHBondContact CA-OG 3.44Å; G337-S341 WeakPolarHBondContact O-CB 3.45Å; G337-S341 PolarHBondContact O-N 3.48Å; G337-S341 PolarHBondContact O-OG 3.27Å; V338-S341 WeakPolarHBondContact O-CB 3.12Å; V338-S341 PolarHBondContact O-N 3.3Å; L339-S341 VanDerWaalsContact C-N 3.31Å; L339-S341 PolarHBondContact O-N 2.86Å; S341-A344 VanDerWaalsContact O-CB 3.22Å; S341-A344 WeakPolarHBondContact O-CB 3.29Å; S341-A344 PolarHBondContact O-N 2.92Å; S341-M345 PolarHBondContact O-N 3.08Å |
| 342 | L | 67.6 | Low | 62.4 | Low | 93 Ų | 93 | 42.2 Ų | 42.2 | 49% | 0.487 | 25% | 0.251 | S | S | . | . | H | α-helix | trans | -69.2 | -38.2 | 177.4 | -165.9 | 69.8 | 0 | 0 | 0 | 111.2 | V338 L339 A344 M345 | V338-L342 WeakPolarHBondContact O-CB 3.29Å; V338-L342 PolarHBondContact O-N 3.27Å; L339-L342 PolarHBondContact O-N 2.82Å; L342-A344 PolarHBondContact O-N 3.13Å; L342-M345 PolarHBondContact O-N 3.4Å; L342-M345 VanDerWaalsContact O-N 3.13Å |
| 343 | S | 60.8 | Low | 61.3 | Low | 1 Ų | 1 | 42.7 Ų | 42.7 | 1% | 0.007 | 26% | 0.257 | C | S | . | . | H | α-helix | trans | -63.3 | -26.2 | 173.4 | 61.8 | 0 | 0 | 0 | 0 | 112.8 | L339 A340 | L339-S343 PolarHBondContact O-N 3.22Å; L339-S343 PolarHBondContact O-OG 2.99Å; A340-S343 VanDerWaalsContact C-OG 3.31Å; A340-S343 VanDerWaalsContact CA-OG 3.29Å; A340-S343 WeakPolarHBondContact CA-OG 3.47Å; A340-S343 PolarHBondContact O-OG 2.95Å |
| 344 | A | 58.7 | Low | 60.4 | Low | 15 Ų | 15 | 42.8 Ų | 42.8 | 12% | 0.124 | 26% | 0.257 | C | S | . | . | H | α-helix | trans | -72.1 | -27.5 | 175.1 | 0 | 0 | 0 | 0 | 0 | 114.2 | G32 Q35 A340 S341 L342 | G32-A344 WeakPolarHBondContact O-CB 3.17Å; Q35-A344 HydrophobicContact CB-CB 3.5Å; Q35-A344 VanDerWaalsContact CB-CB 3.5Å; Q35-A344 HydrophobicContact CG-CB 4.48Å; A340-A344 PolarHBondContact O-N 3.39Å; S341-A344 VanDerWaalsContact O-CB 3.22Å; S341-A344 WeakPolarHBondContact O-CB 3.29Å; S341-A344 PolarHBondContact O-N 2.92Å; L342-A344 PolarHBondContact O-N 3.13Å |
| 345 | M | 59.7 | Low | 59.4 | Low | 165 Ų | 165 | 41 Ų | 41 | 81% | 0.813 | 25% | 0.248 | S | C | * | . | H | α-helix | trans | -82.5 | -16.5 | 178.6 | -61.5 | -160 | 112.7 | 0 | 0 | 112.7 | S341 L342 | S341-M345 PolarHBondContact O-N 3.08Å; L342-M345 PolarHBondContact O-N 3.4Å; L342-M345 VanDerWaalsContact O-N 3.13Å |
| 346 | L | 58.7 | Low | 58.8 | Low | 65 Ų | 65 | 44.1 Ų | 44.1 | 34% | 0.34 | 26% | 0.261 | S | S | . | . | S | Bend | trans | -79.5 | 138.4 | 174.3 | -74.2 | 160.2 | 0 | 0 | 0 | 110 | Q348 L357 | L346-Q348 PolarHBondContact O-N 3.22Å; L346-L357 HydrophobicContact CD1-CD1 3.8Å; L346-L357 HydrophobicContact CD1-CD2 3.69Å; L346-L357 HydrophobicContact CD1-CG 3.74Å |
| 347 | P | 50.9 | Low | 58.3 | Low | 71 Ų | 71 | 44.7 Ų | 44.7 | 46% | 0.461 | 26% | 0.264 | S | S | . | . | trans | -57.9 | 112 | -179.6 | -21.7 | 31.8 | 0 | 0 | 0 | 111.5 | T349 S353 | P347-T349 PolarHBondContact O-N 3.32Å; P347-S353 PolarHBondContact O-OG 3.34Å | ||
| 348 | Q | 52.8 | Low | 57.9 | Low | 38 Ų | 38 | 44.8 Ų | 44.8 | 18% | 0.178 | 26% | 0.264 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -69.7 | 12.7 | 177.3 | -74.7 | -78.9 | -14.3 | 0 | 0 | 113.9 | Q35 C218 L346 | Q35-Q348 VanDerWaalsContact OE1-NE2 3.11Å; C218-Q348 PolarHBondContact SG-NE2 3.11Å; L346-Q348 PolarHBondContact O-N 3.22Å |
| 349 | T | 48.3 | Very low | 57.2 | Low | 128 Ų | 128 | 42 Ų | 42 | 79% | 0.785 | 25% | 0.247 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -92.2 | 2.6 | -175.9 | 51.1 | 0 | 0 | 0 | 0 | 114 | P347 | P347-T349 PolarHBondContact O-N 3.32Š|
| 350 | G | 50.2 | Low | 57 | Low | 34 Ų | 34 | 44.1 Ų | 44.1 | 35% | 0.351 | 26% | 0.259 | S | S | . | . | trans | -146 | 134.4 | 176 | 0 | 0 | 0 | 0 | 0 | 112.6 | G352 S353 | G350-G352 PolarHBondContact O-N 3.38Å; G350-G352 VanDerWaalsContact O-N 3.1Å; G350-S353 PolarHBondContact O-N 3.13Å; G350-S353 VanDerWaalsContact O-N 3.09Å | ||
| 351 | Q | 51.7 | Low | 56.8 | Low | 27 Ų | 27 | 44.7 Ų | 44.7 | 13% | 0.126 | 26% | 0.262 | C | S | . | . | H | α-helix | trans | -52.2 | -27.8 | 173.3 | -90.6 | 179.8 | -27.9 | 0 | 0 | 112.3 | D281 S353 L354 G355 | D281-Q351 HydrophobicContact CB-CB 4.3Å; D281-Q351 WeakPolarHBondContact OD1-CB 3.4Å; Q351-S353 VanDerWaalsContact C-N 3.28Å; Q351-S353 PolarHBondContact O-N 2.85Å; Q351-L354 WeakPolarHBondContact O-CB 3.39Å; Q351-L354 PolarHBondContact O-N 2.74Å; Q351-L354 VanDerWaalsContact O-N 3.11Å; Q351-G355 PolarHBondContact O-N 3.35Å |
| 352 | G | 48 | Very low | 56.4 | Low | 22 Ų | 22 | 43.1 Ų | 43.1 | 23% | 0.227 | 25% | 0.251 | C | S | . | . | H | α-helix | trans | -55.1 | -34.3 | 174.6 | 0 | 0 | 0 | 0 | 0 | 115 | D281 G350 L354 G355 L356 | D281-G352 VanDerWaalsContact CG-N 3.27Å; D281-G352 PolarHBondContact OD1-N 3.04Å; D281-G352 VanDerWaalsContact OD2-CA 3.3Å; D281-G352 WeakPolarHBondContact OD2-CA 3.26Å; G350-G352 PolarHBondContact O-N 3.38Å; G350-G352 VanDerWaalsContact O-N 3.1Å; G352-L354 VanDerWaalsContact C-N 3.31Å; G352-L354 PolarHBondContact O-N 3.27Å; G352-G355 PolarHBondContact O-N 3.07Å; G352-L356 WeakPolarHBondContact O-CB 3.24Å; G352-L356 PolarHBondContact O-N 2.84Å |
| 353 | S | 52.1 | Low | 56.1 | Low | 32 Ų | 32 | 42.5 Ų | 42.5 | 22% | 0.224 | 25% | 0.248 | C | C | . | . | H | α-helix | trans | -64.9 | -37.3 | 177.8 | -65.4 | 0 | 0 | 0 | 0 | 111.8 | P347 G350 Q351 L357 | P347-S353 PolarHBondContact O-OG 3.34Å; G350-S353 PolarHBondContact O-N 3.13Å; G350-S353 VanDerWaalsContact O-N 3.09Å; Q351-S353 VanDerWaalsContact C-N 3.28Å; Q351-S353 PolarHBondContact O-N 2.85Å; S353-L357 WeakPolarHBondContact O-CB 3.41Å; S353-L357 WeakPolarHBondContact O-CD1 3.49Å; S353-L357 VanDerWaalsContact O-CG 3.29Å; S353-L357 WeakPolarHBondContact O-CG 3.16Å; S353-L357 PolarHBondContact O-N 3.49Å |
| 354 | L | 55.4 | Low | 56.1 | Low | 13 Ų | 13 | 46.4 Ų | 46.4 | 7% | 0.068 | 27% | 0.268 | C | S | . | . | H | α-helix | trans | -72.7 | -45 | 176.4 | -84.1 | 167.3 | 0 | 0 | 0 | 112.5 | C218 L222 Q351 G352 L356 L357 M358 | C218-L354 HydrophobicContact CB-CD1 3.56Å; C218-L354 HydrophobicContact CB-CD2 3.3Å; C218-L354 HydrophobicContact CB-CG 3.87Å; C218-L354 WeakPolarHBondContact SG-CD2 3.41Å; L222-L354 HydrophobicContact CD1-CD1 3.3Å; L222-L354 HydrophobicContact CG-CD1 4.29Å; Q351-L354 WeakPolarHBondContact O-CB 3.39Å; Q351-L354 PolarHBondContact O-N 2.74Å; Q351-L354 VanDerWaalsContact O-N 3.11Å; G352-L354 VanDerWaalsContact C-N 3.31Å; G352-L354 PolarHBondContact O-N 3.27Å; L354-L356 VanDerWaalsContact C-N 3.26Å; L354-L356 PolarHBondContact O-N 2.84Å; L354-L357 PolarHBondContact O-N 2.81Å; L354-M358 WeakPolarHBondContact O-CB 3.46Å; L354-M358 WeakPolarHBondContact O-CG 3.21Å; L354-M358 PolarHBondContact O-N 3Å |
| 355 | G | 54.8 | Low | 56.2 | Low | 1 Ų | 1 | 45.8 Ų | 45.8 | 1% | 0.01 | 26% | 0.262 | C | S | . | . | H | α-helix | trans | -57 | -43.3 | 173.6 | 0 | 0 | 0 | 0 | 0 | 111 | W278 Q351 G352 T359 | W278-G355 PolarHBondContact NE1-O 2.94Å; Q351-G355 PolarHBondContact O-N 3.35Å; G352-G355 PolarHBondContact O-N 3.07Å; G355-T359 WeakPolarHBondContact O-CB 3.37Å; G355-T359 VanDerWaalsContact O-CG2 3.3Å; G355-T359 WeakPolarHBondContact O-CG2 3.18Å; G355-T359 PolarHBondContact O-N 3.43Å; G355-T359 PolarHBondContact O-OG1 2.88Å |
| 356 | L | 57.7 | Low | 56.2 | Low | 80 Ų | 80 | 39.1 Ų | 39.1 | 42% | 0.419 | 23% | 0.231 | S | C | . | . | H | α-helix | trans | -68.9 | -39.6 | -179.9 | -160.8 | 153.4 | 0 | 0 | 0 | 111.9 | W278 G352 L354 T359 L360 | W278-L356 HydrophobicContact CZ2-CB 4.39Å; W278-L356 HydrophobicContact CZ2-CG 4.43Å; G352-L356 WeakPolarHBondContact O-CB 3.24Å; G352-L356 PolarHBondContact O-N 2.84Å; L354-L356 VanDerWaalsContact C-N 3.26Å; L354-L356 PolarHBondContact O-N 2.84Å; L356-T359 WeakPolarHBondContact CA-OG1 3.42Å; L356-T359 PolarHBondContact O-OG1 2.86Å; L356-T359 VanDerWaalsContact O-OG1 3.11Å; L356-L360 HydrophobicContact CD2-CD1 3.47Å; L356-L360 VanDerWaalsContact CD2-CD1 3.47Å; L356-L360 HydrophobicContact CD2-CG 4Å; L356-L360 VanDerWaalsContact O-CB 3.23Å; L356-L360 WeakPolarHBondContact O-CB 3.21Å; L356-L360 VanDerWaalsContact O-CG 3.27Å; L356-L360 WeakPolarHBondContact O-CG 3.18Å; L356-L360 PolarHBondContact O-N 3.48Å |
| 357 | L | 59.1 | Low | 56.2 | Low | 11 Ų | 11 | 41.1 Ų | 41.1 | 6% | 0.058 | 24% | 0.242 | C | C | . | . | H | α-helix | trans | -65.6 | -45.5 | 174.4 | -79.5 | 164.2 | 0 | 0 | 0 | 112 | L346 S353 L354 L360 M361 | L346-L357 HydrophobicContact CD1-CD1 3.8Å; L346-L357 HydrophobicContact CD1-CD2 3.69Å; L346-L357 HydrophobicContact CD1-CG 3.74Å; S353-L357 WeakPolarHBondContact O-CB 3.41Å; S353-L357 WeakPolarHBondContact O-CD1 3.49Å; S353-L357 VanDerWaalsContact O-CG 3.29Å; S353-L357 WeakPolarHBondContact O-CG 3.16Å; S353-L357 PolarHBondContact O-N 3.49Å; L354-L357 PolarHBondContact O-N 2.81Å; L357-L360 PolarHBondContact O-N 3.01Å; L357-M361 VanDerWaalsContact O-CG 3.29Å; L357-M361 WeakPolarHBondContact O-CG 3.2Å; L357-M361 PolarHBondContact O-N 3.24Å |
| 358 | M | 58.8 | Low | 56.5 | Low | 2 Ų | 2 | 38.8 Ų | 38.8 | 1% | 0.01 | 23% | 0.226 | C | C | . | . | H | α-helix | trans | -71.7 | -33 | -179.8 | -68.6 | -171.3 | 71.2 | 0 | 0 | 112 | F215 M277 F298 L354 M361 G362 | F215-M358 HydrophobicContact CB-CE 4.49Å; F215-M358 HydrophobicContact CB-SD 4.38Å; F215-M358 HydrophobicContact CD2-SD 4.26Å; M277-M358 HydrophobicContact CE-SD 3.8Å; M277-M358 HydrophobicContact SD-CB 4.36Å; M277-M358 HydrophobicContact SD-CE 4.02Å; M277-M358 HydrophobicContact SD-CG 4.27Å; M277-M358 HydrophobicContact SD-SD 3.18Å; F298-M358 HydrophobicContact CB-CE 4.11Å; F298-M358 HydrophobicContact CD1-CE 3.95Å; F298-M358 HydrophobicContact CD2-CE 3.64Å; F298-M358 HydrophobicContact CE1-CE 4.3Å; F298-M358 HydrophobicContact CE2-CE 4.03Å; F298-M358 HydrophobicContact CG-CE 3.6Å; F298-M358 HydrophobicContact CZ-CE 4.36Å; L354-M358 WeakPolarHBondContact O-CB 3.46Å; L354-M358 WeakPolarHBondContact O-CG 3.21Å; L354-M358 PolarHBondContact O-N 3Å; M358-M361 PolarHBondContact O-N 3.05Å; M358-G362 PolarHBondContact O-N 3.18Å |
| 359 | T | 57.9 | Low | 56.7 | Low | 15 Ų | 15 | 37 Ų | 37 | 9% | 0.092 | 22% | 0.218 | C | C | . | . | H | α-helix | trans | -71.4 | -36.7 | 169.8 | 55.5 | 0 | 0 | 0 | 0 | 112.5 | G274 W278 G355 L356 M361 G362 L363 | G274-T359 VanDerWaalsContact C-CG2 3.47Å; G274-T359 WeakPolarHBondContact O-CG2 3.48Å; W278-T359 PolarHBondContact NE1-OG1 2.95Å; G355-T359 WeakPolarHBondContact O-CB 3.37Å; G355-T359 VanDerWaalsContact O-CG2 3.3Å; G355-T359 WeakPolarHBondContact O-CG2 3.18Å; G355-T359 PolarHBondContact O-N 3.43Å; G355-T359 PolarHBondContact O-OG1 2.88Å; L356-T359 WeakPolarHBondContact CA-OG1 3.42Å; L356-T359 PolarHBondContact O-OG1 2.86Å; L356-T359 VanDerWaalsContact O-OG1 3.11Å; T359-M361 VanDerWaalsContact C-N 3.33Å; T359-G362 PolarHBondContact O-N 3.48Å; T359-L363 WeakPolarHBondContact O-CB 3.26Å; T359-L363 WeakPolarHBondContact O-CD1 3.41Å; T359-L363 WeakPolarHBondContact O-CG 3.48Å; T359-L363 PolarHBondContact O-N 3.11Å |
| 360 | L | 62.2 | Low | 57.3 | Low | 79 Ų | 79 | 35 Ų | 35 | 41% | 0.414 | 20% | 0.202 | S | C | . | . | H | α-helix | trans | -63.2 | -40.3 | 171.6 | -84.1 | 175.6 | 0 | 0 | 0 | 111.5 | L356 L357 L363 L364 | L356-L360 HydrophobicContact CD2-CD1 3.47Å; L356-L360 VanDerWaalsContact CD2-CD1 3.47Å; L356-L360 HydrophobicContact CD2-CG 4Å; L356-L360 VanDerWaalsContact O-CB 3.23Å; L356-L360 WeakPolarHBondContact O-CB 3.21Å; L356-L360 VanDerWaalsContact O-CG 3.27Å; L356-L360 WeakPolarHBondContact O-CG 3.18Å; L356-L360 PolarHBondContact O-N 3.48Å; L357-L360 PolarHBondContact O-N 3.01Å; L360-L363 PolarHBondContact O-N 3.45Å; L360-L364 VanDerWaalsContact O-CB 3.31Å; L360-L364 WeakPolarHBondContact O-CB 3.37Å; L360-L364 VanDerWaalsContact O-CG 3.31Å; L360-L364 WeakPolarHBondContact O-CG 3.3Å; L360-L364 PolarHBondContact O-N 3Å |
| 361 | M | 61 | Low | 57.5 | Low | 12 Ų | 12 | 36.4 Ų | 36.4 | 6% | 0.059 | 21% | 0.205 | C | C | . | . | H | α-helix | trans | -67.7 | -43.1 | 175.2 | -69.8 | -50.1 | 105.6 | 0 | 0 | 111.2 | A210 L339 L357 M358 T359 L363 L364 I365 | A210-M361 HydrophobicContact CB-SD 4.42Å; L339-M361 HydrophobicContact CD1-CE 4.35Å; L339-M361 HydrophobicContact CD1-SD 3.69Å; L339-M361 HydrophobicContact CD2-CE 3.35Å; L339-M361 HydrophobicContact CD2-SD 3.77Å; L339-M361 HydrophobicContact CG-CE 4.48Å; L339-M361 HydrophobicContact CG-SD 4.33Å; L357-M361 VanDerWaalsContact O-CG 3.29Å; L357-M361 WeakPolarHBondContact O-CG 3.2Å; L357-M361 PolarHBondContact O-N 3.24Å; M358-M361 PolarHBondContact O-N 3.05Å; T359-M361 VanDerWaalsContact C-N 3.33Å; M361-L363 VanDerWaalsContact C-N 3.35Å; M361-L363 PolarHBondContact O-N 3.06Å; M361-L364 HydrophobicContact CE-CD1 3.49Å; M361-L364 VanDerWaalsContact CE-CD1 3.49Å; M361-L364 PolarHBondContact O-N 3.15Å; M361-L364 HydrophobicContact SD-CD1 4.08Å; M361-I365 WeakPolarHBondContact O-CD1 3.34Å; M361-I365 WeakPolarHBondContact O-CG1 3.5Å; M361-I365 PolarHBondContact O-N 3.15Å |
| 362 | G | 57.9 | Low | 57.7 | Low | 1 Ų | 1 | 35.7 Ų | 35.7 | 1% | 0.01 | 20% | 0.202 | C | C | . | . | H | α-helix | trans | -59.1 | -44.4 | 172.8 | 0 | 0 | 0 | 0 | 0 | 112.2 | M358 T359 I365 V366 | M358-G362 PolarHBondContact O-N 3.18Å; T359-G362 PolarHBondContact O-N 3.48Å; G362-I365 PolarHBondContact O-N 3.11Å; G362-V366 WeakPolarHBondContact O-CG2 3.44Å; G362-V366 PolarHBondContact O-N 3.49Å |
| 363 | L | 60.7 | Low | 58.1 | Low | 81 Ų | 81 | 35.6 Ų | 35.6 | 42% | 0.424 | 20% | 0.199 | S | C | . | . | H | α-helix | trans | -66.2 | -39.3 | 175.8 | -78.2 | 164.7 | 0 | 0 | 0 | 111.8 | T359 L360 M361 I365 V366 L367 | T359-L363 WeakPolarHBondContact O-CB 3.26Å; T359-L363 WeakPolarHBondContact O-CD1 3.41Å; T359-L363 WeakPolarHBondContact O-CG 3.48Å; T359-L363 PolarHBondContact O-N 3.11Å; L360-L363 PolarHBondContact O-N 3.45Å; M361-L363 VanDerWaalsContact C-N 3.35Å; M361-L363 PolarHBondContact O-N 3.06Å; L363-I365 VanDerWaalsContact C-N 3.34Å; L363-V366 PolarHBondContact O-N 3.02Å; L363-L367 WeakPolarHBondContact O-CB 3.11Å; L363-L367 WeakPolarHBondContact O-CG 3.24Å; L363-L367 PolarHBondContact O-N 2.98Å |
| 364 | L | 61.7 | Low | 58.1 | Low | 83 Ų | 83 | 37.4 Ų | 37.4 | 44% | 0.435 | 21% | 0.209 | S | C | . | . | H | α-helix | trans | -63.5 | -41.2 | 174.1 | -83.7 | 165.6 | 0 | 0 | 0 | 111.4 | L360 M361 V366 C368 | L360-L364 VanDerWaalsContact O-CB 3.31Å; L360-L364 WeakPolarHBondContact O-CB 3.37Å; L360-L364 VanDerWaalsContact O-CG 3.31Å; L360-L364 WeakPolarHBondContact O-CG 3.3Å; L360-L364 PolarHBondContact O-N 3Å; M361-L364 HydrophobicContact CE-CD1 3.49Å; M361-L364 VanDerWaalsContact CE-CD1 3.49Å; M361-L364 PolarHBondContact O-N 3.15Å; M361-L364 HydrophobicContact SD-CD1 4.08Å; L364-V366 VanDerWaalsContact C-N 3.33Å; L364-C368 WeakPolarHBondContact O-CB 3.45Å; L364-C368 PolarHBondContact O-N 3.02Å; L364-C368 PolarHBondContact O-SG 3.47Å |
| 365 | I | 60.1 | Low | 58 | Low | 1 Ų | 1 | 43.5 Ų | 43.5 | 1% | 0.005 | 23% | 0.231 | C | C | . | . | H | α-helix | trans | -62.7 | -43.4 | 174.8 | -66.6 | 162.7 | 0 | 0 | 0 | 109.9 | M204 V267 L305 M361 G362 L363 W369 | M204-I365 HydrophobicContact CG-CG2 4.14Å; V267-I365 HydrophobicContact CB-CG2 4.49Å; V267-I365 HydrophobicContact CG1-CG2 4.21Å; V267-I365 HydrophobicContact CG2-CG2 3.81Å; L305-I365 HydrophobicContact CD1-CG2 4.24Å; M361-I365 WeakPolarHBondContact O-CD1 3.34Å; M361-I365 WeakPolarHBondContact O-CG1 3.5Å; M361-I365 PolarHBondContact O-N 3.15Å; G362-I365 PolarHBondContact O-N 3.11Å; L363-I365 VanDerWaalsContact C-N 3.34Å; I365-W369 VanDerWaalsContact O-CB 3.26Å; I365-W369 WeakPolarHBondContact O-CB 3.32Å; I365-W369 PolarHBondContact O-N 2.9Å |
| 366 | V | 59.9 | Low | 57.7 | Low | 25 Ų | 25 | 47.2 Ų | 47.2 | 15% | 0.152 | 25% | 0.249 | C | C | . | . | H | α-helix | trans | -67 | -46.2 | 178.7 | 173.3 | 0 | 0 | 0 | 0 | 112 | V267 L271 G362 L363 L364 C368 W369 L370 | V267-V366 HydrophobicContact CG1-CB 4.4Å; V267-V366 HydrophobicContact CG1-CG2 3.43Å; V267-V366 VanDerWaalsContact CG1-CG2 3.43Å; L271-V366 HydrophobicContact CD1-CB 4.47Å; L271-V366 HydrophobicContact CD1-CG2 3.27Å; L271-V366 HydrophobicContact CG-CG2 3.77Å; G362-V366 WeakPolarHBondContact O-CG2 3.44Å; G362-V366 PolarHBondContact O-N 3.49Å; L363-V366 PolarHBondContact O-N 3.02Å; L364-V366 VanDerWaalsContact C-N 3.33Å; V366-C368 VanDerWaalsContact C-N 3.32Å; V366-C368 PolarHBondContact O-N 2.87Å; V366-W369 PolarHBondContact O-N 3.35Å; V366-W369 VanDerWaalsContact O-N 3.07Å; V366-L370 HydrophobicContact CG1-CD1 3.96Å; V366-L370 WeakPolarHBondContact O-CD1 3.37Å; V366-L370 PolarHBondContact O-N 3.37Å |
| 367 | L | 59.6 | Low | 57.1 | Low | 108 Ų | 108 | 47.7 Ų | 47.7 | 57% | 0.565 | 26% | 0.259 | S | S | * | . | H | α-helix | trans | -64.9 | -37.2 | 177.9 | -76.2 | 167.5 | 0 | 0 | 0 | 111.4 | L363 W369 L370 P371 | L363-L367 WeakPolarHBondContact O-CB 3.11Å; L363-L367 WeakPolarHBondContact O-CG 3.24Å; L363-L367 PolarHBondContact O-N 2.98Å; L367-W369 VanDerWaalsContact C-N 3.3Å; L367-L370 HydrophobicContact CD2-CD1 4.48Å; L367-P371 WeakPolarHBondContact O-CD 3.38Å |
| 368 | C | 57.4 | Low | 56.5 | Low | 21 Ų | 21 | 55.2 Ų | 55.2 | 14% | 0.142 | 29% | 0.293 | C | S | . | . | H | α-helix | trans | -68.3 | -34.8 | 172.1 | -72.4 | 0 | 0 | 0 | 0 | 110.7 | C200 L203 M204 L364 V366 P371 | C200-C368 PolarHBondContact SG-O 3.38Å; L203-C368 HydrophobicContact CB-CB 4.43Å; M204-C368 HydrophobicContact CE-CB 4.37Å; M204-C368 HydrophobicContact CG-CB 4.29Å; L364-C368 WeakPolarHBondContact O-CB 3.45Å; L364-C368 PolarHBondContact O-N 3.02Å; L364-C368 PolarHBondContact O-SG 3.47Å; V366-C368 VanDerWaalsContact C-N 3.32Å; V366-C368 PolarHBondContact O-N 2.87Å; C368-P371 WeakPolarHBondContact O-CD 3.13Å; C368-P371 WeakPolarHBondContact O-CG 3.01Å |
| 369 | W | 56.6 | Low | 55.8 | Low | 1 Ų | 1 | 63 Ų | 63 | 0% | 0.004 | 33% | 0.33 | C | S | . | . | H | α-helix | trans | -84.6 | -30.4 | -174.6 | -169.5 | 39.2 | 0 | 0 | 0 | 115.9 | M204 M263 W264 V267 I365 V366 L367 P371 L372 A373 | M204-W369 VanDerWaalsContact CE-CA 3.44Å; M204-W369 HydrophobicContact CE-CB 3.39Å; M204-W369 VanDerWaalsContact CE-CD1 3.5Å; M204-W369 HydrophobicContact CE-CG 3.69Å; M204-W369 HydrophobicContact SD-CB 4.11Å; M204-W369 HydrophobicContact SD-CG 4.32Å; M263-W369 VanDerWaalsContact C-CH2 3.47Å; M263-W369 HydrophobicContact CB-CH2 4.09Å; M263-W369 HydrophobicContact CB-CZ2 3.84Å; M263-W369 HydrophobicContact CE-CZ2 3.67Å; M263-W369 HydrophobicContact CG-CD2 4.29Å; M263-W369 HydrophobicContact CG-CH2 4.04Å; M263-W369 HydrophobicContact CG-CZ2 3.71Å; M263-W369 HydrophobicContact SD-CZ2 4.28Å; W264-W369 HydrophobicContact CB-CH2 3.44Å; W264-W369 VanDerWaalsContact CB-CH2 3.44Å; W264-W369 HydrophobicContact CB-CZ3 3.84Å; W264-W369 AromaticContact CD1-CH2 3.04Å; W264-W369 AromaticContact CD1-CZ2 3.59Å; W264-W369 AromaticContact CD1-CZ3 3.86Å; W264-W369 AromaticContact CD2-CE3 3.97Å; W264-W369 HydrophobicContact CD2-CE3 3.97Å; W264-W369 AromaticContact CD2-CH2 3.05Å; W264-W369 HydrophobicContact CD2-CH2 3.05Å; W264-W369 HydrophobicContact CD2-CZ2 4.08Å; W264-W369 AromaticContact CD2-CZ3 2.94Å; W264-W369 HydrophobicContact CD2-CZ3 2.94Å; W264-W369 AromaticContact CE2-CE3 3.95Å; W264-W369 AromaticContact CE2-CH2 3.16Å; W264-W369 AromaticContact CE2-CZ2 3.75Å; W264-W369 AromaticContact CE2-CZ3 3.24Å; W264-W369 AromaticContact CE3-CE3 3.94Å; W264-W369 HydrophobicContact CE3-CE3 3.94Å; W264-W369 AromaticContact CE3-CH2 3.79Å; W264-W369 HydrophobicContact CE3-CH2 3.79Å; W264-W369 AromaticContact CE3-CZ3 3.12Å; W264-W369 HydrophobicContact CE3-CZ3 3.12Å; W264-W369 AromaticContact CG-CH2 2.91Å; W264-W369 HydrophobicContact CG-CH2 2.91Å; W264-W369 AromaticContact CG-CZ2 3.92Å; W264-W369 HydrophobicContact CG-CZ2 3.92Å; W264-W369 AromaticContact CG-CZ3 3.34Å; W264-W369 HydrophobicContact CG-CZ3 3.34Å; W264-W369 AromaticContact CH2-CE3 3.86Å; W264-W369 HydrophobicContact CH2-CE3 3.86Å; W264-W369 AromaticContact CH2-CZ3 3.8Å; W264-W369 HydrophobicContact CH2-CZ3 3.8Å; W264-W369 HydrophobicContact CZ2-CD2 4.45Å; W264-W369 AromaticContact CZ2-CE3 3.91Å; W264-W369 HydrophobicContact CZ2-CE3 3.91Å; W264-W369 AromaticContact CZ2-CH2 3.94Å; W264-W369 HydrophobicContact CZ2-CH2 3.94Å; W264-W369 HydrophobicContact CZ2-CZ2 4.35Å; W264-W369 AromaticContact CZ2-CZ3 3.67Å; W264-W369 HydrophobicContact CZ2-CZ3 3.67Å; W264-W369 AromaticContact CZ3-CE3 3.87Å; W264-W369 HydrophobicContact CZ3-CE3 3.87Å; W264-W369 HydrophobicContact CZ3-CH2 4.45Å; W264-W369 AromaticContact CZ3-CZ3 3.55Å; W264-W369 HydrophobicContact CZ3-CZ3 3.55Å; W264-W369 AromaticContact NE1-CH2 3.17Å; W264-W369 AromaticContact NE1-CZ2 3.47Å; W264-W369 AromaticContact NE1-CZ3 3.8Å; V267-W369 HydrophobicContact CB-CE3 3.99Å; V267-W369 HydrophobicContact CB-CZ3 3.96Å; V267-W369 HydrophobicContact CG1-CE3 4.01Å; V267-W369 HydrophobicContact CG1-CZ3 4.33Å; V267-W369 HydrophobicContact CG2-CD2 4.28Å; V267-W369 HydrophobicContact CG2-CE3 3.69Å; V267-W369 HydrophobicContact CG2-CZ3 3.9Å; I365-W369 VanDerWaalsContact O-CB 3.26Å; I365-W369 WeakPolarHBondContact O-CB 3.32Å; I365-W369 PolarHBondContact O-N 2.9Å; V366-W369 PolarHBondContact O-N 3.35Å; V366-W369 VanDerWaalsContact O-N 3.07Å; L367-W369 VanDerWaalsContact C-N 3.3Å; W369-P371 VanDerWaalsContact C-N 3.35Å; W369-L372 WeakPolarHBondContact O-CA 3.44Å; W369-L372 WeakPolarHBondContact O-CB 3.46Å; W369-L372 PolarHBondContact O-N 3.38Å; W369-A373 PolarHBondContact O-N 2.96Å |
| 370 | L | 59.5 | Low | 54.8 | Low | 85 Ų | 85 | 65.5 Ų | 65.5 | 45% | 0.445 | 36% | 0.359 | S | S | . | . | H | α-helix | trans | -42.9 | -51 | 170.5 | -90.2 | 150.6 | 0 | 0 | 0 | 113.7 | V366 L367 L372 A373 T374 | V366-L370 HydrophobicContact CG1-CD1 3.96Å; V366-L370 WeakPolarHBondContact O-CD1 3.37Å; V366-L370 PolarHBondContact O-N 3.37Å; L367-L370 HydrophobicContact CD2-CD1 4.48Å; L370-L372 VanDerWaalsContact C-N 3.28Å; L370-L372 PolarHBondContact O-N 2.94Å; L370-A373 PolarHBondContact O-N 3.13Å; L370-T374 VanDerWaalsContact O-CG2 3.3Å; L370-T374 WeakPolarHBondContact O-CG2 3.4Å; L370-T374 PolarHBondContact O-N 3.47Å; L370-T374 VanDerWaalsContact O-N 3.08Å; L370-T374 PolarHBondContact O-OG1 2.98Å; L370-T374 VanDerWaalsContact O-OG1 3.12Å |
| 371 | P | 55.4 | Low | 53.2 | Low | 64 Ų | 64 | 70.2 Ų | 70.2 | 42% | 0.416 | 38% | 0.379 | S | S | . | . | H | α-helix | trans | -70.8 | -18.4 | 178.3 | 27.1 | -35.6 | 0 | 0 | 0 | 114.3 | L367 C368 W369 T374 R375 | L367-P371 WeakPolarHBondContact O-CD 3.38Å; C368-P371 WeakPolarHBondContact O-CD 3.13Å; C368-P371 WeakPolarHBondContact O-CG 3.01Å; W369-P371 VanDerWaalsContact C-N 3.35Å; P371-T374 WeakPolarHBondContact CA-OG1 3.19Å; P371-T374 PolarHBondContact O-OG1 3.25Å; P371-T374 VanDerWaalsContact O-OG1 3.13Å; P371-R375 VanDerWaalsContact O-CG 3.31Å; P371-R375 WeakPolarHBondContact O-CG 3.3Å; P371-R375 PolarHBondContact O-N 3.12Å |
| 372 | L | 56.8 | Low | 51.8 | Low | 12 Ų | 12 | 75.8 Ų | 75.8 | 6% | 0.063 | 42% | 0.416 | C | S | . | . | H | α-helix | trans | -85.8 | -39.6 | 176 | -146.7 | 78 | 0 | 0 | 0 | 111.2 | C200 Y201 M204 M263 W369 L370 T374 R375 M376 | C200-L372 HydrophobicContact CB-CD1 3.99Å; Y201-L372 HydrophobicContact CD1-CD2 4.31Å; Y201-L372 HydrophobicContact CD2-CD2 4.38Å; Y201-L372 HydrophobicContact CE1-CD2 3.71Å; Y201-L372 HydrophobicContact CE2-CD2 3.81Å; Y201-L372 VanDerWaalsContact CZ-CD2 3.43Å; M204-L372 HydrophobicContact CE-CD2 4.5Å; M263-L372 HydrophobicContact CE-CD2 4.48Å; W369-L372 WeakPolarHBondContact O-CA 3.44Å; W369-L372 WeakPolarHBondContact O-CB 3.46Å; W369-L372 PolarHBondContact O-N 3.38Å; L370-L372 VanDerWaalsContact C-N 3.28Å; L370-L372 PolarHBondContact O-N 2.94Å; L372-T374 VanDerWaalsContact C-N 3.32Å; L372-R375 PolarHBondContact O-N 3.08Å; L372-M376 PolarHBondContact O-N 3.01Å |
| 373 | A | 54.9 | Low | 50.6 | Low | 20 Ų | 20 | 86 Ų | 86 | 17% | 0.165 | 48% | 0.478 | C | S | . | . | H | α-helix | trans | -62.8 | -39.6 | 174 | 0 | 0 | 0 | 0 | 0 | 111.3 | W264 W369 L370 M376 S377 | W264-A373 HydrophobicContact CZ2-CB 3.83Å; W369-A373 PolarHBondContact O-N 2.96Å; L370-A373 PolarHBondContact O-N 3.13Å; A373-M376 PolarHBondContact O-N 3.3Å; A373-S377 PolarHBondContact O-N 3.12Å; A373-S377 PolarHBondContact O-OG 3.43Å |
| 374 | T | 53.3 | Low | 50.1 | Low | 71 Ų | 71 | 86.3 Ų | 86.3 | 44% | 0.436 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -69.7 | -30.7 | 175.2 | 55.2 | 0 | 0 | 0 | 0 | 113 | L370 P371 L372 S377 H378 | L370-T374 VanDerWaalsContact O-CG2 3.3Å; L370-T374 WeakPolarHBondContact O-CG2 3.4Å; L370-T374 PolarHBondContact O-N 3.47Å; L370-T374 VanDerWaalsContact O-N 3.08Å; L370-T374 PolarHBondContact O-OG1 2.98Å; L370-T374 VanDerWaalsContact O-OG1 3.12Å; P371-T374 WeakPolarHBondContact CA-OG1 3.19Å; P371-T374 PolarHBondContact O-OG1 3.25Å; P371-T374 VanDerWaalsContact O-OG1 3.13Å; L372-T374 VanDerWaalsContact C-N 3.32Å; T374-S377 WeakPolarHBondContact CA-OG 3.31Å; T374-S377 PolarHBondContact O-OG 3.33Å; T374-H378 PolarHBondContact O-CD2 3.31Å; T374-H378 VanDerWaalsContact O-CD2 3.29Å; T374-H378 PolarHBondContact O-N 3.25Å |
| 375 | R | 52.4 | Low | 49.5 | Very low | 140 Ų | 140 | 86.4 Ų | 86.4 | 53% | 0.528 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -72.2 | -40.6 | 173.3 | -77.9 | -177.9 | -172.9 | -149.4 | 5.2 | 112.6 | P371 L372 H378 Q379 | P371-R375 VanDerWaalsContact O-CG 3.31Å; P371-R375 WeakPolarHBondContact O-CG 3.3Å; P371-R375 PolarHBondContact O-N 3.12Å; L372-R375 PolarHBondContact O-N 3.08Å; R375-H378 PolarHBondContact O-N 3.33Å; R375-Q379 PolarHBondContact O-N 3.42Å |
| 376 | M | 49.9 | Very low | 48.9 | Very low | 80 Ų | 80 | 91.2 Ų | 91.2 | 39% | 0.394 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -68.2 | -34.3 | 175.7 | -77.7 | -173.6 | 168.3 | 0 | 0 | 112.5 | F259 L372 A373 H378 Q379 | F259-M376 HydrophobicContact CD1-CE 4.48Å; L372-M376 PolarHBondContact O-N 3.01Å; A373-M376 PolarHBondContact O-N 3.3Å; M376-H378 VanDerWaalsContact C-N 3.26Å; M376-H378 PolarHBondContact O-N 3.29Å; M376-Q379 PolarHBondContact O-N 2.91Å |
| 377 | S | 44.4 | Very low | 48.3 | Very low | 89 Ų | 89 | 95.1 Ų | 95.1 | 62% | 0.622 | 53% | 0.531 | S | S | * | . | H | α-helix | trans | -67.3 | -27.2 | 173.4 | 61.3 | 0 | 0 | 0 | 0 | 112.8 | A373 T374 | A373-S377 PolarHBondContact O-N 3.12Å; A373-S377 PolarHBondContact O-OG 3.43Å; T374-S377 WeakPolarHBondContact CA-OG 3.31Å; T374-S377 PolarHBondContact O-OG 3.33Å |
| 378 | H | 45.3 | Very low | 47.6 | Very low | 169 Ų | 169 | 94.3 Ų | 94.3 | 78% | 0.782 | 53% | 0.528 | S | S | * | . | H | α-helix | trans | -82.4 | -13.8 | 176.1 | -88.2 | -62.6 | 0 | 0 | 0 | 114.6 | T374 R375 M376 | T374-H378 PolarHBondContact O-CD2 3.31Å; T374-H378 VanDerWaalsContact O-CD2 3.29Å; T374-H378 PolarHBondContact O-N 3.25Å; R375-H378 PolarHBondContact O-N 3.33Å; M376-H378 VanDerWaalsContact C-N 3.26Å; M376-H378 PolarHBondContact O-N 3.29Å |
| 379 | Q | 45.2 | Very low | 46.9 | Very low | 165 Ų | 165 | 99.1 Ų | 99.1 | 77% | 0.771 | 55% | 0.554 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -107.5 | 17.2 | 177.3 | -75.4 | -171.9 | -25.6 | 0 | 0 | 114 | R375 M376 Q381 | R375-Q379 PolarHBondContact O-N 3.42Å; M376-Q379 PolarHBondContact O-N 2.91Å; Q379-Q381 VanDerWaalsContact C-N 3.25Å; Q379-Q381 PolarHBondContact O-N 2.91Å |
| 380 | G | 35.8 | Very low | 46.2 | Very low | 69 Ų | 69 | 106.1 Ų | 106.1 | 71% | 0.711 | 59% | 0.593 | S | S | * | * | trans | -72.2 | 32.5 | -172.2 | 0 | 0 | 0 | 0 | 0 | 118.7 | ||||
| 381 | Q | 29 | Very low | 45.2 | Very low | 177 Ų | 177 | 107.8 Ų | 107.8 | 83% | 0.827 | 61% | 0.605 | S | S | * | * | S | Bend | trans | -94.8 | 131.5 | 155.6 | -84.4 | -168.6 | -12.9 | 0 | 0 | 109 | Q379 | Q379-Q381 VanDerWaalsContact C-N 3.25Å; Q379-Q381 PolarHBondContact O-N 2.91Å |
| 382 | P | 32.1 | Very low | 44.4 | Very low | 129 Ų | 129 | 111.4 Ų | 111.4 | 84% | 0.838 | 62% | 0.621 | S | S | * | * | trans | -70.7 | 136.9 | -174.8 | 31.3 | -32.7 | 0 | 0 | 0 | 109.9 | ||||
| 383 | V | 33.6 | Very low | 43.2 | Very low | 216 Ų | 216 | 120.5 Ų | 120.5 | 100% | 1.309 | 67% | 0.671 | S | S | * | * | trans | -120.7 | 0 | 154.1 | -160.1 | 0 | 0 | 0 | 0 | 107.5 |
Retrieved 383 of 383 residues in 212.5 ms
(Link to these results)