| 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 | 93.2 | Very high | 95.9 | Very high | 63 Ų | 63 | 43.7 Ų | 43.7 | 31% | 0.31 | 22% | 0.215 | S | C | . | . | 0 | -70.2 | 0 | -167 | -175.5 | 81.3 | 0 | 0 | 111.1 | F3 V4 I5 R59 K62 | M1-F3 VanDerWaalsContact C-N 3.33Å; M1-F3 PolarHBondContact O-N 3.11Å; M1-V4 WeakPolarHBondContact O-CA 3.47Å; M1-V4 WeakPolarHBondContact O-CB 3.2Å; M1-V4 PolarHBondContact O-N 2.91Å; M1-I5 HydrophobicContact CG-CD1 4.23Å; M1-I5 PolarHBondContact O-N 3.11Å; M1-R59 WeakPolarHBondContact CA-O 3.3Å; M1-R59 WeakPolarHBondContact CB-O 3.46Å; M1-K62 HydrophobicContact SD-CD 3.94Å; M1-K62 HydrophobicContact SD-CG 3.93Å | |||
| 2 | Q | 95.1 | Very high | 95.8 | Very high | 48 Ų | 48 | 43.8 Ų | 43.8 | 22% | 0.224 | 21% | 0.211 | C | C | . | . | H | α-helix | trans | -55.2 | -43.6 | -176.7 | -63.2 | -62.8 | 8.3 | 0 | 0 | 113.6 | V4 I5 F6 S307 A310 F311 | Q2-V4 VanDerWaalsContact C-N 3.28Å; Q2-V4 PolarHBondContact O-N 3.39Å; Q2-I5 WeakPolarHBondContact O-CA 3.48Å; Q2-I5 WeakPolarHBondContact O-CB 3.33Å; Q2-I5 PolarHBondContact O-N 3Å; Q2-F6 PolarHBondContact O-N 2.76Å; Q2-S307 WeakPolarHBondContact O-CB 3.18Å; Q2-A310 HydrophobicContact CG-CB 4.12Å; Q2-F311 HydrophobicContact CB-CB 3.98Å |
| 3 | F | 95 | Very high | 95.6 | Very high | 95 Ų | 95 | 40.4 Ų | 40.4 | 42% | 0.417 | 20% | 0.195 | S | C | . | . | H | α-helix | trans | -59.7 | -35.1 | 174.5 | -172 | -112.9 | 0 | 0 | 0 | 114 | M1 F6 I7 F311 | M1-F3 VanDerWaalsContact C-N 3.33Å; M1-F3 PolarHBondContact O-N 3.11Å; F3-F6 HydrophobicContact CD2-CD1 4.14Å; F3-F6 HydrophobicContact CE2-CD1 4.11Å; F3-F6 HydrophobicContact CE2-CE1 4.45Å; F3-F6 WeakPolarHBondContact O-CB 3.44Å; F3-F6 PolarHBondContact O-N 3.36Å; F3-I7 HydrophobicContact CD1-CD1 3.92Å; F3-I7 HydrophobicContact CE1-CD1 3.44Å; F3-I7 VanDerWaalsContact CE1-CD1 3.44Å; F3-I7 HydrophobicContact CE1-CG1 4.5Å; F3-I7 HydrophobicContact CE2-CD1 4.38Å; F3-I7 HydrophobicContact CZ-CD1 3.71Å; F3-I7 HydrophobicContact CZ-CG1 4.44Å; F3-I7 WeakPolarHBondContact O-CG1 3.41Å; F3-I7 PolarHBondContact O-N 3.13Å; F3-I7 VanDerWaalsContact O-N 3.14Å; F3-F311 HydrophobicContact CB-CD2 4.01Å; F3-F311 HydrophobicContact CB-CE2 4.13Å; F3-F311 HydrophobicContact CB-CG 4.26Å; F3-F311 HydrophobicContact CB-CZ 4.49Å; F3-F311 HydrophobicContact CD2-CD1 4.14Å; F3-F311 HydrophobicContact CD2-CE1 4.03Å; F3-F311 HydrophobicContact CD2-CZ 4.36Å |
| 4 | V | 97.4 | Very high | 95.3 | Very high | 25 Ų | 25 | 42.4 Ų | 42.4 | 15% | 0.152 | 20% | 0.2 | C | C | . | . | H | α-helix | trans | -69 | -39.2 | 174.9 | 177.7 | 0 | 0 | 0 | 0 | 110.3 | M1 Q2 I7 L8 I60 I64 | M1-V4 WeakPolarHBondContact O-CA 3.47Å; M1-V4 WeakPolarHBondContact O-CB 3.2Å; M1-V4 PolarHBondContact O-N 2.91Å; Q2-V4 VanDerWaalsContact C-N 3.28Å; Q2-V4 PolarHBondContact O-N 3.39Å; V4-I7 PolarHBondContact O-N 2.9Å; V4-L8 HydrophobicContact CG1-CD1 3.7Å; V4-L8 HydrophobicContact CG1-CG 4.27Å; V4-L8 WeakPolarHBondContact O-CB 3.47Å; V4-L8 WeakPolarHBondContact O-CG 3.37Å; V4-L8 PolarHBondContact O-N 3.47Å; V4-I60 HydrophobicContact CG2-CG1 4.39Å; V4-I60 HydrophobicContact CG2-CG2 4.31Å; V4-I64 HydrophobicContact CG1-CG1 3.87Å |
| 5 | I | 97.6 | Very high | 95.1 | Very high | 2 Ų | 2 | 46.7 Ų | 46.7 | 1% | 0.01 | 21% | 0.214 | C | C | . | . | H | α-helix | trans | -64.5 | -42.9 | 176.1 | -57.3 | 170.1 | 0 | 0 | 0 | 110.7 | M1 Q2 I7 L8 S9 G63 A66 A67 T303 S307 | M1-I5 HydrophobicContact CG-CD1 4.23Å; M1-I5 PolarHBondContact O-N 3.11Å; Q2-I5 WeakPolarHBondContact O-CA 3.48Å; Q2-I5 WeakPolarHBondContact O-CB 3.33Å; Q2-I5 PolarHBondContact O-N 3Å; I5-I7 PolarHBondContact O-N 3.27Å; I5-L8 PolarHBondContact O-N 2.82Å; I5-S9 VanDerWaalsContact CG2-OG 3.24Å; I5-S9 WeakPolarHBondContact CG2-OG 3.34Å; I5-S9 VanDerWaalsContact O-CB 3.22Å; I5-S9 WeakPolarHBondContact O-CB 3.34Å; I5-S9 PolarHBondContact O-N 2.92Å; I5-S9 PolarHBondContact O-OG 2.91Å; I5-G63 WeakPolarHBondContact CG1-O 3.46Å; I5-A66 HydrophobicContact CD1-CB 3.67Å; I5-A66 HydrophobicContact CG1-CB 4.12Å; I5-A67 HydrophobicContact CB-CB 4.23Å; I5-A67 HydrophobicContact CG1-CB 4.23Å; I5-A67 HydrophobicContact CG2-CB 3.93Å; I5-T303 HydrophobicContact CG2-CG2 3.91Å; I5-S307 WeakPolarHBondContact CB-OG 3.34Å; I5-S307 WeakPolarHBondContact CG2-OG 3.35Å |
| 6 | F | 96.8 | Very high | 94.8 | Very high | 62 Ų | 62 | 43.8 Ų | 43.8 | 27% | 0.272 | 20% | 0.201 | S | C | . | . | H | α-helix | trans | -53.7 | -50.6 | 173 | 165.3 | -112.4 | 0 | 0 | 0 | 112.2 | Q2 F3 P10 S304 L308 | Q2-F6 PolarHBondContact O-N 2.76Å; F3-F6 HydrophobicContact CD2-CD1 4.14Å; F3-F6 HydrophobicContact CE2-CD1 4.11Å; F3-F6 HydrophobicContact CE2-CE1 4.45Å; F3-F6 WeakPolarHBondContact O-CB 3.44Å; F3-F6 PolarHBondContact O-N 3.36Å; F6-P10 WeakPolarHBondContact O-CD 3.4Å; F6-S304 WeakPolarHBondContact CD2-O 3.24Å; F6-S304 WeakPolarHBondContact CD2-OG 3.42Å; F6-S304 WeakPolarHBondContact CE2-OG 3.44Å; F6-S304 PolarHBondContact O-OG 3.12Å; F6-L308 HydrophobicContact CD1-CD1 4.13Å; F6-L308 HydrophobicContact CD2-CB 3.62Å; F6-L308 HydrophobicContact CD2-CD1 4.08Å; F6-L308 HydrophobicContact CD2-CD2 4.26Å; F6-L308 HydrophobicContact CD2-CG 4.19Å; F6-L308 HydrophobicContact CE1-CD1 4.12Å; F6-L308 HydrophobicContact CE2-CB 4.02Å; F6-L308 HydrophobicContact CE2-CD1 4.09Å; F6-L308 HydrophobicContact CE2-CD2 3.77Å; F6-L308 HydrophobicContact CE2-CG 4.17Å; F6-L308 HydrophobicContact CG-CB 4.16Å; F6-L308 HydrophobicContact CG-CD1 4.1Å; F6-L308 HydrophobicContact CZ-CD1 4.1Å; F6-L308 HydrophobicContact CZ-CD2 4.16Å |
| 7 | I | 96.7 | Very high | 94.2 | Very high | 80 Ų | 80 | 42.6 Ų | 42.6 | 41% | 0.41 | 20% | 0.199 | S | C | . | . | H | α-helix | trans | -68.3 | -42.3 | -178 | -66.7 | 169.9 | 0 | 0 | 0 | 112.1 | F3 V4 I5 | F3-I7 HydrophobicContact CD1-CD1 3.92Å; F3-I7 HydrophobicContact CE1-CD1 3.44Å; F3-I7 VanDerWaalsContact CE1-CD1 3.44Å; F3-I7 HydrophobicContact CE1-CG1 4.5Å; F3-I7 HydrophobicContact CE2-CD1 4.38Å; F3-I7 HydrophobicContact CZ-CD1 3.71Å; F3-I7 HydrophobicContact CZ-CG1 4.44Å; F3-I7 WeakPolarHBondContact O-CG1 3.41Å; F3-I7 PolarHBondContact O-N 3.13Å; F3-I7 VanDerWaalsContact O-N 3.14Å; V4-I7 PolarHBondContact O-N 2.9Å; I5-I7 PolarHBondContact O-N 3.27Å |
| 8 | L | 97.2 | Very high | 93.7 | Very high | 36 Ų | 36 | 47.2 Ų | 47.2 | 19% | 0.188 | 22% | 0.223 | C | C | . | . | H | α-helix | trans | -87.7 | -27.4 | -170 | -65.8 | -177.6 | 0 | 0 | 0 | 114.1 | V4 I5 L11 Y12 I64 A67 | V4-L8 HydrophobicContact CG1-CD1 3.7Å; V4-L8 HydrophobicContact CG1-CG 4.27Å; V4-L8 WeakPolarHBondContact O-CB 3.47Å; V4-L8 WeakPolarHBondContact O-CG 3.37Å; V4-L8 PolarHBondContact O-N 3.47Å; I5-L8 PolarHBondContact O-N 2.82Å; L8-L11 HydrophobicContact CD2-CD1 4.02Å; L8-L11 WeakPolarHBondContact O-CB 3.11Å; L8-L11 PolarHBondContact O-N 2.85Å; L8-L11 VanDerWaalsContact O-N 3.1Å; L8-Y12 HydrophobicContact CB-CD2 4.1Å; L8-Y12 HydrophobicContact CB-CE2 3.93Å; L8-Y12 HydrophobicContact CD1-CE2 4.35Å; L8-Y12 PolarHBondContact O-N 3.29Å; L8-I64 HydrophobicContact CD1-CB 4.11Å; L8-I64 HydrophobicContact CD1-CG1 3.72Å; L8-I64 HydrophobicContact CD1-CG2 4.13Å; L8-A67 HydrophobicContact CB-CB 3.99Å |
| 9 | S | 96.8 | Very high | 93.4 | Very high | 0 Ų | 0 | 48.9 Ų | 48.9 | 0% | 0 | 23% | 0.234 | C | C | . | . | H | α-helix | trans | -58.7 | -43 | -177.4 | -58.6 | 0 | 0 | 0 | 0 | 113.4 | I5 L11 Y12 G13 T71 G300 T303 | I5-S9 VanDerWaalsContact CG2-OG 3.24Å; I5-S9 WeakPolarHBondContact CG2-OG 3.34Å; I5-S9 VanDerWaalsContact O-CB 3.22Å; I5-S9 WeakPolarHBondContact O-CB 3.34Å; I5-S9 PolarHBondContact O-N 2.92Å; I5-S9 PolarHBondContact O-OG 2.91Å; S9-L11 VanDerWaalsContact C-N 3.34Å; S9-L11 PolarHBondContact O-N 3Å; S9-Y12 PolarHBondContact O-N 2.86Å; S9-G13 PolarHBondContact O-N 3.24Å; S9-T71 WeakPolarHBondContact CB-OG1 3.49Å; S9-G300 CarbonylContact C-O 3.31Å; S9-G300 VanDerWaalsContact CB-O 3.24Å; S9-G300 WeakPolarHBondContact CB-O 3.45Å; S9-G300 VanDerWaalsContact O-CA 3.22Å; S9-G300 WeakPolarHBondContact O-CA 3.32Å; S9-T303 WeakPolarHBondContact OG-CG2 2.89Å |
| 10 | P | 94.5 | Very high | 93.3 | Very high | 9 Ų | 9 | 47.7 Ų | 47.7 | 6% | 0.058 | 23% | 0.234 | C | C | . | . | H | α-helix | trans | -65 | -36.7 | 175 | -23.9 | 36.8 | 0 | 0 | 0 | 113 | F6 G13 R14 W153 F301 S304 | F6-P10 WeakPolarHBondContact O-CD 3.4Å; P10-G13 PolarHBondContact O-N 3.38Å; P10-R14 WeakPolarHBondContact O-CB 3.5Å; P10-R14 PolarHBondContact O-N 3.36Å; P10-W153 HydrophobicContact CB-CH2 3.64Å; P10-W153 HydrophobicContact CB-CZ3 3.85Å; P10-F301 HydrophobicContact CB-CD1 3.92Å; P10-F301 HydrophobicContact CB-CE1 3.81Å; P10-F301 HydrophobicContact CG-CD1 4.14Å; P10-F301 HydrophobicContact CG-CE1 4.44Å; P10-S304 WeakPolarHBondContact CG-OG 3.39Å |
| 11 | L | 94.5 | Very high | 93.2 | Very high | 61 Ų | 61 | 45.7 Ų | 45.7 | 32% | 0.319 | 23% | 0.225 | S | C | . | . | H | α-helix | trans | -66.8 | -47.1 | 177.7 | -63.5 | 175.9 | 0 | 0 | 0 | 110.7 | L8 S9 R14 Y15 W153 | L8-L11 HydrophobicContact CD2-CD1 4.02Å; L8-L11 WeakPolarHBondContact O-CB 3.11Å; L8-L11 PolarHBondContact O-N 2.85Å; L8-L11 VanDerWaalsContact O-N 3.1Å; S9-L11 VanDerWaalsContact C-N 3.34Å; S9-L11 PolarHBondContact O-N 3Å; L11-R14 PolarHBondContact O-N 2.9Å; L11-Y15 HydrophobicContact CD2-CE2 4.46Å; L11-Y15 WeakPolarHBondContact O-CD2 3.34Å; L11-Y15 PolarHBondContact O-N 3.27Å; L11-W153 HydrophobicContact CD2-CH2 4.45Å; L11-W153 HydrophobicContact CD2-CZ2 3.92Å |
| 12 | Y | 95 | Very high | 93.2 | Very high | 44 Ų | 44 | 45.8 Ų | 45.8 | 17% | 0.173 | 22% | 0.224 | C | C | . | . | H | α-helix | trans | -61.2 | -45.4 | 174 | -75.2 | -33.7 | 0 | 0 | 0 | 111.8 | L8 S9 R14 Y15 M16 L19 L24 I64 A67 A68 | L8-Y12 HydrophobicContact CB-CD2 4.1Å; L8-Y12 HydrophobicContact CB-CE2 3.93Å; L8-Y12 HydrophobicContact CD1-CE2 4.35Å; L8-Y12 PolarHBondContact O-N 3.29Å; S9-Y12 PolarHBondContact O-N 2.86Å; Y12-R14 VanDerWaalsContact C-N 3.31Å; Y12-R14 PolarHBondContact O-N 3.36Å; Y12-Y15 PolarHBondContact O-N 3.36Å; Y12-M16 WeakPolarHBondContact O-CA 3.48Å; Y12-M16 VanDerWaalsContact O-CB 3.24Å; Y12-M16 WeakPolarHBondContact O-CB 3.47Å; Y12-M16 PolarHBondContact O-N 2.67Å; Y12-L19 HydrophobicContact CD1-CD1 4.38Å; Y12-L24 HydrophobicContact CD1-CD1 3.63Å; Y12-L24 HydrophobicContact CD1-CD2 4.24Å; Y12-L24 HydrophobicContact CE1-CD1 3.73Å; Y12-L24 HydrophobicContact CG-CD1 4.1Å; Y12-L24 HydrophobicContact CG-CD2 4.14Å; Y12-I64 WeakPolarHBondContact CE2-O 3.17Å; Y12-I64 VanDerWaalsContact OH-CG2 3.23Å; Y12-I64 WeakPolarHBondContact OH-CG2 3.21Å; Y12-A67 HydrophobicContact CD2-CB 3.8Å; Y12-A67 HydrophobicContact CE2-CB 3.78Å; Y12-A68 HydrophobicContact CD2-CB 4.1Å; Y12-A68 HydrophobicContact CE2-CB 3.7Å |
| 13 | G | 93.2 | Very high | 93.2 | Very high | 0 Ų | 0 | 49.6 Ų | 49.6 | 0% | 0 | 24% | 0.24 | C | C | . | . | H | α-helix | trans | -56.6 | -42.4 | 175.2 | 0 | 0 | 0 | 0 | 0 | 113.1 | S9 P10 S296 | S9-G13 PolarHBondContact O-N 3.24Å; P10-G13 PolarHBondContact O-N 3.38Å; G13-S296 WeakPolarHBondContact CA-O 3.5Å; G13-S296 CarbonylContact O-C 3.43Å; G13-S296 VanDerWaalsContact O-CB 3.23Å; G13-S296 WeakPolarHBondContact O-CB 3.04Å; G13-S296 PolarHBondContact O-OG 2.94Å |
| 14 | R | 91.4 | Very high | 93.2 | Very high | 69 Ų | 69 | 45.3 Ų | 45.3 | 26% | 0.26 | 22% | 0.221 | S | C | . | . | H | α-helix | trans | -67.9 | -45.9 | 178.3 | 179.2 | 176.3 | 176.3 | 161 | -2.8 | 113.1 | P10 L11 Y12 A152 H293 L297 | P10-R14 WeakPolarHBondContact O-CB 3.5Å; P10-R14 PolarHBondContact O-N 3.36Å; L11-R14 PolarHBondContact O-N 2.9Å; Y12-R14 VanDerWaalsContact C-N 3.31Å; Y12-R14 PolarHBondContact O-N 3.36Å; R14-A152 HydrophobicContact CG-CB 4.28Å; R14-H293 PolarHBondContact O-CE1 3.22Å; R14-L297 HydrophobicContact CB-CD2 3.84Å; R14-L297 HydrophobicContact CG-CD2 4.37Å |
| 15 | Y | 91.3 | Very high | 93.1 | Very high | 107 Ų | 107 | 46.3 Ų | 46.3 | 42% | 0.42 | 22% | 0.224 | S | C | . | . | H | α-helix | trans | -94.2 | 1 | -173.2 | -63.3 | -65 | 0 | 0 | 0 | 113.7 | L11 Y12 S17 I18 L19 | L11-Y15 HydrophobicContact CD2-CE2 4.46Å; L11-Y15 WeakPolarHBondContact O-CD2 3.34Å; L11-Y15 PolarHBondContact O-N 3.27Å; Y12-Y15 PolarHBondContact O-N 3.36Å; Y15-S17 VanDerWaalsContact C-N 3.3Å; Y15-S17 PolarHBondContact O-N 2.96Å; Y15-I18 HydrophobicContact CD1-CD1 4.28Å; Y15-I18 PolarHBondContact O-N 3.4Å; Y15-L19 WeakPolarHBondContact O-CG 3.25Å; Y15-L19 PolarHBondContact O-N 3.03Å |
| 16 | M | 91.3 | Very high | 93.1 | Very high | 0 Ų | 0 | 46.9 Ų | 46.9 | 0% | 0 | 23% | 0.228 | C | C | . | . | H | α-helix | trans | -59.2 | -37.4 | -176.4 | -162.3 | 178 | -58.6 | 0 | 0 | 113.7 | Y12 I18 G20 L24 T71 A72 S75 F292 | Y12-M16 WeakPolarHBondContact O-CA 3.48Å; Y12-M16 VanDerWaalsContact O-CB 3.24Å; Y12-M16 WeakPolarHBondContact O-CB 3.47Å; Y12-M16 PolarHBondContact O-N 2.67Å; M16-I18 PolarHBondContact O-N 2.9Å; M16-G20 WeakPolarHBondContact O-CA 3.45Å; M16-G20 PolarHBondContact O-N 3.45Å; M16-L24 HydrophobicContact CE-CD2 3.87Å; M16-L24 HydrophobicContact CG-CD2 3.99Å; M16-L24 HydrophobicContact SD-CD2 4.49Å; M16-T71 HydrophobicContact CE-CG2 3.65Å; M16-A72 HydrophobicContact CE-CB 4.17Å; M16-A72 HydrophobicContact SD-CB 4.22Å; M16-S75 WeakPolarHBondContact CE-OG 3.41Å; M16-F292 HydrophobicContact CB-CE1 4.35Å; M16-F292 HydrophobicContact CG-CE1 3.95Å; M16-F292 HydrophobicContact CG-CZ 4.28Å; M16-F292 HydrophobicContact SD-CE1 3.83Å; M16-F292 HydrophobicContact SD-CZ 3.6Å; M16-F292 VanDerWaalsContact SD-CZ 3.6Å |
| 17 | S | 83.7 | Confident | 93.1 | Very high | 23 Ų | 23 | 46.1 Ų | 46.1 | 16% | 0.161 | 23% | 0.228 | C | C | . | . | H | α-helix | trans | -63.7 | -24.4 | 177.9 | 52.7 | 0 | 0 | 0 | 0 | 112.7 | Y15 | Y15-S17 VanDerWaalsContact C-N 3.3Å; Y15-S17 PolarHBondContact O-N 2.96Å |
| 18 | I | 85.9 | Confident | 93.1 | Very high | 126 Ų | 126 | 42.4 Ų | 42.4 | 65% | 0.646 | 21% | 0.209 | S | C | * | . | H | α-helix | trans | -92.8 | -45.7 | 178.2 | -53.1 | 178.1 | 0 | 0 | 0 | 110.7 | Y15 M16 G20 | Y15-I18 HydrophobicContact CD1-CD1 4.28Å; Y15-I18 PolarHBondContact O-N 3.4Å; M16-I18 PolarHBondContact O-N 2.9Å; I18-G20 VanDerWaalsContact C-N 3.26Å; I18-G20 PolarHBondContact O-N 3.47Å |
| 19 | L | 88.8 | Confident | 93.1 | Very high | 80 Ų | 80 | 41 Ų | 41 | 42% | 0.419 | 20% | 0.202 | S | C | . | . | H | α-helix | trans | -68.9 | -25.1 | -179.6 | -66.8 | 173 | 0 | 0 | 0 | 112.9 | Y12 Y15 L24 | Y12-L19 HydrophobicContact CD1-CD1 4.38Å; Y15-L19 WeakPolarHBondContact O-CG 3.25Å; Y15-L19 PolarHBondContact O-N 3.03Å; L19-L24 HydrophobicContact CD1-CD1 4.48Å |
| 20 | G | 90.2 | Very high | 93.2 | Very high | 24 Ų | 24 | 45.8 Ų | 45.8 | 25% | 0.247 | 22% | 0.223 | C | C | . | . | trans | 86.1 | 122.4 | -173 | 0 | 0 | 0 | 0 | 0 | 111.8 | M16 I18 K22 F23 L24 | M16-G20 WeakPolarHBondContact O-CA 3.45Å; M16-G20 PolarHBondContact O-N 3.45Å; I18-G20 VanDerWaalsContact C-N 3.26Å; I18-G20 PolarHBondContact O-N 3.47Å; G20-K22 PolarHBondContact O-N 2.99Å; G20-F23 PolarHBondContact O-N 3.46Å; G20-L24 PolarHBondContact O-N 2.84Å | ||
| 21 | S | 92.5 | Very high | 93.4 | Very high | 5 Ų | 5 | 47.4 Ų | 47.4 | 4% | 0.035 | 23% | 0.232 | C | C | . | . | H | α-helix | trans | -61 | -41.5 | -177.3 | 60.2 | 0 | 0 | 0 | 0 | 113.2 | L24 F25 F292 | S21-L24 PolarHBondContact O-N 2.94Å; S21-F25 VanDerWaalsContact O-CB 3.26Å; S21-F25 WeakPolarHBondContact O-CB 3.25Å; S21-F25 PolarHBondContact O-N 3.47Å; S21-F292 VanDerWaalsContact CB-CZ 3.42Å |
| 22 | K | 92.9 | Very high | 93.5 | Very high | 65 Ų | 65 | 44.7 Ų | 44.7 | 28% | 0.283 | 22% | 0.218 | S | C | . | . | H | α-helix | trans | -63 | -45.5 | 175.9 | -179.7 | -179.2 | 173.5 | -176.4 | 0 | 112 | G20 F25 C26 S134 S135 L137 A139 | G20-K22 PolarHBondContact O-N 2.99Å; K22-F25 PolarHBondContact O-N 3.31Å; K22-C26 WeakPolarHBondContact O-CB 3.28Å; K22-C26 PolarHBondContact O-N 3.39Å; K22-C26 PolarHBondContact O-SG 2.81Å; K22-S134 WeakPolarHBondContact CE-O 3.36Å; K22-S135 VanDerWaalsContact CE-O 3.25Å; K22-S135 WeakPolarHBondContact CE-O 3.5Å; K22-S135 PolarHBondContact NZ-O 3.08Å; K22-L137 VanDerWaalsContact CE-O 3.25Å; K22-L137 WeakPolarHBondContact CE-O 3.49Å; K22-L137 PolarHBondContact NZ-O 3.25Å; K22-A139 HydrophobicContact CB-CB 4.33Å; K22-A139 HydrophobicContact CD-CB 4Å |
| 23 | F | 93.8 | Very high | 93.7 | Very high | 128 Ų | 128 | 42.6 Ų | 42.6 | 56% | 0.561 | 21% | 0.21 | S | C | * | . | H | α-helix | trans | -61.6 | -48.8 | 179.3 | 173.2 | -99.6 | 0 | 0 | 0 | 110.3 | G20 F25 C26 T27 | G20-F23 PolarHBondContact O-N 3.46Å; F23-F25 VanDerWaalsContact C-N 3.35Å; F23-F25 PolarHBondContact O-N 3.1Å; F23-C26 PolarHBondContact O-N 2.62Å; F23-T27 HydrophobicContact CD1-CG2 4.39Å; F23-T27 HydrophobicContact CD2-CG2 3.91Å; F23-T27 HydrophobicContact CE1-CG2 4.04Å; F23-T27 HydrophobicContact CE2-CG2 3.52Å; F23-T27 HydrophobicContact CG-CG2 4.34Å; F23-T27 HydrophobicContact CZ-CG2 3.6Å; F23-T27 WeakPolarHBondContact O-CB 3.44Å; F23-T27 WeakPolarHBondContact O-CG2 3.43Å; F23-T27 PolarHBondContact O-N 3.31Å; F23-T27 PolarHBondContact O-OG1 3.29Å |
| 24 | L | 95.2 | Very high | 93.9 | Very high | 6 Ų | 6 | 48.1 Ų | 48.1 | 3% | 0.031 | 23% | 0.232 | C | C | . | . | H | α-helix | trans | -62.3 | -41.1 | 178.8 | -171.3 | 68.4 | 0 | 0 | 0 | 112.3 | Y12 M16 L19 G20 S21 T27 G28 A68 A72 | Y12-L24 HydrophobicContact CD1-CD1 3.63Å; Y12-L24 HydrophobicContact CD1-CD2 4.24Å; Y12-L24 HydrophobicContact CE1-CD1 3.73Å; Y12-L24 HydrophobicContact CG-CD1 4.1Å; Y12-L24 HydrophobicContact CG-CD2 4.14Å; M16-L24 HydrophobicContact CE-CD2 3.87Å; M16-L24 HydrophobicContact CG-CD2 3.99Å; M16-L24 HydrophobicContact SD-CD2 4.49Å; L19-L24 HydrophobicContact CD1-CD1 4.48Å; G20-L24 PolarHBondContact O-N 2.84Å; S21-L24 PolarHBondContact O-N 2.94Å; L24-T27 PolarHBondContact O-OG1 3.43Å; L24-G28 PolarHBondContact O-N 3.26Å; L24-A68 HydrophobicContact CD1-CB 3.51Å; L24-A68 HydrophobicContact CG-CB 3.84Å; L24-A72 HydrophobicContact CD2-CB 4.36Å; L24-A72 HydrophobicContact CG-CB 4.49Å |
| 25 | F | 96 | Very high | 94.2 | Very high | 46 Ų | 46 | 45.3 Ų | 45.3 | 20% | 0.202 | 22% | 0.222 | C | C | . | . | H | α-helix | trans | -62.1 | -51 | 175.5 | -176 | -106.3 | 0 | 0 | 0 | 112.2 | S21 K22 F23 G28 L29 A72 A73 I76 S134 | S21-F25 VanDerWaalsContact O-CB 3.26Å; S21-F25 WeakPolarHBondContact O-CB 3.25Å; S21-F25 PolarHBondContact O-N 3.47Å; K22-F25 PolarHBondContact O-N 3.31Å; F23-F25 VanDerWaalsContact C-N 3.35Å; F23-F25 PolarHBondContact O-N 3.1Å; F25-G28 PolarHBondContact O-N 2.94Å; F25-L29 HydrophobicContact CD1-CD1 3.97Å; F25-L29 HydrophobicContact CE1-CD1 3.47Å; F25-L29 VanDerWaalsContact CE1-CD1 3.47Å; F25-L29 HydrophobicContact CE1-CG 4.4Å; F25-L29 HydrophobicContact CE2-CD1 4.37Å; F25-L29 HydrophobicContact CZ-CD1 3.7Å; F25-L29 HydrophobicContact CZ-CG 4.34Å; F25-L29 WeakPolarHBondContact O-CG 3.32Å; F25-L29 PolarHBondContact O-N 3.07Å; F25-A72 HydrophobicContact CB-CB 3.82Å; F25-A72 HydrophobicContact CD2-CB 4.24Å; F25-A73 HydrophobicContact CD2-CB 4.25Å; F25-A73 HydrophobicContact CE2-CB 3.88Å; F25-I76 HydrophobicContact CB-CD1 4.39Å; F25-S134 WeakPolarHBondContact CE1-OG 3.23Å |
| 26 | C | 96.8 | Very high | 94.5 | Very high | 14 Ų | 14 | 40.5 Ų | 40.5 | 10% | 0.095 | 20% | 0.204 | C | C | . | . | H | α-helix | trans | -66 | -47.6 | -178.2 | -63.4 | 0 | 0 | 0 | 0 | 111.6 | K22 F23 G28 L29 F30 C131 | K22-C26 WeakPolarHBondContact O-CB 3.28Å; K22-C26 PolarHBondContact O-N 3.39Å; K22-C26 PolarHBondContact O-SG 2.81Å; F23-C26 PolarHBondContact O-N 2.62Å; C26-G28 VanDerWaalsContact C-N 3.32Å; C26-G28 PolarHBondContact O-N 2.92Å; C26-L29 PolarHBondContact O-N 3.32Å; C26-F30 PolarHBondContact O-N 3.38Å; C26-C131 PolarHBondContact O-SG 2.89Å |
| 27 | T | 96.6 | Very high | 94.7 | Very high | 46 Ų | 46 | 42.3 Ų | 42.3 | 28% | 0.282 | 21% | 0.213 | S | C | . | . | H | α-helix | trans | -63.4 | -38.5 | 177.6 | 53.4 | 0 | 0 | 0 | 0 | 111.9 | F23 L24 F30 V31 | F23-T27 HydrophobicContact CD1-CG2 4.39Å; F23-T27 HydrophobicContact CD2-CG2 3.91Å; F23-T27 HydrophobicContact CE1-CG2 4.04Å; F23-T27 HydrophobicContact CE2-CG2 3.52Å; F23-T27 HydrophobicContact CG-CG2 4.34Å; F23-T27 HydrophobicContact CZ-CG2 3.6Å; F23-T27 WeakPolarHBondContact O-CB 3.44Å; F23-T27 WeakPolarHBondContact O-CG2 3.43Å; F23-T27 PolarHBondContact O-N 3.31Å; F23-T27 PolarHBondContact O-OG1 3.29Å; L24-T27 PolarHBondContact O-OG1 3.43Å; T27-F30 PolarHBondContact O-N 3.19Å; T27-V31 WeakPolarHBondContact O-CB 3.38Å; T27-V31 VanDerWaalsContact O-CG2 3.28Å; T27-V31 WeakPolarHBondContact O-CG2 3.26Å; T27-V31 PolarHBondContact O-N 3.31Å |
| 28 | G | 97.7 | Very high | 95.4 | Very high | 1 Ų | 1 | 44 Ų | 44 | 1% | 0.01 | 22% | 0.221 | C | C | . | . | H | α-helix | trans | -60.7 | -45.4 | 173.9 | 0 | 0 | 0 | 0 | 0 | 112.9 | L24 F25 C26 T32 G65 | L24-G28 PolarHBondContact O-N 3.26Å; F25-G28 PolarHBondContact O-N 2.94Å; C26-G28 VanDerWaalsContact C-N 3.32Å; C26-G28 PolarHBondContact O-N 2.92Å; G28-T32 VanDerWaalsContact O-CB 3.31Å; G28-T32 WeakPolarHBondContact O-CB 3.4Å; G28-T32 PolarHBondContact O-N 3.12Å; G28-T32 PolarHBondContact O-OG1 3.4Å; G28-G65 CarbonylContact C-O 3.56Å; G28-G65 WeakPolarHBondContact CA-O 3.28Å; G28-G65 CarbonylContact O-C 3.32Å |
| 29 | L | 97.8 | Very high | 95.8 | Very high | 8 Ų | 8 | 39.2 Ų | 39.2 | 4% | 0.042 | 20% | 0.195 | C | C | . | . | H | α-helix | trans | -61.7 | -46.9 | 174.7 | -75.3 | 177 | 0 | 0 | 0 | 111.7 | F25 C26 T32 G33 Y69 L127 F130 C131 | F25-L29 HydrophobicContact CD1-CD1 3.97Å; F25-L29 HydrophobicContact CE1-CD1 3.47Å; F25-L29 VanDerWaalsContact CE1-CD1 3.47Å; F25-L29 HydrophobicContact CE1-CG 4.4Å; F25-L29 HydrophobicContact CE2-CD1 4.37Å; F25-L29 HydrophobicContact CZ-CD1 3.7Å; F25-L29 HydrophobicContact CZ-CG 4.34Å; F25-L29 WeakPolarHBondContact O-CG 3.32Å; F25-L29 PolarHBondContact O-N 3.07Å; C26-L29 PolarHBondContact O-N 3.32Å; L29-T32 PolarHBondContact O-N 3.3Å; L29-G33 PolarHBondContact O-N 2.71Å; L29-Y69 HydrophobicContact CD2-CD1 4.37Å; L29-Y69 HydrophobicContact CD2-CD2 4.12Å; L29-Y69 HydrophobicContact CD2-CG 3.99Å; L29-Y69 HydrophobicContact CG-CG 4.38Å; L29-L127 HydrophobicContact CD2-CD2 3.92Å; L29-F130 HydrophobicContact CD1-CB 4.21Å; L29-C131 HydrophobicContact CB-CB 3.83Å; L29-C131 HydrophobicContact CD1-CB 4.46Å |
| 30 | F | 98.2 | Very high | 96.1 | Very high | 100 Ų | 100 | 35.4 Ų | 35.4 | 44% | 0.439 | 18% | 0.175 | S | C | . | . | H | α-helix | trans | -60.1 | -51.5 | 178.8 | -178.9 | -94.7 | 0 | 0 | 0 | 111.7 | C26 T27 T32 G33 Y34 I128 C131 | C26-F30 PolarHBondContact O-N 3.38Å; T27-F30 PolarHBondContact O-N 3.19Å; F30-T32 VanDerWaalsContact C-N 3.34Å; F30-T32 PolarHBondContact O-N 2.61Å; F30-G33 PolarHBondContact O-N 2.89Å; F30-Y34 WeakPolarHBondContact O-CB 3.37Å; F30-Y34 PolarHBondContact O-N 3.36Å; F30-I128 HydrophobicContact CD2-CG1 4.45Å; F30-I128 HydrophobicContact CD2-CG2 4.48Å; F30-C131 HydrophobicContact CB-CB 4.47Å |
| 31 | V | 98.1 | Very high | 96.3 | Very high | 42 Ų | 42 | 37.2 Ų | 37.2 | 26% | 0.255 | 18% | 0.179 | S | C | . | . | H | α-helix | trans | -61.1 | -44.2 | 179.8 | 171.9 | 0 | 0 | 0 | 0 | 110.6 | T27 T35 F61 | T27-V31 WeakPolarHBondContact O-CB 3.38Å; T27-V31 VanDerWaalsContact O-CG2 3.28Å; T27-V31 WeakPolarHBondContact O-CG2 3.26Å; T27-V31 PolarHBondContact O-N 3.31Å; V31-T35 HydrophobicContact CG1-CG2 4.18Å; V31-T35 VanDerWaalsContact O-CB 3.26Å; V31-T35 WeakPolarHBondContact O-CB 3.2Å; V31-T35 WeakPolarHBondContact O-CG2 3.45Å; V31-T35 PolarHBondContact O-N 3.27Å; V31-T35 PolarHBondContact O-OG1 3.1Å; V31-F61 VanDerWaalsContact CG1-O 3.32Å; V31-F61 WeakPolarHBondContact CG1-O 3.19Å |
| 32 | T | 98 | Very high | 96.4 | Very high | 4 Ų | 4 | 37.3 Ų | 37.3 | 3% | 0.025 | 18% | 0.179 | C | C | . | . | H | α-helix | trans | -64.2 | -43.6 | 178.7 | -54.6 | 0 | 0 | 0 | 0 | 111.7 | G28 L29 F30 T35 S36 K62 G65 A66 Y69 L127 | G28-T32 VanDerWaalsContact O-CB 3.31Å; G28-T32 WeakPolarHBondContact O-CB 3.4Å; G28-T32 PolarHBondContact O-N 3.12Å; G28-T32 PolarHBondContact O-OG1 3.4Å; L29-T32 PolarHBondContact O-N 3.3Å; F30-T32 VanDerWaalsContact C-N 3.34Å; F30-T32 PolarHBondContact O-N 2.61Å; T32-T35 PolarHBondContact O-OG1 2.69Å; T32-S36 VanDerWaalsContact O-CB 3.3Å; T32-S36 WeakPolarHBondContact O-CB 3.47Å; T32-S36 PolarHBondContact O-N 2.91Å; T32-S36 PolarHBondContact O-OG 3.16Å; T32-K62 HydrophobicContact CG2-CG 4.16Å; T32-G65 WeakPolarHBondContact OG1-CA 3.15Å; T32-A66 PolarHBondContact OG1-N 3.11Å; T32-A66 VanDerWaalsContact OG1-N 3.15Å; T32-Y69 HydrophobicContact CG2-CE1 3.99Å; T32-L127 HydrophobicContact CG2-CD1 3.78Å |
| 33 | G | 97.9 | Very high | 96.1 | Very high | 0 Ų | 0 | 39.9 Ų | 39.9 | 0% | 0 | 19% | 0.188 | C | C | . | . | H | α-helix | trans | -65.1 | -52.8 | 178.5 | 0 | 0 | 0 | 0 | 0 | 111.7 | L29 F30 T35 S36 I37 G124 | L29-G33 PolarHBondContact O-N 2.71Å; F30-G33 PolarHBondContact O-N 2.89Å; G33-T35 PolarHBondContact O-N 3.43Å; G33-S36 WeakPolarHBondContact O-CB 3.34Å; G33-S36 PolarHBondContact O-N 3.38Å; G33-S36 VanDerWaalsContact O-N 3.14Å; G33-I37 WeakPolarHBondContact O-CG1 3.34Å; G33-I37 PolarHBondContact O-N 2.93Å; G33-G124 WeakPolarHBondContact CA-O 3.31Å; G33-G124 WeakPolarHBondContact O-CA 3.17Å |
| 34 | Y | 97.9 | Very high | 96 | Very high | 117 Ų | 117 | 39.7 Ų | 39.7 | 46% | 0.459 | 19% | 0.19 | S | C | . | . | H | α-helix | trans | -59.5 | -47.9 | 179.7 | -176.5 | -107.3 | 0 | 0 | 0 | 112.3 | F30 S36 I37 L38 | F30-Y34 WeakPolarHBondContact O-CB 3.37Å; F30-Y34 PolarHBondContact O-N 3.36Å; Y34-S36 VanDerWaalsContact C-N 3.27Å; Y34-S36 PolarHBondContact O-N 2.72Å; Y34-I37 PolarHBondContact O-N 3.26Å; Y34-L38 HydrophobicContact CD1-CD1 3.85Å; Y34-L38 HydrophobicContact CD1-CG 4.29Å; Y34-L38 HydrophobicContact CE1-CD1 3.41Å; Y34-L38 VanDerWaalsContact CE1-CD1 3.41Å; Y34-L38 HydrophobicContact CE1-CD2 4.45Å; Y34-L38 HydrophobicContact CE1-CG 3.98Å; Y34-L38 WeakPolarHBondContact O-CG 3.23Å; Y34-L38 PolarHBondContact O-N 2.88Å |
| 35 | T | 97.7 | Very high | 95.7 | Very high | 9 Ų | 9 | 41.2 Ų | 41.2 | 6% | 0.055 | 20% | 0.2 | C | C | . | . | H | α-helix | trans | -66.8 | -28.2 | 177.7 | 55.8 | 0 | 0 | 0 | 0 | 113 | V31 T32 G33 F39 F61 K62 | V31-T35 HydrophobicContact CG1-CG2 4.18Å; V31-T35 VanDerWaalsContact O-CB 3.26Å; V31-T35 WeakPolarHBondContact O-CB 3.2Å; V31-T35 WeakPolarHBondContact O-CG2 3.45Å; V31-T35 PolarHBondContact O-N 3.27Å; V31-T35 PolarHBondContact O-OG1 3.1Å; T32-T35 PolarHBondContact O-OG1 2.69Å; G33-T35 PolarHBondContact O-N 3.43Å; T35-F39 WeakPolarHBondContact O-CB 3.47Å; T35-F39 PolarHBondContact O-N 3.44Å; T35-F61 HydrophobicContact CG2-CB 3.54Å; T35-K62 WeakPolarHBondContact OG1-CA 3.35Å; T35-K62 WeakPolarHBondContact OG1-CB 3.41Å |
| 36 | S | 96.6 | Very high | 95.3 | Very high | 6 Ų | 6 | 43.4 Ų | 43.4 | 4% | 0.042 | 22% | 0.219 | C | C | . | . | H | α-helix | trans | -67.3 | -43.2 | 172.4 | -62.5 | 0 | 0 | 0 | 0 | 111 | T32 G33 Y34 F39 G40 K62 F120 | T32-S36 VanDerWaalsContact O-CB 3.3Å; T32-S36 WeakPolarHBondContact O-CB 3.47Å; T32-S36 PolarHBondContact O-N 2.91Å; T32-S36 PolarHBondContact O-OG 3.16Å; G33-S36 WeakPolarHBondContact O-CB 3.34Å; G33-S36 PolarHBondContact O-N 3.38Å; G33-S36 VanDerWaalsContact O-N 3.14Å; Y34-S36 VanDerWaalsContact C-N 3.27Å; Y34-S36 PolarHBondContact O-N 2.72Å; S36-F39 WeakPolarHBondContact O-CB 3.23Å; S36-F39 PolarHBondContact O-N 3.16Å; S36-G40 PolarHBondContact O-N 3.39Å; S36-K62 PolarHBondContact OG-NZ 3.17Å; S36-F120 WeakPolarHBondContact O-CB 3.47Å |
| 37 | I | 97.4 | Very high | 94.8 | Very high | 38 Ų | 38 | 47.2 Ų | 47.2 | 20% | 0.195 | 25% | 0.246 | C | C | . | . | H | α-helix | trans | -61.5 | -46 | 174 | -58.8 | 172.5 | 0 | 0 | 0 | 110.5 | G33 Y34 F39 G40 L41 I128 | G33-I37 WeakPolarHBondContact O-CG1 3.34Å; G33-I37 PolarHBondContact O-N 2.93Å; Y34-I37 PolarHBondContact O-N 3.26Å; I37-F39 VanDerWaalsContact C-N 3.3Å; I37-F39 PolarHBondContact O-N 3.41Å; I37-G40 WeakPolarHBondContact O-CA 3.23Å; I37-G40 PolarHBondContact O-N 3.47Å; I37-L41 HydrophobicContact CG2-CD1 4.29Å; I37-L41 PolarHBondContact O-N 2.96Å; I37-I128 HydrophobicContact CD1-CD1 3.75Å |
| 38 | L | 96.6 | Very high | 94.3 | Very high | 59 Ų | 59 | 51 Ų | 51 | 31% | 0.309 | 27% | 0.265 | S | S | . | . | H | α-helix | trans | -58.8 | -40.2 | 175.7 | -70.6 | -177.7 | 0 | 0 | 0 | 112.4 | Y34 G40 L41 L42 T58 | Y34-L38 HydrophobicContact CD1-CD1 3.85Å; Y34-L38 HydrophobicContact CD1-CG 4.29Å; Y34-L38 HydrophobicContact CE1-CD1 3.41Å; Y34-L38 VanDerWaalsContact CE1-CD1 3.41Å; Y34-L38 HydrophobicContact CE1-CD2 4.45Å; Y34-L38 HydrophobicContact CE1-CG 3.98Å; Y34-L38 WeakPolarHBondContact O-CG 3.23Å; Y34-L38 PolarHBondContact O-N 2.88Å; L38-G40 VanDerWaalsContact C-N 3.3Å; L38-G40 PolarHBondContact O-N 3.47Å; L38-L41 HydrophobicContact CD2-CD1 4.36Å; L38-L41 PolarHBondContact O-N 3.1Å; L38-L41 VanDerWaalsContact O-N 3.12Å; L38-L42 PolarHBondContact O-N 3.24Å; L38-T58 HydrophobicContact CB-CG2 4.11Å |
| 39 | F | 95.6 | Very high | 94.1 | Very high | 26 Ų | 26 | 57.1 Ų | 57.1 | 11% | 0.114 | 30% | 0.296 | C | S | . | . | H | α-helix | trans | -59.9 | -42.9 | 174.5 | -167.3 | -84.7 | 0 | 0 | 0 | 111.1 | T35 S36 I37 L41 L42 T58 R59 F120 | T35-F39 WeakPolarHBondContact O-CB 3.47Å; T35-F39 PolarHBondContact O-N 3.44Å; S36-F39 WeakPolarHBondContact O-CB 3.23Å; S36-F39 PolarHBondContact O-N 3.16Å; I37-F39 VanDerWaalsContact C-N 3.3Å; I37-F39 PolarHBondContact O-N 3.41Å; F39-L41 PolarHBondContact O-N 2.92Å; F39-L42 HydrophobicContact CD2-CD1 3.81Å; F39-L42 HydrophobicContact CE2-CD1 4.07Å; F39-L42 HydrophobicContact CG-CD1 4.18Å; F39-L42 VanDerWaalsContact O-CB 3.3Å; F39-L42 WeakPolarHBondContact O-CB 3.19Å; F39-L42 VanDerWaalsContact O-CG 3.32Å; F39-L42 WeakPolarHBondContact O-CG 3.36Å; F39-L42 PolarHBondContact O-N 3.36Å; F39-L42 VanDerWaalsContact O-N 3.15Å; F39-T58 WeakPolarHBondContact CD2-OG1 3.37Å; F39-R59 HydrophobicContact CD2-CG 4.36Å; F39-R59 HydrophobicContact CE2-CG 3.97Å; F39-F120 AromaticContact CD1-CD1 3.95Å; F39-F120 HydrophobicContact CD1-CD1 3.95Å; F39-F120 AromaticContact CD1-CE1 3.49Å; F39-F120 HydrophobicContact CD1-CE1 3.49Å; F39-F120 VanDerWaalsContact CD1-CE1 3.49Å; F39-F120 HydrophobicContact CD1-CE2 4.39Å; F39-F120 AromaticContact CD1-CZ 3.75Å; F39-F120 HydrophobicContact CD1-CZ 3.75Å; F39-F120 AromaticContact CE1-CE1 3.94Å; F39-F120 HydrophobicContact CE1-CE1 3.94Å; F39-F120 AromaticContact CE1-CZ 3.87Å; F39-F120 HydrophobicContact CE1-CZ 3.87Å |
| 40 | G | 94.9 | Very high | 93.8 | Very high | 0 Ų | 0 | 59.5 Ų | 59.5 | 0% | 0 | 31% | 0.312 | C | S | . | . | H | α-helix | trans | -62.1 | -28.5 | 174.7 | 0 | 0 | 0 | 0 | 0 | 114 | S36 I37 L38 L42 Y43 Y116 | S36-G40 PolarHBondContact O-N 3.39Å; I37-G40 WeakPolarHBondContact O-CA 3.23Å; I37-G40 PolarHBondContact O-N 3.47Å; L38-G40 VanDerWaalsContact C-N 3.3Å; L38-G40 PolarHBondContact O-N 3.47Å; G40-L42 VanDerWaalsContact C-N 3.34Å; G40-Y43 WeakPolarHBondContact O-CD1 3.45Å; G40-Y116 WeakPolarHBondContact O-CD1 3.24Å |
| 41 | L | 95.2 | Very high | 93.6 | Very high | 61 Ų | 61 | 58.1 Ų | 58.1 | 32% | 0.319 | 31% | 0.306 | S | S | . | . | H | α-helix | trans | -81.1 | -9.3 | 177 | -71.8 | 165.4 | 0 | 0 | 0 | 113.6 | I37 L38 F39 Y43 M44 I117 | I37-L41 HydrophobicContact CG2-CD1 4.29Å; I37-L41 PolarHBondContact O-N 2.96Å; L38-L41 HydrophobicContact CD2-CD1 4.36Å; L38-L41 PolarHBondContact O-N 3.1Å; L38-L41 VanDerWaalsContact O-N 3.12Å; F39-L41 PolarHBondContact O-N 2.92Å; L41-Y43 PolarHBondContact O-N 2.9Å; L41-Y43 VanDerWaalsContact O-N 3.11Å; L41-M44 HydrophobicContact CD2-CE 4.2Å; L41-M44 HydrophobicContact CD2-SD 4.06Å; L41-M44 WeakPolarHBondContact O-CB 3.43Å; L41-M44 PolarHBondContact O-N 3.49Å; L41-I117 HydrophobicContact CD2-CD1 3.45Å; L41-I117 VanDerWaalsContact CD2-CD1 3.45Å; L41-I117 HydrophobicContact CG-CD1 4Å |
| 42 | L | 93.5 | Very high | 93.4 | Very high | 7 Ų | 7 | 60.2 Ų | 60.2 | 4% | 0.037 | 32% | 0.315 | C | S | . | . | G | 310 helix | trans | -62.2 | -21.5 | -178.2 | -65.5 | 179.3 | 0 | 0 | 0 | 113.5 | L38 F39 G40 M44 C45 F51 L54 S55 | L38-L42 PolarHBondContact O-N 3.24Å; F39-L42 HydrophobicContact CD2-CD1 3.81Å; F39-L42 HydrophobicContact CE2-CD1 4.07Å; F39-L42 HydrophobicContact CG-CD1 4.18Å; F39-L42 VanDerWaalsContact O-CB 3.3Å; F39-L42 WeakPolarHBondContact O-CB 3.19Å; F39-L42 VanDerWaalsContact O-CG 3.32Å; F39-L42 WeakPolarHBondContact O-CG 3.36Å; F39-L42 PolarHBondContact O-N 3.36Å; F39-L42 VanDerWaalsContact O-N 3.15Å; G40-L42 VanDerWaalsContact C-N 3.34Å; L42-M44 PolarHBondContact O-N 3.3Å; L42-M44 VanDerWaalsContact O-N 3.13Å; L42-C45 VanDerWaalsContact O-CB 3.31Å; L42-C45 WeakPolarHBondContact O-CB 3.4Å; L42-C45 PolarHBondContact O-N 2.62Å; L42-F51 HydrophobicContact CB-CD2 4.04Å; L42-F51 HydrophobicContact CB-CE2 3.73Å; L42-F51 WeakPolarHBondContact O-CD2 3.24Å; L42-L54 HydrophobicContact CD2-CB 3.47Å; L42-L54 VanDerWaalsContact CD2-CB 3.47Å; L42-L54 HydrophobicContact CD2-CD1 4.15Å; L42-L54 HydrophobicContact CD2-CG 4.41Å; L42-S55 WeakPolarHBondContact CD1-OG 3.35Å |
| 43 | Y | 87.5 | Confident | 93.3 | Very high | 120 Ų | 120 | 63.5 Ų | 63.5 | 47% | 0.471 | 34% | 0.335 | S | S | . | . | G | 310 helix | trans | -61.4 | -19.3 | 174.7 | 86.4 | -79.7 | 0 | 0 | 0 | 113.4 | G40 L41 Y116 I117 | G40-Y43 WeakPolarHBondContact O-CD1 3.45Å; L41-Y43 PolarHBondContact O-N 2.9Å; L41-Y43 VanDerWaalsContact O-N 3.11Å; Y43-Y116 HydrophobicContact CD1-CD1 4.04Å; Y43-Y116 HydrophobicContact CG-CD1 4.13Å; Y43-I117 HydrophobicContact CE1-CB 4.07Å; Y43-I117 HydrophobicContact CE1-CD1 4.41Å |
| 44 | M | 90.7 | Very high | 93.1 | Very high | 124 Ų | 124 | 66.7 Ų | 66.7 | 61% | 0.611 | 35% | 0.351 | S | S | * | . | G | 310 helix | trans | -83 | -11.9 | 174.9 | -59.5 | -176.8 | 168.4 | 0 | 0 | 113.1 | L41 L42 | L41-M44 HydrophobicContact CD2-CE 4.2Å; L41-M44 HydrophobicContact CD2-SD 4.06Å; L41-M44 WeakPolarHBondContact O-CB 3.43Å; L41-M44 PolarHBondContact O-N 3.49Å; L42-M44 PolarHBondContact O-N 3.3Å; L42-M44 VanDerWaalsContact O-N 3.13Å |
| 45 | C | 89.1 | Confident | 93 | Very high | 37 Ų | 37 | 62 Ų | 62 | 25% | 0.25 | 34% | 0.336 | C | S | . | . | S | Bend | trans | -79.5 | 149.3 | -179.1 | -64.8 | 0 | 0 | 0 | 0 | 111.2 | L42 S47 L54 | L42-C45 VanDerWaalsContact O-CB 3.31Å; L42-C45 WeakPolarHBondContact O-CB 3.4Å; L42-C45 PolarHBondContact O-N 2.62Å; C45-S47 PolarHBondContact O-N 3.07Å; C45-L54 HydrophobicContact CB-CD1 4.27Å; C45-L54 WeakPolarHBondContact SG-CD1 3.11Å |
| 46 | P | 87.8 | Confident | 92.8 | Very high | 92 Ų | 92 | 69.2 Ų | 69.2 | 60% | 0.597 | 36% | 0.363 | S | S | * | . | P | Polyproline II helix | trans | -55.9 | 140.3 | 172.3 | -23 | 32.8 | 0 | 0 | 0 | 111.8 | P50 F51 | P46-P50 HydrophobicContact CB-CG 4.4Å; P46-F51 PolarHBondContact O-N 3.45Å |
| 47 | S | 85.1 | Confident | 92.8 | Very high | 95 Ų | 95 | 72.6 Ų | 72.6 | 66% | 0.664 | 38% | 0.38 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -60.6 | 161.7 | 177.9 | -49.1 | 0 | 0 | 0 | 0 | 112.1 | C45 | C45-S47 PolarHBondContact O-N 3.07Š|
| 48 | N | 87.9 | Confident | 92.8 | Very high | 124 Ų | 124 | 71.4 Ų | 71.4 | 66% | 0.663 | 38% | 0.375 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 78.8 | -127.5 | -179.1 | -47.5 | -60.7 | 0 | 0 | 0 | 114 | F51 I52 | N48-F51 PolarHBondContact O-N 2.89Å; N48-I52 WeakPolarHBondContact O-CG1 3.24Å; N48-I52 PolarHBondContact O-N 3.19Å |
| 49 | I | 92.8 | Very high | 92.8 | Very high | 131 Ų | 131 | 73.7 Ų | 73.7 | 67% | 0.672 | 38% | 0.379 | S | S | * | . | H | α-helix | trans | -58 | -48.6 | -167.3 | -58.8 | 172.7 | 0 | 0 | 0 | 112.2 | F51 I52 T53 | I49-F51 PolarHBondContact O-N 3.02Å; I49-I52 PolarHBondContact O-N 2.98Å; I49-T53 WeakPolarHBondContact O-CB 3.46Å; I49-T53 PolarHBondContact O-N 3.5Å; I49-T53 PolarHBondContact O-OG1 3.47Å; I49-T53 VanDerWaalsContact O-OG1 3.04Å |
| 50 | P | 92.1 | Very high | 92.9 | Very high | 57 Ų | 57 | 76 Ų | 76 | 37% | 0.37 | 39% | 0.392 | S | S | . | . | H | α-helix | trans | -60.7 | -45.7 | -178.6 | -23.4 | 35.4 | 0 | 0 | 0 | 112.5 | P46 I52 T53 L54 | P46-P50 HydrophobicContact CB-CG 4.4Å; P50-I52 PolarHBondContact O-N 3.41Å; P50-T53 PolarHBondContact O-N 3.36Å; P50-L54 WeakPolarHBondContact O-CB 3.22Å; P50-L54 VanDerWaalsContact O-CG 3.26Å; P50-L54 WeakPolarHBondContact O-CG 3.22Å; P50-L54 PolarHBondContact O-N 2.83Å |
| 51 | F | 93.4 | Very high | 93 | Very high | 71 Ų | 71 | 81.1 Ų | 81.1 | 31% | 0.311 | 42% | 0.415 | S | S | . | . | H | α-helix | trans | -59.8 | -46.7 | 177.2 | -179.7 | -92.1 | 0 | 0 | 0 | 112 | L42 P46 N48 I49 S55 | L42-F51 HydrophobicContact CB-CD2 4.04Å; L42-F51 HydrophobicContact CB-CE2 3.73Å; L42-F51 WeakPolarHBondContact O-CD2 3.24Å; P46-F51 PolarHBondContact O-N 3.45Å; N48-F51 PolarHBondContact O-N 2.89Å; I49-F51 PolarHBondContact O-N 3.02Å; F51-S55 VanDerWaalsContact O-CB 3.23Å; F51-S55 WeakPolarHBondContact O-CB 3.24Å; F51-S55 PolarHBondContact O-N 2.9Å; F51-S55 PolarHBondContact O-OG 2.93Å |
| 52 | I | 93.5 | Very high | 93.1 | Very high | 87 Ų | 87 | 80.7 Ų | 80.7 | 45% | 0.446 | 41% | 0.41 | S | S | . | . | H | α-helix | trans | -63.9 | -49 | -180 | -67.6 | 168.9 | 0 | 0 | 0 | 110.5 | N48 I49 P50 L54 S55 Y56 | N48-I52 WeakPolarHBondContact O-CG1 3.24Å; N48-I52 PolarHBondContact O-N 3.19Å; I49-I52 PolarHBondContact O-N 2.98Å; P50-I52 PolarHBondContact O-N 3.41Å; I52-L54 PolarHBondContact O-N 2.94Å; I52-S55 WeakPolarHBondContact O-CB 3.21Å; I52-S55 PolarHBondContact O-N 2.99Å; I52-Y56 HydrophobicContact CG2-CD2 3.76Å; I52-Y56 HydrophobicContact CG2-CE2 3.53Å; I52-Y56 VanDerWaalsContact O-CD2 3.24Å; I52-Y56 WeakPolarHBondContact O-CD2 3.05Å; I52-Y56 PolarHBondContact O-N 3.01Å |
| 53 | T | 95.1 | Very high | 93.3 | Very high | 72 Ų | 72 | 80.4 Ų | 80.4 | 44% | 0.442 | 41% | 0.409 | S | S | . | . | H | α-helix | trans | -60.3 | -47.7 | 179.9 | -59.8 | 0 | 0 | 0 | 0 | 111.4 | I49 P50 S55 Y56 L57 | I49-T53 WeakPolarHBondContact O-CB 3.46Å; I49-T53 PolarHBondContact O-N 3.5Å; I49-T53 PolarHBondContact O-OG1 3.47Å; I49-T53 VanDerWaalsContact O-OG1 3.04Å; P50-T53 PolarHBondContact O-N 3.36Å; T53-S55 VanDerWaalsContact C-N 3.33Å; T53-S55 PolarHBondContact O-N 3.14Å; T53-Y56 PolarHBondContact O-N 3Å; T53-L57 HydrophobicContact CG2-CD1 4.14Å; T53-L57 WeakPolarHBondContact O-CG 3.49Å; T53-L57 PolarHBondContact O-N 3.47Å |
| 54 | L | 95.2 | Very high | 93.8 | Very high | 67 Ų | 67 | 77 Ų | 77 | 35% | 0.351 | 40% | 0.398 | S | S | . | . | H | α-helix | trans | -67.3 | -33.7 | 178.7 | -68.4 | 170.7 | 0 | 0 | 0 | 112.3 | L42 C45 P50 I52 L57 T58 | L42-L54 HydrophobicContact CD2-CB 3.47Å; L42-L54 VanDerWaalsContact CD2-CB 3.47Å; L42-L54 HydrophobicContact CD2-CD1 4.15Å; L42-L54 HydrophobicContact CD2-CG 4.41Å; C45-L54 HydrophobicContact CB-CD1 4.27Å; C45-L54 WeakPolarHBondContact SG-CD1 3.11Å; P50-L54 WeakPolarHBondContact O-CB 3.22Å; P50-L54 VanDerWaalsContact O-CG 3.26Å; P50-L54 WeakPolarHBondContact O-CG 3.22Å; P50-L54 PolarHBondContact O-N 2.83Å; I52-L54 PolarHBondContact O-N 2.94Å; L54-L57 HydrophobicContact CD2-CD1 4.48Å; L54-L57 PolarHBondContact O-N 3.4Å; L54-T58 WeakPolarHBondContact O-CB 3.13Å; L54-T58 VanDerWaalsContact O-CG2 3.31Å; L54-T58 WeakPolarHBondContact O-CG2 3.46Å; L54-T58 PolarHBondContact O-N 3.47Å; L54-T58 PolarHBondContact O-OG1 2.68Å |
| 55 | S | 94.8 | Very high | 94.2 | Very high | 19 Ų | 19 | 71.1 Ų | 71.1 | 13% | 0.133 | 37% | 0.369 | C | S | . | . | H | α-helix | trans | -61.4 | -44.1 | 172.9 | -65.4 | 0 | 0 | 0 | 0 | 111.8 | L42 F51 I52 T53 T58 R59 | L42-S55 WeakPolarHBondContact CD1-OG 3.35Å; F51-S55 VanDerWaalsContact O-CB 3.23Å; F51-S55 WeakPolarHBondContact O-CB 3.24Å; F51-S55 PolarHBondContact O-N 2.9Å; F51-S55 PolarHBondContact O-OG 2.93Å; I52-S55 WeakPolarHBondContact O-CB 3.21Å; I52-S55 PolarHBondContact O-N 2.99Å; T53-S55 VanDerWaalsContact C-N 3.33Å; T53-S55 PolarHBondContact O-N 3.14Å; S55-T58 WeakPolarHBondContact CA-OG1 3.47Å; S55-T58 PolarHBondContact O-OG1 3.19Å; S55-R59 WeakPolarHBondContact O-CB 3.44Å; S55-R59 WeakPolarHBondContact O-CG 3.24Å; S55-R59 PolarHBondContact O-N 3.1Å; S55-R59 VanDerWaalsContact O-N 3.11Å |
| 56 | Y | 95 | Very high | 94.6 | Very high | 161 Ų | 161 | 69.6 Ų | 69.6 | 63% | 0.631 | 36% | 0.359 | S | S | * | . | H | α-helix | trans | -66.1 | -46.2 | 175.7 | -79.3 | -63.3 | 0 | 0 | 0 | 111.8 | I52 T53 R59 I60 | I52-Y56 HydrophobicContact CG2-CD2 3.76Å; I52-Y56 HydrophobicContact CG2-CE2 3.53Å; I52-Y56 VanDerWaalsContact O-CD2 3.24Å; I52-Y56 WeakPolarHBondContact O-CD2 3.05Å; I52-Y56 PolarHBondContact O-N 3.01Å; T53-Y56 PolarHBondContact O-N 3Å; Y56-R59 PolarHBondContact O-N 3.3Å; Y56-I60 VanDerWaalsContact O-CG1 3.28Å; Y56-I60 WeakPolarHBondContact O-CG1 3.45Å; Y56-I60 PolarHBondContact O-N 3.14Å |
| 57 | L | 96.6 | Very high | 95.1 | Very high | 77 Ų | 77 | 65.2 Ų | 65.2 | 40% | 0.403 | 33% | 0.331 | S | S | . | . | H | α-helix | trans | -59.3 | -51.3 | 179.6 | -71.9 | 173.7 | 0 | 0 | 0 | 111.7 | T53 L54 R59 I60 F61 | T53-L57 HydrophobicContact CG2-CD1 4.14Å; T53-L57 WeakPolarHBondContact O-CG 3.49Å; T53-L57 PolarHBondContact O-N 3.47Å; L54-L57 HydrophobicContact CD2-CD1 4.48Å; L54-L57 PolarHBondContact O-N 3.4Å; L57-R59 VanDerWaalsContact C-N 3.29Å; L57-R59 PolarHBondContact O-N 3.16Å; L57-I60 WeakPolarHBondContact O-CB 3.34Å; L57-I60 PolarHBondContact O-N 3.46Å; L57-F61 VanDerWaalsContact O-CD2 3.28Å; L57-F61 WeakPolarHBondContact O-CD2 3.12Å; L57-F61 PolarHBondContact O-N 3.02Å |
| 58 | T | 96.5 | Very high | 95.6 | Very high | 13 Ų | 13 | 60.8 Ų | 60.8 | 8% | 0.08 | 30% | 0.3 | C | S | . | . | H | α-helix | trans | -59.1 | -39 | 177.7 | 49.8 | 0 | 0 | 0 | 0 | 111.9 | L38 F39 L54 S55 K62 | L38-T58 HydrophobicContact CB-CG2 4.11Å; F39-T58 WeakPolarHBondContact CD2-OG1 3.37Å; L54-T58 WeakPolarHBondContact O-CB 3.13Å; L54-T58 VanDerWaalsContact O-CG2 3.31Å; L54-T58 WeakPolarHBondContact O-CG2 3.46Å; L54-T58 PolarHBondContact O-N 3.47Å; L54-T58 PolarHBondContact O-OG1 2.68Å; S55-T58 WeakPolarHBondContact CA-OG1 3.47Å; S55-T58 PolarHBondContact O-OG1 3.19Å; T58-K62 WeakPolarHBondContact O-CB 3.14Å; T58-K62 PolarHBondContact O-N 3.36Å |
| 59 | R | 95.6 | Very high | 96.1 | Very high | 106 Ų | 106 | 57.8 Ų | 57.8 | 40% | 0.4 | 28% | 0.28 | S | S | . | . | H | α-helix | trans | -70.4 | -27.2 | 174.8 | -73 | -72.8 | -175.7 | 144.5 | 4 | 114.1 | M1 F39 S55 Y56 L57 G63 | M1-R59 WeakPolarHBondContact CA-O 3.3Å; M1-R59 WeakPolarHBondContact CB-O 3.46Å; F39-R59 HydrophobicContact CD2-CG 4.36Å; F39-R59 HydrophobicContact CE2-CG 3.97Å; S55-R59 WeakPolarHBondContact O-CB 3.44Å; S55-R59 WeakPolarHBondContact O-CG 3.24Å; S55-R59 PolarHBondContact O-N 3.1Å; S55-R59 VanDerWaalsContact O-N 3.11Å; Y56-R59 PolarHBondContact O-N 3.3Å; L57-R59 VanDerWaalsContact C-N 3.29Å; L57-R59 PolarHBondContact O-N 3.16Å; R59-G63 PolarHBondContact O-N 3.46Å |
| 60 | I | 97.6 | Very high | 96.2 | Very high | 74 Ų | 74 | 54.3 Ų | 54.3 | 38% | 0.379 | 26% | 0.261 | S | S | . | . | H | α-helix | trans | -70.9 | -55.7 | 172.3 | -71.1 | 163.5 | 0 | 0 | 0 | 109 | V4 Y56 L57 K62 G63 I64 | V4-I60 HydrophobicContact CG2-CG1 4.39Å; V4-I60 HydrophobicContact CG2-CG2 4.31Å; Y56-I60 VanDerWaalsContact O-CG1 3.28Å; Y56-I60 WeakPolarHBondContact O-CG1 3.45Å; Y56-I60 PolarHBondContact O-N 3.14Å; L57-I60 WeakPolarHBondContact O-CB 3.34Å; L57-I60 PolarHBondContact O-N 3.46Å; I60-K62 VanDerWaalsContact C-N 3.32Å; I60-K62 PolarHBondContact O-N 2.93Å; I60-G63 CarbonylContact O-C 3.51Å; I60-G63 WeakPolarHBondContact O-CA 3.32Å; I60-G63 PolarHBondContact O-N 2.9Å; I60-I64 HydrophobicContact CG2-CD1 4.35Å; I60-I64 WeakPolarHBondContact O-CG1 3.48Å; I60-I64 PolarHBondContact O-N 2.99Å |
| 61 | F | 98 | Very high | 96.4 | Very high | 109 Ų | 109 | 51.6 Ų | 51.6 | 48% | 0.478 | 24% | 0.244 | S | C | . | . | H | α-helix | trans | -62 | -37.4 | 179.7 | -77.5 | -80.1 | 0 | 0 | 0 | 112.7 | V31 T35 L57 G63 I64 G65 | V31-F61 VanDerWaalsContact CG1-O 3.32Å; V31-F61 WeakPolarHBondContact CG1-O 3.19Å; T35-F61 HydrophobicContact CG2-CB 3.54Å; L57-F61 VanDerWaalsContact O-CD2 3.28Å; L57-F61 WeakPolarHBondContact O-CD2 3.12Å; L57-F61 PolarHBondContact O-N 3.02Å; F61-G63 VanDerWaalsContact C-N 3.26Å; F61-G63 PolarHBondContact O-N 3.46Å; F61-I64 HydrophobicContact CD1-CD1 4.01Å; F61-I64 HydrophobicContact CE1-CD1 4.38Å; F61-I64 WeakPolarHBondContact O-CB 3.36Å; F61-I64 PolarHBondContact O-N 3.36Å; F61-I64 VanDerWaalsContact O-N 3.14Å; F61-G65 PolarHBondContact O-N 3.22Å |
| 62 | K | 97.5 | Very high | 96.5 | Very high | 52 Ų | 52 | 48.2 Ų | 48.2 | 23% | 0.226 | 23% | 0.229 | C | C | . | . | H | α-helix | trans | -58.7 | -39.5 | 170.5 | -175.9 | 169.8 | 178.1 | 155.1 | 0 | 111.7 | M1 T32 T35 S36 T58 I60 G65 A66 | M1-K62 HydrophobicContact SD-CD 3.94Å; M1-K62 HydrophobicContact SD-CG 3.93Å; T32-K62 HydrophobicContact CG2-CG 4.16Å; T35-K62 WeakPolarHBondContact OG1-CA 3.35Å; T35-K62 WeakPolarHBondContact OG1-CB 3.41Å; S36-K62 PolarHBondContact OG-NZ 3.17Å; T58-K62 WeakPolarHBondContact O-CB 3.14Å; T58-K62 PolarHBondContact O-N 3.36Å; I60-K62 VanDerWaalsContact C-N 3.32Å; I60-K62 PolarHBondContact O-N 2.93Å; K62-G65 PolarHBondContact O-N 3.14Å; K62-A66 WeakPolarHBondContact O-CB 3.4Å; K62-A66 PolarHBondContact O-N 3.17Å |
| 63 | G | 97.6 | Very high | 96.6 | Very high | 0 Ų | 0 | 45.1 Ų | 45.1 | 0% | 0 | 22% | 0.216 | C | C | . | . | H | α-helix | trans | -64.6 | -39.6 | 173.9 | 0 | 0 | 0 | 0 | 0 | 113 | I5 R59 I60 F61 A66 A67 | I5-G63 WeakPolarHBondContact CG1-O 3.46Å; R59-G63 PolarHBondContact O-N 3.46Å; I60-G63 CarbonylContact O-C 3.51Å; I60-G63 WeakPolarHBondContact O-CA 3.32Å; I60-G63 PolarHBondContact O-N 2.9Å; F61-G63 VanDerWaalsContact C-N 3.26Å; F61-G63 PolarHBondContact O-N 3.46Å; G63-A66 PolarHBondContact O-N 2.95Å; G63-A67 WeakPolarHBondContact O-CB 3.33Å; G63-A67 PolarHBondContact O-N 3.34Å |
| 64 | I | 98.2 | Very high | 96.6 | Very high | 49 Ų | 49 | 42.4 Ų | 42.4 | 25% | 0.251 | 20% | 0.2 | S | C | . | . | H | α-helix | trans | -60.5 | -49.3 | 174.8 | -59.6 | 176.7 | 0 | 0 | 0 | 110.5 | V4 L8 Y12 I60 F61 A68 | V4-I64 HydrophobicContact CG1-CG1 3.87Å; L8-I64 HydrophobicContact CD1-CB 4.11Å; L8-I64 HydrophobicContact CD1-CG1 3.72Å; L8-I64 HydrophobicContact CD1-CG2 4.13Å; Y12-I64 WeakPolarHBondContact CE2-O 3.17Å; Y12-I64 VanDerWaalsContact OH-CG2 3.23Å; Y12-I64 WeakPolarHBondContact OH-CG2 3.21Å; I60-I64 HydrophobicContact CG2-CD1 4.35Å; I60-I64 WeakPolarHBondContact O-CG1 3.48Å; I60-I64 PolarHBondContact O-N 2.99Å; F61-I64 HydrophobicContact CD1-CD1 4.01Å; F61-I64 HydrophobicContact CE1-CD1 4.38Å; F61-I64 WeakPolarHBondContact O-CB 3.36Å; F61-I64 PolarHBondContact O-N 3.36Å; F61-I64 VanDerWaalsContact O-N 3.14Å; I64-A68 PolarHBondContact O-N 3.04Å |
| 65 | G | 98 | Very high | 96.5 | Very high | 1 Ų | 1 | 39.2 Ų | 39.2 | 1% | 0.01 | 18% | 0.183 | C | C | . | . | H | α-helix | trans | -64.3 | -43.1 | 177.9 | 0 | 0 | 0 | 0 | 0 | 112.5 | G28 T32 F61 K62 A68 Y69 | G28-G65 CarbonylContact C-O 3.56Å; G28-G65 WeakPolarHBondContact CA-O 3.28Å; G28-G65 CarbonylContact O-C 3.32Å; T32-G65 WeakPolarHBondContact OG1-CA 3.15Å; F61-G65 PolarHBondContact O-N 3.22Å; K62-G65 PolarHBondContact O-N 3.14Å; G65-A68 WeakPolarHBondContact O-CB 3.31Å; G65-A68 PolarHBondContact O-N 3.42Å; G65-Y69 WeakPolarHBondContact O-CD1 3.26Å; G65-Y69 PolarHBondContact O-N 2.95Å |
| 66 | A | 97.5 | Very high | 96.5 | Very high | 4 Ų | 4 | 40.4 Ų | 40.4 | 3% | 0.033 | 19% | 0.188 | C | C | . | . | H | α-helix | trans | -63.3 | -45.8 | -179.3 | 0 | 0 | 0 | 0 | 0 | 112.4 | I5 T32 K62 G63 A68 Y69 M70 | I5-A66 HydrophobicContact CD1-CB 3.67Å; I5-A66 HydrophobicContact CG1-CB 4.12Å; T32-A66 PolarHBondContact OG1-N 3.11Å; T32-A66 VanDerWaalsContact OG1-N 3.15Å; K62-A66 WeakPolarHBondContact O-CB 3.4Å; K62-A66 PolarHBondContact O-N 3.17Å; G63-A66 PolarHBondContact O-N 2.95Å; A66-A68 VanDerWaalsContact C-N 3.28Å; A66-A68 PolarHBondContact O-N 3.43Å; A66-Y69 VanDerWaalsContact CA-CE1 3.46Å; A66-Y69 HydrophobicContact CB-CE1 4.02Å; A66-Y69 PolarHBondContact O-N 3.25Å; A66-M70 HydrophobicContact CB-SD 4.44Å; A66-M70 WeakPolarHBondContact O-CB 3.32Å; A66-M70 WeakPolarHBondContact O-CG 3.26Å; A66-M70 PolarHBondContact O-N 2.87Å |
| 67 | A | 98 | Very high | 96.4 | Very high | 0 Ų | 0 | 34.3 Ų | 34.3 | 0% | 0 | 17% | 0.167 | C | C | . | . | H | α-helix | trans | -58.3 | -42.3 | 175 | 0 | 0 | 0 | 0 | 0 | 111.9 | I5 L8 Y12 G63 T71 | I5-A67 HydrophobicContact CB-CB 4.23Å; I5-A67 HydrophobicContact CG1-CB 4.23Å; I5-A67 HydrophobicContact CG2-CB 3.93Å; L8-A67 HydrophobicContact CB-CB 3.99Å; Y12-A67 HydrophobicContact CD2-CB 3.8Å; Y12-A67 HydrophobicContact CE2-CB 3.78Å; G63-A67 WeakPolarHBondContact O-CB 3.33Å; G63-A67 PolarHBondContact O-N 3.34Å; A67-T71 VanDerWaalsContact O-CB 3.23Å; A67-T71 WeakPolarHBondContact O-CB 3.17Å; A67-T71 PolarHBondContact O-N 3.21Å; A67-T71 VanDerWaalsContact O-N 3.16Å; A67-T71 PolarHBondContact O-OG1 3.46Å |
| 68 | A | 97.6 | Very high | 96.3 | Very high | 3 Ų | 3 | 30.7 Ų | 30.7 | 3% | 0.025 | 15% | 0.148 | C | C | . | . | H | α-helix | trans | -62.3 | -55.6 | 179.1 | 0 | 0 | 0 | 0 | 0 | 112 | Y12 L24 I64 G65 A66 A72 | Y12-A68 HydrophobicContact CD2-CB 4.1Å; Y12-A68 HydrophobicContact CE2-CB 3.7Å; L24-A68 HydrophobicContact CD1-CB 3.51Å; L24-A68 HydrophobicContact CG-CB 3.84Å; I64-A68 PolarHBondContact O-N 3.04Å; G65-A68 WeakPolarHBondContact O-CB 3.31Å; G65-A68 PolarHBondContact O-N 3.42Å; A66-A68 VanDerWaalsContact C-N 3.28Å; A66-A68 PolarHBondContact O-N 3.43Å; A68-A72 WeakPolarHBondContact O-CB 3.4Å; A68-A72 PolarHBondContact O-N 2.89Å; A68-A72 VanDerWaalsContact O-N 3.1Å |
| 69 | Y | 96.5 | Very high | 96.1 | Very high | 61 Ų | 61 | 32.2 Ų | 32.2 | 24% | 0.239 | 15% | 0.154 | C | C | . | . | H | α-helix | trans | -73.5 | -37.2 | -175.4 | 87 | -102 | 0 | 0 | 0 | 112.8 | L29 T32 G65 A66 A72 A73 | L29-Y69 HydrophobicContact CD2-CD1 4.37Å; L29-Y69 HydrophobicContact CD2-CD2 4.12Å; L29-Y69 HydrophobicContact CD2-CG 3.99Å; L29-Y69 HydrophobicContact CG-CG 4.38Å; T32-Y69 HydrophobicContact CG2-CE1 3.99Å; G65-Y69 WeakPolarHBondContact O-CD1 3.26Å; G65-Y69 PolarHBondContact O-N 2.95Å; A66-Y69 VanDerWaalsContact CA-CE1 3.46Å; A66-Y69 HydrophobicContact CB-CE1 4.02Å; A66-Y69 PolarHBondContact O-N 3.25Å; Y69-A72 PolarHBondContact O-N 2.62Å; Y69-A73 VanDerWaalsContact O-CB 3.26Å; Y69-A73 WeakPolarHBondContact O-CB 3.44Å; Y69-A73 PolarHBondContact O-N 2.83Å |
| 70 | M | 95.9 | Very high | 96 | Very high | 57 Ų | 57 | 32 Ų | 32 | 28% | 0.281 | 16% | 0.157 | S | C | . | . | H | α-helix | trans | -66.2 | -49.4 | -179.1 | -70.1 | 178.8 | 68.2 | 0 | 0 | 110.6 | A66 A72 A73 V74 T303 | A66-M70 HydrophobicContact CB-SD 4.44Å; A66-M70 WeakPolarHBondContact O-CB 3.32Å; A66-M70 WeakPolarHBondContact O-CG 3.26Å; A66-M70 PolarHBondContact O-N 2.87Å; M70-A72 VanDerWaalsContact C-N 3.31Å; M70-A72 PolarHBondContact O-N 3.18Å; M70-A73 PolarHBondContact O-N 2.64Å; M70-V74 WeakPolarHBondContact O-CG2 3.5Å; M70-V74 PolarHBondContact O-N 2.86Å; M70-V74 VanDerWaalsContact O-N 3.12Å; M70-T303 HydrophobicContact CB-CG2 4.18Å; M70-T303 HydrophobicContact CE-CG2 4.49Å |
| 71 | T | 96.4 | Very high | 95.8 | Very high | 0 Ų | 0 | 33.4 Ų | 33.4 | 0% | 0 | 16% | 0.161 | C | C | . | . | H | α-helix | trans | -62.3 | -41.3 | 178 | -57.4 | 0 | 0 | 0 | 0 | 110.7 | S9 M16 A67 S75 G300 | S9-T71 WeakPolarHBondContact CB-OG1 3.49Å; M16-T71 HydrophobicContact CE-CG2 3.65Å; A67-T71 VanDerWaalsContact O-CB 3.23Å; A67-T71 WeakPolarHBondContact O-CB 3.17Å; A67-T71 PolarHBondContact O-N 3.21Å; A67-T71 VanDerWaalsContact O-N 3.16Å; A67-T71 PolarHBondContact O-OG1 3.46Å; T71-S75 WeakPolarHBondContact O-CB 3.26Å; T71-S75 PolarHBondContact O-N 2.92Å; T71-S75 PolarHBondContact O-OG 2.99Å; T71-G300 VanDerWaalsContact CG2-CA 3.48Å |
| 72 | A | 95.8 | Very high | 95.4 | Very high | 0 Ų | 0 | 30.8 Ų | 30.8 | 0% | 0 | 16% | 0.155 | C | C | . | . | H | α-helix | trans | -64.2 | -42.9 | 176.5 | 0 | 0 | 0 | 0 | 0 | 112.9 | M16 L24 F25 A68 Y69 M70 S75 I76 | M16-A72 HydrophobicContact CE-CB 4.17Å; M16-A72 HydrophobicContact SD-CB 4.22Å; L24-A72 HydrophobicContact CD2-CB 4.36Å; L24-A72 HydrophobicContact CG-CB 4.49Å; F25-A72 HydrophobicContact CB-CB 3.82Å; F25-A72 HydrophobicContact CD2-CB 4.24Å; A68-A72 WeakPolarHBondContact O-CB 3.4Å; A68-A72 PolarHBondContact O-N 2.89Å; A68-A72 VanDerWaalsContact O-N 3.1Å; Y69-A72 PolarHBondContact O-N 2.62Å; M70-A72 VanDerWaalsContact C-N 3.31Å; M70-A72 PolarHBondContact O-N 3.18Å; A72-S75 PolarHBondContact O-N 3.36Å; A72-I76 HydrophobicContact CB-CD1 4.49Å; A72-I76 WeakPolarHBondContact O-CB 3.3Å; A72-I76 WeakPolarHBondContact O-CD1 3.43Å; A72-I76 WeakPolarHBondContact O-CG1 3.44Å; A72-I76 PolarHBondContact O-N 2.95Å |
| 73 | A | 94.8 | Very high | 95.2 | Very high | 22 Ų | 22 | 35.7 Ų | 35.7 | 18% | 0.182 | 18% | 0.178 | C | C | . | . | H | α-helix | trans | -58.6 | -53.1 | 178.7 | 0 | 0 | 0 | 0 | 0 | 111.5 | F25 Y69 M70 S75 I76 V77 | F25-A73 HydrophobicContact CD2-CB 4.25Å; F25-A73 HydrophobicContact CE2-CB 3.88Å; Y69-A73 VanDerWaalsContact O-CB 3.26Å; Y69-A73 WeakPolarHBondContact O-CB 3.44Å; Y69-A73 PolarHBondContact O-N 2.83Å; M70-A73 PolarHBondContact O-N 2.64Å; A73-S75 VanDerWaalsContact C-N 3.29Å; A73-S75 PolarHBondContact O-N 3.31Å; A73-I76 PolarHBondContact O-N 2.86Å; A73-V77 WeakPolarHBondContact O-CB 3.41Å; A73-V77 WeakPolarHBondContact O-CG2 3.33Å; A73-V77 PolarHBondContact O-N 3.49Å |
| 74 | V | 94.9 | Very high | 95.1 | Very high | 16 Ų | 16 | 41.8 Ų | 41.8 | 10% | 0.097 | 21% | 0.205 | C | C | . | . | H | α-helix | trans | -59.1 | -43.4 | 178.9 | 177 | 0 | 0 | 0 | 0 | 110.2 | M70 A78 I89 F276 S299 | M70-V74 WeakPolarHBondContact O-CG2 3.5Å; M70-V74 PolarHBondContact O-N 2.86Å; M70-V74 VanDerWaalsContact O-N 3.12Å; V74-A78 WeakPolarHBondContact O-CB 3.45Å; V74-A78 PolarHBondContact O-N 3.43Å; V74-I89 HydrophobicContact CB-CD1 4.34Å; V74-I89 HydrophobicContact CG1-CD1 3.64Å; V74-I89 HydrophobicContact CG2-CD1 4.49Å; V74-F276 HydrophobicContact CG1-CD2 4.22Å; V74-F276 HydrophobicContact CG1-CE2 3.57Å; V74-F276 HydrophobicContact CG1-CZ 4Å; V74-S299 VanDerWaalsContact CG1-OG 3.28Å; V74-S299 WeakPolarHBondContact CG1-OG 3.36Å |
| 75 | S | 94.7 | Very high | 94.9 | Very high | 0 Ų | 0 | 39.6 Ų | 39.6 | 0% | 0 | 19% | 0.194 | C | C | . | . | H | α-helix | trans | -64.4 | -47.8 | -179.4 | -53.7 | 0 | 0 | 0 | 0 | 113 | M16 T71 A72 A73 F79 S296 S299 | M16-S75 WeakPolarHBondContact CE-OG 3.41Å; T71-S75 WeakPolarHBondContact O-CB 3.26Å; T71-S75 PolarHBondContact O-N 2.92Å; T71-S75 PolarHBondContact O-OG 2.99Å; A72-S75 PolarHBondContact O-N 3.36Å; A73-S75 VanDerWaalsContact C-N 3.29Å; A73-S75 PolarHBondContact O-N 3.31Å; S75-F79 VanDerWaalsContact O-CB 3.24Å; S75-F79 WeakPolarHBondContact O-CB 3.4Å; S75-F79 PolarHBondContact O-N 2.98Å; S75-S296 WeakPolarHBondContact OG-CA 3.13Å; S75-S299 WeakPolarHBondContact CA-OG 3.31Å; S75-S299 PolarHBondContact N-OG 3.42Å; S75-S299 WeakPolarHBondContact OG-CB 3.36Å; S75-S299 PolarHBondContact OG-OG 3.42Å |
| 76 | I | 93.7 | Very high | 94.8 | Very high | 44 Ų | 44 | 39.5 Ų | 39.5 | 23% | 0.226 | 19% | 0.194 | C | C | . | . | H | α-helix | trans | -62.2 | -48.5 | -179.2 | -69.8 | 163.4 | 0 | 0 | 0 | 109.7 | F25 A72 A73 Q80 F292 | F25-I76 HydrophobicContact CB-CD1 4.39Å; A72-I76 HydrophobicContact CB-CD1 4.49Å; A72-I76 WeakPolarHBondContact O-CB 3.3Å; A72-I76 WeakPolarHBondContact O-CD1 3.43Å; A72-I76 WeakPolarHBondContact O-CG1 3.44Å; A72-I76 PolarHBondContact O-N 2.95Å; A73-I76 PolarHBondContact O-N 2.86Å; I76-Q80 VanDerWaalsContact O-CB 3.3Å; I76-Q80 WeakPolarHBondContact O-CB 3.45Å; I76-Q80 PolarHBondContact O-N 3.46Å; I76-F292 HydrophobicContact CG1-CE2 4.5Å |
| 77 | V | 93.2 | Very high | 94.7 | Very high | 33 Ų | 33 | 41 Ų | 41 | 20% | 0.2 | 20% | 0.202 | C | C | . | . | H | α-helix | trans | -71.8 | -42.4 | -172.5 | -179.4 | 0 | 0 | 0 | 0 | 111 | A73 Q80 F81 V88 L92 | A73-V77 WeakPolarHBondContact O-CB 3.41Å; A73-V77 WeakPolarHBondContact O-CG2 3.33Å; A73-V77 PolarHBondContact O-N 3.49Å; V77-Q80 PolarHBondContact O-N 3.26Å; V77-F81 WeakPolarHBondContact O-CD2 3.18Å; V77-F81 PolarHBondContact O-N 3.47Å; V77-V88 HydrophobicContact CG1-CB 3.67Å; V77-V88 HydrophobicContact CG1-CG1 3.1Å; V77-L92 HydrophobicContact CB-CD1 4.39Å; V77-L92 HydrophobicContact CG1-CD1 4.41Å; V77-L92 HydrophobicContact CG2-CD1 4.47Å |
| 78 | A | 93.9 | Very high | 94.6 | Very high | 0 Ų | 0 | 42.3 Ų | 42.3 | 0% | 0 | 21% | 0.21 | C | C | . | . | H | α-helix | trans | -66.2 | -38.8 | 177 | 0 | 0 | 0 | 0 | 0 | 112.2 | V74 F81 P82 A85 F276 Y295 | V74-A78 WeakPolarHBondContact O-CB 3.45Å; V74-A78 PolarHBondContact O-N 3.43Å; A78-F81 CarbonylContact O-C 3.55Å; A78-F81 VanDerWaalsContact O-C 3.31Å; A78-F81 PolarHBondContact O-N 2.95Å; A78-P82 WeakPolarHBondContact O-CA 3.24Å; A78-A85 HydrophobicContact CB-CB 4.33Å; A78-F276 HydrophobicContact CB-CE1 3.93Å; A78-F276 HydrophobicContact CB-CZ 3.74Å; A78-Y295 VanDerWaalsContact C-CD1 3.49Å; A78-Y295 HydrophobicContact CB-CD1 3.63Å; A78-Y295 HydrophobicContact CB-CE1 4.2Å; A78-Y295 VanDerWaalsContact O-CE1 3.28Å; A78-Y295 WeakPolarHBondContact O-CE1 3.28Å |
| 79 | F | 93.1 | Very high | 94.4 | Very high | 45 Ų | 45 | 42.2 Ų | 42.2 | 20% | 0.197 | 21% | 0.209 | C | C | . | . | H | α-helix | trans | -71.9 | -32 | 176.7 | -179.3 | -99.2 | 0 | 0 | 0 | 113.4 | S75 F81 P82 L140 F292 Y295 | S75-F79 VanDerWaalsContact O-CB 3.24Å; S75-F79 WeakPolarHBondContact O-CB 3.4Å; S75-F79 PolarHBondContact O-N 2.98Å; F79-F81 VanDerWaalsContact C-N 3.26Å; F79-F81 PolarHBondContact O-N 2.89Å; F79-P82 WeakPolarHBondContact O-CD 3.32Å; F79-L140 HydrophobicContact CD1-CD1 4.46Å; F79-L140 HydrophobicContact CD1-CD2 3.39Å; F79-L140 HydrophobicContact CD1-CG 4.26Å; F79-L140 HydrophobicContact CE1-CD2 3.86Å; F79-L140 HydrophobicContact CE1-CG 4.33Å; F79-L140 HydrophobicContact CG-CD2 4.39Å; F79-F292 HydrophobicContact CB-CD2 3.82Å; F79-F292 HydrophobicContact CB-CE2 4.29Å; F79-F292 HydrophobicContact CD1-CB 4.49Å; F79-F292 AromaticContact CD1-CD2 3.78Å; F79-F292 HydrophobicContact CD1-CD2 3.78Å; F79-F292 HydrophobicContact CD2-CB 4.07Å; F79-F292 HydrophobicContact CD2-CD2 4.23Å; F79-F292 HydrophobicContact CE1-CB 4.38Å; F79-F292 HydrophobicContact CE1-CD2 4.36Å; F79-F292 HydrophobicContact CE2-CB 4Å; F79-F292 HydrophobicContact CG-CB 4.3Å; F79-F292 AromaticContact CG-CD2 3.66Å; F79-F292 HydrophobicContact CG-CD2 3.66Å; F79-F292 HydrophobicContact CG-CG 4.49Å; F79-F292 HydrophobicContact CZ-CB 4.14Å; F79-Y295 HydrophobicContact CB-CD1 4.28Å; F79-Y295 HydrophobicContact CB-CD2 4.32Å; F79-Y295 HydrophobicContact CB-CG 4.01Å; F79-Y295 AromaticContact CD2-CD2 3.7Å; F79-Y295 HydrophobicContact CD2-CD2 3.7Å; F79-Y295 AromaticContact CD2-CE2 3.98Å; F79-Y295 HydrophobicContact CD2-CE2 3.98Å; F79-Y295 HydrophobicContact CD2-CG 4.25Å |
| 80 | Q | 92.4 | Very high | 94.4 | Very high | 103 Ų | 103 | 39.3 Ų | 39.3 | 48% | 0.481 | 20% | 0.198 | S | C | . | . | H | α-helix | trans | -69.1 | -27.5 | 177 | -172.5 | 64.4 | 32.8 | 0 | 0 | 112.1 | I76 V77 | I76-Q80 VanDerWaalsContact O-CB 3.3Å; I76-Q80 WeakPolarHBondContact O-CB 3.45Å; I76-Q80 PolarHBondContact O-N 3.46Å; V77-Q80 PolarHBondContact O-N 3.26Å |
| 81 | F | 93.2 | Very high | 94.4 | Very high | 102 Ų | 102 | 39.5 Ų | 39.5 | 45% | 0.447 | 20% | 0.202 | S | C | . | . | S | Bend | trans | -129.6 | 63 | -177.8 | -59.3 | -76.4 | 0 | 0 | 0 | 111.4 | V77 A78 F79 Q83 K84 A85 V88 | V77-F81 WeakPolarHBondContact O-CD2 3.18Å; V77-F81 PolarHBondContact O-N 3.47Å; A78-F81 CarbonylContact O-C 3.55Å; A78-F81 VanDerWaalsContact O-C 3.31Å; A78-F81 PolarHBondContact O-N 2.95Å; F79-F81 VanDerWaalsContact C-N 3.26Å; F79-F81 PolarHBondContact O-N 2.89Å; F81-Q83 VanDerWaalsContact C-N 3.27Å; F81-Q83 PolarHBondContact O-N 2.91Å; F81-K84 HydrophobicContact CB-CB 4.4Å; F81-K84 CarbonylContact O-C 3.58Å; F81-K84 VanDerWaalsContact O-C 3.32Å; F81-K84 PolarHBondContact O-N 3.41Å; F81-A85 WeakPolarHBondContact O-CA 3.36Å; F81-A85 PolarHBondContact O-N 2.74Å; F81-V88 HydrophobicContact CB-CG2 3.66Å; F81-V88 HydrophobicContact CD2-CG1 4.45Å; F81-V88 HydrophobicContact CD2-CG2 3.94Å; F81-V88 HydrophobicContact CG-CG2 3.96Å |
| 82 | P | 91.1 | Very high | 94.3 | Very high | 54 Ų | 54 | 42.2 Ų | 42.2 | 35% | 0.351 | 22% | 0.216 | S | C | . | . | G | 310 helix | trans | -60.1 | -36.5 | -170.7 | 25.1 | -34.8 | 0 | 0 | 0 | 112.8 | A78 F79 K84 Y295 | A78-P82 WeakPolarHBondContact O-CA 3.24Å; F79-P82 WeakPolarHBondContact O-CD 3.32Å; P82-K84 VanDerWaalsContact C-N 3.28Å; P82-K84 PolarHBondContact O-N 3.47Å; P82-Y295 HydrophobicContact CB-CE1 4.47Å; P82-Y295 WeakPolarHBondContact CB-OH 3.41Å |
| 83 | Q | 93.1 | Very high | 94.2 | Very high | 155 Ų | 155 | 43 Ų | 43 | 72% | 0.724 | 22% | 0.22 | S | C | * | . | G | 310 helix | trans | -78.7 | -8 | 178.5 | -60.7 | -60.6 | -29.4 | 0 | 0 | 114.4 | F81 | F81-Q83 VanDerWaalsContact C-N 3.27Å; F81-Q83 PolarHBondContact O-N 2.91Å |
| 84 | K | 95 | Very high | 94.2 | Very high | 128 Ų | 128 | 43.3 Ų | 43.3 | 56% | 0.557 | 22% | 0.219 | S | C | * | . | G | 310 helix | trans | -130.4 | 23.5 | -179.5 | -64.1 | -172.2 | 179.1 | 179.9 | 0 | 111.6 | F81 P82 A86 T87 V88 D219 | F81-K84 HydrophobicContact CB-CB 4.4Å; F81-K84 CarbonylContact O-C 3.58Å; F81-K84 VanDerWaalsContact O-C 3.32Å; F81-K84 PolarHBondContact O-N 3.41Å; P82-K84 VanDerWaalsContact C-N 3.28Å; P82-K84 PolarHBondContact O-N 3.47Å; K84-A86 VanDerWaalsContact C-N 3.25Å; K84-A86 PolarHBondContact O-N 2.98Å; K84-T87 WeakPolarHBondContact O-CB 3.2Å; K84-T87 PolarHBondContact O-N 2.85Å; K84-T87 VanDerWaalsContact O-N 3.1Å; K84-V88 HydrophobicContact CB-CG2 4.36Å; K84-V88 WeakPolarHBondContact O-CG2 3.28Å; K84-V88 PolarHBondContact O-N 3.36Å; K84-D219 WeakPolarHBondContact CA-OD2 3.47Å |
| 85 | A | 94.1 | Very high | 94.1 | Very high | 3 Ų | 3 | 48.8 Ų | 48.8 | 3% | 0.025 | 24% | 0.242 | C | C | . | . | H | α-helix | trans | -57.8 | -41.6 | -169.1 | 0 | 0 | 0 | 0 | 0 | 110.7 | A78 F81 V88 I89 D219 F276 L280 | A78-A85 HydrophobicContact CB-CB 4.33Å; F81-A85 WeakPolarHBondContact O-CA 3.36Å; F81-A85 PolarHBondContact O-N 2.74Å; A85-V88 PolarHBondContact O-N 3.04Å; A85-I89 VanDerWaalsContact O-CG1 3.32Å; A85-I89 WeakPolarHBondContact O-CG1 3.11Å; A85-I89 PolarHBondContact O-N 3.46Å; A85-D219 PolarHBondContact N-OD1 3.16Å; A85-F276 HydrophobicContact CB-CE1 4.4Å; A85-L280 HydrophobicContact CB-CD2 4.09Å |
| 86 | A | 95 | Very high | 94 | Very high | 0 Ų | 0 | 52 Ų | 52 | 0% | 0 | 26% | 0.259 | C | S | . | . | H | α-helix | trans | -67.4 | -40.7 | 178.5 | 0 | 0 | 0 | 0 | 0 | 112.6 | K84 V88 I89 G90 I218 D219 V273 H277 | K84-A86 VanDerWaalsContact C-N 3.25Å; K84-A86 PolarHBondContact O-N 2.98Å; A86-V88 VanDerWaalsContact C-N 3.33Å; A86-V88 PolarHBondContact O-N 2.7Å; A86-I89 PolarHBondContact O-N 2.83Å; A86-G90 PolarHBondContact O-N 3.28Å; A86-I218 HydrophobicContact CB-CD1 3.63Å; A86-I218 HydrophobicContact CB-CG1 3.49Å; A86-I218 VanDerWaalsContact CB-CG1 3.49Å; A86-D219 WeakPolarHBondContact CB-OD1 3.19Å; A86-D219 PolarHBondContact N-OD1 3.38Å; A86-V273 HydrophobicContact CB-CG1 4.01Å; A86-H277 HydrophobicContact CB-CB 4.05Å |
| 87 | T | 96.2 | Very high | 93.8 | Very high | 34 Ų | 34 | 49.9 Ų | 49.9 | 21% | 0.209 | 25% | 0.249 | C | C | . | . | H | α-helix | trans | -59.4 | -46.1 | 175.4 | -59.2 | 0 | 0 | 0 | 0 | 110.6 | K84 G90 V91 G215 A216 D219 | K84-T87 WeakPolarHBondContact O-CB 3.2Å; K84-T87 PolarHBondContact O-N 2.85Å; K84-T87 VanDerWaalsContact O-N 3.1Å; T87-G90 CarbonylContact O-C 3.6Å; T87-G90 WeakPolarHBondContact O-CA 3.37Å; T87-G90 PolarHBondContact O-N 3.15Å; T87-G90 VanDerWaalsContact O-N 3.17Å; T87-V91 WeakPolarHBondContact O-CG2 3.49Å; T87-V91 PolarHBondContact O-N 3.03Å; T87-G215 PolarHBondContact OG1-O 3.43Å; T87-A216 VanDerWaalsContact OG1-CA 3.28Å; T87-A216 WeakPolarHBondContact OG1-CA 3.17Å; T87-A216 PolarHBondContact OG1-N 2.86Å; T87-D219 WeakPolarHBondContact CB-OD2 3.4Å; T87-D219 PolarHBondContact N-OD2 3.14Å; T87-D219 PolarHBondContact OG1-OD2 3.24Å |
| 88 | V | 95.4 | Very high | 93.7 | Very high | 29 Ų | 29 | 51.8 Ų | 51.8 | 18% | 0.176 | 26% | 0.257 | C | S | . | . | H | α-helix | trans | -73.2 | -34.7 | -175.7 | -149.2 | 0 | 0 | 0 | 0 | 112 | V77 F81 K84 A85 A86 G90 V91 L92 | V77-V88 HydrophobicContact CG1-CB 3.67Å; V77-V88 HydrophobicContact CG1-CG1 3.1Å; F81-V88 HydrophobicContact CB-CG2 3.66Å; F81-V88 HydrophobicContact CD2-CG1 4.45Å; F81-V88 HydrophobicContact CD2-CG2 3.94Å; F81-V88 HydrophobicContact CG-CG2 3.96Å; K84-V88 HydrophobicContact CB-CG2 4.36Å; K84-V88 WeakPolarHBondContact O-CG2 3.28Å; K84-V88 PolarHBondContact O-N 3.36Å; A85-V88 PolarHBondContact O-N 3.04Å; A86-V88 VanDerWaalsContact C-N 3.33Å; A86-V88 PolarHBondContact O-N 2.7Å; V88-G90 VanDerWaalsContact C-N 3.32Å; V88-V91 PolarHBondContact O-N 3.39Å; V88-L92 WeakPolarHBondContact O-CG 3.48Å; V88-L92 PolarHBondContact O-N 2.96Å |
| 89 | I | 94.6 | Very high | 93.6 | Very high | 1 Ų | 1 | 53.9 Ų | 53.9 | 1% | 0.005 | 28% | 0.278 | C | S | . | . | H | α-helix | trans | -61 | -44.2 | 167 | -64.7 | -42.7 | 0 | 0 | 0 | 110.4 | V74 A85 A86 V91 L92 E93 F276 | V74-I89 HydrophobicContact CB-CD1 4.34Å; V74-I89 HydrophobicContact CG1-CD1 3.64Å; V74-I89 HydrophobicContact CG2-CD1 4.49Å; A85-I89 VanDerWaalsContact O-CG1 3.32Å; A85-I89 WeakPolarHBondContact O-CG1 3.11Å; A85-I89 PolarHBondContact O-N 3.46Å; A86-I89 PolarHBondContact O-N 2.83Å; I89-V91 VanDerWaalsContact C-N 3.26Å; I89-V91 PolarHBondContact O-N 3.37Å; I89-L92 HydrophobicContact CD1-CD1 4.01Å; I89-L92 WeakPolarHBondContact O-CB 3.38Å; I89-L92 PolarHBondContact O-N 3.4Å; I89-E93 HydrophobicContact CG2-CG 4.36Å; I89-E93 WeakPolarHBondContact O-CG 3.5Å; I89-E93 PolarHBondContact O-N 3.28Å; I89-F276 HydrophobicContact CB-CD1 4.49Å; I89-F276 HydrophobicContact CD1-CE1 4.35Å; I89-F276 HydrophobicContact CD1-CZ 4.49Å; I89-F276 HydrophobicContact CG1-CD1 3.6Å; I89-F276 HydrophobicContact CG1-CE1 3.7Å; I89-F276 HydrophobicContact CG1-CG 4.09Å; I89-F276 HydrophobicContact CG1-CZ 4.28Å |
| 90 | G | 95.7 | Very high | 93.2 | Very high | 0 Ų | 0 | 57.4 Ų | 57.4 | 0% | 0 | 29% | 0.291 | C | S | . | . | H | α-helix | trans | -56.8 | -39.6 | 176.4 | 0 | 0 | 0 | 0 | 0 | 112.8 | A86 T87 V88 E93 V94 C211 | A86-G90 PolarHBondContact O-N 3.28Å; T87-G90 CarbonylContact O-C 3.6Å; T87-G90 WeakPolarHBondContact O-CA 3.37Å; T87-G90 PolarHBondContact O-N 3.15Å; T87-G90 VanDerWaalsContact O-N 3.17Å; V88-G90 VanDerWaalsContact C-N 3.32Å; G90-E93 PolarHBondContact O-N 2.99Å; G90-V94 VanDerWaalsContact O-CG2 3.25Å; G90-V94 WeakPolarHBondContact O-CG2 3.48Å; G90-V94 PolarHBondContact O-N 3.45Å; G90-C211 WeakPolarHBondContact O-CB 3.33Å |
| 91 | V | 96 | Very high | 93 | Very high | 60 Ų | 60 | 53.5 Ų | 53.5 | 36% | 0.364 | 27% | 0.274 | S | S | . | . | H | α-helix | trans | -65.3 | -43.6 | 173.5 | 173 | 0 | 0 | 0 | 0 | 112 | T87 V88 I89 E93 V94 F95 P212 | T87-V91 WeakPolarHBondContact O-CG2 3.49Å; T87-V91 PolarHBondContact O-N 3.03Å; V88-V91 PolarHBondContact O-N 3.39Å; I89-V91 VanDerWaalsContact C-N 3.26Å; I89-V91 PolarHBondContact O-N 3.37Å; V91-E93 VanDerWaalsContact C-N 3.26Å; V91-E93 PolarHBondContact O-N 3.28Å; V91-V94 WeakPolarHBondContact O-CB 3.44Å; V91-V94 PolarHBondContact O-N 2.88Å; V91-V94 VanDerWaalsContact O-N 3.15Å; V91-F95 HydrophobicContact CG1-CD2 4.41Å; V91-F95 HydrophobicContact CG1-CE2 3.9Å; V91-F95 VanDerWaalsContact O-CD2 3.26Å; V91-F95 WeakPolarHBondContact O-CD2 3.48Å; V91-F95 PolarHBondContact O-N 3.32Å; V91-P212 HydrophobicContact CG2-CB 4.43Å |
| 92 | L | 94.5 | Very high | 92.8 | Very high | 58 Ų | 58 | 53 Ų | 53 | 30% | 0.304 | 28% | 0.275 | S | S | . | . | H | α-helix | trans | -59.4 | -39.6 | 175 | -69.1 | 177.4 | 0 | 0 | 0 | 111.5 | V77 V88 I89 V94 F95 N96 | V77-L92 HydrophobicContact CB-CD1 4.39Å; V77-L92 HydrophobicContact CG1-CD1 4.41Å; V77-L92 HydrophobicContact CG2-CD1 4.47Å; V88-L92 WeakPolarHBondContact O-CG 3.48Å; V88-L92 PolarHBondContact O-N 2.96Å; I89-L92 HydrophobicContact CD1-CD1 4.01Å; I89-L92 WeakPolarHBondContact O-CB 3.38Å; I89-L92 PolarHBondContact O-N 3.4Å; L92-V94 VanDerWaalsContact C-N 3.3Å; L92-V94 PolarHBondContact O-N 3.04Å; L92-F95 PolarHBondContact O-N 2.9Å; L92-F95 VanDerWaalsContact O-N 3.16Å; L92-N96 PolarHBondContact O-N 3.01Å |
| 93 | E | 93.9 | Very high | 92.7 | Very high | 15 Ų | 15 | 51.8 Ų | 51.8 | 7% | 0.07 | 27% | 0.272 | C | S | . | . | H | α-helix | trans | -68.8 | -25.7 | 177.7 | -67.3 | -54.8 | 158.2 | 0 | 0 | 113.3 | I89 G90 V91 F95 N96 G97 Y207 C211 V272 | I89-E93 HydrophobicContact CG2-CG 4.36Å; I89-E93 WeakPolarHBondContact O-CG 3.5Å; I89-E93 PolarHBondContact O-N 3.28Å; G90-E93 PolarHBondContact O-N 2.99Å; V91-E93 VanDerWaalsContact C-N 3.26Å; V91-E93 PolarHBondContact O-N 3.28Å; E93-F95 VanDerWaalsContact C-N 3.35Å; E93-N96 WeakPolarHBondContact O-CB 3.49Å; E93-N96 PolarHBondContact O-N 3.06Å; E93-N96 WeakPolarHBondContact OE2-CB 3.01Å; E93-N96 PolarHBondContact OE2-ND2 3.25Å; E93-G97 PolarHBondContact O-N 3.11Å; E93-Y207 HydrophobicContact CB-CE1 3.97Å; E93-Y207 WeakPolarHBondContact CB-OH 3.34Å; E93-Y207 VanDerWaalsContact CG-OH 3.29Å; E93-Y207 WeakPolarHBondContact CG-OH 3.29Å; E93-Y207 PolarHBondContact OE2-OH 2.96Å; E93-C211 HydrophobicContact CB-CB 3.93Å; E93-V272 HydrophobicContact CG-CG1 4.21Å |
| 94 | V | 94.3 | Very high | 92.4 | Very high | 29 Ų | 29 | 48.7 Ų | 48.7 | 18% | 0.176 | 27% | 0.266 | C | S | . | . | H | α-helix | trans | -61.4 | -45.7 | 169.1 | -168.1 | 0 | 0 | 0 | 0 | 110.5 | G90 V91 L92 N96 G97 M98 A208 P212 | G90-V94 VanDerWaalsContact O-CG2 3.25Å; G90-V94 WeakPolarHBondContact O-CG2 3.48Å; G90-V94 PolarHBondContact O-N 3.45Å; V91-V94 WeakPolarHBondContact O-CB 3.44Å; V91-V94 PolarHBondContact O-N 2.88Å; V91-V94 VanDerWaalsContact O-N 3.15Å; L92-V94 VanDerWaalsContact C-N 3.3Å; L92-V94 PolarHBondContact O-N 3.04Å; V94-N96 VanDerWaalsContact C-N 3.28Å; V94-N96 PolarHBondContact O-N 2.89Å; V94-G97 PolarHBondContact O-N 2.95Å; V94-M98 HydrophobicContact CB-CE 4.21Å; V94-M98 HydrophobicContact CG1-CE 3.44Å; V94-M98 VanDerWaalsContact CG1-CE 3.44Å; V94-M98 WeakPolarHBondContact O-CB 3.24Å; V94-M98 WeakPolarHBondContact O-CG 3.45Å; V94-M98 PolarHBondContact O-N 2.97Å; V94-A208 HydrophobicContact CB-CB 4.5Å; V94-A208 HydrophobicContact CG1-CB 4Å; V94-A208 VanDerWaalsContact CG2-O 3.25Å; V94-A208 WeakPolarHBondContact CG2-O 3.4Å; V94-P212 HydrophobicContact CG2-CB 4.41Å; V94-P212 HydrophobicContact CG2-CG 3.79Å |
| 95 | F | 94 | Very high | 92.1 | Very high | 132 Ų | 132 | 46.2 Ų | 46.2 | 58% | 0.579 | 26% | 0.263 | S | S | * | . | H | α-helix | trans | -65.7 | -34.3 | 177.4 | -68.5 | -73.5 | 0 | 0 | 0 | 112 | V91 L92 E93 M98 G99 | V91-F95 HydrophobicContact CG1-CD2 4.41Å; V91-F95 HydrophobicContact CG1-CE2 3.9Å; V91-F95 VanDerWaalsContact O-CD2 3.26Å; V91-F95 WeakPolarHBondContact O-CD2 3.48Å; V91-F95 PolarHBondContact O-N 3.32Å; L92-F95 PolarHBondContact O-N 2.9Å; L92-F95 VanDerWaalsContact O-N 3.16Å; E93-F95 VanDerWaalsContact C-N 3.35Å; F95-M98 HydrophobicContact CD1-CE 3.82Å; F95-M98 HydrophobicContact CE1-CE 4.03Å; F95-M98 HydrophobicContact CG-CE 4.36Å; F95-G99 PolarHBondContact O-N 2.91Å |
| 96 | N | 91.3 | Very high | 91.9 | Very high | 66 Ų | 66 | 49.2 Ų | 49.2 | 35% | 0.353 | 28% | 0.278 | S | S | . | . | H | α-helix | trans | -63.5 | -50.6 | 173.1 | -165.9 | 22 | 0 | 0 | 0 | 111.1 | L92 E93 V94 M98 G99 Y100 | L92-N96 PolarHBondContact O-N 3.01Å; E93-N96 WeakPolarHBondContact O-CB 3.49Å; E93-N96 PolarHBondContact O-N 3.06Å; E93-N96 WeakPolarHBondContact OE2-CB 3.01Å; E93-N96 PolarHBondContact OE2-ND2 3.25Å; V94-N96 VanDerWaalsContact C-N 3.28Å; V94-N96 PolarHBondContact O-N 2.89Å; N96-M98 PolarHBondContact O-N 3.32Å; N96-G99 WeakPolarHBondContact O-CA 3.4Å; N96-G99 PolarHBondContact O-N 3.16Å; N96-Y100 VanDerWaalsContact O-CD2 3.31Å; N96-Y100 WeakPolarHBondContact O-CD2 3.04Å; N96-Y100 PolarHBondContact O-N 3.12Å; N96-Y100 WeakPolarHBondContact OD1-CE2 3.36Å |
| 97 | G | 89.9 | Confident | 91.7 | Very high | 1 Ų | 1 | 50 Ų | 50 | 1% | 0.01 | 29% | 0.286 | C | S | . | . | H | α-helix | trans | -60 | -42.8 | 176.1 | 0 | 0 | 0 | 0 | 0 | 112.9 | E93 V94 G99 Y100 T101 | E93-G97 PolarHBondContact O-N 3.11Å; V94-G97 PolarHBondContact O-N 2.95Å; G97-G99 VanDerWaalsContact C-N 3.3Å; G97-G99 PolarHBondContact O-N 3.4Å; G97-Y100 PolarHBondContact O-N 3.3Å; G97-T101 PolarHBondContact O-N 2.92Å; G97-T101 PolarHBondContact O-OG1 3.24Å |
| 98 | M | 90.8 | Very high | 91.3 | Very high | 73 Ų | 73 | 50.3 Ų | 50.3 | 36% | 0.36 | 30% | 0.296 | S | S | . | . | H | α-helix | trans | -59.9 | -40.1 | 172 | -76.1 | -169.3 | -101.7 | 0 | 0 | 112.1 | V94 F95 N96 T101 I102 | V94-M98 HydrophobicContact CB-CE 4.21Å; V94-M98 HydrophobicContact CG1-CE 3.44Å; V94-M98 VanDerWaalsContact CG1-CE 3.44Å; V94-M98 WeakPolarHBondContact O-CB 3.24Å; V94-M98 WeakPolarHBondContact O-CG 3.45Å; V94-M98 PolarHBondContact O-N 2.97Å; F95-M98 HydrophobicContact CD1-CE 3.82Å; F95-M98 HydrophobicContact CE1-CE 4.03Å; F95-M98 HydrophobicContact CG-CE 4.36Å; N96-M98 PolarHBondContact O-N 3.32Å; M98-T101 PolarHBondContact O-N 2.96Å; M98-I102 HydrophobicContact CB-CD1 4.47Å; M98-I102 WeakPolarHBondContact O-CB 3.31Å; M98-I102 WeakPolarHBondContact O-CG1 3.28Å; M98-I102 PolarHBondContact O-N 2.96Å |
| 99 | G | 91.9 | Very high | 91.1 | Very high | 44 Ų | 44 | 53.3 Ų | 53.3 | 45% | 0.454 | 31% | 0.31 | S | S | . | . | H | α-helix | trans | -60.5 | -42.8 | 175.3 | 0 | 0 | 0 | 0 | 0 | 112.8 | F95 N96 G97 G103 | F95-G99 PolarHBondContact O-N 2.91Å; N96-G99 WeakPolarHBondContact O-CA 3.4Å; N96-G99 PolarHBondContact O-N 3.16Å; G97-G99 VanDerWaalsContact C-N 3.3Å; G97-G99 PolarHBondContact O-N 3.4Å; G99-G103 WeakPolarHBondContact O-CA 3.48Å; G99-G103 PolarHBondContact O-N 3.07Å |
| 100 | Y | 85.6 | Confident | 91.1 | Very high | 118 Ų | 118 | 54.7 Ų | 54.7 | 46% | 0.463 | 32% | 0.317 | S | S | . | . | H | α-helix | trans | -66.1 | -37.7 | 174.6 | -80.7 | -72 | 0 | 0 | 0 | 112.9 | N96 G97 P104 | N96-Y100 VanDerWaalsContact O-CD2 3.31Å; N96-Y100 WeakPolarHBondContact O-CD2 3.04Å; N96-Y100 PolarHBondContact O-N 3.12Å; N96-Y100 WeakPolarHBondContact OD1-CE2 3.36Å; G97-Y100 PolarHBondContact O-N 3.3Å; Y100-P104 WeakPolarHBondContact O-CD 3.25Å |
| 101 | T | 88.1 | Confident | 91 | Very high | 21 Ų | 21 | 61.3 Ų | 61.3 | 13% | 0.129 | 34% | 0.343 | C | S | . | . | H | α-helix | trans | -72.4 | -48.7 | 179.3 | -64.9 | 0 | 0 | 0 | 0 | 112.8 | G97 M98 P105 T201 A204 | G97-T101 PolarHBondContact O-N 2.92Å; G97-T101 PolarHBondContact O-OG1 3.24Å; M98-T101 PolarHBondContact O-N 2.96Å; T101-P105 WeakPolarHBondContact O-CD 3.42Å; T101-T201 HydrophobicContact CG2-CG2 3.5Å; T101-T201 VanDerWaalsContact CG2-CG2 3.5Å; T101-A204 VanDerWaalsContact OG1-CB 3.28Å; T101-A204 WeakPolarHBondContact OG1-CB 3.49Å |
| 102 | I | 89.1 | Confident | 90.8 | Very high | 92 Ų | 92 | 66 Ų | 66 | 47% | 0.472 | 36% | 0.359 | S | S | . | . | H | α-helix | trans | -87.5 | -28 | -171.9 | -59.7 | 170.5 | 0 | 0 | 0 | 110.9 | M98 P105 L106 | M98-I102 HydrophobicContact CB-CD1 4.47Å; M98-I102 WeakPolarHBondContact O-CB 3.31Å; M98-I102 WeakPolarHBondContact O-CG1 3.28Å; M98-I102 PolarHBondContact O-N 2.96Å; I102-P105 WeakPolarHBondContact O-CD 3.25Å; I102-L106 HydrophobicContact CG2-CB 4.09Å; I102-L106 HydrophobicContact CG2-CD2 4.03Å; I102-L106 WeakPolarHBondContact O-CB 3.5Å; I102-L106 PolarHBondContact O-N 3.27Å |
| 103 | G | 89.3 | Confident | 90.8 | Very high | 28 Ų | 28 | 72 Ų | 72 | 29% | 0.289 | 38% | 0.379 | S | S | . | . | H | α-helix | trans | -54.9 | -56.3 | -173.6 | 0 | 0 | 0 | 0 | 0 | 114.1 | G99 G107 | G99-G103 WeakPolarHBondContact O-CA 3.48Å; G99-G103 PolarHBondContact O-N 3.07Å; G103-G107 PolarHBondContact O-N 2.93Å |
| 104 | P | 86.3 | Confident | 90.7 | Very high | 91 Ų | 91 | 73 Ų | 73 | 59% | 0.591 | 39% | 0.393 | S | S | * | . | H | α-helix | trans | -64.3 | -49.3 | -178.6 | -17.8 | 28.9 | 0 | 0 | 0 | 113.8 | Y100 L106 G107 G108 | Y100-P104 WeakPolarHBondContact O-CD 3.25Å; P104-L106 PolarHBondContact O-N 2.95Å; P104-G107 PolarHBondContact O-N 2.99Å; P104-G108 PolarHBondContact O-N 2.92Å |
| 105 | P | 88.1 | Confident | 90.6 | Very high | 76 Ų | 76 | 73.1 Ų | 73.1 | 49% | 0.494 | 40% | 0.4 | S | S | . | . | H | α-helix | trans | -59.3 | -45.2 | 175.8 | -25 | 34.8 | 0 | 0 | 0 | 112.8 | T101 I102 G108 I109 | T101-P105 WeakPolarHBondContact O-CD 3.42Å; I102-P105 WeakPolarHBondContact O-CD 3.25Å; P105-G108 PolarHBondContact O-N 3.44Å; P105-I109 WeakPolarHBondContact O-CG1 3.16Å; P105-I109 PolarHBondContact O-N 3.29Å |
| 106 | L | 90.4 | Very high | 90.5 | Very high | 65 Ų | 65 | 70.4 Ų | 70.4 | 34% | 0.34 | 39% | 0.387 | S | S | . | . | H | α-helix | trans | -66.1 | -41 | 179.8 | -174.1 | 56.2 | 0 | 0 | 0 | 111.3 | I102 P104 G108 I109 L110 F123 | I102-L106 HydrophobicContact CG2-CB 4.09Å; I102-L106 HydrophobicContact CG2-CD2 4.03Å; I102-L106 WeakPolarHBondContact O-CB 3.5Å; I102-L106 PolarHBondContact O-N 3.27Å; P104-L106 PolarHBondContact O-N 2.95Å; L106-G108 PolarHBondContact O-N 3.19Å; L106-I109 PolarHBondContact O-N 3.27Å; L106-L110 HydrophobicContact CD1-CD1 4.46Å; L106-L110 HydrophobicContact CG-CD1 4.14Å; L106-L110 WeakPolarHBondContact O-CB 3.37Å; L106-L110 WeakPolarHBondContact O-CD1 3.49Å; L106-L110 WeakPolarHBondContact O-CG 3.24Å; L106-L110 PolarHBondContact O-N 3.06Å; L106-F123 HydrophobicContact CD2-CE1 4.31Å; L106-F123 HydrophobicContact CD2-CZ 3.74Å; L106-F123 HydrophobicContact CG-CZ 4.09Å |
| 107 | G | 89.8 | Confident | 90.7 | Very high | 17 Ų | 17 | 69.3 Ų | 69.3 | 18% | 0.175 | 38% | 0.381 | C | S | . | . | H | α-helix | trans | -61.4 | -41.1 | 173.7 | 0 | 0 | 0 | 0 | 0 | 112.8 | G103 P104 L110 Y111 | G103-G107 PolarHBondContact O-N 2.93Å; P104-G107 PolarHBondContact O-N 2.99Å; G107-L110 PolarHBondContact O-N 2.87Å; G107-Y111 VanDerWaalsContact O-CB 3.3Å; G107-Y111 WeakPolarHBondContact O-CB 3.44Å; G107-Y111 PolarHBondContact O-N 3.47Å |
| 108 | G | 88 | Confident | 91 | Very high | 40 Ų | 40 | 71.3 Ų | 71.3 | 41% | 0.412 | 39% | 0.392 | S | S | . | . | H | α-helix | trans | -65.2 | -42.3 | 175.3 | 0 | 0 | 0 | 0 | 0 | 113.1 | P104 P105 L106 Y111 K112 | P104-G108 PolarHBondContact O-N 2.92Å; P105-G108 PolarHBondContact O-N 3.44Å; L106-G108 PolarHBondContact O-N 3.19Å; G108-Y111 PolarHBondContact O-N 3.44Å; G108-K112 WeakPolarHBondContact O-CB 3.49Å; G108-K112 PolarHBondContact O-N 3.04Å |
| 109 | I | 92.6 | Very high | 91.2 | Very high | 92 Ų | 92 | 68.7 Ų | 68.7 | 47% | 0.472 | 38% | 0.381 | S | S | . | . | H | α-helix | trans | -61.9 | -48.3 | 174.5 | -70.1 | 167.2 | 0 | 0 | 0 | 110.5 | P105 L106 Y111 K112 Y113 | P105-I109 WeakPolarHBondContact O-CG1 3.16Å; P105-I109 PolarHBondContact O-N 3.29Å; L106-I109 PolarHBondContact O-N 3.27Å; I109-Y111 VanDerWaalsContact C-N 3.31Å; I109-Y111 PolarHBondContact O-N 2.62Å; I109-K112 PolarHBondContact O-N 2.77Å; I109-Y113 HydrophobicContact CG2-CD2 3.89Å; I109-Y113 HydrophobicContact CG2-CE2 3.99Å; I109-Y113 VanDerWaalsContact O-CD2 3.26Å; I109-Y113 WeakPolarHBondContact O-CD2 3.38Å; I109-Y113 PolarHBondContact O-N 3.02Å; I109-Y113 VanDerWaalsContact O-N 3.16Å |
| 110 | L | 94.3 | Very high | 91.4 | Very high | 31 Ų | 31 | 69.1 Ų | 69.1 | 16% | 0.162 | 37% | 0.37 | C | S | . | . | H | α-helix | trans | -61.6 | -39.7 | 178.3 | -71 | 168.5 | 0 | 0 | 0 | 112 | L106 G107 G114 T118 P119 L122 F123 | L106-L110 HydrophobicContact CD1-CD1 4.46Å; L106-L110 HydrophobicContact CG-CD1 4.14Å; L106-L110 WeakPolarHBondContact O-CB 3.37Å; L106-L110 WeakPolarHBondContact O-CD1 3.49Å; L106-L110 WeakPolarHBondContact O-CG 3.24Å; L106-L110 PolarHBondContact O-N 3.06Å; G107-L110 PolarHBondContact O-N 2.87Å; L110-G114 WeakPolarHBondContact O-CA 3.23Å; L110-G114 PolarHBondContact O-N 2.9Å; L110-T118 HydrophobicContact CB-CG2 4.12Å; L110-T118 HydrophobicContact CD2-CG2 4.12Å; L110-P119 HydrophobicContact CB-CB 4.1Å; L110-P119 HydrophobicContact CD1-CB 4.34Å; L110-L122 HydrophobicContact CD1-CD2 3.6Å; L110-L122 HydrophobicContact CD2-CD2 3.74Å; L110-L122 HydrophobicContact CG-CD2 4.34Å; L110-F123 HydrophobicContact CD1-CE2 3.88Å; L110-F123 HydrophobicContact CD1-CZ 4.24Å |
| 111 | Y | 92 | Very high | 92 | Very high | 139 Ų | 139 | 64.9 Ų | 64.9 | 55% | 0.545 | 36% | 0.359 | S | S | . | . | H | α-helix | trans | -62.1 | -45.9 | 173.2 | 174.1 | -99.5 | 0 | 0 | 0 | 112.1 | G107 G108 I109 Y113 G115 | G107-Y111 VanDerWaalsContact O-CB 3.3Å; G107-Y111 WeakPolarHBondContact O-CB 3.44Å; G107-Y111 PolarHBondContact O-N 3.47Å; G108-Y111 PolarHBondContact O-N 3.44Å; I109-Y111 VanDerWaalsContact C-N 3.31Å; I109-Y111 PolarHBondContact O-N 2.62Å; Y111-Y113 PolarHBondContact O-N 2.71Å; Y111-G115 WeakPolarHBondContact O-CA 3.23Å; Y111-G115 PolarHBondContact O-N 3.37Å |
| 112 | K | 93.4 | Very high | 92.4 | Very high | 157 Ų | 157 | 67.5 Ų | 67.5 | 68% | 0.683 | 37% | 0.372 | S | S | * | . | H | α-helix | trans | -60.3 | -41.9 | -178.7 | -176.7 | 179.3 | 179.5 | 179 | 0 | 112.7 | G108 I109 | G108-K112 WeakPolarHBondContact O-CB 3.49Å; G108-K112 PolarHBondContact O-N 3.04Å; I109-K112 PolarHBondContact O-N 2.77Å |
| 113 | Y | 93.8 | Very high | 92.7 | Very high | 185 Ų | 185 | 67 Ų | 67 | 73% | 0.725 | 37% | 0.367 | S | S | * | . | H | α-helix | trans | -94.5 | -25.5 | -174.8 | -67 | -68.4 | 0 | 0 | 0 | 114.5 | I109 Y111 | I109-Y113 HydrophobicContact CG2-CD2 3.89Å; I109-Y113 HydrophobicContact CG2-CE2 3.99Å; I109-Y113 VanDerWaalsContact O-CD2 3.26Å; I109-Y113 WeakPolarHBondContact O-CD2 3.38Å; I109-Y113 PolarHBondContact O-N 3.02Å; I109-Y113 VanDerWaalsContact O-N 3.16Å; Y111-Y113 PolarHBondContact O-N 2.71Å |
| 114 | G | 92.1 | Very high | 93.1 | Very high | 36 Ų | 36 | 65.7 Ų | 65.7 | 37% | 0.371 | 35% | 0.353 | S | S | . | . | H | α-helix | trans | -123.3 | 3 | -176.1 | 0 | 0 | 0 | 0 | 0 | 115 | L110 T118 | L110-G114 WeakPolarHBondContact O-CA 3.23Å; L110-G114 PolarHBondContact O-N 2.9Å; G114-T118 VanDerWaalsContact CA-OG1 3.24Å; G114-T118 WeakPolarHBondContact CA-OG1 3.35Å; G114-T118 PolarHBondContact O-OG1 3.24Å |
| 115 | G | 92.8 | Very high | 93.6 | Very high | 32 Ų | 32 | 64.4 Ų | 64.4 | 33% | 0.33 | 34% | 0.344 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 73.6 | -172.2 | -178.8 | 0 | 0 | 0 | 0 | 0 | 114.3 | Y111 I117 T118 P119 | Y111-G115 WeakPolarHBondContact O-CA 3.23Å; Y111-G115 PolarHBondContact O-N 3.37Å; G115-I117 PolarHBondContact O-N 3.12Å; G115-T118 PolarHBondContact O-N 3.5Å; G115-P119 WeakPolarHBondContact O-CD 3.43Å |
| 116 | Y | 92 | Very high | 94.1 | Very high | 74 Ų | 74 | 63.7 Ų | 63.7 | 29% | 0.29 | 34% | 0.335 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -54.4 | -44.8 | -170.8 | -176.6 | -98.4 | 0 | 0 | 0 | 114.4 | G40 Y43 T118 P119 F120 | G40-Y116 WeakPolarHBondContact O-CD1 3.24Å; Y43-Y116 HydrophobicContact CD1-CD1 4.04Å; Y43-Y116 HydrophobicContact CG-CD1 4.13Å; Y116-T118 PolarHBondContact O-N 2.87Å; Y116-P119 WeakPolarHBondContact O-CD 3.45Å; Y116-F120 HydrophobicContact CD1-CE2 4.49Å; Y116-F120 HydrophobicContact CD2-CE2 4.49Å; Y116-F120 HydrophobicContact CE1-CD2 4.42Å; Y116-F120 HydrophobicContact CE1-CE2 4.07Å; Y116-F120 HydrophobicContact CE2-CE2 4.07Å; Y116-F120 AromaticContact CZ-CE2 3.86Å; Y116-F120 VanDerWaalsContact O-CD2 3.23Å; Y116-F120 WeakPolarHBondContact O-CD2 3.24Å |
| 117 | I | 95.1 | Very high | 94.4 | Very high | 44 Ų | 44 | 62.4 Ų | 62.4 | 23% | 0.226 | 33% | 0.328 | C | S | . | . | H | α-helix | trans | -70.4 | -30.8 | -174.2 | -169.1 | 175.3 | 0 | 0 | 0 | 113.3 | L41 Y43 G115 F120 A121 | L41-I117 HydrophobicContact CD2-CD1 3.45Å; L41-I117 VanDerWaalsContact CD2-CD1 3.45Å; L41-I117 HydrophobicContact CG-CD1 4Å; Y43-I117 HydrophobicContact CE1-CB 4.07Å; Y43-I117 HydrophobicContact CE1-CD1 4.41Å; G115-I117 PolarHBondContact O-N 3.12Å; I117-F120 PolarHBondContact O-N 2.86Å; I117-F120 VanDerWaalsContact O-N 3.16Å; I117-A121 HydrophobicContact CG1-CB 4.25Å; I117-A121 WeakPolarHBondContact O-CB 3.26Å; I117-A121 PolarHBondContact O-N 3.23Å |
| 118 | T | 95.8 | Very high | 94.8 | Very high | 42 Ų | 42 | 63.8 Ų | 63.8 | 26% | 0.258 | 33% | 0.332 | S | S | . | . | H | α-helix | trans | -57.8 | -49.4 | -167.7 | -69.1 | 0 | 0 | 0 | 0 | 114.8 | L110 G114 G115 Y116 F120 A121 L122 | L110-T118 HydrophobicContact CB-CG2 4.12Å; L110-T118 HydrophobicContact CD2-CG2 4.12Å; G114-T118 VanDerWaalsContact CA-OG1 3.24Å; G114-T118 WeakPolarHBondContact CA-OG1 3.35Å; G114-T118 PolarHBondContact O-OG1 3.24Å; G115-T118 PolarHBondContact O-N 3.5Å; Y116-T118 PolarHBondContact O-N 2.87Å; T118-F120 VanDerWaalsContact C-N 3.31Å; T118-F120 PolarHBondContact O-N 3.3Å; T118-A121 PolarHBondContact O-N 3.02Å; T118-L122 WeakPolarHBondContact O-CB 3.36Å; T118-L122 PolarHBondContact O-N 3.47Å |
| 119 | P | 95.7 | Very high | 95.2 | Very high | 18 Ų | 18 | 66.2 Ų | 66.2 | 12% | 0.117 | 33% | 0.334 | C | S | . | . | H | α-helix | trans | -59.6 | -42.1 | 177.1 | 21.3 | -32.9 | 0 | 0 | 0 | 112.3 | L110 G115 Y116 F123 | L110-P119 HydrophobicContact CB-CB 4.1Å; L110-P119 HydrophobicContact CD1-CB 4.34Å; G115-P119 WeakPolarHBondContact O-CD 3.43Å; Y116-P119 WeakPolarHBondContact O-CD 3.45Å; P119-F123 WeakPolarHBondContact O-CD2 3.37Å; P119-F123 PolarHBondContact O-N 3.01Å |
| 120 | F | 96.4 | Very high | 95.4 | Very high | 54 Ų | 54 | 67.4 Ų | 67.4 | 24% | 0.237 | 34% | 0.336 | C | S | . | . | H | α-helix | trans | -69.5 | -42.1 | -179.3 | -62.3 | -75.2 | 0 | 0 | 0 | 112.7 | S36 F39 Y116 I117 T118 G124 | S36-F120 WeakPolarHBondContact O-CB 3.47Å; F39-F120 AromaticContact CD1-CD1 3.95Å; F39-F120 HydrophobicContact CD1-CD1 3.95Å; F39-F120 AromaticContact CD1-CE1 3.49Å; F39-F120 HydrophobicContact CD1-CE1 3.49Å; F39-F120 VanDerWaalsContact CD1-CE1 3.49Å; F39-F120 HydrophobicContact CD1-CE2 4.39Å; F39-F120 AromaticContact CD1-CZ 3.75Å; F39-F120 HydrophobicContact CD1-CZ 3.75Å; F39-F120 AromaticContact CE1-CE1 3.94Å; F39-F120 HydrophobicContact CE1-CE1 3.94Å; F39-F120 AromaticContact CE1-CZ 3.87Å; F39-F120 HydrophobicContact CE1-CZ 3.87Å; Y116-F120 HydrophobicContact CD1-CE2 4.49Å; Y116-F120 HydrophobicContact CD2-CE2 4.49Å; Y116-F120 HydrophobicContact CE1-CD2 4.42Å; Y116-F120 HydrophobicContact CE1-CE2 4.07Å; Y116-F120 HydrophobicContact CE2-CE2 4.07Å; Y116-F120 AromaticContact CZ-CE2 3.86Å; Y116-F120 VanDerWaalsContact O-CD2 3.23Å; Y116-F120 WeakPolarHBondContact O-CD2 3.24Å; I117-F120 PolarHBondContact O-N 2.86Å; I117-F120 VanDerWaalsContact O-N 3.16Å; T118-F120 VanDerWaalsContact C-N 3.31Å; T118-F120 PolarHBondContact O-N 3.3Å; F120-G124 WeakPolarHBondContact O-CA 3.47Å; F120-G124 PolarHBondContact O-N 2.87Å |
| 121 | A | 96.7 | Very high | 95.5 | Very high | 28 Ų | 28 | 66.8 Ų | 66.8 | 23% | 0.231 | 33% | 0.334 | C | S | . | . | H | α-helix | trans | -64.1 | -45.4 | 177.6 | 0 | 0 | 0 | 0 | 0 | 111.4 | I117 T118 T125 | I117-A121 HydrophobicContact CG1-CB 4.25Å; I117-A121 WeakPolarHBondContact O-CB 3.26Å; I117-A121 PolarHBondContact O-N 3.23Å; T118-A121 PolarHBondContact O-N 3.02Å; A121-T125 VanDerWaalsContact O-CB 3.24Å; A121-T125 WeakPolarHBondContact O-CB 3.41Å; A121-T125 PolarHBondContact O-N 3.46Å; A121-T125 PolarHBondContact O-OG1 3.24Å |
| 122 | L | 96.9 | Very high | 95.7 | Very high | 76 Ų | 76 | 66.4 Ų | 66.4 | 40% | 0.398 | 34% | 0.336 | S | S | . | . | H | α-helix | trans | -62.3 | -57.9 | -179.8 | -178.9 | 66 | 0 | 0 | 0 | 111.5 | L110 T118 G124 T125 I126 | L110-L122 HydrophobicContact CD1-CD2 3.6Å; L110-L122 HydrophobicContact CD2-CD2 3.74Å; L110-L122 HydrophobicContact CG-CD2 4.34Å; T118-L122 WeakPolarHBondContact O-CB 3.36Å; T118-L122 PolarHBondContact O-N 3.47Å; L122-G124 VanDerWaalsContact C-N 3.33Å; L122-G124 PolarHBondContact O-N 2.95Å; L122-T125 PolarHBondContact O-N 3.36Å; L122-I126 HydrophobicContact CD1-CD1 4.22Å; L122-I126 HydrophobicContact CG-CD1 4.04Å; L122-I126 WeakPolarHBondContact O-CG1 3.32Å; L122-I126 PolarHBondContact O-N 3.43Å |
| 123 | F | 95.4 | Very high | 95.7 | Very high | 82 Ų | 82 | 62.6 Ų | 62.6 | 36% | 0.36 | 33% | 0.325 | S | S | . | . | H | α-helix | trans | -67.6 | -35 | -177.7 | -68.6 | -61.7 | 0 | 0 | 0 | 112.3 | L106 L110 P119 I126 L127 | L106-F123 HydrophobicContact CD2-CE1 4.31Å; L106-F123 HydrophobicContact CD2-CZ 3.74Å; L106-F123 HydrophobicContact CG-CZ 4.09Å; L110-F123 HydrophobicContact CD1-CE2 3.88Å; L110-F123 HydrophobicContact CD1-CZ 4.24Å; P119-F123 WeakPolarHBondContact O-CD2 3.37Å; P119-F123 PolarHBondContact O-N 3.01Å; F123-I126 HydrophobicContact CD1-CD1 4.27Å; F123-I126 PolarHBondContact O-N 3.28Å; F123-L127 WeakPolarHBondContact O-CG 3.3Å; F123-L127 PolarHBondContact O-N 3Å; F123-L127 VanDerWaalsContact O-N 3.08Å |
| 124 | G | 97.4 | Very high | 95.7 | Very high | 0 Ų | 0 | 54.7 Ų | 54.7 | 0% | 0 | 30% | 0.297 | C | S | . | . | H | α-helix | trans | -62.2 | -42.4 | 173.7 | 0 | 0 | 0 | 0 | 0 | 112.6 | G33 F120 L122 L127 I128 | G33-G124 WeakPolarHBondContact CA-O 3.31Å; G33-G124 WeakPolarHBondContact O-CA 3.17Å; F120-G124 WeakPolarHBondContact O-CA 3.47Å; F120-G124 PolarHBondContact O-N 2.87Å; L122-G124 VanDerWaalsContact C-N 3.33Å; L122-G124 PolarHBondContact O-N 2.95Å; G124-L127 PolarHBondContact O-N 2.96Å; G124-I128 WeakPolarHBondContact O-CG1 3.44Å; G124-I128 PolarHBondContact O-N 3.47Å; G124-I128 VanDerWaalsContact O-N 3.15Å |
| 125 | T | 97.9 | Very high | 95.7 | Very high | 65 Ų | 65 | 55.3 Ų | 55.3 | 40% | 0.399 | 30% | 0.295 | S | S | . | . | H | α-helix | trans | -67.1 | -42.3 | 176.4 | -55.6 | 0 | 0 | 0 | 0 | 111.3 | A121 L122 L127 I128 I129 | A121-T125 VanDerWaalsContact O-CB 3.24Å; A121-T125 WeakPolarHBondContact O-CB 3.41Å; A121-T125 PolarHBondContact O-N 3.46Å; A121-T125 PolarHBondContact O-OG1 3.24Å; L122-T125 PolarHBondContact O-N 3.36Å; T125-L127 VanDerWaalsContact C-N 3.3Å; T125-L127 PolarHBondContact O-N 3.34Å; T125-I128 PolarHBondContact O-N 2.77Å; T125-I128 VanDerWaalsContact O-N 3.11Å; T125-I129 HydrophobicContact CG2-CD1 3.95Å; T125-I129 HydrophobicContact CG2-CG1 4.39Å; T125-I129 WeakPolarHBondContact O-CG1 3.42Å; T125-I129 PolarHBondContact O-N 3.04Å |
| 126 | I | 97.2 | Very high | 95.6 | Very high | 61 Ų | 61 | 60.7 Ų | 60.7 | 31% | 0.313 | 31% | 0.31 | S | S | . | . | H | α-helix | trans | -56.9 | -43.9 | 175.6 | -69.6 | 166.9 | 0 | 0 | 0 | 110.9 | L122 F123 I128 I129 F130 | L122-I126 HydrophobicContact CD1-CD1 4.22Å; L122-I126 HydrophobicContact CG-CD1 4.04Å; L122-I126 WeakPolarHBondContact O-CG1 3.32Å; L122-I126 PolarHBondContact O-N 3.43Å; F123-I126 HydrophobicContact CD1-CD1 4.27Å; F123-I126 PolarHBondContact O-N 3.28Å; I126-I128 PolarHBondContact O-N 3.25Å; I126-I129 PolarHBondContact O-N 3.48Å; I126-F130 HydrophobicContact CG2-CD2 4.21Å; I126-F130 HydrophobicContact CG2-CE2 3.91Å; I126-F130 HydrophobicContact CG2-CZ 4.11Å; I126-F130 PolarHBondContact O-N 3.02Å |
| 127 | L | 97.3 | Very high | 95.5 | Very high | 37 Ų | 37 | 62.3 Ų | 62.3 | 19% | 0.194 | 32% | 0.323 | C | S | . | . | H | α-helix | trans | -63.5 | -38.8 | 176.7 | -69.1 | 174.1 | 0 | 0 | 0 | 112.6 | L29 T32 F123 G124 T125 F130 C131 | L29-L127 HydrophobicContact CD2-CD2 3.92Å; T32-L127 HydrophobicContact CG2-CD1 3.78Å; F123-L127 WeakPolarHBondContact O-CG 3.3Å; F123-L127 PolarHBondContact O-N 3Å; F123-L127 VanDerWaalsContact O-N 3.08Å; G124-L127 PolarHBondContact O-N 2.96Å; T125-L127 VanDerWaalsContact C-N 3.3Å; T125-L127 PolarHBondContact O-N 3.34Å; L127-F130 PolarHBondContact O-N 3.28Å; L127-C131 PolarHBondContact O-N 2.99Å |
| 128 | I | 97.9 | Very high | 95.1 | Very high | 47 Ų | 47 | 69.9 Ų | 69.9 | 24% | 0.241 | 35% | 0.354 | C | S | . | . | H | α-helix | trans | -67.2 | -40.1 | 175.4 | -66.8 | 169.8 | 0 | 0 | 0 | 110.9 | F30 I37 G124 T125 I126 F130 C131 F132 | F30-I128 HydrophobicContact CD2-CG1 4.45Å; F30-I128 HydrophobicContact CD2-CG2 4.48Å; I37-I128 HydrophobicContact CD1-CD1 3.75Å; G124-I128 WeakPolarHBondContact O-CG1 3.44Å; G124-I128 PolarHBondContact O-N 3.47Å; G124-I128 VanDerWaalsContact O-N 3.15Å; T125-I128 PolarHBondContact O-N 2.77Å; T125-I128 VanDerWaalsContact O-N 3.11Å; I126-I128 PolarHBondContact O-N 3.25Å; I128-F130 VanDerWaalsContact C-N 3.34Å; I128-C131 VanDerWaalsContact O-CB 3.32Å; I128-C131 WeakPolarHBondContact O-CB 3.41Å; I128-C131 PolarHBondContact O-N 3.46Å; I128-F132 PolarHBondContact O-N 2.8Å |
| 129 | I | 97.6 | Very high | 94.4 | Very high | 91 Ų | 91 | 70.5 Ų | 70.5 | 47% | 0.467 | 36% | 0.364 | S | S | . | . | H | α-helix | trans | -61.5 | -44.8 | 173.9 | -68 | 166.3 | 0 | 0 | 0 | 109.9 | T125 I126 C131 F132 V133 | T125-I129 HydrophobicContact CG2-CD1 3.95Å; T125-I129 HydrophobicContact CG2-CG1 4.39Å; T125-I129 WeakPolarHBondContact O-CG1 3.42Å; T125-I129 PolarHBondContact O-N 3.04Å; I126-I129 PolarHBondContact O-N 3.48Å; I129-C131 VanDerWaalsContact C-N 3.32Å; I129-C131 PolarHBondContact O-N 3.43Å; I129-F132 WeakPolarHBondContact O-CB 3.43Å; I129-F132 PolarHBondContact O-N 3.4Å; I129-F132 VanDerWaalsContact O-N 3.11Å; I129-V133 HydrophobicContact CG2-CG2 4.3Å; I129-V133 WeakPolarHBondContact O-CG2 3.3Å; I129-V133 PolarHBondContact O-N 3.11Å |
| 130 | F | 95.9 | Very high | 93.5 | Very high | 116 Ų | 116 | 71.5 Ų | 71.5 | 51% | 0.509 | 37% | 0.368 | S | S | . | . | H | α-helix | trans | -63.5 | -36 | 174.9 | -74 | -13.4 | 0 | 0 | 0 | 112.8 | L29 I126 L127 I128 F132 S134 | L29-F130 HydrophobicContact CD1-CB 4.21Å; I126-F130 HydrophobicContact CG2-CD2 4.21Å; I126-F130 HydrophobicContact CG2-CE2 3.91Å; I126-F130 HydrophobicContact CG2-CZ 4.11Å; I126-F130 PolarHBondContact O-N 3.02Å; L127-F130 PolarHBondContact O-N 3.28Å; I128-F130 VanDerWaalsContact C-N 3.34Å; F130-F132 VanDerWaalsContact C-N 3.34Å; F130-S134 WeakPolarHBondContact O-CB 3.43Å; F130-S134 PolarHBondContact O-N 3.15Å; F130-S134 PolarHBondContact O-OG 3.35Å |
| 131 | C | 96.3 | Very high | 92.1 | Very high | 18 Ų | 18 | 73.7 Ų | 73.7 | 12% | 0.122 | 39% | 0.39 | C | S | . | . | H | α-helix | trans | -58.2 | -48.7 | 169.7 | 172.2 | 0 | 0 | 0 | 0 | 110.8 | C26 L29 F30 L127 I128 I129 S134 S135 | C26-C131 PolarHBondContact O-SG 2.89Å; L29-C131 HydrophobicContact CB-CB 3.83Å; L29-C131 HydrophobicContact CD1-CB 4.46Å; F30-C131 HydrophobicContact CB-CB 4.47Å; L127-C131 PolarHBondContact O-N 2.99Å; I128-C131 VanDerWaalsContact O-CB 3.32Å; I128-C131 WeakPolarHBondContact O-CB 3.41Å; I128-C131 PolarHBondContact O-N 3.46Å; I129-C131 VanDerWaalsContact C-N 3.32Å; I129-C131 PolarHBondContact O-N 3.43Å; C131-S134 PolarHBondContact O-N 2.87Å; C131-S135 PolarHBondContact O-N 2.89Å |
| 132 | F | 95.5 | Very high | 90.7 | Very high | 132 Ų | 132 | 74 Ų | 74 | 58% | 0.579 | 39% | 0.39 | S | S | * | . | H | α-helix | trans | -61.5 | -49.6 | -179.9 | -174.2 | -106.9 | 0 | 0 | 0 | 111.8 | I128 I129 F130 S134 S135 F136 | I128-F132 PolarHBondContact O-N 2.8Å; I129-F132 WeakPolarHBondContact O-CB 3.43Å; I129-F132 PolarHBondContact O-N 3.4Å; I129-F132 VanDerWaalsContact O-N 3.11Å; F130-F132 VanDerWaalsContact C-N 3.34Å; F132-S134 VanDerWaalsContact C-N 3.34Å; F132-S134 PolarHBondContact O-N 3.43Å; F132-S135 WeakPolarHBondContact O-CB 3.44Å; F132-S135 PolarHBondContact O-N 2.65Å; F132-S135 VanDerWaalsContact O-N 3.14Å; F132-S135 PolarHBondContact O-OG 2.95Å; F132-F136 AromaticContact CD1-CE2 3.78Å; F132-F136 HydrophobicContact CD1-CE2 3.78Å; F132-F136 HydrophobicContact CD2-CE2 4.16Å; F132-F136 AromaticContact CE1-CE2 3.45Å; F132-F136 HydrophobicContact CE1-CE2 3.45Å; F132-F136 VanDerWaalsContact CE1-CE2 3.45Å; F132-F136 AromaticContact CE1-CZ 3.96Å; F132-F136 HydrophobicContact CE1-CZ 3.96Å; F132-F136 AromaticContact CE2-CE2 3.85Å; F132-F136 HydrophobicContact CE2-CE2 3.85Å; F132-F136 AromaticContact CE2-CZ 3.96Å; F132-F136 HydrophobicContact CE2-CZ 3.96Å; F132-F136 HydrophobicContact CG-CE2 4.14Å; F132-F136 AromaticContact CZ-CE2 3.48Å; F132-F136 HydrophobicContact CZ-CE2 3.48Å; F132-F136 VanDerWaalsContact CZ-CE2 3.48Å; F132-F136 AromaticContact CZ-CZ 3.56Å; F132-F136 HydrophobicContact CZ-CZ 3.56Å; F132-F136 WeakPolarHBondContact O-CD2 3.49Å; F132-F136 WeakPolarHBondContact O-CE2 3.32Å |
| 133 | V | 95.2 | Very high | 88.7 | Confident | 77 Ų | 77 | 76.1 Ų | 76.1 | 47% | 0.467 | 40% | 0.401 | S | S | . | . | H | α-helix | trans | -58.4 | -46.1 | 175.8 | 174.4 | 0 | 0 | 0 | 0 | 111.1 | I129 S135 F136 | I129-V133 HydrophobicContact CG2-CG2 4.3Å; I129-V133 WeakPolarHBondContact O-CG2 3.3Å; I129-V133 PolarHBondContact O-N 3.11Å; V133-S135 PolarHBondContact O-N 3.4Å; V133-F136 PolarHBondContact O-N 3.41Å; V133-F136 VanDerWaalsContact O-N 3.12Å |
| 134 | S | 92.8 | Very high | 86.8 | Confident | 18 Ų | 18 | 77 Ų | 77 | 13% | 0.126 | 41% | 0.413 | C | S | . | . | H | α-helix | trans | -65.4 | -25.4 | -179.9 | -54.4 | 0 | 0 | 0 | 0 | 112.7 | K22 F25 F130 C131 F132 F136 L137 | K22-S134 WeakPolarHBondContact CE-O 3.36Å; F25-S134 WeakPolarHBondContact CE1-OG 3.23Å; F130-S134 WeakPolarHBondContact O-CB 3.43Å; F130-S134 PolarHBondContact O-N 3.15Å; F130-S134 PolarHBondContact O-OG 3.35Å; C131-S134 PolarHBondContact O-N 2.87Å; F132-S134 VanDerWaalsContact C-N 3.34Å; F132-S134 PolarHBondContact O-N 3.43Å; S134-F136 PolarHBondContact O-N 2.85Å; S134-L137 WeakPolarHBondContact O-CB 3.43Å; S134-L137 PolarHBondContact O-N 3.47Å; S134-L137 VanDerWaalsContact O-N 3.16Å |
| 135 | S | 91.4 | Very high | 84.7 | Confident | 49 Ų | 49 | 80.5 Ų | 80.5 | 34% | 0.343 | 43% | 0.434 | S | S | . | . | H | α-helix | trans | -66.5 | -21.1 | 176.2 | 82.2 | 0 | 0 | 0 | 0 | 113.3 | K22 C131 F132 V133 | K22-S135 VanDerWaalsContact CE-O 3.25Å; K22-S135 WeakPolarHBondContact CE-O 3.5Å; K22-S135 PolarHBondContact NZ-O 3.08Å; C131-S135 PolarHBondContact O-N 2.89Å; F132-S135 WeakPolarHBondContact O-CB 3.44Å; F132-S135 PolarHBondContact O-N 2.65Å; F132-S135 VanDerWaalsContact O-N 3.14Å; F132-S135 PolarHBondContact O-OG 2.95Å; V133-S135 PolarHBondContact O-N 3.4Å |
| 136 | F | 92.1 | Very high | 82.5 | Confident | 146 Ų | 146 | 85.4 Ų | 85.4 | 64% | 0.64 | 45% | 0.452 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -87.5 | -13.7 | 174.6 | -64.2 | -78.7 | 0 | 0 | 0 | 113.6 | F132 V133 S134 | F132-F136 AromaticContact CD1-CE2 3.78Å; F132-F136 HydrophobicContact CD1-CE2 3.78Å; F132-F136 HydrophobicContact CD2-CE2 4.16Å; F132-F136 AromaticContact CE1-CE2 3.45Å; F132-F136 HydrophobicContact CE1-CE2 3.45Å; F132-F136 VanDerWaalsContact CE1-CE2 3.45Å; F132-F136 AromaticContact CE1-CZ 3.96Å; F132-F136 HydrophobicContact CE1-CZ 3.96Å; F132-F136 AromaticContact CE2-CE2 3.85Å; F132-F136 HydrophobicContact CE2-CE2 3.85Å; F132-F136 AromaticContact CE2-CZ 3.96Å; F132-F136 HydrophobicContact CE2-CZ 3.96Å; F132-F136 HydrophobicContact CG-CE2 4.14Å; F132-F136 AromaticContact CZ-CE2 3.48Å; F132-F136 HydrophobicContact CZ-CE2 3.48Å; F132-F136 VanDerWaalsContact CZ-CE2 3.48Å; F132-F136 AromaticContact CZ-CZ 3.56Å; F132-F136 HydrophobicContact CZ-CZ 3.56Å; F132-F136 WeakPolarHBondContact O-CD2 3.49Å; F132-F136 WeakPolarHBondContact O-CE2 3.32Å; V133-F136 PolarHBondContact O-N 3.41Å; V133-F136 VanDerWaalsContact O-N 3.12Å; S134-F136 PolarHBondContact O-N 2.85Å |
| 137 | L | 90 | Very high | 80.4 | Confident | 108 Ų | 108 | 87.4 Ų | 87.4 | 57% | 0.565 | 47% | 0.468 | S | S | * | . | S | Bend | trans | -71.6 | 146.1 | 178.5 | -61.9 | 178 | 0 | 0 | 0 | 111.1 | K22 S134 A139 | K22-L137 VanDerWaalsContact CE-O 3.25Å; K22-L137 WeakPolarHBondContact CE-O 3.49Å; K22-L137 PolarHBondContact NZ-O 3.25Å; S134-L137 WeakPolarHBondContact O-CB 3.43Å; S134-L137 PolarHBondContact O-N 3.47Å; S134-L137 VanDerWaalsContact O-N 3.16Å; L137-A139 PolarHBondContact O-N 3.37Å |
| 138 | K | 85 | Confident | 78.2 | Confident | 202 Ų | 202 | 88 Ų | 88 | 88% | 0.878 | 48% | 0.478 | S | S | * | . | P | Polyproline II helix | trans | -63.3 | 132.7 | 177.7 | -170.4 | 174.1 | 178.1 | 179.5 | 0 | 109.7 | L140 | K138-L140 PolarHBondContact O-N 2.92Š|
| 139 | A | 81.2 | Confident | 75.9 | Confident | 56 Ų | 56 | 92.8 Ų | 92.8 | 46% | 0.463 | 51% | 0.509 | S | S | . | . | P | Polyproline II helix | trans | -63.8 | 135.6 | 171.7 | 0 | 0 | 0 | 0 | 0 | 109.2 | K22 L137 S141 | K22-A139 HydrophobicContact CB-CB 4.33Å; K22-A139 HydrophobicContact CD-CB 4Å; L137-A139 PolarHBondContact O-N 3.37Å; A139-S141 PolarHBondContact O-N 3.27Å |
| 140 | L | 78.1 | Confident | 74.2 | Confident | 38 Ų | 38 | 93.2 Ų | 93.2 | 20% | 0.199 | 51% | 0.509 | C | S | . | . | P | Polyproline II helix | trans | -59.2 | 131.6 | 173.5 | -171.8 | 68.3 | 0 | 0 | 0 | 108.7 | F79 K138 T142 F292 | F79-L140 HydrophobicContact CD1-CD1 4.46Å; F79-L140 HydrophobicContact CD1-CD2 3.39Å; F79-L140 HydrophobicContact CD1-CG 4.26Å; F79-L140 HydrophobicContact CE1-CD2 3.86Å; F79-L140 HydrophobicContact CE1-CG 4.33Å; F79-L140 HydrophobicContact CG-CD2 4.39Å; K138-L140 PolarHBondContact O-N 2.92Å; L140-T142 VanDerWaalsContact C-N 3.26Å; L140-T142 PolarHBondContact O-N 2.88Å; L140-F292 HydrophobicContact CD2-CD2 3.76Å; L140-F292 HydrophobicContact CD2-CE2 3.79Å |
| 141 | S | 66.4 | Low | 73 | Confident | 101 Ų | 101 | 89.8 Ų | 89.8 | 71% | 0.706 | 50% | 0.5 | S | S | * | . | trans | -70.2 | 89.8 | 172.4 | 60.6 | 0 | 0 | 0 | 0 | 108.4 | A139 N143 | A139-S141 PolarHBondContact O-N 3.27Å; S141-N143 PolarHBondContact O-N 3.48Å | ||
| 142 | T | 66.6 | Low | 72 | Confident | 35 Ų | 35 | 89 Ų | 89 | 22% | 0.215 | 50% | 0.495 | C | S | . | . | trans | -72.8 | 115.4 | 172.4 | 54.5 | 0 | 0 | 0 | 0 | 107.2 | L140 V144 F292 | L140-T142 VanDerWaalsContact C-N 3.26Å; L140-T142 PolarHBondContact O-N 2.88Å; T142-V144 PolarHBondContact O-N 2.95Å; T142-F292 HydrophobicContact CG2-CB 4.26Å; T142-F292 HydrophobicContact CG2-CD1 3.54Å; T142-F292 HydrophobicContact CG2-CD2 4.19Å; T142-F292 HydrophobicContact CG2-CE1 3.93Å; T142-F292 HydrophobicContact CG2-CG 3.7Å; T142-F292 HydrophobicContact CG2-CZ 4.42Å | ||
| 143 | N | 56.4 | Low | 71.4 | Confident | 120 Ų | 120 | 87.6 Ų | 87.6 | 64% | 0.642 | 49% | 0.486 | S | S | * | . | trans | -57.7 | 108.9 | 162.7 | -70.7 | -27.1 | 0 | 0 | 0 | 105.8 | S141 V145 | S141-N143 PolarHBondContact O-N 3.48Å; N143-V145 HydrophobicContact CB-CG2 4.31Å; N143-V145 PolarHBondContact O-N 3.13Å | ||
| 144 | V | 55.4 | Low | 71 | Confident | 100 Ų | 100 | 89.4 Ų | 89.4 | 61% | 0.606 | 49% | 0.487 | S | S | * | . | trans | -70.4 | 80.4 | 172.3 | -176.4 | 0 | 0 | 0 | 0 | 105.4 | T142 H146 | T142-V144 PolarHBondContact O-N 2.95Å; V144-H146 PolarHBondContact O-N 3.33Å; V144-H146 VanDerWaalsContact O-N 3.11Å | ||
| 145 | V | 53.5 | Low | 70.8 | Confident | 74 Ų | 74 | 88.5 Ų | 88.5 | 45% | 0.448 | 48% | 0.481 | S | S | . | . | trans | -69.1 | 110.2 | 167.1 | -178.3 | 0 | 0 | 0 | 0 | 104.5 | N143 T147 | N143-V145 HydrophobicContact CB-CG2 4.31Å; N143-V145 PolarHBondContact O-N 3.13Å; V145-T147 PolarHBondContact O-N 3.15Å | ||
| 146 | H | 51.7 | Low | 70.7 | Confident | 167 Ų | 167 | 88.6 Ų | 88.6 | 77% | 0.773 | 48% | 0.478 | S | S | * | . | trans | -49.3 | 109.9 | 169.5 | -81.5 | -79.5 | 0 | 0 | 0 | 107.9 | V144 | V144-H146 PolarHBondContact O-N 3.33Å; V144-H146 VanDerWaalsContact O-N 3.11Å | ||
| 147 | T | 51.5 | Low | 70.5 | Confident | 104 Ų | 104 | 88.8 Ų | 88.8 | 64% | 0.638 | 48% | 0.484 | S | S | * | . | trans | 17.6 | 109.4 | 166.4 | 50.6 | 0 | 0 | 0 | 0 | 115.2 | V145 T149 | V145-T147 PolarHBondContact O-N 3.15Å; T147-T149 PolarHBondContact O-N 3.11Å; T147-T149 VanDerWaalsContact O-N 3.11Å | ||
| 148 | A | 51.5 | Low | 70.6 | Confident | 49 Ų | 49 | 88.2 Ų | 88.2 | 41% | 0.405 | 48% | 0.477 | S | S | . | . | trans | -47.5 | 125.1 | 158.2 | 0 | 0 | 0 | 0 | 0 | 108.2 | E150 | A148-E150 PolarHBondContact O-N 3.04Å; A148-E150 VanDerWaalsContact O-N 3.13Å | ||
| 149 | T | 50.4 | Low | 71 | Confident | 148 Ų | 148 | 85.1 Ų | 85.1 | 91% | 0.908 | 47% | 0.469 | S | S | * | . | S | Bend | trans | -62.4 | -17.7 | -176.4 | 43.4 | 0 | 0 | 0 | 0 | 112.4 | T147 | T147-T149 PolarHBondContact O-N 3.11Å; T147-T149 VanDerWaalsContact O-N 3.11Å |
| 150 | E | 61.1 | Low | 71.6 | Confident | 100 Ų | 100 | 85.6 Ų | 85.6 | 47% | 0.467 | 46% | 0.464 | S | S | . | . | S | Bend | trans | -87.1 | 135.5 | 175.7 | -60 | -149.1 | 142 | 0 | 0 | 112.4 | A148 A152 | A148-E150 PolarHBondContact O-N 3.04Å; A148-E150 VanDerWaalsContact O-N 3.13Å; E150-A152 PolarHBondContact O-N 3.46Å; E150-A152 VanDerWaalsContact O-N 3.12Å |
| 151 | S | 70.5 | Confident | 72.3 | Confident | 43 Ų | 43 | 83.8 Ų | 83.8 | 30% | 0.301 | 46% | 0.455 | S | S | . | . | trans | -55.6 | 120.1 | 170.6 | 174.3 | 0 | 0 | 0 | 0 | 109.4 | W153 K154 | S151-W153 PolarHBondContact O-N 3.33Å; S151-W153 PolarHBondContact OG-N 3.06Å; S151-K154 WeakPolarHBondContact O-CB 3.16Å; S151-K154 PolarHBondContact O-N 3.12Å | ||
| 152 | A | 76 | Confident | 73.7 | Confident | 3 Ų | 3 | 84.4 Ų | 84.4 | 3% | 0.025 | 45% | 0.445 | C | S | . | . | G | 310 helix | trans | -46.7 | -28.4 | 174.1 | 0 | 0 | 0 | 0 | 0 | 113.6 | R14 E150 V155 L297 | R14-A152 HydrophobicContact CG-CB 4.28Å; E150-A152 PolarHBondContact O-N 3.46Å; E150-A152 VanDerWaalsContact O-N 3.12Å; A152-V155 WeakPolarHBondContact O-CB 3.2Å; A152-V155 WeakPolarHBondContact O-CG1 3.35Å; A152-V155 PolarHBondContact O-N 3.06Å; A152-L297 HydrophobicContact CB-CD1 3.88Å; A152-L297 HydrophobicContact CB-CD2 3.51Å; A152-L297 HydrophobicContact CB-CG 4.37Å |
| 153 | W | 83.4 | Confident | 75 | Confident | 102 Ų | 102 | 85.7 Ų | 85.7 | 39% | 0.386 | 45% | 0.448 | S | S | . | . | G | 310 helix | trans | -73 | -24.4 | 178.1 | -56.8 | 112.9 | 0 | 0 | 0 | 113.9 | P10 L11 S151 V155 L156 F301 | P10-W153 HydrophobicContact CB-CH2 3.64Å; P10-W153 HydrophobicContact CB-CZ3 3.85Å; L11-W153 HydrophobicContact CD2-CH2 4.45Å; L11-W153 HydrophobicContact CD2-CZ2 3.92Å; S151-W153 PolarHBondContact O-N 3.33Å; S151-W153 PolarHBondContact OG-N 3.06Å; W153-V155 PolarHBondContact O-N 3.05Å; W153-L156 HydrophobicContact CE3-CD1 3.77Å; W153-L156 HydrophobicContact CZ3-CD1 4.23Å; W153-L156 WeakPolarHBondContact O-CB 3.47Å; W153-L156 PolarHBondContact O-N 2.9Å; W153-F301 AromaticContact CE3-CE1 3.95Å; W153-F301 HydrophobicContact CE3-CE1 3.95Å; W153-F301 HydrophobicContact CE3-CZ 4.3Å; W153-F301 AromaticContact CZ3-CE1 3.86Å; W153-F301 HydrophobicContact CZ3-CE1 3.86Å |
| 154 | K | 86.1 | Confident | 76.8 | Confident | 114 Ų | 114 | 80 Ų | 80 | 50% | 0.496 | 42% | 0.418 | S | S | . | . | G | 310 helix | trans | -64.2 | -25.4 | 175.2 | -72.6 | -179.6 | 176.4 | -175 | 0 | 111.9 | S151 L156 L157 | S151-K154 WeakPolarHBondContact O-CB 3.16Å; S151-K154 PolarHBondContact O-N 3.12Å; K154-L156 PolarHBondContact O-N 3.07Å; K154-L157 WeakPolarHBondContact O-CB 2.98Å; K154-L157 PolarHBondContact O-N 3.14Å; K154-L157 VanDerWaalsContact O-N 3.1Å |
| 155 | V | 87.7 | Confident | 78.7 | Confident | 0 Ų | 0 | 76.2 Ų | 76.2 | 0% | 0 | 39% | 0.394 | C | S | . | . | G | 310 helix | trans | -62.8 | -30.1 | 177.3 | 91.2 | 0 | 0 | 0 | 0 | 111.9 | A152 W153 L157 K158 V161 M283 Y288 F301 | A152-V155 WeakPolarHBondContact O-CB 3.2Å; A152-V155 WeakPolarHBondContact O-CG1 3.35Å; A152-V155 PolarHBondContact O-N 3.06Å; W153-V155 PolarHBondContact O-N 3.05Å; V155-L157 PolarHBondContact O-N 3.37Å; V155-K158 VanDerWaalsContact O-CB 3.3Å; V155-K158 WeakPolarHBondContact O-CB 3.49Å; V155-K158 WeakPolarHBondContact O-CG 3.19Å; V155-K158 PolarHBondContact O-N 3.24Å; V155-K158 VanDerWaalsContact O-N 3.1Å; V155-V161 HydrophobicContact CG1-CG1 4.44Å; V155-V161 HydrophobicContact CG2-CG2 4.3Å; V155-M283 HydrophobicContact CG1-CE 4.46Å; V155-M283 HydrophobicContact CG2-CE 4.15Å; V155-M283 HydrophobicContact CG2-CG 3.83Å; V155-M283 HydrophobicContact CG2-SD 4.49Å; V155-Y288 HydrophobicContact CB-CE2 4.45Å; V155-Y288 HydrophobicContact CG2-CD2 4.44Å; V155-Y288 HydrophobicContact CG2-CE1 4.43Å; V155-Y288 HydrophobicContact CG2-CE2 3.71Å; V155-F301 HydrophobicContact CG1-CD2 4.06Å; V155-F301 HydrophobicContact CG1-CE2 3.41Å; V155-F301 VanDerWaalsContact CG1-CE2 3.41Å; V155-F301 HydrophobicContact CG1-CZ 4.1Å |
| 156 | L | 89.5 | Confident | 80.7 | Confident | 51 Ų | 51 | 76.1 Ų | 76.1 | 27% | 0.267 | 39% | 0.387 | S | S | . | . | G | 310 helix | trans | -68.5 | -19.6 | 177.3 | -63.8 | 179.4 | 0 | 0 | 0 | 113.2 | W153 K154 K158 L165 F301 | W153-L156 HydrophobicContact CE3-CD1 3.77Å; W153-L156 HydrophobicContact CZ3-CD1 4.23Å; W153-L156 WeakPolarHBondContact O-CB 3.47Å; W153-L156 PolarHBondContact O-N 2.9Å; K154-L156 PolarHBondContact O-N 3.07Å; L156-K158 VanDerWaalsContact C-N 3.25Å; L156-L165 HydrophobicContact CD2-CD1 3.35Å; L156-F301 HydrophobicContact CD1-CD1 4.23Å; L156-F301 HydrophobicContact CD1-CE1 3.7Å; L156-F301 HydrophobicContact CD1-CZ 4.21Å; L156-F301 HydrophobicContact CD2-CD1 3.66Å; L156-F301 HydrophobicContact CD2-CD2 4.16Å; L156-F301 HydrophobicContact CD2-CE1 3.76Å; L156-F301 HydrophobicContact CD2-CE2 4.26Å; L156-F301 HydrophobicContact CD2-CG 3.87Å; L156-F301 HydrophobicContact CD2-CZ 4.06Å; L156-F301 HydrophobicContact CG-CD1 4.26Å; L156-F301 HydrophobicContact CG-CE1 3.84Å; L156-F301 HydrophobicContact CG-CE2 4.49Å; L156-F301 HydrophobicContact CG-CZ 3.97Å |
| 157 | L | 89.3 | Confident | 82.8 | Confident | 149 Ų | 149 | 68.1 Ų | 68.1 | 78% | 0.78 | 35% | 0.351 | S | S | * | . | G | 310 helix | trans | -80 | -9.3 | 175.2 | -60.6 | 174 | 0 | 0 | 0 | 112.2 | K154 V155 L159 | K154-L157 WeakPolarHBondContact O-CB 2.98Å; K154-L157 PolarHBondContact O-N 3.14Å; K154-L157 VanDerWaalsContact O-N 3.1Å; V155-L157 PolarHBondContact O-N 3.37Å; L157-L159 PolarHBondContact O-N 3.47Å |
| 158 | K | 91.8 | Very high | 84.9 | Confident | 97 Ų | 97 | 63.2 Ų | 63.2 | 42% | 0.422 | 32% | 0.32 | S | S | . | . | S | Bend | trans | -75.5 | 123.1 | 174.2 | -59.4 | -64.9 | -174.5 | 176.5 | 0 | 108.6 | V155 L156 D160 V161 F162 | V155-K158 VanDerWaalsContact O-CB 3.3Å; V155-K158 WeakPolarHBondContact O-CB 3.49Å; V155-K158 WeakPolarHBondContact O-CG 3.19Å; V155-K158 PolarHBondContact O-N 3.24Å; V155-K158 VanDerWaalsContact O-N 3.1Å; L156-K158 VanDerWaalsContact C-N 3.25Å; K158-D160 VanDerWaalsContact C-N 3.26Å; K158-D160 PolarHBondContact O-N 3.04Å; K158-V161 HydrophobicContact CB-CB 4.3Å; K158-V161 HydrophobicContact CB-CG2 4.16Å; K158-V161 PolarHBondContact O-N 2.7Å; K158-F162 PolarHBondContact O-N 3.21Å |
| 159 | L | 93.3 | Very high | 87 | Confident | 136 Ų | 136 | 62.4 Ų | 62.4 | 71% | 0.712 | 31% | 0.308 | S | S | * | . | H | α-helix | trans | -54 | -42.9 | -175.5 | -173.6 | 62.5 | 0 | 0 | 0 | 112.1 | L157 V161 F162 F163 | L157-L159 PolarHBondContact O-N 3.47Å; L159-V161 PolarHBondContact O-N 3.34Å; L159-F162 PolarHBondContact O-N 2.71Å; L159-F163 VanDerWaalsContact O-CB 3.24Å; L159-F163 WeakPolarHBondContact O-CB 3.27Å; L159-F163 PolarHBondContact O-N 3.03Å |
| 160 | D | 93.3 | Very high | 89.1 | Confident | 67 Ų | 67 | 56.1 Ų | 56.1 | 36% | 0.358 | 27% | 0.268 | S | S | . | . | H | α-helix | trans | -61.8 | -42.1 | 178.9 | -63.7 | 9.3 | 0 | 0 | 0 | 112.8 | K158 A164 F278 S282 | K158-D160 VanDerWaalsContact C-N 3.26Å; K158-D160 PolarHBondContact O-N 3.04Å; D160-A164 WeakPolarHBondContact O-CB 3.35Å; D160-A164 PolarHBondContact O-N 3.02Å; D160-F278 HydrophobicContact CB-CE1 3.92Å; D160-F278 HydrophobicContact CB-CZ 3.9Å; D160-F278 VanDerWaalsContact O-CE1 3.26Å; D160-F278 WeakPolarHBondContact O-CE1 3.32Å; D160-S282 WeakPolarHBondContact CB-OG 3.45Å |
| 161 | V | 93.3 | Very high | 90.7 | Very high | 0 Ų | 0 | 51.3 Ų | 51.3 | 0% | 0 | 25% | 0.246 | C | C | . | . | H | α-helix | trans | -72.1 | -44.4 | 179.9 | 176 | 0 | 0 | 0 | 0 | 109.8 | V155 K158 L159 F163 A164 L165 M283 | V155-V161 HydrophobicContact CG1-CG1 4.44Å; V155-V161 HydrophobicContact CG2-CG2 4.3Å; K158-V161 HydrophobicContact CB-CB 4.3Å; K158-V161 HydrophobicContact CB-CG2 4.16Å; K158-V161 PolarHBondContact O-N 2.7Å; L159-V161 PolarHBondContact O-N 3.34Å; V161-F163 VanDerWaalsContact C-N 3.32Å; V161-F163 PolarHBondContact O-N 3.41Å; V161-A164 WeakPolarHBondContact O-CB 3.27Å; V161-A164 PolarHBondContact O-N 3.48Å; V161-L165 HydrophobicContact CG1-CD1 3.91Å; V161-L165 HydrophobicContact CG1-CG 4.4Å; V161-L165 VanDerWaalsContact O-CG 3.24Å; V161-L165 WeakPolarHBondContact O-CG 3.5Å; V161-L165 PolarHBondContact O-N 2.99Å; V161-M283 HydrophobicContact CG2-CG 4.02Å |
| 162 | F | 94.7 | Very high | 91.8 | Very high | 113 Ų | 113 | 50.3 Ų | 50.3 | 50% | 0.496 | 24% | 0.237 | S | C | . | . | H | α-helix | trans | -57.1 | -46.8 | 173.8 | -179.8 | -94.2 | 0 | 0 | 0 | 111.3 | K158 L159 A164 L165 F166 | K158-F162 PolarHBondContact O-N 3.21Å; L159-F162 PolarHBondContact O-N 2.71Å; F162-A164 PolarHBondContact O-N 3.01Å; F162-L165 PolarHBondContact O-N 3.1Å; F162-F166 HydrophobicContact CE1-CB 4.23Å; F162-F166 HydrophobicContact CE1-CG 4.42Å; F162-F166 HydrophobicContact CZ-CD2 4.32Å; F162-F166 VanDerWaalsContact O-CB 3.23Å; F162-F166 WeakPolarHBondContact O-CB 3.18Å; F162-F166 PolarHBondContact O-N 3.41Å |
| 163 | F | 94.6 | Very high | 92.7 | Very high | 63 Ų | 63 | 50.9 Ų | 50.9 | 28% | 0.276 | 24% | 0.24 | S | C | . | . | H | α-helix | trans | -62.1 | -41.4 | 178.5 | -178.8 | -102.3 | 0 | 0 | 0 | 112.3 | L159 V161 L165 S167 L225 M228 F278 L340 | L159-F163 VanDerWaalsContact O-CB 3.24Å; L159-F163 WeakPolarHBondContact O-CB 3.27Å; L159-F163 PolarHBondContact O-N 3.03Å; V161-F163 VanDerWaalsContact C-N 3.32Å; V161-F163 PolarHBondContact O-N 3.41Å; F163-L165 PolarHBondContact O-N 3.25Å; F163-S167 WeakPolarHBondContact O-CB 3.24Å; F163-S167 PolarHBondContact O-N 3.46Å; F163-S167 PolarHBondContact O-OG 3.47Å; F163-L225 HydrophobicContact CE1-CD2 4.11Å; F163-M228 HydrophobicContact CD1-SD 4.37Å; F163-M228 HydrophobicContact CE1-SD 3.64Å; F163-M228 HydrophobicContact CZ-SD 4.34Å; F163-F278 HydrophobicContact CD1-CD1 4.37Å; F163-F278 AromaticContact CD1-CE1 3.99Å; F163-F278 HydrophobicContact CD1-CE1 3.99Å; F163-L340 HydrophobicContact CE2-CD2 4.19Å |
| 164 | A | 94.9 | Very high | 93.1 | Very high | 1 Ų | 1 | 46 Ų | 46 | 1% | 0.008 | 22% | 0.221 | C | C | . | . | H | α-helix | trans | -60.1 | -45.1 | 174.9 | 0 | 0 | 0 | 0 | 0 | 112.1 | D160 V161 F162 S167 V168 S275 F278 C279 | D160-A164 WeakPolarHBondContact O-CB 3.35Å; D160-A164 PolarHBondContact O-N 3.02Å; V161-A164 WeakPolarHBondContact O-CB 3.27Å; V161-A164 PolarHBondContact O-N 3.48Å; F162-A164 PolarHBondContact O-N 3.01Å; A164-S167 WeakPolarHBondContact O-CB 3.23Å; A164-S167 PolarHBondContact O-N 2.99Å; A164-V168 PolarHBondContact O-N 3.03Å; A164-S275 WeakPolarHBondContact O-CB 3.03Å; A164-F278 HydrophobicContact CB-CB 4.45Å; A164-F278 HydrophobicContact CB-CD1 3.8Å; A164-C279 HydrophobicContact CB-CB 3.7Å |
| 165 | L | 95.4 | Very high | 93.4 | Very high | 20 Ų | 20 | 42.1 Ų | 42.1 | 11% | 0.105 | 21% | 0.207 | C | C | . | . | H | α-helix | trans | -74.7 | -39.4 | -177.5 | -64.9 | 174.8 | 0 | 0 | 0 | 112.4 | L156 V161 F162 F163 S167 V168 F169 F301 | L156-L165 HydrophobicContact CD2-CD1 3.35Å; V161-L165 HydrophobicContact CG1-CD1 3.91Å; V161-L165 HydrophobicContact CG1-CG 4.4Å; V161-L165 VanDerWaalsContact O-CG 3.24Å; V161-L165 WeakPolarHBondContact O-CG 3.5Å; V161-L165 PolarHBondContact O-N 2.99Å; F162-L165 PolarHBondContact O-N 3.1Å; F163-L165 PolarHBondContact O-N 3.25Å; L165-S167 PolarHBondContact O-N 3.44Å; L165-V168 VanDerWaalsContact O-CG1 3.24Å; L165-V168 WeakPolarHBondContact O-CG1 3.22Å; L165-F169 VanDerWaalsContact O-CB 3.31Å; L165-F169 WeakPolarHBondContact O-CB 3.43Å; L165-F169 PolarHBondContact O-N 3.05Å; L165-F301 HydrophobicContact CD1-CB 3.72Å; L165-F301 HydrophobicContact CD1-CG 4.29Å; L165-F301 VanDerWaalsContact CD2-C 3.44Å; L165-F301 HydrophobicContact CD2-CB 3.71Å; L165-F301 WeakPolarHBondContact CD2-O 3.48Å; L165-F301 HydrophobicContact CG-CB 4.36Å |
| 166 | F | 95.3 | Very high | 93.6 | Very high | 71 Ų | 71 | 42.3 Ų | 42.3 | 31% | 0.311 | 21% | 0.208 | S | C | . | . | H | α-helix | trans | -61.9 | -35.2 | 171.4 | -169.7 | -103.6 | 0 | 0 | 0 | 110.3 | F162 F169 M170 L340 | F162-F166 HydrophobicContact CE1-CB 4.23Å; F162-F166 HydrophobicContact CE1-CG 4.42Å; F162-F166 HydrophobicContact CZ-CD2 4.32Å; F162-F166 VanDerWaalsContact O-CB 3.23Å; F162-F166 WeakPolarHBondContact O-CB 3.18Å; F162-F166 PolarHBondContact O-N 3.41Å; F166-F169 AromaticContact CD2-CD1 3.86Å; F166-F169 HydrophobicContact CD2-CD1 3.86Å; F166-F169 HydrophobicContact CD2-CE1 4.38Å; F166-F169 AromaticContact CE2-CD1 3.82Å; F166-F169 HydrophobicContact CE2-CD1 3.82Å; F166-F169 AromaticContact CE2-CE1 3.9Å; F166-F169 HydrophobicContact CE2-CE1 3.9Å; F166-F169 WeakPolarHBondContact O-CB 3.38Å; F166-F169 PolarHBondContact O-N 2.88Å; F166-M170 HydrophobicContact CD1-CG 3.88Å; F166-M170 HydrophobicContact CE1-CG 3.45Å; F166-M170 VanDerWaalsContact CE1-CG 3.45Å; F166-M170 HydrophobicContact CE1-SD 4.13Å; F166-M170 HydrophobicContact CE2-CG 4.25Å; F166-M170 HydrophobicContact CE2-SD 4.39Å; F166-M170 HydrophobicContact CG-CG 4.44Å; F166-M170 HydrophobicContact CZ-CG 3.66Å; F166-M170 HydrophobicContact CZ-SD 3.78Å; F166-M170 WeakPolarHBondContact O-CB 3.35Å; F166-M170 WeakPolarHBondContact O-CG 3.47Å; F166-M170 PolarHBondContact O-N 2.96Å; F166-L340 HydrophobicContact CD1-CD1 4.41Å; F166-L340 HydrophobicContact CD1-CD2 3.91Å; F166-L340 HydrophobicContact CE1-CD1 4.06Å; F166-L340 HydrophobicContact CE1-CD2 3.85Å |
| 167 | S | 95 | Very high | 93.7 | Very high | 0 Ų | 0 | 40 Ų | 40 | 0% | 0 | 20% | 0.196 | C | C | . | . | H | α-helix | trans | -65.2 | -50.7 | 179.9 | -77.1 | 0 | 0 | 0 | 0 | 113.5 | F163 A164 L165 F169 M170 G171 Y232 | F163-S167 WeakPolarHBondContact O-CB 3.24Å; F163-S167 PolarHBondContact O-N 3.46Å; F163-S167 PolarHBondContact O-OG 3.47Å; A164-S167 WeakPolarHBondContact O-CB 3.23Å; A164-S167 PolarHBondContact O-N 2.99Å; L165-S167 PolarHBondContact O-N 3.44Å; S167-F169 VanDerWaalsContact C-N 3.29Å; S167-F169 PolarHBondContact O-N 3.47Å; S167-M170 PolarHBondContact O-N 3.36Å; S167-G171 PolarHBondContact O-N 2.82Å; S167-Y232 WeakPolarHBondContact CA-OH 3.45Å; S167-Y232 WeakPolarHBondContact CB-OH 3.46Å; S167-Y232 PolarHBondContact O-OH 2.68Å; S167-Y232 VanDerWaalsContact O-OH 3.1Å; S167-Y232 PolarHBondContact OG-OH 3.15Å |
| 168 | V | 95.1 | Very high | 93.8 | Very high | 0 Ų | 0 | 33.1 Ų | 33.1 | 0% | 0 | 16% | 0.16 | C | C | . | . | H | α-helix | trans | -63.8 | -37.1 | 174.6 | 68 | 0 | 0 | 0 | 0 | 111.5 | A164 L165 M170 G171 L172 S275 Y302 I306 | A164-V168 PolarHBondContact O-N 3.03Å; L165-V168 VanDerWaalsContact O-CG1 3.24Å; L165-V168 WeakPolarHBondContact O-CG1 3.22Å; V168-M170 PolarHBondContact O-N 2.94Å; V168-G171 PolarHBondContact O-N 2.9Å; V168-L172 HydrophobicContact CG2-CD2 3.7Å; V168-L172 WeakPolarHBondContact O-CB 3.44Å; V168-L172 VanDerWaalsContact O-CD2 3.32Å; V168-L172 WeakPolarHBondContact O-CD2 3.19Å; V168-L172 PolarHBondContact O-N 3.22Å; V168-S275 PolarHBondContact N-OG 3.21Å; V168-Y302 HydrophobicContact CB-CD2 4.48Å; V168-Y302 HydrophobicContact CB-CE2 4.29Å; V168-Y302 HydrophobicContact CG1-CD2 4.23Å; V168-Y302 HydrophobicContact CG2-CD2 4.29Å; V168-Y302 HydrophobicContact CG2-CE2 3.81Å; V168-I306 HydrophobicContact CG2-CD1 4.21Å; V168-I306 HydrophobicContact CG2-CG1 3.38Å |
| 169 | F | 96.2 | Very high | 93.5 | Very high | 33 Ų | 33 | 32.9 Ų | 32.9 | 15% | 0.145 | 16% | 0.16 | C | C | . | . | H | α-helix | trans | -57.4 | -47.2 | 173.9 | 159.9 | -101.6 | 0 | 0 | 0 | 112.1 | L165 F166 S167 L172 T173 L308 G309 V312 | L165-F169 VanDerWaalsContact O-CB 3.31Å; L165-F169 WeakPolarHBondContact O-CB 3.43Å; L165-F169 PolarHBondContact O-N 3.05Å; F166-F169 AromaticContact CD2-CD1 3.86Å; F166-F169 HydrophobicContact CD2-CD1 3.86Å; F166-F169 HydrophobicContact CD2-CE1 4.38Å; F166-F169 AromaticContact CE2-CD1 3.82Å; F166-F169 HydrophobicContact CE2-CD1 3.82Å; F166-F169 AromaticContact CE2-CE1 3.9Å; F166-F169 HydrophobicContact CE2-CE1 3.9Å; F166-F169 WeakPolarHBondContact O-CB 3.38Å; F166-F169 PolarHBondContact O-N 2.88Å; S167-F169 VanDerWaalsContact C-N 3.29Å; S167-F169 PolarHBondContact O-N 3.47Å; F169-L172 PolarHBondContact O-N 3.41Å; F169-T173 WeakPolarHBondContact CE2-OG1 3.43Å; F169-T173 WeakPolarHBondContact O-CB 3.33Å; F169-T173 PolarHBondContact O-N 3.44Å; F169-T173 PolarHBondContact O-OG1 3.44Å; F169-L308 HydrophobicContact CD2-CB 3.97Å; F169-L308 HydrophobicContact CD2-CD2 3.84Å; F169-L308 HydrophobicContact CD2-CG 3.71Å; F169-L308 HydrophobicContact CE2-CB 4.43Å; F169-L308 HydrophobicContact CE2-CD2 4.02Å; F169-L308 HydrophobicContact CE2-CG 3.75Å; F169-G309 WeakPolarHBondContact O-CA 3.25Å; F169-V312 HydrophobicContact CE2-CB 4.03Å; F169-V312 HydrophobicContact CE2-CG1 4.35Å; F169-V312 HydrophobicContact CE2-CG2 3.94Å; F169-V312 HydrophobicContact CZ-CB 4.45Å; F169-V312 HydrophobicContact CZ-CG1 4.27Å; F169-V312 HydrophobicContact CZ-CG2 4.45Å |
| 170 | M | 94.7 | Very high | 93.3 | Very high | 15 Ų | 15 | 29.2 Ų | 29.2 | 7% | 0.074 | 15% | 0.145 | C | C | . | . | H | α-helix | trans | -68.9 | -42.1 | -179.7 | -74.8 | -61.8 | -56.2 | 0 | 0 | 112.4 | F166 S167 V168 L172 T173 T174 F336 L340 | F166-M170 HydrophobicContact CD1-CG 3.88Å; F166-M170 HydrophobicContact CE1-CG 3.45Å; F166-M170 VanDerWaalsContact CE1-CG 3.45Å; F166-M170 HydrophobicContact CE1-SD 4.13Å; F166-M170 HydrophobicContact CE2-CG 4.25Å; F166-M170 HydrophobicContact CE2-SD 4.39Å; F166-M170 HydrophobicContact CG-CG 4.44Å; F166-M170 HydrophobicContact CZ-CG 3.66Å; F166-M170 HydrophobicContact CZ-SD 3.78Å; F166-M170 WeakPolarHBondContact O-CB 3.35Å; F166-M170 WeakPolarHBondContact O-CG 3.47Å; F166-M170 PolarHBondContact O-N 2.96Å; S167-M170 PolarHBondContact O-N 3.36Å; V168-M170 PolarHBondContact O-N 2.94Å; M170-L172 PolarHBondContact O-N 3.27Å; M170-T173 PolarHBondContact O-N 3.46Å; M170-T174 WeakPolarHBondContact O-CB 3.31Å; M170-T174 PolarHBondContact O-N 2.88Å; M170-T174 PolarHBondContact O-OG1 3.45Å; M170-F336 HydrophobicContact CE-CB 3.72Å; M170-F336 HydrophobicContact CE-CG 4.26Å; M170-L340 HydrophobicContact CB-CD1 3.78Å; M170-L340 HydrophobicContact CE-CD1 4.35Å; M170-L340 HydrophobicContact CG-CD1 3.66Å |
| 171 | G | 93.8 | Very high | 93.2 | Very high | 0 Ų | 0 | 26.3 Ų | 26.3 | 0% | 0 | 13% | 0.13 | C | C | . | . | H | α-helix | trans | -57.1 | -48.7 | 173.3 | 0 | 0 | 0 | 0 | 0 | 111.8 | S167 V168 T174 V175 Y264 L268 | S167-G171 PolarHBondContact O-N 2.82Å; V168-G171 PolarHBondContact O-N 2.9Å; G171-T174 PolarHBondContact O-N 2.86Å; G171-V175 PolarHBondContact O-N 3.42Å; G171-V175 VanDerWaalsContact O-N 3.17Å; G171-Y264 PolarHBondContact O-OH 3.28Å; G171-L268 WeakPolarHBondContact O-CD1 3.47Å |
| 172 | L | 94.6 | Very high | 93 | Very high | 22 Ų | 22 | 26.3 Ų | 26.3 | 12% | 0.115 | 13% | 0.13 | C | C | . | . | H | α-helix | trans | -71.8 | -34.1 | -179.1 | -86.4 | -65.4 | 0 | 0 | 0 | 113.3 | V168 F169 M170 T174 V175 T176 V272 I306 | V168-L172 HydrophobicContact CG2-CD2 3.7Å; V168-L172 WeakPolarHBondContact O-CB 3.44Å; V168-L172 VanDerWaalsContact O-CD2 3.32Å; V168-L172 WeakPolarHBondContact O-CD2 3.19Å; V168-L172 PolarHBondContact O-N 3.22Å; F169-L172 PolarHBondContact O-N 3.41Å; M170-L172 PolarHBondContact O-N 3.27Å; L172-T174 VanDerWaalsContact C-N 3.28Å; L172-T174 PolarHBondContact O-N 3.19Å; L172-V175 HydrophobicContact CD1-CG1 3.98Å; L172-V175 WeakPolarHBondContact O-CG1 3.01Å; L172-T176 WeakPolarHBondContact O-CB 3.39Å; L172-T176 WeakPolarHBondContact O-CG2 3.21Å; L172-T176 PolarHBondContact O-N 2.82Å; L172-T176 VanDerWaalsContact O-N 3.12Å; L172-T176 PolarHBondContact O-OG1 3.33Å; L172-V272 HydrophobicContact CD2-CG2 3.75Å; L172-I306 HydrophobicContact CD1-CG2 4.2Å; L172-I306 HydrophobicContact CD2-CG1 4.16Å; L172-I306 HydrophobicContact CG-CB 4.25Å; L172-I306 HydrophobicContact CG-CG1 4.2Å; L172-I306 HydrophobicContact CG-CG2 4Å |
| 173 | T | 94.4 | Very high | 92.6 | Very high | 14 Ų | 14 | 23 Ų | 23 | 9% | 0.086 | 12% | 0.123 | C | C | . | . | H | α-helix | trans | -59.9 | -43.7 | 172 | -60.5 | 0 | 0 | 0 | 0 | 110.5 | F169 M170 T176 F177 G309 V312 G313 | F169-T173 WeakPolarHBondContact CE2-OG1 3.43Å; F169-T173 WeakPolarHBondContact O-CB 3.33Å; F169-T173 PolarHBondContact O-N 3.44Å; F169-T173 PolarHBondContact O-OG1 3.44Å; M170-T173 PolarHBondContact O-N 3.46Å; T173-T176 PolarHBondContact O-OG1 3.01Å; T173-F177 VanDerWaalsContact O-CB 3.23Å; T173-F177 WeakPolarHBondContact O-CB 2.89Å; T173-F177 PolarHBondContact O-N 3.27Å; T173-G309 WeakPolarHBondContact CA-O 3.38Å; T173-G309 VanDerWaalsContact OG1-CA 3.27Å; T173-G309 WeakPolarHBondContact OG1-CA 3.49Å; T173-V312 HydrophobicContact CG2-CG1 4.09Å; T173-G313 WeakPolarHBondContact O-CA 3.26Å |
| 174 | T | 92.5 | Very high | 92.3 | Very high | 0 Ų | 0 | 23.9 Ų | 23.9 | 0% | 0 | 14% | 0.137 | C | C | . | . | H | α-helix | trans | -68 | -41.1 | -176.9 | -54.2 | 0 | 0 | 0 | 0 | 112.3 | M170 G171 L172 F177 F178 I239 Y264 N337 | M170-T174 WeakPolarHBondContact O-CB 3.31Å; M170-T174 PolarHBondContact O-N 2.88Å; M170-T174 PolarHBondContact O-OG1 3.45Å; G171-T174 PolarHBondContact O-N 2.86Å; L172-T174 VanDerWaalsContact C-N 3.28Å; L172-T174 PolarHBondContact O-N 3.19Å; T174-F177 WeakPolarHBondContact O-CB 3.23Å; T174-F178 HydrophobicContact CG2-CE2 4.36Å; T174-F178 WeakPolarHBondContact O-CD2 3.35Å; T174-F178 WeakPolarHBondContact O-CE2 3.47Å; T174-I239 HydrophobicContact CG2-CD1 3.4Å; T174-I239 HydrophobicContact CG2-CG1 4.46Å; T174-Y264 WeakPolarHBondContact CB-OH 3.41Å; T174-Y264 HydrophobicContact CG2-CE2 3.59Å; T174-Y264 WeakPolarHBondContact CG2-OH 3.33Å; T174-N337 PolarHBondContact OG1-ND2 3.47Å |
| 175 | V | 91.9 | Very high | 92 | Very high | 33 Ų | 33 | 24.9 Ų | 24.9 | 20% | 0.2 | 14% | 0.141 | C | C | . | . | H | α-helix | trans | -72 | -43.6 | -180 | 64.4 | 0 | 0 | 0 | 0 | 111.1 | G171 L172 F177 F178 Y264 L268 | G171-V175 PolarHBondContact O-N 3.42Å; G171-V175 VanDerWaalsContact O-N 3.17Å; L172-V175 HydrophobicContact CD1-CG1 3.98Å; L172-V175 WeakPolarHBondContact O-CG1 3.01Å; V175-F177 VanDerWaalsContact C-N 3.3Å; V175-F177 PolarHBondContact O-N 2.72Å; V175-F178 WeakPolarHBondContact O-CB 3.33Å; V175-F178 PolarHBondContact O-N 2.93Å; V175-Y264 VanDerWaalsContact CA-OH 3.28Å; V175-Y264 WeakPolarHBondContact CA-OH 3.39Å; V175-Y264 HydrophobicContact CB-CE1 3.84Å; V175-Y264 WeakPolarHBondContact CB-OH 3.41Å; V175-Y264 HydrophobicContact CG2-CE1 3.97Å; V175-Y264 PolarHBondContact N-OH 3.28Å; V175-L268 HydrophobicContact CB-CD2 3.76Å; V175-L268 HydrophobicContact CG1-CD2 4Å; V175-L268 HydrophobicContact CG2-CD2 3.85Å |
| 176 | T | 92.5 | Very high | 91.8 | Very high | 3 Ų | 3 | 24 Ų | 24 | 2% | 0.018 | 14% | 0.137 | C | C | . | . | H | α-helix | trans | -76.2 | -20.5 | -176.6 | 57.8 | 0 | 0 | 0 | 0 | 112.7 | L172 T173 F178 E179 P180 G309 A310 P314 | L172-T176 WeakPolarHBondContact O-CB 3.39Å; L172-T176 WeakPolarHBondContact O-CG2 3.21Å; L172-T176 PolarHBondContact O-N 2.82Å; L172-T176 VanDerWaalsContact O-N 3.12Å; L172-T176 PolarHBondContact O-OG1 3.33Å; T173-T176 PolarHBondContact O-OG1 3.01Å; T176-F178 PolarHBondContact O-N 3.45Å; T176-E179 WeakPolarHBondContact O-CB 3.26Å; T176-E179 PolarHBondContact O-N 3.21Å; T176-P180 VanDerWaalsContact O-CD 3.3Å; T176-P180 WeakPolarHBondContact O-CD 3.37Å; T176-G309 PolarHBondContact OG1-O 3.39Å; T176-A310 HydrophobicContact CG2-CB 3.96Å; T176-P314 WeakPolarHBondContact OG1-CD 3.34Å |
| 177 | F | 91.7 | Very high | 91.5 | Very high | 4 Ų | 4 | 27.6 Ų | 27.6 | 2% | 0.018 | 16% | 0.155 | C | C | . | . | H | α-helix | trans | -52.7 | -40.6 | 165.5 | 163.5 | -97 | 0 | 0 | 0 | 112.2 | T173 T174 V175 E179 P180 T181 G317 V321 F326 T329 T330 L333 | T173-F177 VanDerWaalsContact O-CB 3.23Å; T173-F177 WeakPolarHBondContact O-CB 2.89Å; T173-F177 PolarHBondContact O-N 3.27Å; T174-F177 WeakPolarHBondContact O-CB 3.23Å; V175-F177 VanDerWaalsContact C-N 3.3Å; V175-F177 PolarHBondContact O-N 2.72Å; F177-E179 VanDerWaalsContact C-N 3.3Å; F177-E179 PolarHBondContact O-N 3.43Å; F177-P180 WeakPolarHBondContact O-CD 3.45Å; F177-T181 HydrophobicContact CD2-CG2 4.26Å; F177-T181 HydrophobicContact CE2-CG2 3.79Å; F177-T181 HydrophobicContact CZ-CG2 4.05Å; F177-T181 WeakPolarHBondContact O-CG2 3.43Å; F177-T181 PolarHBondContact O-OG1 3.41Å; F177-G317 VanDerWaalsContact CD2-CA 3.45Å; F177-V321 HydrophobicContact CE2-CG2 3.55Å; F177-V321 HydrophobicContact CZ-CG2 3.6Å; F177-F326 AromaticContact CE1-CE2 3.99Å; F177-F326 HydrophobicContact CE1-CE2 3.99Å; F177-F326 HydrophobicContact CE1-CZ 4.38Å; F177-F326 HydrophobicContact CZ-CD2 4.26Å; F177-F326 HydrophobicContact CZ-CE2 4.18Å; F177-T329 HydrophobicContact CD2-CG2 4.28Å; F177-T329 HydrophobicContact CE2-CG2 3.37Å; F177-T329 HydrophobicContact CZ-CG2 3.58Å; F177-T330 HydrophobicContact CE1-CG2 4.13Å; F177-L333 HydrophobicContact CB-CD1 4.21Å; F177-L333 HydrophobicContact CD1-CD1 3.57Å; F177-L333 HydrophobicContact CD2-CD1 3.96Å; F177-L333 HydrophobicContact CE1-CD1 3.9Å; F177-L333 HydrophobicContact CE2-CD1 4.29Å; F177-L333 HydrophobicContact CG-CD1 3.61Å; F177-L333 HydrophobicContact CZ-CD1 4.26Å |
| 178 | F | 90.3 | Very high | 91.2 | Very high | 4 Ų | 4 | 33 Ų | 33 | 2% | 0.018 | 18% | 0.183 | C | C | . | . | H | α-helix | trans | -71.1 | -23 | -177.6 | -67.9 | -60 | 0 | 0 | 0 | 113.3 | T174 V175 T176 T181 M182 F200 I239 M242 F326 T330 | T174-F178 HydrophobicContact CG2-CE2 4.36Å; T174-F178 WeakPolarHBondContact O-CD2 3.35Å; T174-F178 WeakPolarHBondContact O-CE2 3.47Å; V175-F178 WeakPolarHBondContact O-CB 3.33Å; V175-F178 PolarHBondContact O-N 2.93Å; T176-F178 PolarHBondContact O-N 3.45Å; F178-T181 WeakPolarHBondContact CA-OG1 3.13Å; F178-T181 PolarHBondContact O-N 3.41Å; F178-M182 HydrophobicContact CB-CB 4.43Å; F178-M182 HydrophobicContact CB-CE 4.2Å; F178-M182 HydrophobicContact CD1-CE 3.38Å; F178-M182 HydrophobicContact CE1-CE 3.91Å; F178-M182 HydrophobicContact CG-CE 3.94Å; F178-M182 WeakPolarHBondContact O-CB 3.38Å; F178-M182 PolarHBondContact O-N 2.87Å; F178-F200 HydrophobicContact CB-CE1 4.43Å; F178-I239 HydrophobicContact CE2-CG1 4.39Å; F178-I239 HydrophobicContact CZ-CG1 4.07Å; F178-I239 HydrophobicContact CZ-CG2 4.17Å; F178-M242 HydrophobicContact CD1-CE 4.04Å; F178-M242 HydrophobicContact CD2-CE 4.33Å; F178-M242 HydrophobicContact CE1-CE 3.6Å; F178-M242 HydrophobicContact CE2-CE 3.92Å; F178-M242 HydrophobicContact CG-CE 4.38Å; F178-M242 HydrophobicContact CZ-CE 3.53Å; F178-M242 HydrophobicContact CZ-SD 4.38Å; F178-F326 HydrophobicContact CD1-CE2 4.42Å; F178-F326 HydrophobicContact CD1-CZ 4.03Å; F178-F326 AromaticContact CE1-CZ 3.94Å; F178-F326 HydrophobicContact CE1-CZ 3.94Å; F178-T330 HydrophobicContact CE1-CG2 4.3Å |
| 179 | E | 86.7 | Confident | 91 | Very high | 91 Ų | 91 | 35.4 Ų | 35.4 | 43% | 0.425 | 20% | 0.196 | S | C | . | . | H | α-helix | trans | -57.2 | -54.9 | -176.9 | -70.4 | 179 | -173 | 0 | 0 | 113 | T176 F177 | T176-E179 WeakPolarHBondContact O-CB 3.26Å; T176-E179 PolarHBondContact O-N 3.21Å; F177-E179 VanDerWaalsContact C-N 3.3Å; F177-E179 PolarHBondContact O-N 3.43Å |
| 180 | P | 88.1 | Confident | 90.6 | Very high | 59 Ų | 59 | 41.2 Ų | 41.2 | 38% | 0.383 | 23% | 0.228 | S | C | . | . | H | α-helix | trans | -81.6 | -23.7 | 177.2 | 30.4 | -34.5 | 0 | 0 | 0 | 113.8 | T176 F177 P314 | T176-P180 VanDerWaalsContact O-CD 3.3Å; T176-P180 WeakPolarHBondContact O-CD 3.37Å; F177-P180 WeakPolarHBondContact O-CD 3.45Å; P180-P314 HydrophobicContact CG-CB 3.95Å |
| 181 | T | 91.6 | Very high | 90.4 | Very high | 7 Ų | 7 | 42.4 Ų | 42.4 | 4% | 0.043 | 24% | 0.235 | C | C | . | . | H | α-helix | trans | -96.5 | -27.7 | -167.5 | 61.1 | 0 | 0 | 0 | 0 | 113.9 | F177 F178 A183 H185 V321 F326 | F177-T181 HydrophobicContact CD2-CG2 4.26Å; F177-T181 HydrophobicContact CE2-CG2 3.79Å; F177-T181 HydrophobicContact CZ-CG2 4.05Å; F177-T181 WeakPolarHBondContact O-CG2 3.43Å; F177-T181 PolarHBondContact O-OG1 3.41Å; F178-T181 WeakPolarHBondContact CA-OG1 3.13Å; F178-T181 PolarHBondContact O-N 3.41Å; T181-A183 PolarHBondContact O-N 3.16Å; T181-H185 WeakPolarHBondContact O-CB 3.5Å; T181-H185 PolarHBondContact O-N 3.33Å; T181-H185 VanDerWaalsContact O-N 3.08Å; T181-V321 HydrophobicContact CG2-CB 4.21Å; T181-V321 HydrophobicContact CG2-CG2 3.77Å; T181-F326 WeakPolarHBondContact OG1-CE2 3.35Å |
| 182 | M | 89.5 | Confident | 90.1 | Very high | 0 Ų | 0 | 44.9 Ų | 44.9 | 0% | 0 | 26% | 0.256 | C | S | . | . | H | α-helix | trans | -66.1 | -41.6 | -175.6 | -174.2 | 62 | 68.2 | 0 | 0 | 112 | F178 S184 H185 V186 I199 F200 M242 I257 F326 | F178-M182 HydrophobicContact CB-CB 4.43Å; F178-M182 HydrophobicContact CB-CE 4.2Å; F178-M182 HydrophobicContact CD1-CE 3.38Å; F178-M182 HydrophobicContact CE1-CE 3.91Å; F178-M182 HydrophobicContact CG-CE 3.94Å; F178-M182 WeakPolarHBondContact O-CB 3.38Å; F178-M182 PolarHBondContact O-N 2.87Å; M182-S184 PolarHBondContact O-N 3.41Å; M182-H185 PolarHBondContact O-N 2.89Å; M182-H185 VanDerWaalsContact O-N 3.15Å; M182-V186 WeakPolarHBondContact O-CG2 3.45Å; M182-V186 PolarHBondContact O-N 2.96Å; M182-V186 HydrophobicContact SD-CG1 4.07Å; M182-I199 HydrophobicContact CG-CG2 4.02Å; M182-I199 HydrophobicContact SD-CG2 4.37Å; M182-F200 HydrophobicContact CB-CE1 4.18Å; M182-F200 HydrophobicContact CB-CZ 3.71Å; M182-F200 HydrophobicContact CG-CZ 4.18Å; M182-M242 HydrophobicContact CE-CE 3.31Å; M182-I257 HydrophobicContact CE-CG2 4.42Å; M182-I257 HydrophobicContact SD-CG2 3.94Å; M182-F326 HydrophobicContact CE-CZ 4.27Å; M182-F326 HydrophobicContact SD-CZ 4.48Å |
| 183 | A | 86.9 | Confident | 89.6 | Confident | 43 Ų | 43 | 48.7 Ų | 48.7 | 36% | 0.355 | 28% | 0.282 | S | S | . | . | H | α-helix | trans | -59.7 | -46.3 | -178.3 | 0 | 0 | 0 | 0 | 0 | 111.6 | T181 V186 E187 | T181-A183 PolarHBondContact O-N 3.16Å; A183-V186 PolarHBondContact O-N 2.85Å; A183-E187 PolarHBondContact O-N 2.97Å |
| 184 | S | 87.6 | Confident | 89.1 | Confident | 82 Ų | 82 | 55 Ų | 55 | 57% | 0.573 | 31% | 0.31 | S | S | * | . | H | α-helix | trans | -66.8 | -35.9 | 175.2 | -57 | 0 | 0 | 0 | 0 | 112.5 | M182 V186 E187 | M182-S184 PolarHBondContact O-N 3.41Å; S184-V186 VanDerWaalsContact C-N 3.29Å; S184-V186 PolarHBondContact O-N 3.43Å; S184-E187 WeakPolarHBondContact O-CB 3.42Å; S184-E187 PolarHBondContact O-N 3.29Å |
| 185 | H | 89.5 | Confident | 88.9 | Confident | 22 Ų | 22 | 56 Ų | 56 | 10% | 0.102 | 32% | 0.318 | C | S | . | . | H | α-helix | trans | -66.2 | -29.5 | 178.1 | 179.4 | 63.1 | 0 | 0 | 0 | 113.4 | T181 M182 M242 G243 K252 F326 | T181-H185 WeakPolarHBondContact O-CB 3.5Å; T181-H185 PolarHBondContact O-N 3.33Å; T181-H185 VanDerWaalsContact O-N 3.08Å; M182-H185 PolarHBondContact O-N 2.89Å; M182-H185 VanDerWaalsContact O-N 3.15Å; H185-M242 PolarHBondContact NE2-O 2.87Å; H185-G243 PolarHBondContact CE1-O 3.18Å; H185-K252 PolarHBondContact O-NZ 2.91Å; H185-F326 HydrophobicContact CB-CD1 4.09Å; H185-F326 HydrophobicContact CB-CD2 3.73Å; H185-F326 HydrophobicContact CB-CE1 4.11Å; H185-F326 HydrophobicContact CB-CE2 3.77Å; H185-F326 HydrophobicContact CB-CG 3.88Å; H185-F326 HydrophobicContact CB-CZ 3.96Å; H185-F326 AromaticContact CD2-CD1 3.69Å; H185-F326 AromaticContact CD2-CE1 3.31Å; H185-F326 WeakPolarHBondContact CD2-CE1 3.24Å; H185-F326 AromaticContact CD2-CZ 3.74Å; H185-F326 AromaticContact CE1-CD1 3.34Å; H185-F326 WeakPolarHBondContact CE1-CD1 3.31Å; H185-F326 AromaticContact CE1-CE1 3.7Å; H185-F326 AromaticContact CG-CD1 3.43Å; H185-F326 VanDerWaalsContact CG-CD1 3.43Å; H185-F326 AromaticContact CG-CE1 3.49Å; H185-F326 VanDerWaalsContact CG-CE1 3.49Å; H185-F326 AromaticContact CG-CG 3.7Å; H185-F326 AromaticContact CG-CZ 3.83Å; H185-F326 AromaticContact ND1-CD1 3.24Å; H185-F326 WeakPolarHBondContact ND1-CD1 3.25Å; H185-F326 AromaticContact ND1-CE1 3.77Å; H185-F326 AromaticContact ND1-CG 3.55Å; H185-F326 AromaticContact NE2-CD1 3.61Å; H185-F326 AromaticContact NE2-CE1 3.44Å; H185-F326 WeakPolarHBondContact NE2-CE1 3.36Å |
| 186 | V | 90.4 | Very high | 88.6 | Confident | 1 Ų | 1 | 56.4 Ų | 56.4 | 1% | 0.006 | 32% | 0.319 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -100 | 5.5 | -179.6 | -55.9 | 0 | 0 | 0 | 0 | 113.9 | M182 A183 S184 D188 L189 L191 I196 I199 I257 | M182-V186 WeakPolarHBondContact O-CG2 3.45Å; M182-V186 PolarHBondContact O-N 2.96Å; M182-V186 HydrophobicContact SD-CG1 4.07Å; A183-V186 PolarHBondContact O-N 2.85Å; S184-V186 VanDerWaalsContact C-N 3.29Å; S184-V186 PolarHBondContact O-N 3.43Å; V186-D188 VanDerWaalsContact C-N 3.33Å; V186-D188 PolarHBondContact O-N 3.06Å; V186-L189 HydrophobicContact CB-CD1 4.27Å; V186-L189 HydrophobicContact CG1-CD1 4.45Å; V186-L189 WeakPolarHBondContact O-CB 3.38Å; V186-L189 PolarHBondContact O-N 3.44Å; V186-L191 HydrophobicContact CB-CD1 4Å; V186-L191 HydrophobicContact CG2-CD1 4.12Å; V186-I196 HydrophobicContact CG2-CD1 4.31Å; V186-I196 HydrophobicContact CG2-CG1 4.07Å; V186-I199 HydrophobicContact CG1-CD1 4.28Å; V186-I257 HydrophobicContact CG1-CD1 3.6Å |
| 187 | E | 88.5 | Confident | 88.3 | Confident | 147 Ų | 147 | 57.9 Ų | 57.9 | 69% | 0.687 | 33% | 0.334 | S | S | * | . | G | 310 helix | trans | -60.4 | -39.8 | -175.2 | -174.4 | 174.1 | -169.8 | 0 | 0 | 112.9 | A183 S184 L189 D190 | A183-E187 PolarHBondContact O-N 2.97Å; S184-E187 WeakPolarHBondContact O-CB 3.42Å; S184-E187 PolarHBondContact O-N 3.29Å; E187-L189 PolarHBondContact O-N 3.16Å; E187-D190 PolarHBondContact O-N 3.42Å; E187-D190 VanDerWaalsContact O-N 3.14Å |
| 188 | D | 89.2 | Confident | 88.1 | Confident | 112 Ų | 112 | 61.5 Ų | 61.5 | 60% | 0.599 | 35% | 0.354 | S | S | * | . | G | 310 helix | trans | -69.9 | -9.8 | 176.6 | 67.8 | -34 | 0 | 0 | 0 | 114.6 | V186 D190 K252 | V186-D188 VanDerWaalsContact C-N 3.33Å; V186-D188 PolarHBondContact O-N 3.06Å; D188-D190 VanDerWaalsContact C-N 3.28Å; D188-K252 WeakPolarHBondContact OD1-CE 3.47Å; D188-K252 IonicContact OD1-NZ 2.56Å; D188-K252 PolarHBondContact OD1-NZ 3.39Å; D188-K252 WeakPolarHBondContact OD2-CE 3.28Å; D188-K252 IonicContact OD2-NZ 2.7Å; D188-K252 PolarHBondContact OD2-NZ 3.38Å |
| 189 | L | 90 | Very high | 88.1 | Confident | 52 Ų | 52 | 61.3 Ų | 61.3 | 27% | 0.272 | 35% | 0.353 | S | S | . | . | G | 310 helix | trans | -84.3 | -4 | 172.7 | -62.2 | -179.5 | 0 | 0 | 0 | 112.5 | V186 E187 L191 K252 I257 | V186-L189 HydrophobicContact CB-CD1 4.27Å; V186-L189 HydrophobicContact CG1-CD1 4.45Å; V186-L189 WeakPolarHBondContact O-CB 3.38Å; V186-L189 PolarHBondContact O-N 3.44Å; E187-L189 PolarHBondContact O-N 3.16Å; L189-L191 HydrophobicContact CB-CD1 4.08Å; L189-L191 HydrophobicContact CB-CD2 4.07Å; L189-L191 HydrophobicContact CB-CG 3.69Å; L189-L191 HydrophobicContact CD1-CD1 4.13Å; L189-L191 PolarHBondContact O-N 2.92Å; L189-K252 HydrophobicContact CD1-CD 4.38Å; L189-K252 HydrophobicContact CD1-CG 4.15Å; L189-K252 HydrophobicContact CD2-CG 4.4Å; L189-K252 HydrophobicContact CG-CD 4.48Å; L189-K252 HydrophobicContact CG-CG 4.49Å; L189-I257 HydrophobicContact CD1-CD1 4.37Å |
| 190 | D | 89.4 | Confident | 88.1 | Confident | 154 Ų | 154 | 60.3 Ų | 60.3 | 82% | 0.824 | 35% | 0.347 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 47.8 | 44.7 | 179.9 | -161.8 | 27.7 | 0 | 0 | 0 | 112.7 | E187 D188 | E187-D190 PolarHBondContact O-N 3.42Å; E187-D190 VanDerWaalsContact O-N 3.14Å; D188-D190 VanDerWaalsContact C-N 3.28Å |
| 191 | L | 88.6 | Confident | 88.2 | Confident | 40 Ų | 40 | 58.9 Ų | 58.9 | 21% | 0.209 | 34% | 0.338 | C | S | . | . | trans | -77 | 140.2 | -176.4 | -61.5 | 174.8 | 0 | 0 | 0 | 110.8 | V186 L189 A195 I196 I199 Y254 | V186-L191 HydrophobicContact CB-CD1 4Å; V186-L191 HydrophobicContact CG2-CD1 4.12Å; L189-L191 HydrophobicContact CB-CD1 4.08Å; L189-L191 HydrophobicContact CB-CD2 4.07Å; L189-L191 HydrophobicContact CB-CG 3.69Å; L189-L191 HydrophobicContact CD1-CD1 4.13Å; L189-L191 PolarHBondContact O-N 2.92Å; L191-A195 HydrophobicContact CB-CB 4.13Å; L191-I196 HydrophobicContact CB-CG1 4.12Å; L191-I199 HydrophobicContact CD1-CD1 4.49Å; L191-Y254 HydrophobicContact CD1-CD2 3.49Å; L191-Y254 VanDerWaalsContact CD1-CD2 3.49Å; L191-Y254 HydrophobicContact CD1-CE2 4.02Å; L191-Y254 HydrophobicContact CD1-CG 4.34Å; L191-Y254 HydrophobicContact CD2-CD2 4.01Å; L191-Y254 HydrophobicContact CD2-CG 4.16Å; L191-Y254 HydrophobicContact CG-CD2 4.41Å | ||
| 192 | A | 88.1 | Confident | 88.2 | Confident | 53 Ų | 53 | 60.4 Ų | 60.4 | 44% | 0.438 | 35% | 0.345 | S | S | . | . | trans | -58.9 | 146.8 | 168.3 | 0 | 0 | 0 | 0 | 0 | 110.7 | E194 A195 I196 | A192-E194 WeakPolarHBondContact CB-OE2 3.2Å; A192-E194 PolarHBondContact O-N 3.15Å; A192-A195 WeakPolarHBondContact O-CB 3.49Å; A192-A195 PolarHBondContact O-N 3.3Å; A192-I196 PolarHBondContact O-N 2.9Å | ||
| 193 | P | 83.5 | Confident | 88.3 | Confident | 102 Ų | 102 | 60.9 Ų | 60.9 | 66% | 0.662 | 35% | 0.348 | S | S | * | . | H | α-helix | trans | -52.6 | -32.6 | 179.5 | -28.2 | 35.7 | 0 | 0 | 0 | 114 | A195 I196 G197 | P193-A195 VanDerWaalsContact C-N 3.35Å; P193-I196 PolarHBondContact O-N 3.05Å; P193-G197 PolarHBondContact O-N 3.03Å |
| 194 | E | 85.2 | Confident | 88.5 | Confident | 147 Ų | 147 | 59.4 Ų | 59.4 | 69% | 0.687 | 34% | 0.336 | S | S | * | . | H | α-helix | trans | -64.2 | -38.1 | 176.4 | -61.7 | 78 | -171.8 | 0 | 0 | 112.2 | A192 G197 L198 | A192-E194 WeakPolarHBondContact CB-OE2 3.2Å; A192-E194 PolarHBondContact O-N 3.15Å; E194-G197 PolarHBondContact O-N 3.46Å; E194-L198 PolarHBondContact O-N 3.27Å |
| 195 | A | 87.9 | Confident | 88.8 | Confident | 20 Ų | 20 | 59.5 Ų | 59.5 | 17% | 0.165 | 33% | 0.33 | C | S | . | . | H | α-helix | trans | -68.9 | -38.2 | 176 | 0 | 0 | 0 | 0 | 0 | 111.5 | L191 A192 P193 L198 I199 Y254 | L191-A195 HydrophobicContact CB-CB 4.13Å; A192-A195 WeakPolarHBondContact O-CB 3.49Å; A192-A195 PolarHBondContact O-N 3.3Å; P193-A195 VanDerWaalsContact C-N 3.35Å; A195-L198 PolarHBondContact O-N 3.47Å; A195-I199 PolarHBondContact O-N 3.17Å; A195-Y254 HydrophobicContact CB-CE2 3.88Å; A195-Y254 PolarHBondContact O-OH 3.44Å |
| 196 | I | 86.4 | Confident | 89 | Confident | 42 Ų | 42 | 59.1 Ų | 59.1 | 22% | 0.215 | 33% | 0.329 | C | S | . | . | H | α-helix | trans | -63.7 | -43.3 | 173.2 | -58.6 | 175.9 | 0 | 0 | 0 | 110.3 | V186 L191 A192 P193 L198 I199 F200 | V186-I196 HydrophobicContact CG2-CD1 4.31Å; V186-I196 HydrophobicContact CG2-CG1 4.07Å; L191-I196 HydrophobicContact CB-CG1 4.12Å; A192-I196 PolarHBondContact O-N 2.9Å; P193-I196 PolarHBondContact O-N 3.05Å; I196-L198 VanDerWaalsContact C-N 3.3Å; I196-L198 PolarHBondContact O-N 3.38Å; I196-I199 WeakPolarHBondContact O-CB 3.29Å; I196-I199 PolarHBondContact O-N 2.55Å; I196-F200 HydrophobicContact CG2-CE2 4.16Å; I196-F200 WeakPolarHBondContact O-CD2 3.46Å |
| 197 | G | 85.4 | Confident | 89.2 | Confident | 33 Ų | 33 | 60 Ų | 60 | 34% | 0.34 | 33% | 0.333 | S | S | . | . | H | α-helix | trans | -62.5 | -34.9 | 175.1 | 0 | 0 | 0 | 0 | 0 | 113.6 | P193 E194 I199 F200 T201 | P193-G197 PolarHBondContact O-N 3.03Å; E194-G197 PolarHBondContact O-N 3.46Å; G197-I199 VanDerWaalsContact C-N 3.32Å; G197-I199 PolarHBondContact O-N 3.28Å; G197-F200 PolarHBondContact O-N 3.44Å; G197-T201 WeakPolarHBondContact O-CB 3.28Å; G197-T201 PolarHBondContact O-N 3.18Å; G197-T201 VanDerWaalsContact O-N 3.07Å; G197-T201 PolarHBondContact O-OG1 2.78Å |
| 198 | L | 87.9 | Confident | 89.4 | Confident | 81 Ų | 81 | 53.3 Ų | 53.3 | 42% | 0.424 | 30% | 0.303 | S | S | . | . | H | α-helix | trans | -64.3 | -36.4 | 177.5 | -170.9 | 65 | 0 | 0 | 0 | 112.1 | E194 A195 I196 F200 T201 I202 Y254 | E194-L198 PolarHBondContact O-N 3.27Å; A195-L198 PolarHBondContact O-N 3.47Å; I196-L198 VanDerWaalsContact C-N 3.3Å; I196-L198 PolarHBondContact O-N 3.38Å; L198-F200 VanDerWaalsContact C-N 3.33Å; L198-F200 PolarHBondContact O-N 2.58Å; L198-T201 PolarHBondContact O-N 2.96Å; L198-I202 HydrophobicContact CD1-CD1 4.46Å; L198-I202 HydrophobicContact CD1-CG1 4.3Å; L198-I202 HydrophobicContact CD2-CD1 4.35Å; L198-I202 HydrophobicContact CG-CD1 3.88Å; L198-I202 HydrophobicContact CG-CG1 4.2Å; L198-I202 VanDerWaalsContact O-CG1 3.27Å; L198-I202 WeakPolarHBondContact O-CG1 3.48Å; L198-I202 PolarHBondContact O-N 3.42Å; L198-Y254 WeakPolarHBondContact CD2-OH 3.3Å |
| 199 | I | 90.1 | Very high | 89.6 | Confident | 0 Ų | 0 | 54 Ų | 54 | 0% | 0 | 31% | 0.306 | C | S | . | . | H | α-helix | trans | -54.7 | -49.4 | 177 | -71.2 | 167 | 0 | 0 | 0 | 110.9 | M182 V186 L191 A195 I196 G197 Y254 I257 N261 | M182-I199 HydrophobicContact CG-CG2 4.02Å; M182-I199 HydrophobicContact SD-CG2 4.37Å; V186-I199 HydrophobicContact CG1-CD1 4.28Å; L191-I199 HydrophobicContact CD1-CD1 4.49Å; A195-I199 PolarHBondContact O-N 3.17Å; I196-I199 WeakPolarHBondContact O-CB 3.29Å; I196-I199 PolarHBondContact O-N 2.55Å; G197-I199 VanDerWaalsContact C-N 3.32Å; G197-I199 PolarHBondContact O-N 3.28Å; I199-Y254 HydrophobicContact CD1-CD2 4.09Å; I199-Y254 HydrophobicContact CD1-CE2 3.9Å; I199-Y254 HydrophobicContact CG1-CD2 4.38Å; I199-Y254 HydrophobicContact CG1-CE2 3.83Å; I199-I257 HydrophobicContact CD1-CG2 4Å; I199-I257 HydrophobicContact CG1-CG2 4.21Å; I199-I257 HydrophobicContact CG2-CG2 4Å; I199-N261 WeakPolarHBondContact CG2-ND2 3.43Å |
| 200 | F | 86.5 | Confident | 89.8 | Confident | 69 Ų | 69 | 52 Ų | 52 | 30% | 0.303 | 30% | 0.296 | S | S | . | . | H | α-helix | trans | -70.9 | -38.4 | 179.1 | -64.8 | -73.7 | 0 | 0 | 0 | 112.5 | F178 M182 I196 G197 L198 I202 S203 A204 | F178-F200 HydrophobicContact CB-CE1 4.43Å; M182-F200 HydrophobicContact CB-CE1 4.18Å; M182-F200 HydrophobicContact CB-CZ 3.71Å; M182-F200 HydrophobicContact CG-CZ 4.18Å; I196-F200 HydrophobicContact CG2-CE2 4.16Å; I196-F200 WeakPolarHBondContact O-CD2 3.46Å; G197-F200 PolarHBondContact O-N 3.44Å; L198-F200 VanDerWaalsContact C-N 3.33Å; L198-F200 PolarHBondContact O-N 2.58Å; F200-I202 VanDerWaalsContact C-N 3.33Å; F200-I202 PolarHBondContact O-N 2.8Å; F200-S203 PolarHBondContact O-N 3.49Å; F200-A204 PolarHBondContact O-N 3.07Å; F200-A204 VanDerWaalsContact O-N 3.09Å |
| 201 | T | 90.1 | Very high | 90.2 | Very high | 30 Ų | 30 | 44.7 Ų | 44.7 | 18% | 0.184 | 26% | 0.257 | C | S | . | . | H | α-helix | trans | -60.8 | -41.7 | 178.9 | -64.3 | 0 | 0 | 0 | 0 | 112 | T101 G197 L198 S203 A204 L205 | T101-T201 HydrophobicContact CG2-CG2 3.5Å; T101-T201 VanDerWaalsContact CG2-CG2 3.5Å; G197-T201 WeakPolarHBondContact O-CB 3.28Å; G197-T201 PolarHBondContact O-N 3.18Å; G197-T201 VanDerWaalsContact O-N 3.07Å; G197-T201 PolarHBondContact O-OG1 2.78Å; L198-T201 PolarHBondContact O-N 2.96Å; T201-S203 VanDerWaalsContact C-N 3.33Å; T201-S203 PolarHBondContact O-N 3.01Å; T201-A204 PolarHBondContact O-N 3.41Å; T201-L205 HydrophobicContact CG2-CD1 3.78Å; T201-L205 HydrophobicContact CG2-CG 4.23Å; T201-L205 WeakPolarHBondContact O-CB 3.44Å; T201-L205 WeakPolarHBondContact O-CG 3.4Å; T201-L205 PolarHBondContact O-N 3.33Å |
| 202 | I | 92.4 | Very high | 90.4 | Very high | 39 Ų | 39 | 44.5 Ų | 44.5 | 20% | 0.2 | 26% | 0.258 | C | S | . | . | H | α-helix | trans | -59.8 | -44.6 | 179.3 | -74.5 | 168.1 | 0 | 0 | 0 | 111 | L198 F200 L205 S206 C258 A262 | L198-I202 HydrophobicContact CD1-CD1 4.46Å; L198-I202 HydrophobicContact CD1-CG1 4.3Å; L198-I202 HydrophobicContact CD2-CD1 4.35Å; L198-I202 HydrophobicContact CG-CD1 3.88Å; L198-I202 HydrophobicContact CG-CG1 4.2Å; L198-I202 VanDerWaalsContact O-CG1 3.27Å; L198-I202 WeakPolarHBondContact O-CG1 3.48Å; L198-I202 PolarHBondContact O-N 3.42Å; F200-I202 VanDerWaalsContact C-N 3.33Å; F200-I202 PolarHBondContact O-N 2.8Å; I202-L205 PolarHBondContact O-N 3.09Å; I202-S206 PolarHBondContact O-N 3.28Å; I202-S206 PolarHBondContact O-OG 3.37Å; I202-C258 HydrophobicContact CD1-CB 3.84Å; I202-A262 HydrophobicContact CG2-CB 3.47Å; I202-A262 VanDerWaalsContact CG2-CB 3.47Å |
| 203 | S | 90.9 | Very high | 90.8 | Very high | 9 Ų | 9 | 45.8 Ų | 45.8 | 6% | 0.063 | 26% | 0.26 | C | S | . | . | H | α-helix | trans | -65.6 | -43.8 | 178.1 | -172.9 | 0 | 0 | 0 | 0 | 111.9 | F200 T201 L205 S206 Y207 | F200-S203 PolarHBondContact O-N 3.49Å; T201-S203 VanDerWaalsContact C-N 3.33Å; T201-S203 PolarHBondContact O-N 3.01Å; S203-L205 VanDerWaalsContact C-N 3.34Å; S203-L205 PolarHBondContact O-N 3.33Å; S203-S206 PolarHBondContact O-N 3.49Å; S203-S206 PolarHBondContact O-OG 3.32Å; S203-S206 VanDerWaalsContact O-OG 3.11Å; S203-Y207 WeakPolarHBondContact O-CB 3.37Å; S203-Y207 PolarHBondContact O-N 3.12Å |
| 204 | A | 92 | Very high | 91.5 | Very high | 13 Ų | 13 | 41.2 Ų | 41.2 | 11% | 0.107 | 23% | 0.231 | C | C | . | . | H | α-helix | trans | -64.7 | -36.4 | 178.7 | 0 | 0 | 0 | 0 | 0 | 112.7 | T101 F200 T201 A208 | T101-A204 VanDerWaalsContact OG1-CB 3.28Å; T101-A204 WeakPolarHBondContact OG1-CB 3.49Å; F200-A204 PolarHBondContact O-N 3.07Å; F200-A204 VanDerWaalsContact O-N 3.09Å; T201-A204 PolarHBondContact O-N 3.41Å; A204-A208 VanDerWaalsContact O-CB 3.26Å; A204-A208 WeakPolarHBondContact O-CB 3.47Å; A204-A208 PolarHBondContact O-N 3.11Å |
| 205 | L | 92.7 | Very high | 92 | Very high | 84 Ų | 84 | 34.2 Ų | 34.2 | 44% | 0.44 | 20% | 0.198 | S | C | . | . | H | α-helix | trans | -70.5 | -46.1 | 175.8 | -74.2 | 173.2 | 0 | 0 | 0 | 112.5 | T201 I202 S203 Y207 A208 L209 | T201-L205 HydrophobicContact CG2-CD1 3.78Å; T201-L205 HydrophobicContact CG2-CG 4.23Å; T201-L205 WeakPolarHBondContact O-CB 3.44Å; T201-L205 WeakPolarHBondContact O-CG 3.4Å; T201-L205 PolarHBondContact O-N 3.33Å; I202-L205 PolarHBondContact O-N 3.09Å; S203-L205 VanDerWaalsContact C-N 3.34Å; S203-L205 PolarHBondContact O-N 3.33Å; L205-Y207 VanDerWaalsContact C-N 3.32Å; L205-Y207 PolarHBondContact O-N 3.08Å; L205-A208 PolarHBondContact O-N 2.64Å; L205-L209 WeakPolarHBondContact O-CG 3.12Å; L205-L209 PolarHBondContact O-N 2.83Å |
| 206 | S | 94.3 | Very high | 92.4 | Very high | 13 Ų | 13 | 34.8 Ų | 34.8 | 9% | 0.091 | 20% | 0.203 | C | C | . | . | H | α-helix | trans | -64 | -41.2 | 177.9 | 62.8 | 0 | 0 | 0 | 0 | 111.1 | I202 S203 A208 L209 T210 A262 G265 | I202-S206 PolarHBondContact O-N 3.28Å; I202-S206 PolarHBondContact O-OG 3.37Å; S203-S206 PolarHBondContact O-N 3.49Å; S203-S206 PolarHBondContact O-OG 3.32Å; S203-S206 VanDerWaalsContact O-OG 3.11Å; S206-A208 PolarHBondContact O-N 3.06Å; S206-L209 PolarHBondContact O-N 3.16Å; S206-T210 PolarHBondContact O-N 2.63Å; S206-T210 VanDerWaalsContact O-N 3.07Å; S206-T210 PolarHBondContact O-OG1 2.65Å; S206-T210 VanDerWaalsContact O-OG1 3.1Å; S206-A262 VanDerWaalsContact CB-O 3.25Å; S206-A262 WeakPolarHBondContact CB-O 3.42Å; S206-A262 PolarHBondContact OG-O 3.47Å; S206-G265 VanDerWaalsContact OG-CA 3.24Å; S206-G265 WeakPolarHBondContact OG-CA 3.38Å |
| 207 | Y | 94.7 | Very high | 92.9 | Very high | 20 Ų | 20 | 36.2 Ų | 36.2 | 8% | 0.078 | 21% | 0.21 | C | C | . | . | H | α-helix | trans | -53.5 | -52 | 169.5 | 171.2 | -101.6 | 0 | 0 | 0 | 112.7 | E93 S203 L205 L209 T210 C211 G265 L268 V272 | E93-Y207 HydrophobicContact CB-CE1 3.97Å; E93-Y207 WeakPolarHBondContact CB-OH 3.34Å; E93-Y207 VanDerWaalsContact CG-OH 3.29Å; E93-Y207 WeakPolarHBondContact CG-OH 3.29Å; E93-Y207 PolarHBondContact OE2-OH 2.96Å; S203-Y207 WeakPolarHBondContact O-CB 3.37Å; S203-Y207 PolarHBondContact O-N 3.12Å; L205-Y207 VanDerWaalsContact C-N 3.32Å; L205-Y207 PolarHBondContact O-N 3.08Å; Y207-L209 VanDerWaalsContact C-N 3.29Å; Y207-L209 PolarHBondContact O-N 3.47Å; Y207-T210 PolarHBondContact O-N 3.48Å; Y207-C211 WeakPolarHBondContact CE2-SG 3.39Å; Y207-C211 VanDerWaalsContact CZ-SG 3.59Å; Y207-C211 PolarHBondContact O-N 2.97Å; Y207-C211 VanDerWaalsContact O-N 3.1Å; Y207-C211 PolarHBondContact O-SG 3.07Å; Y207-G265 VanDerWaalsContact CA-O 3.29Å; Y207-G265 WeakPolarHBondContact CA-O 3.32Å; Y207-L268 HydrophobicContact CD2-CB 4.28Å; Y207-L268 HydrophobicContact CD2-CD2 3.99Å; Y207-L268 HydrophobicContact CD2-CG 3.92Å; Y207-L268 HydrophobicContact CE2-CD2 4.35Å; Y207-L268 HydrophobicContact CE2-CG 4.12Å; Y207-V272 HydrophobicContact CE2-CB 4.12Å; Y207-V272 HydrophobicContact CE2-CG1 4.45Å; Y207-V272 HydrophobicContact CE2-CG2 3.98Å; Y207-V272 WeakPolarHBondContact OH-CG1 3.19Å |
| 208 | A | 92.8 | Very high | 93.4 | Very high | 7 Ų | 7 | 34.8 Ų | 34.8 | 6% | 0.058 | 19% | 0.194 | C | C | . | . | H | α-helix | trans | -62.9 | -32.7 | -178.4 | 0 | 0 | 0 | 0 | 0 | 112.9 | V94 A204 L205 S206 P212 | V94-A208 HydrophobicContact CB-CB 4.5Å; V94-A208 HydrophobicContact CG1-CB 4Å; V94-A208 VanDerWaalsContact CG2-O 3.25Å; V94-A208 WeakPolarHBondContact CG2-O 3.4Å; A204-A208 VanDerWaalsContact O-CB 3.26Å; A204-A208 WeakPolarHBondContact O-CB 3.47Å; A204-A208 PolarHBondContact O-N 3.11Å; L205-A208 PolarHBondContact O-N 2.64Å; S206-A208 PolarHBondContact O-N 3.06Å; A208-P212 WeakPolarHBondContact O-CD 3.38Å |
| 209 | L | 92.5 | Very high | 93.8 | Very high | 127 Ų | 127 | 32.5 Ų | 32.5 | 67% | 0.665 | 18% | 0.182 | S | C | * | . | H | α-helix | trans | -76.1 | -35.8 | 176.9 | -68 | 172.1 | 0 | 0 | 0 | 112.5 | L205 S206 Y207 T213 | L205-L209 WeakPolarHBondContact O-CG 3.12Å; L205-L209 PolarHBondContact O-N 2.83Å; S206-L209 PolarHBondContact O-N 3.16Å; Y207-L209 VanDerWaalsContact C-N 3.29Å; Y207-L209 PolarHBondContact O-N 3.47Å; L209-T213 PolarHBondContact O-OG1 2.89Å |
| 210 | T | 95.4 | Very high | 93.9 | Very high | 10 Ų | 10 | 42.3 Ų | 42.3 | 6% | 0.061 | 22% | 0.219 | C | C | . | . | H | α-helix | trans | -75.2 | -36.2 | -177.4 | -61.7 | 0 | 0 | 0 | 0 | 113 | S206 Y207 T213 V214 L266 M270 | S206-T210 PolarHBondContact O-N 2.63Å; S206-T210 VanDerWaalsContact O-N 3.07Å; S206-T210 PolarHBondContact O-OG1 2.65Å; S206-T210 VanDerWaalsContact O-OG1 3.1Å; Y207-T210 PolarHBondContact O-N 3.48Å; T210-T213 WeakPolarHBondContact CA-OG1 3.33Å; T210-T213 PolarHBondContact O-N 2.8Å; T210-T213 PolarHBondContact O-OG1 3.46Å; T210-V214 HydrophobicContact CG2-CG2 3.52Å; T210-V214 WeakPolarHBondContact O-CB 3.41Å; T210-V214 VanDerWaalsContact O-CG2 3.31Å; T210-V214 WeakPolarHBondContact O-CG2 3.23Å; T210-V214 PolarHBondContact O-N 2.82Å; T210-L266 WeakPolarHBondContact CG2-O 3.46Å; T210-L266 WeakPolarHBondContact OG1-CD2 3.41Å; T210-M270 HydrophobicContact CG2-CE 4.35Å; T210-M270 HydrophobicContact CG2-CG 3.79Å |
| 211 | C | 96 | Very high | 94.1 | Very high | 0 Ų | 0 | 43.8 Ų | 43.8 | 0% | 0 | 23% | 0.227 | C | C | . | . | H | α-helix | trans | -53.8 | -54.9 | -176.3 | -72.2 | 0 | 0 | 0 | 0 | 114.8 | G90 E93 Y207 T213 G215 V273 | G90-C211 WeakPolarHBondContact O-CB 3.33Å; E93-C211 HydrophobicContact CB-CB 3.93Å; Y207-C211 WeakPolarHBondContact CE2-SG 3.39Å; Y207-C211 VanDerWaalsContact CZ-SG 3.59Å; Y207-C211 PolarHBondContact O-N 2.97Å; Y207-C211 VanDerWaalsContact O-N 3.1Å; Y207-C211 PolarHBondContact O-SG 3.07Å; C211-T213 PolarHBondContact O-N 3.27Å; C211-G215 PolarHBondContact O-N 3.34Å; C211-V273 HydrophobicContact CB-CG2 3.76Å |
| 212 | P | 94.6 | Very high | 94 | Very high | 35 Ų | 35 | 48.6 Ų | 48.6 | 23% | 0.227 | 26% | 0.259 | C | S | . | . | H | α-helix | trans | -70.8 | -32.2 | -178.2 | 27.9 | -35.9 | 0 | 0 | 0 | 112.8 | V91 V94 A208 G215 A216 | V91-P212 HydrophobicContact CG2-CB 4.43Å; V94-P212 HydrophobicContact CG2-CB 4.41Å; V94-P212 HydrophobicContact CG2-CG 3.79Å; A208-P212 WeakPolarHBondContact O-CD 3.38Å; P212-G215 PolarHBondContact O-N 3.11Å; P212-A216 WeakPolarHBondContact O-CB 3.44Å; P212-A216 PolarHBondContact O-N 3.42Å |
| 213 | T | 95.7 | Very high | 94.1 | Very high | 81 Ų | 81 | 49.1 Ų | 49.1 | 50% | 0.497 | 26% | 0.262 | S | S | . | . | H | α-helix | trans | -68.5 | -45.6 | 179.1 | 53.5 | 0 | 0 | 0 | 0 | 110.9 | L209 T210 C211 A216 I217 | L209-T213 PolarHBondContact O-OG1 2.89Å; T210-T213 WeakPolarHBondContact CA-OG1 3.33Å; T210-T213 PolarHBondContact O-N 2.8Å; T210-T213 PolarHBondContact O-OG1 3.46Å; C211-T213 PolarHBondContact O-N 3.27Å; T213-A216 PolarHBondContact O-N 3.48Å; T213-I217 WeakPolarHBondContact O-CD1 3.43Å; T213-I217 VanDerWaalsContact O-CG1 3.32Å; T213-I217 WeakPolarHBondContact O-CG1 3.42Å; T213-I217 PolarHBondContact O-N 3.17Å |
| 214 | V | 97.3 | Very high | 94.3 | Very high | 6 Ų | 6 | 49.3 Ų | 49.3 | 4% | 0.036 | 26% | 0.262 | C | S | . | . | H | α-helix | trans | -62.9 | -44.8 | 173.4 | 171.1 | 0 | 0 | 0 | 0 | 111.1 | T210 A216 I217 I218 I227 M270 V273 T274 | T210-V214 HydrophobicContact CG2-CG2 3.52Å; T210-V214 WeakPolarHBondContact O-CB 3.41Å; T210-V214 VanDerWaalsContact O-CG2 3.31Å; T210-V214 WeakPolarHBondContact O-CG2 3.23Å; T210-V214 PolarHBondContact O-N 2.82Å; V214-A216 VanDerWaalsContact C-N 3.32Å; V214-A216 PolarHBondContact O-N 3.3Å; V214-I217 PolarHBondContact O-N 2.97Å; V214-I217 VanDerWaalsContact O-N 3.09Å; V214-I218 HydrophobicContact CG1-CD1 4.41Å; V214-I218 HydrophobicContact CG1-CG2 4.31Å; V214-I218 WeakPolarHBondContact O-CG1 3.42Å; V214-I218 PolarHBondContact O-N 3.1Å; V214-I227 HydrophobicContact CG1-CG2 3.81Å; V214-I227 HydrophobicContact CG2-CG2 4.38Å; V214-M270 HydrophobicContact CG2-CB 4.45Å; V214-M270 HydrophobicContact CG2-CG 3.74Å; V214-V273 HydrophobicContact CG1-CB 4.35Å; V214-V273 HydrophobicContact CG1-CG1 4.32Å; V214-T274 HydrophobicContact CG1-CG2 4.04Å |
| 215 | G | 96.8 | Very high | 94.4 | Very high | 0 Ų | 0 | 52.2 Ų | 52.2 | 0% | 0 | 28% | 0.276 | C | S | . | . | H | α-helix | trans | -54.4 | -47.6 | 177.2 | 0 | 0 | 0 | 0 | 0 | 112.3 | T87 C211 P212 I217 I218 D219 | T87-G215 PolarHBondContact OG1-O 3.43Å; C211-G215 PolarHBondContact O-N 3.34Å; P212-G215 PolarHBondContact O-N 3.11Å; G215-I217 VanDerWaalsContact C-N 3.28Å; G215-I217 PolarHBondContact O-N 2.95Å; G215-I218 PolarHBondContact O-N 3.3Å; G215-D219 WeakPolarHBondContact O-CB 3.24Å; G215-D219 VanDerWaalsContact O-CG 3.28Å; G215-D219 PolarHBondContact O-N 3.03Å; G215-D219 VanDerWaalsContact O-N 3.07Å |
| 216 | A | 96.3 | Very high | 94.6 | Very high | 32 Ų | 32 | 54.7 Ų | 54.7 | 26% | 0.264 | 29% | 0.285 | S | S | . | . | H | α-helix | trans | -65 | -28.6 | 178.6 | 0 | 0 | 0 | 0 | 0 | 114.1 | T87 P212 T213 V214 | T87-A216 VanDerWaalsContact OG1-CA 3.28Å; T87-A216 WeakPolarHBondContact OG1-CA 3.17Å; T87-A216 PolarHBondContact OG1-N 2.86Å; P212-A216 WeakPolarHBondContact O-CB 3.44Å; P212-A216 PolarHBondContact O-N 3.42Å; T213-A216 PolarHBondContact O-N 3.48Å; V214-A216 VanDerWaalsContact C-N 3.32Å; V214-A216 PolarHBondContact O-N 3.3Å |
| 217 | I | 96.8 | Very high | 94.7 | Very high | 72 Ų | 72 | 55.1 Ų | 55.1 | 37% | 0.369 | 29% | 0.286 | S | S | . | . | H | α-helix | trans | -75.8 | -50.8 | 176.7 | -67.5 | 162.3 | 0 | 0 | 0 | 110.4 | T213 V214 G215 D219 R220 Q221 I223 I227 | T213-I217 WeakPolarHBondContact O-CD1 3.43Å; T213-I217 VanDerWaalsContact O-CG1 3.32Å; T213-I217 WeakPolarHBondContact O-CG1 3.42Å; T213-I217 PolarHBondContact O-N 3.17Å; V214-I217 PolarHBondContact O-N 2.97Å; V214-I217 VanDerWaalsContact O-N 3.09Å; G215-I217 VanDerWaalsContact C-N 3.28Å; G215-I217 PolarHBondContact O-N 2.95Å; I217-D219 PolarHBondContact O-N 2.96Å; I217-R220 PolarHBondContact O-N 3.31Å; I217-R220 VanDerWaalsContact O-N 3.09Å; I217-Q221 PolarHBondContact O-N 2.79Å; I217-I223 HydrophobicContact CG2-CD1 3.8Å; I217-I223 HydrophobicContact CG2-CG1 4.42Å; I217-I227 HydrophobicContact CB-CD1 4.43Å; I217-I227 HydrophobicContact CG2-CD1 3.69Å |
| 218 | I | 96.5 | Very high | 94.7 | Very high | 2 Ų | 2 | 54.3 Ų | 54.3 | 1% | 0.01 | 28% | 0.283 | C | S | . | . | H | α-helix | trans | -74.4 | -24.1 | -173.4 | 66.8 | -179.8 | 0 | 0 | 0 | 113.8 | A86 V214 G215 R220 Q221 T224 I227 V273 T274 H277 | A86-I218 HydrophobicContact CB-CD1 3.63Å; A86-I218 HydrophobicContact CB-CG1 3.49Å; A86-I218 VanDerWaalsContact CB-CG1 3.49Å; V214-I218 HydrophobicContact CG1-CD1 4.41Å; V214-I218 HydrophobicContact CG1-CG2 4.31Å; V214-I218 WeakPolarHBondContact O-CG1 3.42Å; V214-I218 PolarHBondContact O-N 3.1Å; G215-I218 PolarHBondContact O-N 3.3Å; I218-R220 PolarHBondContact O-N 3.45Å; I218-Q221 VanDerWaalsContact O-O 3.12Å; I218-T224 HydrophobicContact CD1-CG2 4.35Å; I218-I227 HydrophobicContact CG2-CD1 3.52Å; I218-V273 HydrophobicContact CD1-CG1 3.96Å; I218-T274 HydrophobicContact CD1-CG2 3.97Å; I218-T274 HydrophobicContact CG2-CG2 4.27Å; I218-H277 HydrophobicContact CD1-CB 3.57Å; I218-H277 HydrophobicContact CG1-CB 4.41Å; I218-H277 PolarHBondContact O-CE1 2.84Å; I218-H277 VanDerWaalsContact O-CE1 3.27Å |
| 219 | D | 94.9 | Very high | 94.8 | Very high | 33 Ų | 33 | 56 Ų | 56 | 18% | 0.176 | 29% | 0.294 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -65.8 | -22.4 | 170.1 | -76 | -32.1 | 0 | 0 | 0 | 112 | K84 A85 A86 T87 G215 I217 H277 | K84-D219 WeakPolarHBondContact CA-OD2 3.47Å; A85-D219 PolarHBondContact N-OD1 3.16Å; A86-D219 WeakPolarHBondContact CB-OD1 3.19Å; A86-D219 PolarHBondContact N-OD1 3.38Å; T87-D219 WeakPolarHBondContact CB-OD2 3.4Å; T87-D219 PolarHBondContact N-OD2 3.14Å; T87-D219 PolarHBondContact OG1-OD2 3.24Å; G215-D219 WeakPolarHBondContact O-CB 3.24Å; G215-D219 VanDerWaalsContact O-CG 3.28Å; G215-D219 PolarHBondContact O-N 3.03Å; G215-D219 VanDerWaalsContact O-N 3.07Å; I217-D219 PolarHBondContact O-N 2.96Å; D219-H277 IonicContact OD1-CD2 3.96Å |
| 220 | R | 93.2 | Very high | 95 | Very high | 206 Ų | 206 | 53.3 Ų | 53.3 | 78% | 0.777 | 28% | 0.283 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -104 | -22.1 | -177 | -66.2 | 179.8 | 178.1 | 165.2 | 0.9 | 114 | I217 I218 | I217-R220 PolarHBondContact O-N 3.31Å; I217-R220 VanDerWaalsContact O-N 3.09Å; I218-R220 PolarHBondContact O-N 3.45Å |
| 221 | Q | 90.2 | Very high | 95 | Very high | 100 Ų | 100 | 52.8 Ų | 52.8 | 47% | 0.467 | 28% | 0.28 | S | S | . | . | S | Bend | trans | -133.3 | 136.5 | -169.6 | -63.4 | -175.1 | 10 | 0 | 0 | 110.7 | I217 I218 I223 | I217-Q221 PolarHBondContact O-N 2.79Å; I218-Q221 VanDerWaalsContact O-O 3.12Å; Q221-I223 HydrophobicContact CB-CD1 4.16Å; Q221-I223 HydrophobicContact CB-CG1 3.78Å; Q221-I223 HydrophobicContact CB-CG2 4.42Å; Q221-I223 PolarHBondContact O-N 3.14Å; Q221-I223 VanDerWaalsContact OE1-CD1 3.24Å |
| 222 | P | 88.9 | Confident | 94.9 | Very high | 131 Ų | 131 | 52.8 Ų | 52.8 | 85% | 0.851 | 28% | 0.28 | S | S | * | . | S | Bend | trans | -77.5 | 45.9 | -179.5 | 34.7 | -37.4 | 0 | 0 | 0 | 112.5 | ||
| 223 | I | 94 | Very high | 94.9 | Very high | 51 Ų | 51 | 54 Ų | 54 | 26% | 0.262 | 29% | 0.287 | S | S | . | . | trans | -112.7 | 20 | -174.7 | 62.4 | 167.7 | 0 | 0 | 0 | 112.9 | I217 Q221 L225 H226 I227 | I217-I223 HydrophobicContact CG2-CD1 3.8Å; I217-I223 HydrophobicContact CG2-CG1 4.42Å; Q221-I223 HydrophobicContact CB-CD1 4.16Å; Q221-I223 HydrophobicContact CB-CG1 3.78Å; Q221-I223 HydrophobicContact CB-CG2 4.42Å; Q221-I223 PolarHBondContact O-N 3.14Å; Q221-I223 VanDerWaalsContact OE1-CD1 3.24Å; I223-L225 VanDerWaalsContact C-N 3.34Å; I223-L225 PolarHBondContact O-N 3.13Å; I223-H226 HydrophobicContact CB-CB 4.45Å; I223-H226 PolarHBondContact O-N 3.04Å; I223-H226 VanDerWaalsContact O-N 3.14Å; I223-I227 HydrophobicContact CD1-CD1 3.63Å; I223-I227 HydrophobicContact CD1-CG1 4.15Å; I223-I227 HydrophobicContact CG1-CD1 3.83Å; I223-I227 HydrophobicContact CG1-CG1 4.35Å; I223-I227 PolarHBondContact O-N 2.8Å | ||
| 224 | T | 95.3 | Very high | 94.8 | Very high | 12 Ų | 12 | 52.4 Ų | 52.4 | 7% | 0.074 | 28% | 0.275 | C | S | . | . | H | α-helix | trans | -54.5 | -46.2 | -175.8 | -51.5 | 0 | 0 | 0 | 0 | 113.1 | I218 I227 M228 T274 H277 F278 | I218-T224 HydrophobicContact CD1-CG2 4.35Å; T224-I227 PolarHBondContact O-N 2.9Å; T224-M228 WeakPolarHBondContact O-CB 3.48Å; T224-M228 PolarHBondContact O-N 3.47Å; T224-T274 HydrophobicContact CG2-CG2 4.08Å; T224-T274 WeakPolarHBondContact CG2-O 3.49Å; T224-H277 HydrophobicContact CG2-CB 4.28Å; T224-H277 PolarHBondContact OG1-CE1 2.92Å; T224-H277 PolarHBondContact OG1-ND1 3.34Å; T224-F278 HydrophobicContact CG2-CB 3.95Å |
| 225 | L | 94.4 | Very high | 94.6 | Very high | 75 Ų | 75 | 52.2 Ų | 52.2 | 39% | 0.393 | 27% | 0.273 | S | S | . | . | H | α-helix | trans | -66 | -41.3 | 178.7 | -73.5 | 174.4 | 0 | 0 | 0 | 112 | F163 I223 I227 M228 S229 F278 | F163-L225 HydrophobicContact CE1-CD2 4.11Å; I223-L225 VanDerWaalsContact C-N 3.34Å; I223-L225 PolarHBondContact O-N 3.13Å; L225-I227 VanDerWaalsContact C-N 3.34Å; L225-I227 PolarHBondContact O-N 2.56Å; L225-M228 WeakPolarHBondContact O-CB 3.45Å; L225-M228 PolarHBondContact O-N 3.22Å; L225-M228 VanDerWaalsContact O-N 3.16Å; L225-S229 PolarHBondContact O-N 3.37Å; L225-S229 PolarHBondContact O-OG 3.28Å; L225-S229 VanDerWaalsContact O-OG 3.13Å; L225-F278 HydrophobicContact CD1-CE2 3.79Å; L225-F278 HydrophobicContact CD1-CZ 4.08Å; L225-F278 HydrophobicContact CD2-CD1 4.19Å; L225-F278 HydrophobicContact CD2-CD2 3.94Å; L225-F278 HydrophobicContact CD2-CE1 3.97Å; L225-F278 HydrophobicContact CD2-CE2 3.66Å; L225-F278 HydrophobicContact CD2-CG 4.21Å; L225-F278 HydrophobicContact CD2-CZ 3.71Å; L225-F278 HydrophobicContact CG-CD2 4.06Å; L225-F278 HydrophobicContact CG-CE2 3.71Å; L225-F278 HydrophobicContact CG-CZ 4.18Å |
| 226 | H | 95.1 | Very high | 94.3 | Very high | 135 Ų | 135 | 52.2 Ų | 52.2 | 63% | 0.625 | 27% | 0.273 | S | S | * | . | H | α-helix | trans | -61 | -43.4 | 177.6 | -63.7 | 88.8 | 0 | 0 | 0 | 111.7 | I223 S229 V230 | I223-H226 HydrophobicContact CB-CB 4.45Å; I223-H226 PolarHBondContact O-N 3.04Å; I223-H226 VanDerWaalsContact O-N 3.14Å; H226-S229 PolarHBondContact O-N 3.46Å; H226-V230 VanDerWaalsContact O-CG2 3.28Å; H226-V230 WeakPolarHBondContact O-CG2 3.39Å; H226-V230 PolarHBondContact O-N 3.46Å |
| 227 | I | 96.5 | Very high | 94 | Very high | 23 Ų | 23 | 55.1 Ų | 55.1 | 12% | 0.118 | 28% | 0.284 | C | S | . | . | H | α-helix | trans | -68.5 | -36.8 | 176.5 | -67.3 | 171.4 | 0 | 0 | 0 | 111 | V214 I217 I218 I223 T224 L225 V230 G231 M270 T274 | V214-I227 HydrophobicContact CG1-CG2 3.81Å; V214-I227 HydrophobicContact CG2-CG2 4.38Å; I217-I227 HydrophobicContact CB-CD1 4.43Å; I217-I227 HydrophobicContact CG2-CD1 3.69Å; I218-I227 HydrophobicContact CG2-CD1 3.52Å; I223-I227 HydrophobicContact CD1-CD1 3.63Å; I223-I227 HydrophobicContact CD1-CG1 4.15Å; I223-I227 HydrophobicContact CG1-CD1 3.83Å; I223-I227 HydrophobicContact CG1-CG1 4.35Å; I223-I227 PolarHBondContact O-N 2.8Å; T224-I227 PolarHBondContact O-N 2.9Å; L225-I227 VanDerWaalsContact C-N 3.34Å; L225-I227 PolarHBondContact O-N 2.56Å; I227-V230 PolarHBondContact O-N 2.86Å; I227-G231 PolarHBondContact O-N 3.37Å; I227-M270 HydrophobicContact CG2-CB 3.96Å; I227-M270 HydrophobicContact CG2-CG 4Å; I227-M270 HydrophobicContact CG2-SD 4.3Å; I227-T274 HydrophobicContact CB-CG2 4.02Å; I227-T274 HydrophobicContact CG2-CG2 3.79Å |
| 228 | M | 95.9 | Very high | 93.7 | Very high | 2 Ų | 2 | 51.9 Ų | 51.9 | 1% | 0.01 | 27% | 0.268 | C | S | . | . | H | α-helix | trans | -61.2 | -47.8 | 174.6 | -173.6 | 179.5 | -73.5 | 0 | 0 | 111.4 | F163 T224 L225 G231 Y232 T274 F278 | F163-M228 HydrophobicContact CD1-SD 4.37Å; F163-M228 HydrophobicContact CE1-SD 3.64Å; F163-M228 HydrophobicContact CZ-SD 4.34Å; T224-M228 WeakPolarHBondContact O-CB 3.48Å; T224-M228 PolarHBondContact O-N 3.47Å; L225-M228 WeakPolarHBondContact O-CB 3.45Å; L225-M228 PolarHBondContact O-N 3.22Å; L225-M228 VanDerWaalsContact O-N 3.16Å; M228-G231 WeakPolarHBondContact O-CA 3.21Å; M228-G231 PolarHBondContact O-N 3.29Å; M228-G231 VanDerWaalsContact O-N 3.11Å; M228-Y232 HydrophobicContact CG-CD2 4.14Å; M228-Y232 HydrophobicContact CG-CE2 3.88Å; M228-Y232 WeakPolarHBondContact O-CD2 3.37Å; M228-Y232 PolarHBondContact O-N 2.92Å; M228-Y232 HydrophobicContact SD-CE2 4.42Å; M228-T274 HydrophobicContact CB-CG2 4.45Å; M228-T274 WeakPolarHBondContact CB-OG1 3.28Å; M228-T274 VanDerWaalsContact CE-C 3.49Å; M228-T274 WeakPolarHBondContact CE-OG1 3.32Å; M228-F278 HydrophobicContact CE-CB 4.23Å |
| 229 | S | 94.9 | Very high | 93.4 | Very high | 42 Ų | 42 | 51.8 Ų | 51.8 | 29% | 0.294 | 27% | 0.267 | S | S | . | . | H | α-helix | trans | -58.7 | -47.2 | 175.8 | -64.6 | 0 | 0 | 0 | 0 | 112.2 | L225 H226 G231 Y232 V233 A341 | L225-S229 PolarHBondContact O-N 3.37Å; L225-S229 PolarHBondContact O-OG 3.28Å; L225-S229 VanDerWaalsContact O-OG 3.13Å; H226-S229 PolarHBondContact O-N 3.46Å; S229-G231 VanDerWaalsContact C-N 3.28Å; S229-G231 PolarHBondContact O-N 2.87Å; S229-Y232 PolarHBondContact O-N 2.85Å; S229-V233 PolarHBondContact O-N 3.01Å; S229-V233 VanDerWaalsContact O-N 3.11Å; S229-A341 WeakPolarHBondContact CB-O 3.47Å; S229-A341 WeakPolarHBondContact O-CB 3.49Å; S229-A341 PolarHBondContact OG-O 2.66Å |
| 230 | V | 95.9 | Very high | 93.1 | Very high | 71 Ų | 71 | 52 Ų | 52 | 43% | 0.43 | 27% | 0.268 | S | S | . | . | H | α-helix | trans | -60.3 | -41.2 | 174.4 | 170.7 | 0 | 0 | 0 | 0 | 110.7 | H226 I227 Y232 V233 I234 M270 | H226-V230 VanDerWaalsContact O-CG2 3.28Å; H226-V230 WeakPolarHBondContact O-CG2 3.39Å; H226-V230 PolarHBondContact O-N 3.46Å; I227-V230 PolarHBondContact O-N 2.86Å; V230-Y232 VanDerWaalsContact C-N 3.31Å; V230-Y232 PolarHBondContact O-N 3.29Å; V230-V233 PolarHBondContact O-N 3.19Å; V230-I234 HydrophobicContact CG1-CD1 3.52Å; V230-I234 HydrophobicContact CG1-CG1 4.15Å; V230-I234 WeakPolarHBondContact O-CB 3.43Å; V230-I234 VanDerWaalsContact O-CG1 3.28Å; V230-I234 WeakPolarHBondContact O-CG1 3.21Å; V230-I234 PolarHBondContact O-N 3.29Å; V230-M270 HydrophobicContact CG1-SD 4.1Å |
| 231 | G | 95.8 | Very high | 92.8 | Very high | 0 Ų | 0 | 45 Ų | 45 | 0% | 0 | 25% | 0.245 | C | C | . | . | H | α-helix | trans | -55.5 | -44 | 175 | 0 | 0 | 0 | 0 | 0 | 112.8 | I227 M228 S229 I234 S235 G267 | I227-G231 PolarHBondContact O-N 3.37Å; M228-G231 WeakPolarHBondContact O-CA 3.21Å; M228-G231 PolarHBondContact O-N 3.29Å; M228-G231 VanDerWaalsContact O-N 3.11Å; S229-G231 VanDerWaalsContact C-N 3.28Å; S229-G231 PolarHBondContact O-N 2.87Å; G231-I234 PolarHBondContact O-N 3.41Å; G231-S235 WeakPolarHBondContact O-CB 3.42Å; G231-S235 PolarHBondContact O-N 3.05Å; G231-S235 PolarHBondContact O-OG 3.44Å; G231-G267 WeakPolarHBondContact O-CA 3.25Å |
| 232 | Y | 94.4 | Very high | 92.6 | Very high | 0 Ų | 0 | 40.2 Ų | 40.2 | 0% | 0 | 22% | 0.223 | C | C | . | . | H | α-helix | trans | -67.5 | -38 | 176.9 | -86.5 | -57.7 | 0 | 0 | 0 | 114.7 | S167 M228 S229 V230 S235 G236 I271 N337 L340 | S167-Y232 WeakPolarHBondContact CA-OH 3.45Å; S167-Y232 WeakPolarHBondContact CB-OH 3.46Å; S167-Y232 PolarHBondContact O-OH 2.68Å; S167-Y232 VanDerWaalsContact O-OH 3.1Å; S167-Y232 PolarHBondContact OG-OH 3.15Å; M228-Y232 HydrophobicContact CG-CD2 4.14Å; M228-Y232 HydrophobicContact CG-CE2 3.88Å; M228-Y232 WeakPolarHBondContact O-CD2 3.37Å; M228-Y232 PolarHBondContact O-N 2.92Å; M228-Y232 HydrophobicContact SD-CE2 4.42Å; S229-Y232 PolarHBondContact O-N 2.85Å; V230-Y232 VanDerWaalsContact C-N 3.31Å; V230-Y232 PolarHBondContact O-N 3.29Å; Y232-S235 WeakPolarHBondContact CA-OG 3.41Å; Y232-S235 PolarHBondContact O-OG 2.85Å; Y232-S235 VanDerWaalsContact O-OG 3.12Å; Y232-G236 WeakPolarHBondContact O-CA 3.18Å; Y232-G236 PolarHBondContact O-N 3.24Å; Y232-I271 HydrophobicContact CD1-CD1 3.6Å; Y232-I271 HydrophobicContact CD1-CG1 4.27Å; Y232-I271 HydrophobicContact CD2-CG1 4.4Å; Y232-I271 HydrophobicContact CE1-CD1 3.71Å; Y232-I271 HydrophobicContact CE1-CG1 4.27Å; Y232-I271 HydrophobicContact CE1-CG2 4.46Å; Y232-I271 HydrophobicContact CE2-CG1 4.41Å; Y232-I271 HydrophobicContact CG-CD1 4.06Å; Y232-I271 HydrophobicContact CG-CG1 4.32Å; Y232-N337 WeakPolarHBondContact CB-O 3.36Å; Y232-N337 HydrophobicContact CD1-CB 4.21Å; Y232-N337 WeakPolarHBondContact CD1-O 3.24Å; Y232-L340 HydrophobicContact CD1-CB 3.95Å; Y232-L340 HydrophobicContact CD2-CB 3.9Å; Y232-L340 WeakPolarHBondContact CD2-O 2.97Å; Y232-L340 HydrophobicContact CE1-CB 3.83Å; Y232-L340 HydrophobicContact CE1-CD1 3.82Å; Y232-L340 HydrophobicContact CE1-CG 4.49Å; Y232-L340 HydrophobicContact CE2-CB 3.77Å; Y232-L340 HydrophobicContact CG-CB 3.98Å |
| 233 | V | 94.4 | Very high | 92 | Very high | 60 Ų | 60 | 34 Ų | 34 | 36% | 0.364 | 18% | 0.183 | S | C | . | . | H | α-helix | trans | -66.4 | -46.4 | 173.7 | 177.3 | 0 | 0 | 0 | 0 | 110.2 | S229 V230 S235 G236 L237 A341 | S229-V233 PolarHBondContact O-N 3.01Å; S229-V233 VanDerWaalsContact O-N 3.11Å; V230-V233 PolarHBondContact O-N 3.19Å; V233-S235 VanDerWaalsContact C-N 3.34Å; V233-S235 PolarHBondContact O-N 3.01Å; V233-G236 PolarHBondContact O-N 2.84Å; V233-L237 HydrophobicContact CG1-CD1 3.72Å; V233-L237 HydrophobicContact CG1-CG 4.26Å; V233-L237 WeakPolarHBondContact O-CG 3.31Å; V233-L237 PolarHBondContact O-N 3.16Å; V233-L237 VanDerWaalsContact O-N 3.1Å; V233-A341 HydrophobicContact CG2-CB 3.59Å |
| 234 | I | 94 | Very high | 91 | Very high | 48 Ų | 48 | 32.7 Ų | 32.7 | 25% | 0.246 | 18% | 0.178 | C | C | . | . | H | α-helix | trans | -67.4 | -32.2 | 179.9 | -68 | 178.5 | 0 | 0 | 0 | 111.5 | V230 G231 P238 I263 L266 M270 | V230-I234 HydrophobicContact CG1-CD1 3.52Å; V230-I234 HydrophobicContact CG1-CG1 4.15Å; V230-I234 WeakPolarHBondContact O-CB 3.43Å; V230-I234 VanDerWaalsContact O-CG1 3.28Å; V230-I234 WeakPolarHBondContact O-CG1 3.21Å; V230-I234 PolarHBondContact O-N 3.29Å; G231-I234 PolarHBondContact O-N 3.41Å; I234-P238 WeakPolarHBondContact O-CD 3.47Å; I234-P238 WeakPolarHBondContact O-CG 3.44Å; I234-I263 HydrophobicContact CG2-CG2 3.64Å; I234-I263 WeakPolarHBondContact CG2-O 3.45Å; I234-L266 HydrophobicContact CG2-CB 4.32Å; I234-M270 HydrophobicContact CD1-CE 4.06Å; I234-M270 HydrophobicContact CD1-SD 4.23Å |
| 235 | S | 92.1 | Very high | 90 | Very high | 1 Ų | 1 | 32.2 Ų | 32.2 | 1% | 0.007 | 18% | 0.175 | C | C | . | . | H | α-helix | trans | -78.7 | -38.4 | 173.6 | 67.1 | 0 | 0 | 0 | 0 | 112 | G231 Y232 V233 I239 Y264 N337 | G231-S235 WeakPolarHBondContact O-CB 3.42Å; G231-S235 PolarHBondContact O-N 3.05Å; G231-S235 PolarHBondContact O-OG 3.44Å; Y232-S235 WeakPolarHBondContact CA-OG 3.41Å; Y232-S235 PolarHBondContact O-OG 2.85Å; Y232-S235 VanDerWaalsContact O-OG 3.12Å; V233-S235 VanDerWaalsContact C-N 3.34Å; V233-S235 PolarHBondContact O-N 3.01Å; S235-I239 WeakPolarHBondContact O-CD1 3.49Å; S235-I239 VanDerWaalsContact O-CG1 3.25Å; S235-I239 WeakPolarHBondContact O-CG1 3.14Å; S235-Y264 WeakPolarHBondContact O-CD2 3.37Å; S235-N337 PolarHBondContact OG-OD1 3.33Å |
| 236 | G | 91.4 | Very high | 89 | Confident | 0 Ų | 0 | 35.2 Ų | 35.2 | 0% | 0 | 19% | 0.191 | C | C | . | . | H | α-helix | trans | -71.5 | -46.3 | -174.4 | 0 | 0 | 0 | 0 | 0 | 114.2 | Y232 V233 I239 A334 | Y232-G236 WeakPolarHBondContact O-CA 3.18Å; Y232-G236 PolarHBondContact O-N 3.24Å; V233-G236 PolarHBondContact O-N 2.84Å; G236-I239 WeakPolarHBondContact O-CB 3.25Å; G236-I239 PolarHBondContact O-N 3.1Å; G236-A334 WeakPolarHBondContact O-CB 3.38Å |
| 237 | L | 90.2 | Very high | 88 | Confident | 93 Ų | 93 | 37 Ų | 37 | 49% | 0.487 | 20% | 0.197 | S | C | . | . | H | α-helix | trans | -63.8 | -44 | -174.9 | -66.2 | 174.9 | 0 | 0 | 0 | 114 | V233 I239 L240 | V233-L237 HydrophobicContact CG1-CD1 3.72Å; V233-L237 HydrophobicContact CG1-CG 4.26Å; V233-L237 WeakPolarHBondContact O-CG 3.31Å; V233-L237 PolarHBondContact O-N 3.16Å; V233-L237 VanDerWaalsContact O-N 3.1Å; L237-I239 VanDerWaalsContact C-N 3.25Å; L237-I239 PolarHBondContact O-N 3.24Å; L237-L240 WeakPolarHBondContact O-CB 3.43Å; L237-L240 PolarHBondContact O-N 3.33Å |
| 238 | P | 90.7 | Very high | 87 | Confident | 5 Ų | 5 | 38.7 Ų | 38.7 | 3% | 0.032 | 21% | 0.205 | C | C | . | . | H | α-helix | trans | -63.9 | -27.7 | 179.7 | -24.2 | 35.7 | 0 | 0 | 0 | 114.3 | I234 L240 I241 M242 G260 I263 | I234-P238 WeakPolarHBondContact O-CD 3.47Å; I234-P238 WeakPolarHBondContact O-CG 3.44Å; P238-L240 PolarHBondContact O-N 2.95Å; P238-I241 WeakPolarHBondContact O-CA 3.15Å; P238-I241 WeakPolarHBondContact O-CB 3.43Å; P238-I241 PolarHBondContact O-N 3.33Å; P238-M242 WeakPolarHBondContact O-CG 3.41Å; P238-M242 PolarHBondContact O-N 3.23Å; P238-G260 VanDerWaalsContact CB-O 3.24Å; P238-G260 WeakPolarHBondContact CB-O 3.28Å; P238-I263 HydrophobicContact CB-CB 4.27Å; P238-I263 HydrophobicContact CB-CG2 4.49Å; P238-I263 HydrophobicContact CG-CB 3.62Å; P238-I263 HydrophobicContact CG-CG2 3.37Å |
| 239 | I | 90.3 | Very high | 86 | Confident | 0 Ų | 0 | 45 Ų | 45 | 0% | 0 | 25% | 0.247 | C | C | . | . | H | α-helix | trans | -61 | -36.1 | 177.8 | -63.3 | 165.8 | 0 | 0 | 0 | 110.5 | T174 F178 S235 G236 L237 I241 M242 G243 Y264 T330 A334 | T174-I239 HydrophobicContact CG2-CD1 3.4Å; T174-I239 HydrophobicContact CG2-CG1 4.46Å; F178-I239 HydrophobicContact CE2-CG1 4.39Å; F178-I239 HydrophobicContact CZ-CG1 4.07Å; F178-I239 HydrophobicContact CZ-CG2 4.17Å; S235-I239 WeakPolarHBondContact O-CD1 3.49Å; S235-I239 VanDerWaalsContact O-CG1 3.25Å; S235-I239 WeakPolarHBondContact O-CG1 3.14Å; G236-I239 WeakPolarHBondContact O-CB 3.25Å; G236-I239 PolarHBondContact O-N 3.1Å; L237-I239 VanDerWaalsContact C-N 3.25Å; L237-I239 PolarHBondContact O-N 3.24Å; I239-I241 PolarHBondContact O-N 2.86Å; I239-M242 PolarHBondContact O-N 3.09Å; I239-G243 PolarHBondContact O-N 3.41Å; I239-Y264 HydrophobicContact CD1-CD2 4.05Å; I239-Y264 HydrophobicContact CD1-CE2 3.94Å; I239-Y264 HydrophobicContact CG1-CD2 3.95Å; I239-Y264 HydrophobicContact CG1-CE2 4.29Å; I239-T330 HydrophobicContact CG2-CG2 4.08Å; I239-T330 VanDerWaalsContact CG2-O 3.28Å; I239-T330 WeakPolarHBondContact CG2-O 3.34Å; I239-A334 HydrophobicContact CB-CB 4.25Å; I239-A334 HydrophobicContact CG2-CB 4.27Å |
| 240 | L | 88 | Confident | 85.2 | Confident | 38 Ų | 38 | 46.4 Ų | 46.4 | 20% | 0.199 | 25% | 0.251 | C | S | . | . | H | α-helix | trans | -64.7 | -28.7 | 175.3 | -62 | 173.8 | 0 | 0 | 0 | 112.8 | L237 P238 P244 S245 I248 T331 A334 | L237-L240 WeakPolarHBondContact O-CB 3.43Å; L237-L240 PolarHBondContact O-N 3.33Å; P238-L240 PolarHBondContact O-N 2.95Å; L240-P244 WeakPolarHBondContact O-CA 3.44Å; L240-S245 PolarHBondContact O-N 3.49Å; L240-I248 HydrophobicContact CB-CD1 3.92Å; L240-T331 HydrophobicContact CD2-CG2 4.26Å; L240-A334 HydrophobicContact CD1-CB 4.36Å; L240-A334 HydrophobicContact CD2-CB 3.46Å; L240-A334 VanDerWaalsContact CD2-CB 3.46Å; L240-A334 HydrophobicContact CG-CB 3.6Å |
| 241 | I | 86.1 | Confident | 84.5 | Confident | 58 Ų | 58 | 52 Ų | 52 | 30% | 0.297 | 27% | 0.269 | S | S | . | . | H | α-helix | trans | -81.1 | -38.2 | 178.2 | -57.2 | 173.4 | 0 | 0 | 0 | 110.3 | P238 I239 L250 L256 | P238-I241 WeakPolarHBondContact O-CA 3.15Å; P238-I241 WeakPolarHBondContact O-CB 3.43Å; P238-I241 PolarHBondContact O-N 3.33Å; I239-I241 PolarHBondContact O-N 2.86Å; I241-L250 HydrophobicContact CG2-CD1 4.34Å; I241-L256 HydrophobicContact CG2-CB 4.08Å; I241-L256 HydrophobicContact CG2-CD2 4.32Å |
| 242 | M | 85.5 | Confident | 84 | Confident | 0 Ų | 0 | 54.6 Ų | 54.6 | 0% | 0 | 28% | 0.281 | C | S | . | . | H | α-helix | trans | -68.4 | -39.4 | 179 | -67.4 | 167 | 54.7 | 0 | 0 | 112.5 | F178 M182 H185 P238 I239 P244 G260 N261 | F178-M242 HydrophobicContact CD1-CE 4.04Å; F178-M242 HydrophobicContact CD2-CE 4.33Å; F178-M242 HydrophobicContact CE1-CE 3.6Å; F178-M242 HydrophobicContact CE2-CE 3.92Å; F178-M242 HydrophobicContact CG-CE 4.38Å; F178-M242 HydrophobicContact CZ-CE 3.53Å; F178-M242 HydrophobicContact CZ-SD 4.38Å; M182-M242 HydrophobicContact CE-CE 3.31Å; H185-M242 PolarHBondContact NE2-O 2.87Å; P238-M242 WeakPolarHBondContact O-CG 3.41Å; P238-M242 PolarHBondContact O-N 3.23Å; I239-M242 PolarHBondContact O-N 3.09Å; M242-P244 VanDerWaalsContact O-CD 3.26Å; M242-P244 WeakPolarHBondContact O-CD 3.31Å; M242-G260 VanDerWaalsContact SD-C 3.56Å; M242-N261 WeakPolarHBondContact CE-ND2 3.34Å; M242-N261 WeakPolarHBondContact CE-OD1 3.4Å |
| 243 | G | 76.4 | Confident | 83.7 | Confident | 1 Ų | 1 | 56.8 Ų | 56.8 | 1% | 0.01 | 30% | 0.296 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -63.6 | -20 | 177.3 | 0 | 0 | 0 | 0 | 0 | 115.7 | H185 I239 T330 | H185-G243 PolarHBondContact CE1-O 3.18Å; I239-G243 PolarHBondContact O-N 3.41Å; G243-T330 WeakPolarHBondContact CA-OG1 3.26Å |
| 244 | P | 74.7 | Confident | 83.5 | Confident | 22 Ų | 22 | 57.1 Ų | 57.1 | 14% | 0.143 | 29% | 0.291 | C | S | . | . | T | Hydrogen-bonded Turn | -2.5 | 113.7 | -108.3 | 15.2 | -33.3 | 0 | 0 | 0 | 114.2 | L240 M242 L246 L250 K252 | L240-P244 WeakPolarHBondContact O-CA 3.44Å; M242-P244 VanDerWaalsContact O-CD 3.26Å; M242-P244 WeakPolarHBondContact O-CD 3.31Å; P244-L246 PolarHBondContact O-N 3.44Å; P244-L250 HydrophobicContact CB-CB 4.23Å; P244-L250 WeakPolarHBondContact CB-O 3.32Å; P244-K252 HydrophobicContact CG-CB 4.39Å | |
| 245 | S | 74.1 | Confident | 83.4 | Confident | 3 Ų | 3 | 60.2 Ų | 60.2 | 2% | 0.021 | 31% | 0.307 | C | S | . | . | trans | -49.8 | 141.9 | 172.9 | 172.7 | 0 | 0 | 0 | 0 | 111.1 | L240 F247 I248 T331 | L240-S245 PolarHBondContact O-N 3.49Å; S245-F247 PolarHBondContact O-N 3.22Å; S245-F247 VanDerWaalsContact OG-CD2 3.28Å; S245-F247 WeakPolarHBondContact OG-CD2 3.42Å; S245-F247 PolarHBondContact OG-N 3.17Å; S245-I248 PolarHBondContact O-N 3.33Å; S245-T331 WeakPolarHBondContact CB-OG1 3.38Å; S245-T331 PolarHBondContact OG-OG1 3.39Å | ||
| 246 | L | 71.8 | Confident | 83.3 | Confident | 138 Ų | 138 | 62.7 Ų | 62.7 | 72% | 0.723 | 32% | 0.32 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -54.2 | -19.5 | 174.8 | -64.8 | 173.1 | 0 | 0 | 0 | 112.9 | P244 P327 | P244-L246 PolarHBondContact O-N 3.44Å; L246-P327 HydrophobicContact CD2-CB 4.36Å; L246-P327 HydrophobicContact CG-CB 4.25Å |
| 247 | F | 74.3 | Confident | 83.3 | Confident | 172 Ų | 172 | 62.7 Ų | 62.7 | 75% | 0.754 | 32% | 0.32 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -86.7 | -12.2 | 178.4 | -55.9 | -64.4 | 0 | 0 | 0 | 114.2 | S245 T331 | S245-F247 PolarHBondContact O-N 3.22Å; S245-F247 VanDerWaalsContact OG-CD2 3.28Å; S245-F247 WeakPolarHBondContact OG-CD2 3.42Å; S245-F247 PolarHBondContact OG-N 3.17Å; F247-T331 HydrophobicContact CD2-CG2 4.18Å; F247-T331 HydrophobicContact CE2-CG2 4.03Å |
| 248 | I | 77.2 | Confident | 83.5 | Confident | 58 Ų | 58 | 58.9 Ų | 58.9 | 30% | 0.297 | 30% | 0.301 | S | S | . | . | S | Bend | trans | -115.3 | 117.7 | -176.9 | -54.1 | 178 | 0 | 0 | 0 | 108.5 | L240 S245 L250 | L240-I248 HydrophobicContact CB-CD1 3.92Å; S245-I248 PolarHBondContact O-N 3.33Å; I248-L250 HydrophobicContact CG2-CB 4.23Å; I248-L250 HydrophobicContact CG2-CD1 3.62Å; I248-L250 HydrophobicContact CG2-CG 3.65Å; I248-L250 PolarHBondContact O-N 3.32Å |
| 249 | P | 74.9 | Confident | 83.6 | Confident | 135 Ų | 135 | 62.6 Ų | 62.6 | 88% | 0.877 | 32% | 0.32 | S | S | * | . | trans | -77.1 | 52.5 | -178.1 | 34 | -37 | 0 | 0 | 0 | 112 | ||||
| 250 | L | 78.1 | Confident | 83.7 | Confident | 72 Ų | 72 | 62.6 Ų | 62.6 | 38% | 0.377 | 32% | 0.32 | S | S | . | . | P | Polyproline II helix | trans | -96.7 | 131.7 | 174 | -75.9 | 171.8 | 0 | 0 | 0 | 109.7 | I241 P244 I248 L256 | I241-L250 HydrophobicContact CG2-CD1 4.34Å; P244-L250 HydrophobicContact CB-CB 4.23Å; P244-L250 WeakPolarHBondContact CB-O 3.32Å; I248-L250 HydrophobicContact CG2-CB 4.23Å; I248-L250 HydrophobicContact CG2-CD1 3.62Å; I248-L250 HydrophobicContact CG2-CG 3.65Å; I248-L250 PolarHBondContact O-N 3.32Å; L250-L256 HydrophobicContact CD2-CD1 4.31Å |
| 251 | K | 80.5 | Confident | 83.9 | Confident | 189 Ų | 189 | 60.9 Ų | 60.9 | 82% | 0.822 | 31% | 0.311 | S | S | * | . | P | Polyproline II helix | trans | -72.5 | 138.7 | 166.9 | -68.3 | -174.1 | 178.1 | -176.7 | 0 | 108.8 | S253 | K251-S253 PolarHBondContact O-N 2.89Š|
| 252 | K | 84.2 | Confident | 84.3 | Confident | 54 Ų | 54 | 59.6 Ų | 59.6 | 24% | 0.235 | 31% | 0.309 | C | S | . | . | P | Polyproline II helix | trans | -55.2 | 129.2 | 171.6 | -176.6 | 167.5 | 57.9 | -165.7 | 0 | 109.5 | H185 D188 L189 P244 I257 | H185-K252 PolarHBondContact O-NZ 2.91Å; D188-K252 WeakPolarHBondContact OD1-CE 3.47Å; D188-K252 IonicContact OD1-NZ 2.56Å; D188-K252 PolarHBondContact OD1-NZ 3.39Å; D188-K252 WeakPolarHBondContact OD2-CE 3.28Å; D188-K252 IonicContact OD2-NZ 2.7Å; D188-K252 PolarHBondContact OD2-NZ 3.38Å; L189-K252 HydrophobicContact CD1-CD 4.38Å; L189-K252 HydrophobicContact CD1-CG 4.15Å; L189-K252 HydrophobicContact CD2-CG 4.4Å; L189-K252 HydrophobicContact CG-CD 4.48Å; L189-K252 HydrophobicContact CG-CG 4.49Å; P244-K252 HydrophobicContact CG-CB 4.39Å; K252-I257 HydrophobicContact CD-CD1 4.37Å; K252-I257 HydrophobicContact CG-CD1 4.05Å |
| 253 | S | 89 | Confident | 84.8 | Confident | 46 Ų | 46 | 62.6 Ų | 62.6 | 32% | 0.322 | 32% | 0.324 | S | S | . | . | trans | -143.5 | 131.5 | -178.8 | 171.2 | 0 | 0 | 0 | 0 | 109.2 | K251 L255 L256 I257 | K251-S253 PolarHBondContact O-N 2.89Å; S253-L255 PolarHBondContact O-N 2.65Å; S253-L255 PolarHBondContact OG-N 2.92Å; S253-L256 PolarHBondContact O-N 3.49Å; S253-L256 VanDerWaalsContact O-N 3.09Å; S253-I257 WeakPolarHBondContact O-CG1 3.49Å; S253-I257 PolarHBondContact O-N 3.25Å | ||
| 254 | Y | 90.1 | Very high | 85.7 | Confident | 67 Ų | 67 | 62.6 Ų | 62.6 | 26% | 0.263 | 32% | 0.324 | S | S | . | . | H | α-helix | trans | -52.1 | -42.1 | 175.8 | 173.7 | -109.9 | 0 | 0 | 0 | 112.3 | L191 A195 L198 I199 L256 I257 C258 | L191-Y254 HydrophobicContact CD1-CD2 3.49Å; L191-Y254 VanDerWaalsContact CD1-CD2 3.49Å; L191-Y254 HydrophobicContact CD1-CE2 4.02Å; L191-Y254 HydrophobicContact CD1-CG 4.34Å; L191-Y254 HydrophobicContact CD2-CD2 4.01Å; L191-Y254 HydrophobicContact CD2-CG 4.16Å; L191-Y254 HydrophobicContact CG-CD2 4.41Å; A195-Y254 HydrophobicContact CB-CE2 3.88Å; A195-Y254 PolarHBondContact O-OH 3.44Å; L198-Y254 WeakPolarHBondContact CD2-OH 3.3Å; I199-Y254 HydrophobicContact CD1-CD2 4.09Å; I199-Y254 HydrophobicContact CD1-CE2 3.9Å; I199-Y254 HydrophobicContact CG1-CD2 4.38Å; I199-Y254 HydrophobicContact CG1-CE2 3.83Å; Y254-L256 PolarHBondContact O-N 3.17Å; Y254-I257 PolarHBondContact O-N 3.31Å; Y254-C258 VanDerWaalsContact CZ-SG 3.54Å; Y254-C258 PolarHBondContact O-N 3.42Å; Y254-C258 PolarHBondContact O-SG 3.02Å |
| 255 | L | 91 | Very high | 86.6 | Confident | 113 Ų | 113 | 61.6 Ų | 61.6 | 59% | 0.592 | 32% | 0.317 | S | S | * | . | H | α-helix | trans | -64.6 | -42.4 | 179.3 | -178.6 | 63.4 | 0 | 0 | 0 | 111.8 | S253 I257 C258 I259 | S253-L255 PolarHBondContact O-N 2.65Å; S253-L255 PolarHBondContact OG-N 2.92Å; L255-I257 VanDerWaalsContact C-N 3.33Å; L255-I257 PolarHBondContact O-N 3.23Å; L255-C258 PolarHBondContact O-N 3.12Å; L255-I259 HydrophobicContact CD1-CD1 4.11Å; L255-I259 HydrophobicContact CD1-CG1 4.37Å; L255-I259 HydrophobicContact CG-CD1 3.89Å; L255-I259 VanDerWaalsContact O-CG1 3.3Å; L255-I259 WeakPolarHBondContact O-CG1 3.49Å; L255-I259 PolarHBondContact O-N 2.8Å |
| 256 | L | 91.2 | Very high | 87.7 | Confident | 52 Ų | 52 | 64.6 Ų | 64.6 | 27% | 0.272 | 33% | 0.333 | S | S | . | . | H | α-helix | trans | -65.1 | -38.5 | 177.4 | -70.4 | 178.3 | 0 | 0 | 0 | 111.6 | I241 L250 S253 Y254 G260 | I241-L256 HydrophobicContact CG2-CB 4.08Å; I241-L256 HydrophobicContact CG2-CD2 4.32Å; L250-L256 HydrophobicContact CD2-CD1 4.31Å; S253-L256 PolarHBondContact O-N 3.49Å; S253-L256 VanDerWaalsContact O-N 3.09Å; Y254-L256 PolarHBondContact O-N 3.17Å; L256-G260 PolarHBondContact O-N 3.4Å |
| 257 | I | 92.1 | Very high | 88.8 | Confident | 1 Ų | 1 | 58 Ų | 58 | 1% | 0.005 | 30% | 0.299 | C | S | . | . | H | α-helix | trans | -64.3 | -43.9 | 175.1 | -65.6 | 171.6 | 0 | 0 | 0 | 110.3 | M182 V186 L189 I199 K252 S253 Y254 L255 G260 N261 | M182-I257 HydrophobicContact CE-CG2 4.42Å; M182-I257 HydrophobicContact SD-CG2 3.94Å; V186-I257 HydrophobicContact CG1-CD1 3.6Å; L189-I257 HydrophobicContact CD1-CD1 4.37Å; I199-I257 HydrophobicContact CD1-CG2 4Å; I199-I257 HydrophobicContact CG1-CG2 4.21Å; I199-I257 HydrophobicContact CG2-CG2 4Å; K252-I257 HydrophobicContact CD-CD1 4.37Å; K252-I257 HydrophobicContact CG-CD1 4.05Å; S253-I257 WeakPolarHBondContact O-CG1 3.49Å; S253-I257 PolarHBondContact O-N 3.25Å; Y254-I257 PolarHBondContact O-N 3.31Å; L255-I257 VanDerWaalsContact C-N 3.33Å; L255-I257 PolarHBondContact O-N 3.23Å; I257-G260 PolarHBondContact O-N 2.92Å; I257-N261 WeakPolarHBondContact CG2-ND2 3.35Å; I257-N261 WeakPolarHBondContact O-CB 3.49Å; I257-N261 PolarHBondContact O-N 3.11Å; I257-N261 PolarHBondContact O-ND2 3.41Å |
| 258 | C | 92.6 | Very high | 89.8 | Confident | 13 Ų | 13 | 50.2 Ų | 50.2 | 9% | 0.088 | 27% | 0.265 | C | S | . | . | H | α-helix | trans | -62.7 | -47.8 | 177.2 | -69.6 | 0 | 0 | 0 | 0 | 112.2 | I202 Y254 L255 G260 N261 A262 | I202-C258 HydrophobicContact CD1-CB 3.84Å; Y254-C258 VanDerWaalsContact CZ-SG 3.54Å; Y254-C258 PolarHBondContact O-N 3.42Å; Y254-C258 PolarHBondContact O-SG 3.02Å; L255-C258 PolarHBondContact O-N 3.12Å; C258-G260 VanDerWaalsContact C-N 3.3Å; C258-G260 PolarHBondContact O-N 3.14Å; C258-N261 PolarHBondContact O-N 2.83Å; C258-A262 PolarHBondContact O-N 3.44Å |
| 259 | I | 93.5 | Very high | 90.7 | Very high | 82 Ų | 82 | 47.5 Ų | 47.5 | 42% | 0.421 | 25% | 0.251 | S | S | . | . | H | α-helix | trans | -60.9 | -43.6 | 176.3 | -67.6 | 168.4 | 0 | 0 | 0 | 110 | L255 A262 I263 | L255-I259 HydrophobicContact CD1-CD1 4.11Å; L255-I259 HydrophobicContact CD1-CG1 4.37Å; L255-I259 HydrophobicContact CG-CD1 3.89Å; L255-I259 VanDerWaalsContact O-CG1 3.3Å; L255-I259 WeakPolarHBondContact O-CG1 3.49Å; L255-I259 PolarHBondContact O-N 2.8Å; I259-A262 WeakPolarHBondContact O-CB 3.45Å; I259-A262 PolarHBondContact O-N 3.27Å; I259-I263 HydrophobicContact CG2-CD1 3.89Å; I259-I263 WeakPolarHBondContact O-CG1 3.21Å; I259-I263 PolarHBondContact O-N 3.32Å; I259-I263 VanDerWaalsContact O-N 3.09Å |
| 260 | G | 93.4 | Very high | 91.8 | Very high | 0 Ų | 0 | 42.7 Ų | 42.7 | 0% | 0 | 22% | 0.217 | C | C | . | . | H | α-helix | trans | -60.3 | -46.8 | 178.1 | 0 | 0 | 0 | 0 | 0 | 112.6 | P238 M242 L256 I257 C258 A262 I263 Y264 | P238-G260 VanDerWaalsContact CB-O 3.24Å; P238-G260 WeakPolarHBondContact CB-O 3.28Å; M242-G260 VanDerWaalsContact SD-C 3.56Å; L256-G260 PolarHBondContact O-N 3.4Å; I257-G260 PolarHBondContact O-N 2.92Å; C258-G260 VanDerWaalsContact C-N 3.3Å; C258-G260 PolarHBondContact O-N 3.14Å; G260-A262 VanDerWaalsContact C-N 3.34Å; G260-A262 PolarHBondContact O-N 3.3Å; G260-I263 PolarHBondContact O-N 3.48Å; G260-Y264 WeakPolarHBondContact O-CB 3.48Å; G260-Y264 PolarHBondContact O-N 3.41Å |
| 261 | N | 92.4 | Very high | 92.6 | Very high | 3 Ų | 3 | 39.3 Ų | 39.3 | 2% | 0.016 | 20% | 0.199 | C | C | . | . | H | α-helix | trans | -63.6 | -37.5 | 176.4 | -85.3 | -84 | 0 | 0 | 0 | 112.9 | I199 M242 I257 C258 Y264 G265 | I199-N261 WeakPolarHBondContact CG2-ND2 3.43Å; M242-N261 WeakPolarHBondContact CE-ND2 3.34Å; M242-N261 WeakPolarHBondContact CE-OD1 3.4Å; I257-N261 WeakPolarHBondContact CG2-ND2 3.35Å; I257-N261 WeakPolarHBondContact O-CB 3.49Å; I257-N261 PolarHBondContact O-N 3.11Å; I257-N261 PolarHBondContact O-ND2 3.41Å; C258-N261 PolarHBondContact O-N 2.83Å; N261-Y264 PolarHBondContact O-N 3.45Å; N261-G265 PolarHBondContact O-N 3.01Å |
| 262 | A | 94.2 | Very high | 93.3 | Very high | 30 Ų | 30 | 30.3 Ų | 30.3 | 25% | 0.248 | 16% | 0.16 | C | C | . | . | H | α-helix | trans | -60.4 | -52.6 | 176.6 | 0 | 0 | 0 | 0 | 0 | 110.6 | I202 S206 C258 I259 G260 G265 L266 | I202-A262 HydrophobicContact CG2-CB 3.47Å; I202-A262 VanDerWaalsContact CG2-CB 3.47Å; S206-A262 VanDerWaalsContact CB-O 3.25Å; S206-A262 WeakPolarHBondContact CB-O 3.42Å; S206-A262 PolarHBondContact OG-O 3.47Å; C258-A262 PolarHBondContact O-N 3.44Å; I259-A262 WeakPolarHBondContact O-CB 3.45Å; I259-A262 PolarHBondContact O-N 3.27Å; G260-A262 VanDerWaalsContact C-N 3.34Å; G260-A262 PolarHBondContact O-N 3.3Å; A262-G265 PolarHBondContact O-N 2.85Å; A262-L266 PolarHBondContact O-N 3.45Å |
| 263 | I | 95.7 | Very high | 93.9 | Very high | 64 Ų | 64 | 27.8 Ų | 27.8 | 33% | 0.328 | 15% | 0.149 | S | C | . | . | H | α-helix | trans | -64.8 | -42.7 | 179.9 | -58.9 | 168.5 | 0 | 0 | 0 | 110.2 | I234 P238 I259 G260 G265 L266 G267 | I234-I263 HydrophobicContact CG2-CG2 3.64Å; I234-I263 WeakPolarHBondContact CG2-O 3.45Å; P238-I263 HydrophobicContact CB-CB 4.27Å; P238-I263 HydrophobicContact CB-CG2 4.49Å; P238-I263 HydrophobicContact CG-CB 3.62Å; P238-I263 HydrophobicContact CG-CG2 3.37Å; I259-I263 HydrophobicContact CG2-CD1 3.89Å; I259-I263 WeakPolarHBondContact O-CG1 3.21Å; I259-I263 PolarHBondContact O-N 3.32Å; I259-I263 VanDerWaalsContact O-N 3.09Å; G260-I263 PolarHBondContact O-N 3.48Å; I263-G265 VanDerWaalsContact C-N 3.34Å; I263-G265 PolarHBondContact O-N 3.37Å; I263-L266 WeakPolarHBondContact O-CB 3.35Å; I263-L266 PolarHBondContact O-N 2.75Å; I263-L266 VanDerWaalsContact O-N 3.13Å; I263-G267 PolarHBondContact O-N 2.99Å; I263-G267 VanDerWaalsContact O-N 3.14Å |
| 264 | Y | 94.5 | Very high | 94.3 | Very high | 1 Ų | 1 | 25.6 Ų | 25.6 | 0% | 0.004 | 13% | 0.134 | C | C | . | . | H | α-helix | trans | -55 | -47.6 | 175.8 | 173.7 | -98.8 | 0 | 0 | 0 | 112.1 | G171 T174 V175 S235 I239 G260 N261 L266 G267 L268 | G171-Y264 PolarHBondContact O-OH 3.28Å; T174-Y264 WeakPolarHBondContact CB-OH 3.41Å; T174-Y264 HydrophobicContact CG2-CE2 3.59Å; T174-Y264 WeakPolarHBondContact CG2-OH 3.33Å; V175-Y264 VanDerWaalsContact CA-OH 3.28Å; V175-Y264 WeakPolarHBondContact CA-OH 3.39Å; V175-Y264 HydrophobicContact CB-CE1 3.84Å; V175-Y264 WeakPolarHBondContact CB-OH 3.41Å; V175-Y264 HydrophobicContact CG2-CE1 3.97Å; V175-Y264 PolarHBondContact N-OH 3.28Å; S235-Y264 WeakPolarHBondContact O-CD2 3.37Å; I239-Y264 HydrophobicContact CD1-CD2 4.05Å; I239-Y264 HydrophobicContact CD1-CE2 3.94Å; I239-Y264 HydrophobicContact CG1-CD2 3.95Å; I239-Y264 HydrophobicContact CG1-CE2 4.29Å; G260-Y264 WeakPolarHBondContact O-CB 3.48Å; G260-Y264 PolarHBondContact O-N 3.41Å; N261-Y264 PolarHBondContact O-N 3.45Å; Y264-L266 VanDerWaalsContact C-N 3.29Å; Y264-L266 PolarHBondContact O-N 3.44Å; Y264-G267 PolarHBondContact O-N 3Å; Y264-G267 VanDerWaalsContact O-N 3.13Å; Y264-L268 HydrophobicContact CE1-CB 4.4Å; Y264-L268 HydrophobicContact CE1-CD2 4.16Å; Y264-L268 PolarHBondContact O-N 3.3Å |
| 265 | G | 95 | Very high | 94.6 | Very high | 0 Ų | 0 | 22.4 Ų | 22.4 | 0% | 0 | 12% | 0.122 | C | C | . | . | H | α-helix | trans | -63.7 | -31.8 | 178.8 | 0 | 0 | 0 | 0 | 0 | 113.3 | S206 Y207 N261 A262 I263 G269 | S206-G265 VanDerWaalsContact OG-CA 3.24Å; S206-G265 WeakPolarHBondContact OG-CA 3.38Å; Y207-G265 VanDerWaalsContact CA-O 3.29Å; Y207-G265 WeakPolarHBondContact CA-O 3.32Å; N261-G265 PolarHBondContact O-N 3.01Å; A262-G265 PolarHBondContact O-N 2.85Å; I263-G265 VanDerWaalsContact C-N 3.34Å; I263-G265 PolarHBondContact O-N 3.37Å; G265-G269 PolarHBondContact O-N 3.5Å |
| 266 | L | 96 | Very high | 94.8 | Very high | 67 Ų | 67 | 17 Ų | 17 | 35% | 0.351 | 9% | 0.093 | S | C | . | . | H | α-helix | trans | -61.9 | -49.1 | 170.8 | -59.4 | 174 | 0 | 0 | 0 | 110.8 | T210 I234 A262 I263 Y264 L268 G269 M270 | T210-L266 WeakPolarHBondContact CG2-O 3.46Å; T210-L266 WeakPolarHBondContact OG1-CD2 3.41Å; I234-L266 HydrophobicContact CG2-CB 4.32Å; A262-L266 PolarHBondContact O-N 3.45Å; I263-L266 WeakPolarHBondContact O-CB 3.35Å; I263-L266 PolarHBondContact O-N 2.75Å; I263-L266 VanDerWaalsContact O-N 3.13Å; Y264-L266 VanDerWaalsContact C-N 3.29Å; Y264-L266 PolarHBondContact O-N 3.44Å; L266-L268 PolarHBondContact O-N 2.85Å; L266-G269 PolarHBondContact O-N 2.86Å; L266-M270 PolarHBondContact O-N 2.95Å |
| 267 | G | 96 | Very high | 95 | Very high | 0 Ų | 0 | 15.5 Ų | 15.5 | 0% | 0 | 9% | 0.085 | C | C | . | . | H | α-helix | trans | -62 | -43.1 | 178.7 | 0 | 0 | 0 | 0 | 0 | 112.5 | G231 I263 Y264 G269 M270 I271 | G231-G267 WeakPolarHBondContact O-CA 3.25Å; I263-G267 PolarHBondContact O-N 2.99Å; I263-G267 VanDerWaalsContact O-N 3.14Å; Y264-G267 PolarHBondContact O-N 3Å; Y264-G267 VanDerWaalsContact O-N 3.13Å; G267-G269 VanDerWaalsContact C-N 3.35Å; G267-G269 PolarHBondContact O-N 3.31Å; G267-M270 WeakPolarHBondContact O-CB 3.38Å; G267-M270 PolarHBondContact O-N 3.41Å; G267-I271 WeakPolarHBondContact O-CG1 3.44Å; G267-I271 PolarHBondContact O-N 3.38Å |
| 268 | L | 95.4 | Very high | 95.2 | Very high | 8 Ų | 8 | 16 Ų | 16 | 4% | 0.042 | 9% | 0.087 | C | C | . | . | H | α-helix | trans | -59.7 | -43.7 | 176.2 | -177.7 | 65.9 | 0 | 0 | 0 | 112 | G171 V175 Y207 Y264 L266 M270 I271 V272 | G171-L268 WeakPolarHBondContact O-CD1 3.47Å; V175-L268 HydrophobicContact CB-CD2 3.76Å; V175-L268 HydrophobicContact CG1-CD2 4Å; V175-L268 HydrophobicContact CG2-CD2 3.85Å; Y207-L268 HydrophobicContact CD2-CB 4.28Å; Y207-L268 HydrophobicContact CD2-CD2 3.99Å; Y207-L268 HydrophobicContact CD2-CG 3.92Å; Y207-L268 HydrophobicContact CE2-CD2 4.35Å; Y207-L268 HydrophobicContact CE2-CG 4.12Å; Y264-L268 HydrophobicContact CE1-CB 4.4Å; Y264-L268 HydrophobicContact CE1-CD2 4.16Å; Y264-L268 PolarHBondContact O-N 3.3Å; L266-L268 PolarHBondContact O-N 2.85Å; L268-M270 PolarHBondContact O-N 3.44Å; L268-I271 PolarHBondContact O-N 3.48Å; L268-I271 VanDerWaalsContact O-N 3.16Å; L268-V272 HydrophobicContact CD1-CG2 3.94Å; L268-V272 HydrophobicContact CG-CG2 4.18Å; L268-V272 WeakPolarHBondContact O-CG2 3.34Å; L268-V272 PolarHBondContact O-N 3.26Å |
| 269 | G | 95.8 | Very high | 95.4 | Very high | 0 Ų | 0 | 15.4 Ų | 15.4 | 0% | 0 | 8% | 0.083 | C | C | . | . | H | α-helix | trans | -60.5 | -35.4 | 177.8 | 0 | 0 | 0 | 0 | 0 | 112.7 | G265 L266 G267 V273 | G265-G269 PolarHBondContact O-N 3.5Å; L266-G269 PolarHBondContact O-N 2.86Å; G267-G269 VanDerWaalsContact C-N 3.35Å; G267-G269 PolarHBondContact O-N 3.31Å; G269-V273 PolarHBondContact O-N 3.39Å |
| 270 | M | 96.6 | Very high | 95.4 | Very high | 34 Ų | 34 | 11.6 Ų | 11.6 | 17% | 0.167 | 6% | 0.063 | C | C | . | . | H | α-helix | trans | -65.4 | -50 | 172.6 | -64.3 | 177.6 | -172.4 | 0 | 0 | 111.5 | T210 V214 I227 V230 I234 L266 G267 L268 V272 T274 | T210-M270 HydrophobicContact CG2-CE 4.35Å; T210-M270 HydrophobicContact CG2-CG 3.79Å; V214-M270 HydrophobicContact CG2-CB 4.45Å; V214-M270 HydrophobicContact CG2-CG 3.74Å; I227-M270 HydrophobicContact CG2-CB 3.96Å; I227-M270 HydrophobicContact CG2-CG 4Å; I227-M270 HydrophobicContact CG2-SD 4.3Å; V230-M270 HydrophobicContact CG1-SD 4.1Å; I234-M270 HydrophobicContact CD1-CE 4.06Å; I234-M270 HydrophobicContact CD1-SD 4.23Å; L266-M270 PolarHBondContact O-N 2.95Å; G267-M270 WeakPolarHBondContact O-CB 3.38Å; G267-M270 PolarHBondContact O-N 3.41Å; L268-M270 PolarHBondContact O-N 3.44Å; M270-V272 PolarHBondContact O-N 3.11Å; M270-T274 VanDerWaalsContact O-CB 3.29Å; M270-T274 WeakPolarHBondContact O-CB 3.49Å; M270-T274 WeakPolarHBondContact O-CG2 3.35Å; M270-T274 PolarHBondContact O-N 3.2Å; M270-T274 VanDerWaalsContact O-N 3.08Å; M270-T274 PolarHBondContact O-OG1 3.16Å |
| 271 | I | 96.3 | Very high | 95.4 | Very high | 1 Ų | 1 | 14 Ų | 14 | 1% | 0.005 | 8% | 0.076 | C | C | . | . | H | α-helix | trans | -60.8 | -47.2 | -177.2 | -65.8 | 162.1 | 0 | 0 | 0 | 111.1 | Y232 G267 L268 T274 S275 | Y232-I271 HydrophobicContact CD1-CD1 3.6Å; Y232-I271 HydrophobicContact CD1-CG1 4.27Å; Y232-I271 HydrophobicContact CD2-CG1 4.4Å; Y232-I271 HydrophobicContact CE1-CD1 3.71Å; Y232-I271 HydrophobicContact CE1-CG1 4.27Å; Y232-I271 HydrophobicContact CE1-CG2 4.46Å; Y232-I271 HydrophobicContact CE2-CG1 4.41Å; Y232-I271 HydrophobicContact CG-CD1 4.06Å; Y232-I271 HydrophobicContact CG-CG1 4.32Å; G267-I271 WeakPolarHBondContact O-CG1 3.44Å; G267-I271 PolarHBondContact O-N 3.38Å; L268-I271 PolarHBondContact O-N 3.48Å; L268-I271 VanDerWaalsContact O-N 3.16Å; I271-T274 PolarHBondContact O-OG1 3.28Å; I271-T274 VanDerWaalsContact O-OG1 3.11Å; I271-S275 VanDerWaalsContact O-CB 3.23Å; I271-S275 WeakPolarHBondContact O-CB 3.41Å; I271-S275 PolarHBondContact O-N 2.98Å; I271-S275 PolarHBondContact O-OG 2.84Å |
| 272 | V | 95.5 | Very high | 95.4 | Very high | 1 Ų | 1 | 13.9 Ų | 13.9 | 1% | 0.006 | 8% | 0.076 | C | C | . | . | H | α-helix | trans | -63.8 | -51.1 | -173.7 | 173.7 | 0 | 0 | 0 | 0 | 111.3 | E93 L172 Y207 L268 M270 S275 F276 Y302 | E93-V272 HydrophobicContact CG-CG1 4.21Å; L172-V272 HydrophobicContact CD2-CG2 3.75Å; Y207-V272 HydrophobicContact CE2-CB 4.12Å; Y207-V272 HydrophobicContact CE2-CG1 4.45Å; Y207-V272 HydrophobicContact CE2-CG2 3.98Å; Y207-V272 WeakPolarHBondContact OH-CG1 3.19Å; L268-V272 HydrophobicContact CD1-CG2 3.94Å; L268-V272 HydrophobicContact CG-CG2 4.18Å; L268-V272 WeakPolarHBondContact O-CG2 3.34Å; L268-V272 PolarHBondContact O-N 3.26Å; M270-V272 PolarHBondContact O-N 3.11Å; V272-S275 PolarHBondContact O-N 2.9Å; V272-F276 PolarHBondContact O-N 3.48Å; V272-Y302 WeakPolarHBondContact CG1-OH 3.36Å; V272-Y302 PolarHBondContact O-OH 3.25Å |
| 273 | V | 95.8 | Very high | 95.3 | Very high | 0 Ų | 0 | 12.5 Ų | 12.5 | 0% | 0 | 6% | 0.064 | C | C | . | . | H | α-helix | trans | -68.7 | -40.9 | -178.1 | 177.1 | 0 | 0 | 0 | 0 | 111.9 | A86 C211 V214 I218 G269 S275 H277 | A86-V273 HydrophobicContact CB-CG1 4.01Å; C211-V273 HydrophobicContact CB-CG2 3.76Å; V214-V273 HydrophobicContact CG1-CB 4.35Å; V214-V273 HydrophobicContact CG1-CG1 4.32Å; I218-V273 HydrophobicContact CD1-CG1 3.96Å; G269-V273 PolarHBondContact O-N 3.39Å; V273-S275 VanDerWaalsContact C-N 3.32Å; V273-S275 PolarHBondContact O-N 2.99Å; V273-H277 PolarHBondContact O-N 2.95Å |
| 274 | T | 97 | Very high | 95.1 | Very high | 0 Ų | 0 | 11.7 Ų | 11.7 | 0% | 0 | 6% | 0.06 | C | C | . | . | H | α-helix | trans | -67 | -32.6 | 177.3 | 55.4 | 0 | 0 | 0 | 0 | 112.5 | V214 I218 T224 I227 M228 M270 I271 H277 F278 | V214-T274 HydrophobicContact CG1-CG2 4.04Å; I218-T274 HydrophobicContact CD1-CG2 3.97Å; I218-T274 HydrophobicContact CG2-CG2 4.27Å; T224-T274 HydrophobicContact CG2-CG2 4.08Å; T224-T274 WeakPolarHBondContact CG2-O 3.49Å; I227-T274 HydrophobicContact CB-CG2 4.02Å; I227-T274 HydrophobicContact CG2-CG2 3.79Å; M228-T274 HydrophobicContact CB-CG2 4.45Å; M228-T274 WeakPolarHBondContact CB-OG1 3.28Å; M228-T274 VanDerWaalsContact CE-C 3.49Å; M228-T274 WeakPolarHBondContact CE-OG1 3.32Å; M270-T274 VanDerWaalsContact O-CB 3.29Å; M270-T274 WeakPolarHBondContact O-CB 3.49Å; M270-T274 WeakPolarHBondContact O-CG2 3.35Å; M270-T274 PolarHBondContact O-N 3.2Å; M270-T274 VanDerWaalsContact O-N 3.08Å; M270-T274 PolarHBondContact O-OG1 3.16Å; I271-T274 PolarHBondContact O-OG1 3.28Å; I271-T274 VanDerWaalsContact O-OG1 3.11Å; T274-H277 PolarHBondContact O-N 2.92Å; T274-F278 VanDerWaalsContact O-CB 3.22Å; T274-F278 WeakPolarHBondContact O-CB 3.46Å; T274-F278 PolarHBondContact O-N 3.4Å |
| 275 | S | 96.2 | Very high | 94.9 | Very high | 1 Ų | 1 | 19.1 Ų | 19.1 | 1% | 0.007 | 9% | 0.088 | C | C | . | . | H | α-helix | trans | -63.6 | -46 | 178.9 | -65.2 | 0 | 0 | 0 | 0 | 112.2 | A164 V168 I271 V272 V273 C279 | A164-S275 WeakPolarHBondContact O-CB 3.03Å; V168-S275 PolarHBondContact N-OG 3.21Å; I271-S275 VanDerWaalsContact O-CB 3.23Å; I271-S275 WeakPolarHBondContact O-CB 3.41Å; I271-S275 PolarHBondContact O-N 2.98Å; I271-S275 PolarHBondContact O-OG 2.84Å; V272-S275 PolarHBondContact O-N 2.9Å; V273-S275 VanDerWaalsContact C-N 3.32Å; V273-S275 PolarHBondContact O-N 2.99Å; S275-C279 VanDerWaalsContact O-CB 3.25Å; S275-C279 WeakPolarHBondContact O-CB 3.5Å; S275-C279 PolarHBondContact O-N 3.03Å |
| 276 | F | 95.8 | Very high | 94.5 | Very high | 0 Ų | 0 | 21.7 Ų | 21.7 | 0% | 0 | 11% | 0.105 | C | C | . | . | H | α-helix | trans | -62.7 | -48.9 | 175.6 | -178.3 | -96.4 | 0 | 0 | 0 | 111.4 | V74 A78 A85 I89 V272 F278 C279 L280 Y302 | V74-F276 HydrophobicContact CG1-CD2 4.22Å; V74-F276 HydrophobicContact CG1-CE2 3.57Å; V74-F276 HydrophobicContact CG1-CZ 4Å; A78-F276 HydrophobicContact CB-CE1 3.93Å; A78-F276 HydrophobicContact CB-CZ 3.74Å; A85-F276 HydrophobicContact CB-CE1 4.4Å; I89-F276 HydrophobicContact CB-CD1 4.49Å; I89-F276 HydrophobicContact CD1-CE1 4.35Å; I89-F276 HydrophobicContact CD1-CZ 4.49Å; I89-F276 HydrophobicContact CG1-CD1 3.6Å; I89-F276 HydrophobicContact CG1-CE1 3.7Å; I89-F276 HydrophobicContact CG1-CG 4.09Å; I89-F276 HydrophobicContact CG1-CZ 4.28Å; V272-F276 PolarHBondContact O-N 3.48Å; F276-F278 PolarHBondContact O-N 3Å; F276-C279 WeakPolarHBondContact O-CB 3.35Å; F276-C279 PolarHBondContact O-N 3.28Å; F276-L280 HydrophobicContact CE1-CD2 4.14Å; F276-L280 WeakPolarHBondContact O-CB 3.41Å; F276-L280 PolarHBondContact O-N 3.19Å; F276-Y302 HydrophobicContact CB-CD2 3.82Å; F276-Y302 HydrophobicContact CB-CE1 4.47Å; F276-Y302 HydrophobicContact CB-CE2 3.66Å; F276-Y302 HydrophobicContact CB-CG 4.29Å; F276-Y302 AromaticContact CD2-CD1 3.82Å; F276-Y302 HydrophobicContact CD2-CD1 3.82Å; F276-Y302 HydrophobicContact CD2-CD2 4.06Å; F276-Y302 HydrophobicContact CD2-CE1 4.29Å; F276-Y302 AromaticContact CD2-CG 3.67Å; F276-Y302 HydrophobicContact CD2-CG 3.67Å; F276-Y302 HydrophobicContact CG-CD2 4.47Å; F276-Y302 HydrophobicContact CG-CG 4.47Å |
| 277 | H | 95.9 | Very high | 94 | Very high | 19 Ų | 19 | 21.8 Ų | 21.8 | 9% | 0.088 | 12% | 0.122 | C | C | . | . | H | α-helix | trans | -60.6 | -43.9 | -178.8 | -175.9 | -106.6 | 0 | 0 | 0 | 112.1 | A86 I218 D219 T224 V273 T274 N281 | A86-H277 HydrophobicContact CB-CB 4.05Å; I218-H277 HydrophobicContact CD1-CB 3.57Å; I218-H277 HydrophobicContact CG1-CB 4.41Å; I218-H277 PolarHBondContact O-CE1 2.84Å; I218-H277 VanDerWaalsContact O-CE1 3.27Å; D219-H277 IonicContact OD1-CD2 3.96Å; T224-H277 HydrophobicContact CG2-CB 4.28Å; T224-H277 PolarHBondContact OG1-CE1 2.92Å; T224-H277 PolarHBondContact OG1-ND1 3.34Å; V273-H277 PolarHBondContact O-N 2.95Å; T274-H277 PolarHBondContact O-N 2.92Å; H277-N281 PolarHBondContact CD2-ND2 2.95Å; H277-N281 PolarHBondContact CE1-ND2 2.81Å; H277-N281 PolarHBondContact ND1-ND2 3.34Å; H277-N281 PolarHBondContact NE2-ND2 3.5Å; H277-N281 WeakPolarHBondContact O-CB 3.48Å; H277-N281 PolarHBondContact O-N 3.47Å; H277-N281 PolarHBondContact O-ND2 2.83Å |
| 278 | F | 95.9 | Very high | 93.6 | Very high | 12 Ų | 12 | 22.7 Ų | 22.7 | 5% | 0.053 | 13% | 0.126 | C | C | . | . | H | α-helix | trans | -65.7 | -44.8 | 177.1 | -170.3 | -118.4 | 0 | 0 | 0 | 111.2 | D160 F163 A164 T224 L225 M228 T274 F276 L280 N281 S282 R285 | D160-F278 HydrophobicContact CB-CE1 3.92Å; D160-F278 HydrophobicContact CB-CZ 3.9Å; D160-F278 VanDerWaalsContact O-CE1 3.26Å; D160-F278 WeakPolarHBondContact O-CE1 3.32Å; F163-F278 HydrophobicContact CD1-CD1 4.37Å; F163-F278 AromaticContact CD1-CE1 3.99Å; F163-F278 HydrophobicContact CD1-CE1 3.99Å; A164-F278 HydrophobicContact CB-CB 4.45Å; A164-F278 HydrophobicContact CB-CD1 3.8Å; T224-F278 HydrophobicContact CG2-CB 3.95Å; L225-F278 HydrophobicContact CD1-CE2 3.79Å; L225-F278 HydrophobicContact CD1-CZ 4.08Å; L225-F278 HydrophobicContact CD2-CD1 4.19Å; L225-F278 HydrophobicContact CD2-CD2 3.94Å; L225-F278 HydrophobicContact CD2-CE1 3.97Å; L225-F278 HydrophobicContact CD2-CE2 3.66Å; L225-F278 HydrophobicContact CD2-CG 4.21Å; L225-F278 HydrophobicContact CD2-CZ 3.71Å; L225-F278 HydrophobicContact CG-CD2 4.06Å; L225-F278 HydrophobicContact CG-CE2 3.71Å; L225-F278 HydrophobicContact CG-CZ 4.18Å; M228-F278 HydrophobicContact CE-CB 4.23Å; T274-F278 VanDerWaalsContact O-CB 3.22Å; T274-F278 WeakPolarHBondContact O-CB 3.46Å; T274-F278 PolarHBondContact O-N 3.4Å; F276-F278 PolarHBondContact O-N 3Å; F278-L280 PolarHBondContact O-N 3.39Å; F278-N281 PolarHBondContact O-N 2.95Å; F278-S282 VanDerWaalsContact O-CB 3.23Å; F278-S282 WeakPolarHBondContact O-CB 3.3Å; F278-S282 PolarHBondContact O-N 3.29Å; F278-S282 PolarHBondContact O-OG 2.95Å; F278-R285 VanDerWaalsContact CE2-NH2 3.35Å |
| 279 | C | 95.6 | Very high | 93.3 | Very high | 0 Ų | 0 | 25.1 Ų | 25.1 | 0% | 0 | 15% | 0.147 | C | C | . | . | H | α-helix | trans | -55.7 | -52.5 | 176 | -177.1 | 0 | 0 | 0 | 0 | 111.6 | A164 S275 F276 S282 M283 | A164-C279 HydrophobicContact CB-CB 3.7Å; S275-C279 VanDerWaalsContact O-CB 3.25Å; S275-C279 WeakPolarHBondContact O-CB 3.5Å; S275-C279 PolarHBondContact O-N 3.03Å; F276-C279 WeakPolarHBondContact O-CB 3.35Å; F276-C279 PolarHBondContact O-N 3.28Å; C279-S282 PolarHBondContact O-N 3.16Å; C279-M283 WeakPolarHBondContact O-CG 3.41Å; C279-M283 PolarHBondContact O-N 2.91Å |
| 280 | L | 94.5 | Very high | 92.9 | Very high | 3 Ų | 3 | 29.9 Ų | 29.9 | 2% | 0.016 | 17% | 0.172 | C | C | . | . | H | α-helix | trans | -61.5 | -50 | -178.4 | 179.3 | 63.9 | 0 | 0 | 0 | 111.6 | A85 F276 F278 S282 M283 L284 Y295 A298 | A85-L280 HydrophobicContact CB-CD2 4.09Å; F276-L280 HydrophobicContact CE1-CD2 4.14Å; F276-L280 WeakPolarHBondContact O-CB 3.41Å; F276-L280 PolarHBondContact O-N 3.19Å; F278-L280 PolarHBondContact O-N 3.39Å; L280-S282 VanDerWaalsContact C-N 3.29Å; L280-S282 PolarHBondContact O-N 3.42Å; L280-M283 WeakPolarHBondContact O-CB 3.19Å; L280-M283 PolarHBondContact O-N 2.89Å; L280-L284 HydrophobicContact CG-CD1 4.38Å; L280-L284 WeakPolarHBondContact O-CG 3.48Å; L280-L284 PolarHBondContact O-N 3.43Å; L280-Y295 HydrophobicContact CD1-CD1 3.98Å; L280-Y295 HydrophobicContact CD1-CD2 4.47Å; L280-Y295 HydrophobicContact CD1-CE1 4.03Å; L280-Y295 HydrophobicContact CD1-CE2 4.49Å; L280-Y295 HydrophobicContact CD1-CG 4.21Å; L280-Y295 HydrophobicContact CD2-CD1 3.91Å; L280-Y295 HydrophobicContact CD2-CE1 3.46Å; L280-Y295 VanDerWaalsContact CD2-CE1 3.46Å; L280-Y295 HydrophobicContact CG-CE1 4.35Å; L280-A298 HydrophobicContact CB-CB 4.48Å; L280-A298 HydrophobicContact CD1-CB 4.09Å |
| 281 | N | 93.5 | Very high | 92.6 | Very high | 51 Ų | 51 | 28.8 Ų | 28.8 | 27% | 0.273 | 17% | 0.168 | S | C | . | . | H | α-helix | trans | -65.6 | -31.7 | -180 | -75.4 | -31.6 | 0 | 0 | 0 | 112.9 | H277 F278 R285 | H277-N281 PolarHBondContact CD2-ND2 2.95Å; H277-N281 PolarHBondContact CE1-ND2 2.81Å; H277-N281 PolarHBondContact ND1-ND2 3.34Å; H277-N281 PolarHBondContact NE2-ND2 3.5Å; H277-N281 WeakPolarHBondContact O-CB 3.48Å; H277-N281 PolarHBondContact O-N 3.47Å; H277-N281 PolarHBondContact O-ND2 2.83Å; F278-N281 PolarHBondContact O-N 2.95Å; N281-R285 WeakPolarHBondContact O-CB 3.32Å; N281-R285 VanDerWaalsContact O-CG 3.24Å; N281-R285 WeakPolarHBondContact O-CG 3.08Å; N281-R285 PolarHBondContact O-N 3.25Å; N281-R285 PolarHBondContact O-NE 3.37Å |
| 282 | S | 93 | Very high | 92.4 | Very high | 0 Ų | 0 | 28.9 Ų | 28.9 | 0% | 0 | 17% | 0.169 | C | C | . | . | H | α-helix | trans | -70.1 | -36.6 | 174.7 | -64.4 | 0 | 0 | 0 | 0 | 112.1 | D160 F278 C279 L280 R285 C286 | D160-S282 WeakPolarHBondContact CB-OG 3.45Å; F278-S282 VanDerWaalsContact O-CB 3.23Å; F278-S282 WeakPolarHBondContact O-CB 3.3Å; F278-S282 PolarHBondContact O-N 3.29Å; F278-S282 PolarHBondContact O-OG 2.95Å; C279-S282 PolarHBondContact O-N 3.16Å; L280-S282 VanDerWaalsContact C-N 3.29Å; L280-S282 PolarHBondContact O-N 3.42Å; S282-R285 PolarHBondContact O-N 2.89Å; S282-R285 PolarHBondContact OG-NH2 3.09Å; S282-C286 WeakPolarHBondContact O-CB 3.41Å; S282-C286 PolarHBondContact O-N 3.44Å; S282-C286 PolarHBondContact O-SG 3.49Å |
| 283 | M | 92.3 | Very high | 92.1 | Very high | 0 Ų | 0 | 30.2 Ų | 30.2 | 0% | 0 | 18% | 0.175 | C | C | . | . | H | α-helix | trans | -63 | -47.1 | 171.6 | -69.8 | -179.7 | 69.8 | 0 | 0 | 111.5 | V155 V161 C279 L280 R285 C286 Y288 T294 L297 A298 | V155-M283 HydrophobicContact CG1-CE 4.46Å; V155-M283 HydrophobicContact CG2-CE 4.15Å; V155-M283 HydrophobicContact CG2-CG 3.83Å; V155-M283 HydrophobicContact CG2-SD 4.49Å; V161-M283 HydrophobicContact CG2-CG 4.02Å; C279-M283 WeakPolarHBondContact O-CG 3.41Å; C279-M283 PolarHBondContact O-N 2.91Å; L280-M283 WeakPolarHBondContact O-CB 3.19Å; L280-M283 PolarHBondContact O-N 2.89Å; M283-R285 PolarHBondContact O-N 3.31Å; M283-C286 WeakPolarHBondContact O-CB 3.32Å; M283-C286 PolarHBondContact O-N 3.3Å; M283-C286 VanDerWaalsContact O-N 3.14Å; M283-Y288 HydrophobicContact CE-CD1 4.34Å; M283-Y288 WeakPolarHBondContact O-CB 3.35Å; M283-Y288 WeakPolarHBondContact O-CD2 3.09Å; M283-Y288 PolarHBondContact O-N 3.45Å; M283-T294 HydrophobicContact CB-CG2 4.09Å; M283-T294 HydrophobicContact CE-CG2 4.02Å; M283-L297 HydrophobicContact CE-CB 3.65Å; M283-L297 HydrophobicContact CE-CD1 4.19Å; M283-A298 HydrophobicContact SD-CB 3.71Å |
| 284 | L | 91 | Very high | 91.9 | Very high | 48 Ų | 48 | 30.3 Ų | 30.3 | 25% | 0.251 | 18% | 0.176 | S | C | . | . | H | α-helix | trans | -60.7 | -42.7 | 176.7 | -65.3 | 173.8 | 0 | 0 | 0 | 111.7 | L280 C286 G287 D290 T294 | L280-L284 HydrophobicContact CG-CD1 4.38Å; L280-L284 WeakPolarHBondContact O-CG 3.48Å; L280-L284 PolarHBondContact O-N 3.43Å; L284-C286 VanDerWaalsContact C-N 3.28Å; L284-C286 PolarHBondContact O-N 2.98Å; L284-G287 PolarHBondContact O-N 3.48Å; L284-G287 VanDerWaalsContact O-N 3.07Å; L284-D290 HydrophobicContact CD2-CB 4.14Å; L284-T294 HydrophobicContact CD2-CG2 4.15Å |
| 285 | R | 89.7 | Confident | 91.8 | Very high | 157 Ų | 157 | 30.5 Ų | 30.5 | 59% | 0.592 | 18% | 0.176 | S | C | * | . | H | α-helix | trans | -64.6 | -28.5 | 175.1 | -76.6 | -179.5 | -72.4 | 169.3 | 1.8 | 113.6 | F278 N281 S282 M283 G287 | F278-R285 VanDerWaalsContact CE2-NH2 3.35Å; N281-R285 WeakPolarHBondContact O-CB 3.32Å; N281-R285 VanDerWaalsContact O-CG 3.24Å; N281-R285 WeakPolarHBondContact O-CG 3.08Å; N281-R285 PolarHBondContact O-N 3.25Å; N281-R285 PolarHBondContact O-NE 3.37Å; S282-R285 PolarHBondContact O-N 2.89Å; S282-R285 PolarHBondContact OG-NH2 3.09Å; M283-R285 PolarHBondContact O-N 3.31Å; R285-G287 PolarHBondContact O-N 2.94Å |
| 286 | C | 87.1 | Confident | 91.7 | Very high | 53 Ų | 53 | 30.5 Ų | 30.5 | 36% | 0.358 | 18% | 0.176 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -75 | 2.9 | 173.7 | -71.2 | 0 | 0 | 0 | 0 | 113.7 | S282 M283 L284 Y288 | S282-C286 WeakPolarHBondContact O-CB 3.41Å; S282-C286 PolarHBondContact O-N 3.44Å; S282-C286 PolarHBondContact O-SG 3.49Å; M283-C286 WeakPolarHBondContact O-CB 3.32Å; M283-C286 PolarHBondContact O-N 3.3Å; M283-C286 VanDerWaalsContact O-N 3.14Å; L284-C286 VanDerWaalsContact C-N 3.28Å; L284-C286 PolarHBondContact O-N 2.98Å; C286-Y288 HydrophobicContact CB-CD2 4.08Å; C286-Y288 HydrophobicContact CB-CE2 4.28Å |
| 287 | G | 85.8 | Confident | 91.6 | Very high | 69 Ų | 69 | 30.6 Ų | 30.6 | 71% | 0.711 | 18% | 0.176 | S | C | * | . | T | Hydrogen-bonded Turn | trans | 90.8 | 10.2 | 177.7 | 0 | 0 | 0 | 0 | 0 | 114.7 | L284 R285 | L284-G287 PolarHBondContact O-N 3.48Å; L284-G287 VanDerWaalsContact O-N 3.07Å; R285-G287 PolarHBondContact O-N 2.94Å |
| 288 | Y | 87.9 | Confident | 91.5 | Very high | 20 Ų | 20 | 29.7 Ų | 29.7 | 8% | 0.078 | 17% | 0.172 | C | C | . | . | trans | -68.9 | 135.7 | 170.6 | -73.9 | -107.8 | 0 | 0 | 0 | 109.5 | V155 M283 C286 | V155-Y288 HydrophobicContact CB-CE2 4.45Å; V155-Y288 HydrophobicContact CG2-CD2 4.44Å; V155-Y288 HydrophobicContact CG2-CE1 4.43Å; V155-Y288 HydrophobicContact CG2-CE2 3.71Å; M283-Y288 HydrophobicContact CE-CD1 4.34Å; M283-Y288 WeakPolarHBondContact O-CB 3.35Å; M283-Y288 WeakPolarHBondContact O-CD2 3.09Å; M283-Y288 PolarHBondContact O-N 3.45Å; C286-Y288 HydrophobicContact CB-CD2 4.08Å; C286-Y288 HydrophobicContact CB-CE2 4.28Å | ||
| 289 | A | 87.6 | Confident | 91.5 | Very high | 58 Ų | 58 | 29.1 Ų | 29.1 | 48% | 0.479 | 17% | 0.17 | S | C | . | . | trans | -62.5 | 143.3 | 180 | 0 | 0 | 0 | 0 | 0 | 111.7 | S291 T294 | A289-S291 PolarHBondContact O-N 3.04Å; A289-S291 PolarHBondContact O-OG 3.44Å; A289-T294 WeakPolarHBondContact O-CB 3.35Å; A289-T294 PolarHBondContact O-OG1 2.91Å | ||
| 290 | D | 88.8 | Confident | 91.5 | Very high | 100 Ų | 100 | 29.1 Ų | 29.1 | 54% | 0.535 | 17% | 0.17 | S | C | . | . | S | Bend | trans | -70.2 | 80.1 | 170.5 | -168.7 | 16.5 | 0 | 0 | 0 | 109.5 | L284 Y295 | L284-D290 HydrophobicContact CD2-CB 4.14Å; D290-Y295 WeakPolarHBondContact OD1-CE2 3.46Å; D290-Y295 PolarHBondContact OD1-OH 3.27Å |
| 291 | S | 89.7 | Confident | 91.6 | Very high | 12 Ų | 12 | 29.3 Ų | 29.3 | 8% | 0.084 | 17% | 0.17 | C | C | . | . | S | Bend | trans | -141.2 | 156 | -168.9 | 70.8 | 0 | 0 | 0 | 0 | 110.2 | A289 H293 T294 Y295 | A289-S291 PolarHBondContact O-N 3.04Å; A289-S291 PolarHBondContact O-OG 3.44Å; S291-H293 PolarHBondContact O-N 3.07Å; S291-T294 PolarHBondContact O-N 3.49Å; S291-Y295 WeakPolarHBondContact O-CD2 3.28Å; S291-Y295 PolarHBondContact O-N 3.05Å |
| 292 | F | 91 | Very high | 91.7 | Very high | 2 Ų | 2 | 27 Ų | 27 | 1% | 0.009 | 16% | 0.158 | C | C | . | . | H | α-helix | trans | -52.5 | -33.7 | 179.7 | -174.9 | -99.9 | 0 | 0 | 0 | 113 | M16 S21 I76 F79 L140 T142 T294 Y295 S296 | M16-F292 HydrophobicContact CB-CE1 4.35Å; M16-F292 HydrophobicContact CG-CE1 3.95Å; M16-F292 HydrophobicContact CG-CZ 4.28Å; M16-F292 HydrophobicContact SD-CE1 3.83Å; M16-F292 HydrophobicContact SD-CZ 3.6Å; M16-F292 VanDerWaalsContact SD-CZ 3.6Å; S21-F292 VanDerWaalsContact CB-CZ 3.42Å; I76-F292 HydrophobicContact CG1-CE2 4.5Å; F79-F292 HydrophobicContact CB-CD2 3.82Å; F79-F292 HydrophobicContact CB-CE2 4.29Å; F79-F292 HydrophobicContact CD1-CB 4.49Å; F79-F292 AromaticContact CD1-CD2 3.78Å; F79-F292 HydrophobicContact CD1-CD2 3.78Å; F79-F292 HydrophobicContact CD2-CB 4.07Å; F79-F292 HydrophobicContact CD2-CD2 4.23Å; F79-F292 HydrophobicContact CE1-CB 4.38Å; F79-F292 HydrophobicContact CE1-CD2 4.36Å; F79-F292 HydrophobicContact CE2-CB 4Å; F79-F292 HydrophobicContact CG-CB 4.3Å; F79-F292 AromaticContact CG-CD2 3.66Å; F79-F292 HydrophobicContact CG-CD2 3.66Å; F79-F292 HydrophobicContact CG-CG 4.49Å; F79-F292 HydrophobicContact CZ-CB 4.14Å; L140-F292 HydrophobicContact CD2-CD2 3.76Å; L140-F292 HydrophobicContact CD2-CE2 3.79Å; T142-F292 HydrophobicContact CG2-CB 4.26Å; T142-F292 HydrophobicContact CG2-CD1 3.54Å; T142-F292 HydrophobicContact CG2-CD2 4.19Å; T142-F292 HydrophobicContact CG2-CE1 3.93Å; T142-F292 HydrophobicContact CG2-CG 3.7Å; T142-F292 HydrophobicContact CG2-CZ 4.42Å; F292-T294 PolarHBondContact O-N 3.48Å; F292-Y295 PolarHBondContact O-N 2.92Å; F292-S296 WeakPolarHBondContact O-CB 3.26Å; F292-S296 PolarHBondContact O-N 3.11Å; F292-S296 PolarHBondContact O-OG 3.34Å |
| 293 | H | 90.5 | Very high | 91.9 | Very high | 30 Ų | 30 | 27.2 Ų | 27.2 | 14% | 0.139 | 16% | 0.159 | C | C | . | . | H | α-helix | trans | -62.5 | -39.1 | 177 | -175.6 | 61.4 | 0 | 0 | 0 | 113.2 | R14 S291 S296 L297 | R14-H293 PolarHBondContact O-CE1 3.22Å; S291-H293 PolarHBondContact O-N 3.07Å; H293-S296 WeakPolarHBondContact CA-OG 3.47Å; H293-S296 PolarHBondContact O-N 3.32Å; H293-S296 PolarHBondContact O-OG 3.38Å; H293-L297 WeakPolarHBondContact NE2-CD1 3.38Å; H293-L297 WeakPolarHBondContact O-CB 3.24Å; H293-L297 WeakPolarHBondContact O-CG 3.1Å; H293-L297 PolarHBondContact O-N 3.1Å |
| 294 | T | 91.8 | Very high | 92.1 | Very high | 2 Ų | 2 | 27.7 Ų | 27.7 | 1% | 0.012 | 16% | 0.163 | C | C | . | . | H | α-helix | trans | -68.3 | -42.8 | 178.4 | -57.5 | 0 | 0 | 0 | 0 | 111 | M283 L284 A289 S291 F292 S296 L297 A298 | M283-T294 HydrophobicContact CB-CG2 4.09Å; M283-T294 HydrophobicContact CE-CG2 4.02Å; L284-T294 HydrophobicContact CD2-CG2 4.15Å; A289-T294 WeakPolarHBondContact O-CB 3.35Å; A289-T294 PolarHBondContact O-OG1 2.91Å; S291-T294 PolarHBondContact O-N 3.49Å; F292-T294 PolarHBondContact O-N 3.48Å; T294-S296 VanDerWaalsContact C-N 3.32Å; T294-S296 PolarHBondContact O-N 3.13Å; T294-L297 PolarHBondContact O-N 3.13Å; T294-A298 WeakPolarHBondContact O-CB 3.29Å; T294-A298 PolarHBondContact O-N 3.49Å |
| 295 | Y | 93.5 | Very high | 92.3 | Very high | 4 Ų | 4 | 25.7 Ų | 25.7 | 2% | 0.016 | 15% | 0.154 | C | C | . | . | H | α-helix | trans | -64.3 | -38.6 | 174.6 | -72.3 | -101.3 | 0 | 0 | 0 | 111.5 | A78 F79 P82 L280 D290 S291 F292 A298 S299 | A78-Y295 VanDerWaalsContact C-CD1 3.49Å; A78-Y295 HydrophobicContact CB-CD1 3.63Å; A78-Y295 HydrophobicContact CB-CE1 4.2Å; A78-Y295 VanDerWaalsContact O-CE1 3.28Å; A78-Y295 WeakPolarHBondContact O-CE1 3.28Å; F79-Y295 HydrophobicContact CB-CD1 4.28Å; F79-Y295 HydrophobicContact CB-CD2 4.32Å; F79-Y295 HydrophobicContact CB-CG 4.01Å; F79-Y295 AromaticContact CD2-CD2 3.7Å; F79-Y295 HydrophobicContact CD2-CD2 3.7Å; F79-Y295 AromaticContact CD2-CE2 3.98Å; F79-Y295 HydrophobicContact CD2-CE2 3.98Å; F79-Y295 HydrophobicContact CD2-CG 4.25Å; P82-Y295 HydrophobicContact CB-CE1 4.47Å; P82-Y295 WeakPolarHBondContact CB-OH 3.41Å; L280-Y295 HydrophobicContact CD1-CD1 3.98Å; L280-Y295 HydrophobicContact CD1-CD2 4.47Å; L280-Y295 HydrophobicContact CD1-CE1 4.03Å; L280-Y295 HydrophobicContact CD1-CE2 4.49Å; L280-Y295 HydrophobicContact CD1-CG 4.21Å; L280-Y295 HydrophobicContact CD2-CD1 3.91Å; L280-Y295 HydrophobicContact CD2-CE1 3.46Å; L280-Y295 VanDerWaalsContact CD2-CE1 3.46Å; L280-Y295 HydrophobicContact CG-CE1 4.35Å; D290-Y295 WeakPolarHBondContact OD1-CE2 3.46Å; D290-Y295 PolarHBondContact OD1-OH 3.27Å; S291-Y295 WeakPolarHBondContact O-CD2 3.28Å; S291-Y295 PolarHBondContact O-N 3.05Å; F292-Y295 PolarHBondContact O-N 2.92Å; Y295-A298 PolarHBondContact O-N 2.79Å; Y295-S299 VanDerWaalsContact O-CB 3.24Å; Y295-S299 WeakPolarHBondContact O-CB 3.25Å; Y295-S299 PolarHBondContact O-N 3.4Å; Y295-S299 PolarHBondContact O-OG 3.36Å |
| 296 | S | 93.7 | Very high | 92.6 | Very high | 0 Ų | 0 | 19.4 Ų | 19.4 | 0% | 0 | 13% | 0.132 | C | C | . | . | H | α-helix | trans | -69.1 | -37.9 | 178.9 | 72.9 | 0 | 0 | 0 | 0 | 112.5 | G13 S75 F292 H293 T294 G300 | G13-S296 WeakPolarHBondContact CA-O 3.5Å; G13-S296 CarbonylContact O-C 3.43Å; G13-S296 VanDerWaalsContact O-CB 3.23Å; G13-S296 WeakPolarHBondContact O-CB 3.04Å; G13-S296 PolarHBondContact O-OG 2.94Å; S75-S296 WeakPolarHBondContact OG-CA 3.13Å; F292-S296 WeakPolarHBondContact O-CB 3.26Å; F292-S296 PolarHBondContact O-N 3.11Å; F292-S296 PolarHBondContact O-OG 3.34Å; H293-S296 WeakPolarHBondContact CA-OG 3.47Å; H293-S296 PolarHBondContact O-N 3.32Å; H293-S296 PolarHBondContact O-OG 3.38Å; T294-S296 VanDerWaalsContact C-N 3.32Å; T294-S296 PolarHBondContact O-N 3.13Å; S296-G300 PolarHBondContact O-N 3.08Å |
| 297 | L | 94 | Very high | 93.1 | Very high | 2 Ų | 2 | 17 Ų | 17 | 1% | 0.01 | 12% | 0.115 | C | C | . | . | H | α-helix | trans | -62.8 | -51.3 | 170.9 | -76.2 | 179.7 | 0 | 0 | 0 | 112.1 | R14 A152 M283 H293 T294 S299 G300 F301 | R14-L297 HydrophobicContact CB-CD2 3.84Å; R14-L297 HydrophobicContact CG-CD2 4.37Å; A152-L297 HydrophobicContact CB-CD1 3.88Å; A152-L297 HydrophobicContact CB-CD2 3.51Å; A152-L297 HydrophobicContact CB-CG 4.37Å; M283-L297 HydrophobicContact CE-CB 3.65Å; M283-L297 HydrophobicContact CE-CD1 4.19Å; H293-L297 WeakPolarHBondContact NE2-CD1 3.38Å; H293-L297 WeakPolarHBondContact O-CB 3.24Å; H293-L297 WeakPolarHBondContact O-CG 3.1Å; H293-L297 PolarHBondContact O-N 3.1Å; T294-L297 PolarHBondContact O-N 3.13Å; L297-S299 VanDerWaalsContact C-N 3.3Å; L297-S299 PolarHBondContact O-N 3.14Å; L297-G300 PolarHBondContact O-N 2.85Å; L297-F301 HydrophobicContact CB-CE2 4.36Å; L297-F301 HydrophobicContact CD2-CE2 4.33Å; L297-F301 WeakPolarHBondContact O-CD2 3.39Å; L297-F301 PolarHBondContact O-N 3.26Å |
| 298 | A | 94.8 | Very high | 93.6 | Very high | 0 Ų | 0 | 15.8 Ų | 15.8 | 0% | 0 | 9% | 0.092 | C | C | . | . | H | α-helix | trans | -56.7 | -45.8 | 178.1 | 0 | 0 | 0 | 0 | 0 | 111.3 | L280 M283 T294 Y295 G300 F301 Y302 | L280-A298 HydrophobicContact CB-CB 4.48Å; L280-A298 HydrophobicContact CD1-CB 4.09Å; M283-A298 HydrophobicContact SD-CB 3.71Å; T294-A298 WeakPolarHBondContact O-CB 3.29Å; T294-A298 PolarHBondContact O-N 3.49Å; Y295-A298 PolarHBondContact O-N 2.79Å; A298-G300 PolarHBondContact O-N 3.48Å; A298-F301 PolarHBondContact O-N 3.4Å; A298-Y302 WeakPolarHBondContact O-CB 3.22Å; A298-Y302 PolarHBondContact O-N 3.23Å |
| 299 | S | 95.2 | Very high | 94 | Very high | 0 Ų | 0 | 14.9 Ų | 14.9 | 0% | 0 | 9% | 0.089 | C | C | . | . | H | α-helix | trans | -64 | -40.6 | 178.1 | -57.4 | 0 | 0 | 0 | 0 | 112.7 | V74 S75 Y295 L297 T303 | V74-S299 VanDerWaalsContact CG1-OG 3.28Å; V74-S299 WeakPolarHBondContact CG1-OG 3.36Å; S75-S299 WeakPolarHBondContact CA-OG 3.31Å; S75-S299 PolarHBondContact N-OG 3.42Å; S75-S299 WeakPolarHBondContact OG-CB 3.36Å; S75-S299 PolarHBondContact OG-OG 3.42Å; Y295-S299 VanDerWaalsContact O-CB 3.24Å; Y295-S299 WeakPolarHBondContact O-CB 3.25Å; Y295-S299 PolarHBondContact O-N 3.4Å; Y295-S299 PolarHBondContact O-OG 3.36Å; L297-S299 VanDerWaalsContact C-N 3.3Å; L297-S299 PolarHBondContact O-N 3.14Å; S299-T303 VanDerWaalsContact O-CB 3.31Å; S299-T303 WeakPolarHBondContact O-CB 3.03Å; S299-T303 PolarHBondContact O-N 2.75Å; S299-T303 PolarHBondContact O-OG1 3.49Å |
| 300 | G | 96.2 | Very high | 94.4 | Very high | 0 Ų | 0 | 12.7 Ų | 12.7 | 0% | 0 | 7% | 0.071 | C | C | . | . | H | α-helix | trans | -64.4 | -45.9 | 178.2 | 0 | 0 | 0 | 0 | 0 | 112.2 | S9 T71 S296 L297 A298 S304 | S9-G300 CarbonylContact C-O 3.31Å; S9-G300 VanDerWaalsContact CB-O 3.24Å; S9-G300 WeakPolarHBondContact CB-O 3.45Å; S9-G300 VanDerWaalsContact O-CA 3.22Å; S9-G300 WeakPolarHBondContact O-CA 3.32Å; T71-G300 VanDerWaalsContact CG2-CA 3.48Å; S296-G300 PolarHBondContact O-N 3.08Å; L297-G300 PolarHBondContact O-N 2.85Å; A298-G300 PolarHBondContact O-N 3.48Å; G300-S304 WeakPolarHBondContact O-CB 3.42Å; G300-S304 PolarHBondContact O-N 2.86Å |
| 301 | F | 96 | Very high | 94.7 | Very high | 7 Ų | 7 | 11.6 Ų | 11.6 | 3% | 0.031 | 6% | 0.061 | C | C | . | . | H | α-helix | trans | -68.3 | -41.3 | 175.8 | -65.7 | -50.5 | 0 | 0 | 0 | 112.6 | P10 W153 V155 L156 L165 L297 A298 S304 G305 | P10-F301 HydrophobicContact CB-CD1 3.92Å; P10-F301 HydrophobicContact CB-CE1 3.81Å; P10-F301 HydrophobicContact CG-CD1 4.14Å; P10-F301 HydrophobicContact CG-CE1 4.44Å; W153-F301 AromaticContact CE3-CE1 3.95Å; W153-F301 HydrophobicContact CE3-CE1 3.95Å; W153-F301 HydrophobicContact CE3-CZ 4.3Å; W153-F301 AromaticContact CZ3-CE1 3.86Å; W153-F301 HydrophobicContact CZ3-CE1 3.86Å; V155-F301 HydrophobicContact CG1-CD2 4.06Å; V155-F301 HydrophobicContact CG1-CE2 3.41Å; V155-F301 VanDerWaalsContact CG1-CE2 3.41Å; V155-F301 HydrophobicContact CG1-CZ 4.1Å; L156-F301 HydrophobicContact CD1-CD1 4.23Å; L156-F301 HydrophobicContact CD1-CE1 3.7Å; L156-F301 HydrophobicContact CD1-CZ 4.21Å; L156-F301 HydrophobicContact CD2-CD1 3.66Å; L156-F301 HydrophobicContact CD2-CD2 4.16Å; L156-F301 HydrophobicContact CD2-CE1 3.76Å; L156-F301 HydrophobicContact CD2-CE2 4.26Å; L156-F301 HydrophobicContact CD2-CG 3.87Å; L156-F301 HydrophobicContact CD2-CZ 4.06Å; L156-F301 HydrophobicContact CG-CD1 4.26Å; L156-F301 HydrophobicContact CG-CE1 3.84Å; L156-F301 HydrophobicContact CG-CE2 4.49Å; L156-F301 HydrophobicContact CG-CZ 3.97Å; L165-F301 HydrophobicContact CD1-CB 3.72Å; L165-F301 HydrophobicContact CD1-CG 4.29Å; L165-F301 VanDerWaalsContact CD2-C 3.44Å; L165-F301 HydrophobicContact CD2-CB 3.71Å; L165-F301 WeakPolarHBondContact CD2-O 3.48Å; L165-F301 HydrophobicContact CG-CB 4.36Å; L297-F301 HydrophobicContact CB-CE2 4.36Å; L297-F301 HydrophobicContact CD2-CE2 4.33Å; L297-F301 WeakPolarHBondContact O-CD2 3.39Å; L297-F301 PolarHBondContact O-N 3.26Å; A298-F301 PolarHBondContact O-N 3.4Å; F301-S304 VanDerWaalsContact O-CB 3.25Å; F301-S304 WeakPolarHBondContact O-CB 3.28Å; F301-S304 PolarHBondContact O-N 3.39Å; F301-G305 PolarHBondContact O-N 3.47Å |
| 302 | Y | 96 | Very high | 95 | Very high | 3 Ų | 3 | 12.6 Ų | 12.6 | 1% | 0.012 | 7% | 0.067 | C | C | . | . | H | α-helix | trans | -60.9 | -49.8 | 176.5 | 173.5 | -103.1 | 0 | 0 | 0 | 112.2 | V168 V272 F276 A298 S304 G305 I306 | V168-Y302 HydrophobicContact CB-CD2 4.48Å; V168-Y302 HydrophobicContact CB-CE2 4.29Å; V168-Y302 HydrophobicContact CG1-CD2 4.23Å; V168-Y302 HydrophobicContact CG2-CD2 4.29Å; V168-Y302 HydrophobicContact CG2-CE2 3.81Å; V272-Y302 WeakPolarHBondContact CG1-OH 3.36Å; V272-Y302 PolarHBondContact O-OH 3.25Å; F276-Y302 HydrophobicContact CB-CD2 3.82Å; F276-Y302 HydrophobicContact CB-CE1 4.47Å; F276-Y302 HydrophobicContact CB-CE2 3.66Å; F276-Y302 HydrophobicContact CB-CG 4.29Å; F276-Y302 AromaticContact CD2-CD1 3.82Å; F276-Y302 HydrophobicContact CD2-CD1 3.82Å; F276-Y302 HydrophobicContact CD2-CD2 4.06Å; F276-Y302 HydrophobicContact CD2-CE1 4.29Å; F276-Y302 AromaticContact CD2-CG 3.67Å; F276-Y302 HydrophobicContact CD2-CG 3.67Å; F276-Y302 HydrophobicContact CG-CD2 4.47Å; F276-Y302 HydrophobicContact CG-CG 4.47Å; A298-Y302 WeakPolarHBondContact O-CB 3.22Å; A298-Y302 PolarHBondContact O-N 3.23Å; Y302-S304 PolarHBondContact O-N 3.29Å; Y302-G305 PolarHBondContact O-N 3.08Å; Y302-G305 VanDerWaalsContact O-N 3.12Å; Y302-I306 HydrophobicContact CD1-CD1 3.98Å; Y302-I306 HydrophobicContact CE1-CD1 3.38Å; Y302-I306 HydrophobicContact CE1-CG1 4.45Å; Y302-I306 HydrophobicContact CE2-CD1 4.18Å; Y302-I306 PolarHBondContact O-N 2.95Å |
| 303 | T | 96.5 | Very high | 95.2 | Very high | 4 Ų | 4 | 12.6 Ų | 12.6 | 3% | 0.025 | 7% | 0.067 | C | C | . | . | H | α-helix | trans | -59.9 | -37.4 | 176 | -52 | 0 | 0 | 0 | 0 | 111 | I5 S9 M70 S299 S307 | I5-T303 HydrophobicContact CG2-CG2 3.91Å; S9-T303 WeakPolarHBondContact OG-CG2 2.89Å; M70-T303 HydrophobicContact CB-CG2 4.18Å; M70-T303 HydrophobicContact CE-CG2 4.49Å; S299-T303 VanDerWaalsContact O-CB 3.31Å; S299-T303 WeakPolarHBondContact O-CB 3.03Å; S299-T303 PolarHBondContact O-N 2.75Å; S299-T303 PolarHBondContact O-OG1 3.49Å; T303-S307 WeakPolarHBondContact O-CB 3.43Å; T303-S307 PolarHBondContact O-N 3.37Å; T303-S307 PolarHBondContact O-OG 3.24Å |
| 304 | S | 96.9 | Very high | 95.3 | Very high | 10 Ų | 10 | 12.8 Ų | 12.8 | 7% | 0.07 | 7% | 0.071 | C | C | . | . | H | α-helix | trans | -61.8 | -48.3 | 174.1 | -176.8 | 0 | 0 | 0 | 0 | 112 | F6 P10 G300 F301 Y302 I306 S307 L308 | F6-S304 WeakPolarHBondContact CD2-O 3.24Å; F6-S304 WeakPolarHBondContact CD2-OG 3.42Å; F6-S304 WeakPolarHBondContact CE2-OG 3.44Å; F6-S304 PolarHBondContact O-OG 3.12Å; P10-S304 WeakPolarHBondContact CG-OG 3.39Å; G300-S304 WeakPolarHBondContact O-CB 3.42Å; G300-S304 PolarHBondContact O-N 2.86Å; F301-S304 VanDerWaalsContact O-CB 3.25Å; F301-S304 WeakPolarHBondContact O-CB 3.28Å; F301-S304 PolarHBondContact O-N 3.39Å; Y302-S304 PolarHBondContact O-N 3.29Å; S304-I306 PolarHBondContact O-N 3.39Å; S304-S307 PolarHBondContact O-N 3.1Å; S304-L308 WeakPolarHBondContact O-CB 3.32Å; S304-L308 PolarHBondContact O-N 3.37Å |
| 305 | G | 96.7 | Very high | 95.4 | Very high | 7 Ų | 7 | 15.9 Ų | 15.9 | 7% | 0.072 | 9% | 0.09 | C | C | . | . | H | α-helix | trans | -59.4 | -45.7 | 177.5 | 0 | 0 | 0 | 0 | 0 | 112.6 | F301 Y302 S307 L308 G309 | F301-G305 PolarHBondContact O-N 3.47Å; Y302-G305 PolarHBondContact O-N 3.08Å; Y302-G305 VanDerWaalsContact O-N 3.12Å; G305-S307 VanDerWaalsContact C-N 3.34Å; G305-S307 PolarHBondContact O-N 3.02Å; G305-L308 PolarHBondContact O-N 3.04Å; G305-G309 PolarHBondContact O-N 2.9Å |
| 306 | I | 96 | Very high | 95.3 | Very high | 25 Ų | 25 | 19.1 Ų | 19.1 | 13% | 0.128 | 11% | 0.11 | C | C | . | . | H | α-helix | trans | -54.8 | -51.2 | 173.2 | -72.8 | 176.6 | 0 | 0 | 0 | 110.8 | V168 L172 Y302 S304 L308 G309 A310 | V168-I306 HydrophobicContact CG2-CD1 4.21Å; V168-I306 HydrophobicContact CG2-CG1 3.38Å; L172-I306 HydrophobicContact CD1-CG2 4.2Å; L172-I306 HydrophobicContact CD2-CG1 4.16Å; L172-I306 HydrophobicContact CG-CB 4.25Å; L172-I306 HydrophobicContact CG-CG1 4.2Å; L172-I306 HydrophobicContact CG-CG2 4Å; Y302-I306 HydrophobicContact CD1-CD1 3.98Å; Y302-I306 HydrophobicContact CE1-CD1 3.38Å; Y302-I306 HydrophobicContact CE1-CG1 4.45Å; Y302-I306 HydrophobicContact CE2-CD1 4.18Å; Y302-I306 PolarHBondContact O-N 2.95Å; S304-I306 PolarHBondContact O-N 3.39Å; I306-L308 VanDerWaalsContact C-N 3.34Å; I306-L308 PolarHBondContact O-N 3.33Å; I306-G309 PolarHBondContact O-N 3.41Å; I306-A310 WeakPolarHBondContact O-CB 3.38Å; I306-A310 PolarHBondContact O-N 3.29Å |
| 307 | S | 96.8 | Very high | 95.1 | Very high | 1 Ų | 1 | 19.3 Ų | 19.3 | 1% | 0.007 | 11% | 0.112 | C | C | . | . | H | α-helix | trans | -70.9 | -31.9 | -173.2 | -55.8 | 0 | 0 | 0 | 0 | 112.6 | Q2 I5 T303 S304 G305 F311 | Q2-S307 WeakPolarHBondContact O-CB 3.18Å; I5-S307 WeakPolarHBondContact CB-OG 3.34Å; I5-S307 WeakPolarHBondContact CG2-OG 3.35Å; T303-S307 WeakPolarHBondContact O-CB 3.43Å; T303-S307 PolarHBondContact O-N 3.37Å; T303-S307 PolarHBondContact O-OG 3.24Å; S304-S307 PolarHBondContact O-N 3.1Å; G305-S307 VanDerWaalsContact C-N 3.34Å; G305-S307 PolarHBondContact O-N 3.02Å; S307-F311 WeakPolarHBondContact O-CB 3.34Å; S307-F311 PolarHBondContact O-N 3.41Å |
| 308 | L | 96.9 | Very high | 94.9 | Very high | 45 Ų | 45 | 20.1 Ų | 20.1 | 24% | 0.236 | 12% | 0.121 | C | C | . | . | H | α-helix | trans | -65.2 | -45.3 | 172 | -173.7 | 61.4 | 0 | 0 | 0 | 110.4 | F6 F169 S304 G305 I306 F311 V312 | F6-L308 HydrophobicContact CD1-CD1 4.13Å; F6-L308 HydrophobicContact CD2-CB 3.62Å; F6-L308 HydrophobicContact CD2-CD1 4.08Å; F6-L308 HydrophobicContact CD2-CD2 4.26Å; F6-L308 HydrophobicContact CD2-CG 4.19Å; F6-L308 HydrophobicContact CE1-CD1 4.12Å; F6-L308 HydrophobicContact CE2-CB 4.02Å; F6-L308 HydrophobicContact CE2-CD1 4.09Å; F6-L308 HydrophobicContact CE2-CD2 3.77Å; F6-L308 HydrophobicContact CE2-CG 4.17Å; F6-L308 HydrophobicContact CG-CB 4.16Å; F6-L308 HydrophobicContact CG-CD1 4.1Å; F6-L308 HydrophobicContact CZ-CD1 4.1Å; F6-L308 HydrophobicContact CZ-CD2 4.16Å; F169-L308 HydrophobicContact CD2-CB 3.97Å; F169-L308 HydrophobicContact CD2-CD2 3.84Å; F169-L308 HydrophobicContact CD2-CG 3.71Å; F169-L308 HydrophobicContact CE2-CB 4.43Å; F169-L308 HydrophobicContact CE2-CD2 4.02Å; F169-L308 HydrophobicContact CE2-CG 3.75Å; S304-L308 WeakPolarHBondContact O-CB 3.32Å; S304-L308 PolarHBondContact O-N 3.37Å; G305-L308 PolarHBondContact O-N 3.04Å; I306-L308 VanDerWaalsContact C-N 3.34Å; I306-L308 PolarHBondContact O-N 3.33Å; L308-F311 PolarHBondContact O-N 3.28Å; L308-F311 VanDerWaalsContact O-N 3.15Å; L308-V312 HydrophobicContact CD1-CG2 4.14Å; L308-V312 HydrophobicContact CG-CG2 4.35Å; L308-V312 WeakPolarHBondContact O-CB 3.28Å; L308-V312 WeakPolarHBondContact O-CG2 3.18Å; L308-V312 PolarHBondContact O-N 2.95Å |
| 309 | G | 96.3 | Very high | 94.7 | Very high | 0 Ų | 0 | 24.8 Ų | 24.8 | 0% | 0 | 15% | 0.145 | C | C | . | . | H | α-helix | trans | -62 | -46 | 177.7 | 0 | 0 | 0 | 0 | 0 | 111.6 | F169 T173 T176 G305 I306 F311 V312 G313 | F169-G309 WeakPolarHBondContact O-CA 3.25Å; T173-G309 WeakPolarHBondContact CA-O 3.38Å; T173-G309 VanDerWaalsContact OG1-CA 3.27Å; T173-G309 WeakPolarHBondContact OG1-CA 3.49Å; T176-G309 PolarHBondContact OG1-O 3.39Å; G305-G309 PolarHBondContact O-N 2.9Å; I306-G309 PolarHBondContact O-N 3.41Å; G309-F311 PolarHBondContact O-N 3.07Å; G309-V312 PolarHBondContact O-N 3.46Å; G309-G313 PolarHBondContact O-N 3.29Å |
| 310 | A | 95.7 | Very high | 94.6 | Very high | 12 Ų | 12 | 26.9 Ų | 26.9 | 10% | 0.099 | 16% | 0.158 | C | C | . | . | H | α-helix | trans | -67.1 | -15.6 | 176.5 | 0 | 0 | 0 | 0 | 0 | 114.5 | Q2 T176 I306 P314 | Q2-A310 HydrophobicContact CG-CB 4.12Å; T176-A310 HydrophobicContact CG2-CB 3.96Å; I306-A310 WeakPolarHBondContact O-CB 3.38Å; I306-A310 PolarHBondContact O-N 3.29Å; A310-P314 VanDerWaalsContact O-CD 3.28Å; A310-P314 WeakPolarHBondContact O-CD 3.44Å |
| 311 | F | 95.6 | Very high | 94.3 | Very high | 78 Ų | 78 | 28.2 Ų | 28.2 | 34% | 0.342 | 17% | 0.166 | S | C | . | . | H | α-helix | trans | -88.3 | -47.6 | 171.1 | 173.5 | -107.3 | 0 | 0 | 0 | 111.4 | Q2 F3 S307 L308 G309 T315 | Q2-F311 HydrophobicContact CB-CB 3.98Å; F3-F311 HydrophobicContact CB-CD2 4.01Å; F3-F311 HydrophobicContact CB-CE2 4.13Å; F3-F311 HydrophobicContact CB-CG 4.26Å; F3-F311 HydrophobicContact CB-CZ 4.49Å; F3-F311 HydrophobicContact CD2-CD1 4.14Å; F3-F311 HydrophobicContact CD2-CE1 4.03Å; F3-F311 HydrophobicContact CD2-CZ 4.36Å; S307-F311 WeakPolarHBondContact O-CB 3.34Å; S307-F311 PolarHBondContact O-N 3.41Å; L308-F311 PolarHBondContact O-N 3.28Å; L308-F311 VanDerWaalsContact O-N 3.15Å; G309-F311 PolarHBondContact O-N 3.07Å; F311-T315 VanDerWaalsContact O-CB 3.27Å; F311-T315 WeakPolarHBondContact O-CB 3.48Å; F311-T315 PolarHBondContact O-N 3.43Å; F311-T315 PolarHBondContact O-OG1 3.24Å |
| 312 | V | 95.6 | Very high | 94 | Very high | 33 Ų | 33 | 34.3 Ų | 34.3 | 20% | 0.2 | 20% | 0.199 | C | C | . | . | H | α-helix | trans | -68.3 | -41.8 | -177.3 | 172.1 | 0 | 0 | 0 | 0 | 111.2 | F169 T173 L308 G309 T315 V316 | F169-V312 HydrophobicContact CE2-CB 4.03Å; F169-V312 HydrophobicContact CE2-CG1 4.35Å; F169-V312 HydrophobicContact CE2-CG2 3.94Å; F169-V312 HydrophobicContact CZ-CB 4.45Å; F169-V312 HydrophobicContact CZ-CG1 4.27Å; F169-V312 HydrophobicContact CZ-CG2 4.45Å; T173-V312 HydrophobicContact CG2-CG1 4.09Å; L308-V312 HydrophobicContact CD1-CG2 4.14Å; L308-V312 HydrophobicContact CG-CG2 4.35Å; L308-V312 WeakPolarHBondContact O-CB 3.28Å; L308-V312 WeakPolarHBondContact O-CG2 3.18Å; L308-V312 PolarHBondContact O-N 2.95Å; G309-V312 PolarHBondContact O-N 3.46Å; V312-T315 PolarHBondContact O-N 3.23Å; V312-V316 HydrophobicContact CG1-CB 4.16Å; V312-V316 HydrophobicContact CG1-CG2 3.82Å; V312-V316 WeakPolarHBondContact O-CB 3.35Å; V312-V316 PolarHBondContact O-N 3.45Å |
| 313 | G | 94.1 | Very high | 93.8 | Very high | 1 Ų | 1 | 41.1 Ų | 41.1 | 1% | 0.01 | 23% | 0.231 | C | C | . | . | H | α-helix | trans | -52.8 | -60.1 | -176.5 | 0 | 0 | 0 | 0 | 0 | 113.5 | T173 G309 G317 | T173-G313 WeakPolarHBondContact O-CA 3.26Å; G309-G313 PolarHBondContact O-N 3.29Å; G313-G317 WeakPolarHBondContact O-CA 3.47Å; G313-G317 PolarHBondContact O-N 3.4Å |
| 314 | P | 93 | Very high | 93.5 | Very high | 35 Ų | 35 | 47.2 Ų | 47.2 | 23% | 0.227 | 26% | 0.257 | C | S | . | . | H | α-helix | trans | -68.6 | -38.9 | 179.2 | -20.8 | 33.7 | 0 | 0 | 0 | 112.8 | T176 P180 A310 G318 | T176-P314 WeakPolarHBondContact OG1-CD 3.34Å; P180-P314 HydrophobicContact CG-CB 3.95Å; A310-P314 VanDerWaalsContact O-CD 3.28Å; A310-P314 WeakPolarHBondContact O-CD 3.44Å; P314-G318 PolarHBondContact O-N 2.93Å; P314-G318 VanDerWaalsContact O-N 3.11Å |
| 315 | T | 93.2 | Very high | 93.2 | Very high | 67 Ų | 67 | 48.1 Ų | 48.1 | 41% | 0.411 | 27% | 0.268 | S | S | . | . | H | α-helix | trans | -70.9 | -53.3 | -172.8 | -52.5 | 0 | 0 | 0 | 0 | 112 | F311 V312 I319 | F311-T315 VanDerWaalsContact O-CB 3.27Å; F311-T315 WeakPolarHBondContact O-CB 3.48Å; F311-T315 PolarHBondContact O-N 3.43Å; F311-T315 PolarHBondContact O-OG1 3.24Å; V312-T315 PolarHBondContact O-N 3.23Å; T315-I319 WeakPolarHBondContact O-CD1 3.27Å; T315-I319 WeakPolarHBondContact O-CG1 3.42Å |
| 316 | V | 92.5 | Very high | 92.8 | Very high | 71 Ų | 71 | 48.4 Ų | 48.4 | 43% | 0.43 | 27% | 0.267 | S | S | . | . | H | α-helix | trans | -76.7 | -37 | 178.5 | 179 | 0 | 0 | 0 | 0 | 109.7 | V312 G318 I319 V320 | V312-V316 HydrophobicContact CG1-CB 4.16Å; V312-V316 HydrophobicContact CG1-CG2 3.82Å; V312-V316 WeakPolarHBondContact O-CB 3.35Å; V312-V316 PolarHBondContact O-N 3.45Å; V316-G318 PolarHBondContact O-N 3.07Å; V316-I319 PolarHBondContact O-N 3.15Å; V316-V320 HydrophobicContact CG1-CG2 3.76Å; V316-V320 WeakPolarHBondContact O-CB 3.42Å; V316-V320 VanDerWaalsContact O-CG2 3.24Å; V316-V320 WeakPolarHBondContact O-CG2 3.41Å; V316-V320 PolarHBondContact O-N 3.28Å |
| 317 | G | 89.1 | Confident | 92.4 | Very high | 5 Ų | 5 | 49 Ų | 49 | 5% | 0.052 | 27% | 0.273 | C | S | . | . | H | α-helix | trans | -55.7 | -48.9 | 178.4 | 0 | 0 | 0 | 0 | 0 | 114.3 | F177 G313 V320 V321 | F177-G317 VanDerWaalsContact CD2-CA 3.45Å; G313-G317 WeakPolarHBondContact O-CA 3.47Å; G313-G317 PolarHBondContact O-N 3.4Å; G317-V320 PolarHBondContact O-N 2.8Å; G317-V321 WeakPolarHBondContact O-CB 3.37Å; G317-V321 WeakPolarHBondContact O-CG2 3.44Å; G317-V321 PolarHBondContact O-N 3.45Å |
| 318 | G | 89.5 | Confident | 92.1 | Very high | 19 Ų | 19 | 52.2 Ų | 52.2 | 20% | 0.196 | 29% | 0.289 | C | S | . | . | H | α-helix | trans | -58.7 | -50.6 | 176.1 | 0 | 0 | 0 | 0 | 0 | 111.9 | P314 V316 V320 V321 D322 | P314-G318 PolarHBondContact O-N 2.93Å; P314-G318 VanDerWaalsContact O-N 3.11Å; V316-G318 PolarHBondContact O-N 3.07Å; G318-V320 PolarHBondContact O-N 3.36Å; G318-V321 PolarHBondContact O-N 2.96Å; G318-D322 VanDerWaalsContact O-CG 3.24Å; G318-D322 PolarHBondContact O-N 3.39Å |
| 319 | I | 92 | Very high | 91.8 | Very high | 97 Ų | 97 | 50.5 Ų | 50.5 | 50% | 0.497 | 28% | 0.281 | S | S | . | . | H | α-helix | trans | -59.6 | -44.7 | -179.4 | -62.8 | 169.1 | 0 | 0 | 0 | 111.7 | T315 V316 D322 H323 | T315-I319 WeakPolarHBondContact O-CD1 3.27Å; T315-I319 WeakPolarHBondContact O-CG1 3.42Å; V316-I319 PolarHBondContact O-N 3.15Å; I319-D322 PolarHBondContact O-N 3.09Å; I319-H323 PolarHBondContact O-N 3.28Å; I319-H323 PolarHBondContact O-ND1 2.72Å |
| 320 | V | 91.5 | Very high | 91.6 | Very high | 45 Ų | 45 | 50.5 Ų | 50.5 | 27% | 0.273 | 28% | 0.281 | S | S | . | . | H | α-helix | trans | -68.2 | -40.5 | -177.9 | 176.7 | 0 | 0 | 0 | 0 | 110.6 | V316 G317 G318 D322 H323 F324 T329 | V316-V320 HydrophobicContact CG1-CG2 3.76Å; V316-V320 WeakPolarHBondContact O-CB 3.42Å; V316-V320 VanDerWaalsContact O-CG2 3.24Å; V316-V320 WeakPolarHBondContact O-CG2 3.41Å; V316-V320 PolarHBondContact O-N 3.28Å; G317-V320 PolarHBondContact O-N 2.8Å; G318-V320 PolarHBondContact O-N 3.36Å; V320-D322 VanDerWaalsContact C-N 3.34Å; V320-D322 PolarHBondContact O-N 3.45Å; V320-H323 PolarHBondContact O-N 3.38Å; V320-F324 HydrophobicContact CG1-CB 4.49Å; V320-F324 HydrophobicContact CG1-CD2 3.86Å; V320-F324 WeakPolarHBondContact O-CB 3.4Å; V320-F324 PolarHBondContact O-N 2.88Å; V320-T329 HydrophobicContact CB-CG2 4.29Å; V320-T329 HydrophobicContact CG1-CG2 3.72Å; V320-T329 WeakPolarHBondContact CG1-OG1 3.24Å |
| 321 | V | 90.6 | Very high | 91.3 | Very high | 27 Ų | 27 | 51.1 Ų | 51.1 | 16% | 0.164 | 28% | 0.283 | C | S | . | . | H | α-helix | trans | -64.1 | -39.2 | 176.2 | 169.2 | 0 | 0 | 0 | 0 | 111.7 | F177 T181 G317 G318 H323 G325 F326 T329 | F177-V321 HydrophobicContact CE2-CG2 3.55Å; F177-V321 HydrophobicContact CZ-CG2 3.6Å; T181-V321 HydrophobicContact CG2-CB 4.21Å; T181-V321 HydrophobicContact CG2-CG2 3.77Å; G317-V321 WeakPolarHBondContact O-CB 3.37Å; G317-V321 WeakPolarHBondContact O-CG2 3.44Å; G317-V321 PolarHBondContact O-N 3.45Å; G318-V321 PolarHBondContact O-N 2.96Å; V321-H323 VanDerWaalsContact C-N 3.26Å; V321-H323 PolarHBondContact O-N 2.9Å; V321-G325 WeakPolarHBondContact O-CA 3.14Å; V321-G325 PolarHBondContact O-N 3.34Å; V321-F326 HydrophobicContact CG1-CB 4.33Å; V321-F326 HydrophobicContact CG2-CD2 4.37Å; V321-T329 HydrophobicContact CG2-CG2 4.06Å |
| 322 | D | 90 | Very high | 91.1 | Very high | 136 Ų | 136 | 50.5 Ų | 50.5 | 73% | 0.727 | 29% | 0.286 | S | S | * | . | H | α-helix | trans | -62 | -33.2 | 177.5 | -68.5 | -18.7 | 0 | 0 | 0 | 112.6 | G318 I319 V320 | G318-D322 VanDerWaalsContact O-CG 3.24Å; G318-D322 PolarHBondContact O-N 3.39Å; I319-D322 PolarHBondContact O-N 3.09Å; V320-D322 VanDerWaalsContact C-N 3.34Å; V320-D322 PolarHBondContact O-N 3.45Å |
| 323 | H | 91.8 | Very high | 90.9 | Very high | 146 Ų | 146 | 49.9 Ų | 49.9 | 68% | 0.676 | 28% | 0.281 | S | S | * | . | H | α-helix | trans | -92.9 | -36.9 | -177.4 | -70.3 | 78.4 | 0 | 0 | 0 | 114 | I319 V320 V321 | I319-H323 PolarHBondContact O-N 3.28Å; I319-H323 PolarHBondContact O-ND1 2.72Å; V320-H323 PolarHBondContact O-N 3.38Å; V321-H323 VanDerWaalsContact C-N 3.26Å; V321-H323 PolarHBondContact O-N 2.9Å |
| 324 | F | 90.4 | Very high | 90.8 | Very high | 132 Ų | 132 | 50 Ų | 50 | 58% | 0.579 | 28% | 0.282 | S | S | * | . | H | α-helix | trans | -114.9 | -11.6 | -169.6 | -67.2 | -76.3 | 0 | 0 | 0 | 113.5 | V320 L328 | V320-F324 HydrophobicContact CG1-CB 4.49Å; V320-F324 HydrophobicContact CG1-CD2 3.86Å; V320-F324 WeakPolarHBondContact O-CB 3.4Å; V320-F324 PolarHBondContact O-N 2.88Å; F324-L328 HydrophobicContact CB-CB 4.48Å; F324-L328 HydrophobicContact CB-CD2 3.97Å; F324-L328 HydrophobicContact CB-CG 4.41Å; F324-L328 HydrophobicContact CD1-CD2 3.91Å; F324-L328 HydrophobicContact CG-CD2 4.35Å; F324-L328 WeakPolarHBondContact O-CB 3.47Å |
| 325 | G | 89.2 | Confident | 90.7 | Very high | 29 Ų | 29 | 54.5 Ų | 54.5 | 30% | 0.299 | 30% | 0.298 | S | S | . | . | trans | 81.2 | 158.3 | -174.5 | 0 | 0 | 0 | 0 | 0 | 113.7 | V321 T329 | V321-G325 WeakPolarHBondContact O-CA 3.14Å; V321-G325 PolarHBondContact O-N 3.34Å; G325-T329 PolarHBondContact O-N 2.83Å; G325-T329 PolarHBondContact O-OG1 3.2Å | ||
| 326 | F | 89.1 | Confident | 90.7 | Very high | 12 Ų | 12 | 55.7 Ų | 55.7 | 5% | 0.053 | 30% | 0.298 | C | S | . | . | H | α-helix | trans | -59.6 | -46.8 | -180 | -168.1 | -87.6 | 0 | 0 | 0 | 113.4 | F177 F178 T181 M182 H185 V321 L328 T329 T330 | F177-F326 AromaticContact CE1-CE2 3.99Å; F177-F326 HydrophobicContact CE1-CE2 3.99Å; F177-F326 HydrophobicContact CE1-CZ 4.38Å; F177-F326 HydrophobicContact CZ-CD2 4.26Å; F177-F326 HydrophobicContact CZ-CE2 4.18Å; F178-F326 HydrophobicContact CD1-CE2 4.42Å; F178-F326 HydrophobicContact CD1-CZ 4.03Å; F178-F326 AromaticContact CE1-CZ 3.94Å; F178-F326 HydrophobicContact CE1-CZ 3.94Å; T181-F326 WeakPolarHBondContact OG1-CE2 3.35Å; M182-F326 HydrophobicContact CE-CZ 4.27Å; M182-F326 HydrophobicContact SD-CZ 4.48Å; H185-F326 HydrophobicContact CB-CD1 4.09Å; H185-F326 HydrophobicContact CB-CD2 3.73Å; H185-F326 HydrophobicContact CB-CE1 4.11Å; H185-F326 HydrophobicContact CB-CE2 3.77Å; H185-F326 HydrophobicContact CB-CG 3.88Å; H185-F326 HydrophobicContact CB-CZ 3.96Å; H185-F326 AromaticContact CD2-CD1 3.69Å; H185-F326 AromaticContact CD2-CE1 3.31Å; H185-F326 WeakPolarHBondContact CD2-CE1 3.24Å; H185-F326 AromaticContact CD2-CZ 3.74Å; H185-F326 AromaticContact CE1-CD1 3.34Å; H185-F326 WeakPolarHBondContact CE1-CD1 3.31Å; H185-F326 AromaticContact CE1-CE1 3.7Å; H185-F326 AromaticContact CG-CD1 3.43Å; H185-F326 VanDerWaalsContact CG-CD1 3.43Å; H185-F326 AromaticContact CG-CE1 3.49Å; H185-F326 VanDerWaalsContact CG-CE1 3.49Å; H185-F326 AromaticContact CG-CG 3.7Å; H185-F326 AromaticContact CG-CZ 3.83Å; H185-F326 AromaticContact ND1-CD1 3.24Å; H185-F326 WeakPolarHBondContact ND1-CD1 3.25Å; H185-F326 AromaticContact ND1-CE1 3.77Å; H185-F326 AromaticContact ND1-CG 3.55Å; H185-F326 AromaticContact NE2-CD1 3.61Å; H185-F326 AromaticContact NE2-CE1 3.44Å; H185-F326 WeakPolarHBondContact NE2-CE1 3.36Å; V321-F326 HydrophobicContact CG1-CB 4.33Å; V321-F326 HydrophobicContact CG2-CD2 4.37Å; F326-L328 PolarHBondContact O-N 3.45Å; F326-T329 PolarHBondContact O-N 3.03Å; F326-T330 HydrophobicContact CD1-CG2 3.7Å; F326-T330 HydrophobicContact CE1-CG2 3.41Å; F326-T330 VanDerWaalsContact CE1-CG2 3.41Å; F326-T330 HydrophobicContact CG-CG2 4.4Å; F326-T330 HydrophobicContact CZ-CG2 3.87Å; F326-T330 WeakPolarHBondContact O-CG2 3.44Å; F326-T330 PolarHBondContact O-N 3.32Å; F326-T330 PolarHBondContact O-OG1 2.97Å |
| 327 | P | 88.1 | Confident | 90.5 | Very high | 39 Ų | 39 | 52.3 Ų | 52.3 | 25% | 0.253 | 28% | 0.277 | S | S | . | . | H | α-helix | trans | -60.7 | -46.2 | -176.6 | -25.5 | 36.1 | 0 | 0 | 0 | 113.3 | L246 T329 T330 T331 | L246-P327 HydrophobicContact CD2-CB 4.36Å; L246-P327 HydrophobicContact CG-CB 4.25Å; P327-T329 VanDerWaalsContact C-N 3.34Å; P327-T329 PolarHBondContact O-N 3.35Å; P327-T330 PolarHBondContact O-N 3.48Å; P327-T330 PolarHBondContact O-OG1 2.92Å; P327-T331 PolarHBondContact O-N 3.06Å; P327-T331 PolarHBondContact O-OG1 3.28Å; P327-T331 VanDerWaalsContact O-OG1 3.08Å |
| 328 | L | 89.2 | Confident | 90.6 | Very high | 67 Ų | 67 | 55.1 Ų | 55.1 | 35% | 0.351 | 29% | 0.294 | S | S | . | . | H | α-helix | trans | -65.6 | -40.6 | 179.9 | -177.5 | 55.4 | 0 | 0 | 0 | 111.2 | F324 F326 T330 T331 V332 | F324-L328 HydrophobicContact CB-CB 4.48Å; F324-L328 HydrophobicContact CB-CD2 3.97Å; F324-L328 HydrophobicContact CB-CG 4.41Å; F324-L328 HydrophobicContact CD1-CD2 3.91Å; F324-L328 HydrophobicContact CG-CD2 4.35Å; F324-L328 WeakPolarHBondContact O-CB 3.47Å; F326-L328 PolarHBondContact O-N 3.45Å; L328-T330 PolarHBondContact O-N 3.3Å; L328-T331 PolarHBondContact O-N 2.93Å; L328-V332 WeakPolarHBondContact O-CG2 3.48Å; L328-V332 PolarHBondContact O-N 2.89Å |
| 329 | T | 91.4 | Very high | 90.7 | Very high | 10 Ų | 10 | 59.5 Ų | 59.5 | 6% | 0.061 | 31% | 0.312 | C | S | . | . | H | α-helix | trans | -61.7 | -45.6 | 177.6 | -50.6 | 0 | 0 | 0 | 0 | 111.6 | F177 V320 V321 G325 F326 P327 T331 V332 L333 | F177-T329 HydrophobicContact CD2-CG2 4.28Å; F177-T329 HydrophobicContact CE2-CG2 3.37Å; F177-T329 HydrophobicContact CZ-CG2 3.58Å; V320-T329 HydrophobicContact CB-CG2 4.29Å; V320-T329 HydrophobicContact CG1-CG2 3.72Å; V320-T329 WeakPolarHBondContact CG1-OG1 3.24Å; V321-T329 HydrophobicContact CG2-CG2 4.06Å; G325-T329 PolarHBondContact O-N 2.83Å; G325-T329 PolarHBondContact O-OG1 3.2Å; F326-T329 PolarHBondContact O-N 3.03Å; P327-T329 VanDerWaalsContact C-N 3.34Å; P327-T329 PolarHBondContact O-N 3.35Å; T329-T331 VanDerWaalsContact C-N 3.34Å; T329-T331 PolarHBondContact O-N 2.99Å; T329-V332 PolarHBondContact O-N 2.95Å; T329-L333 HydrophobicContact CG2-CD1 4.41Å; T329-L333 WeakPolarHBondContact O-CG 3.41Å; T329-L333 PolarHBondContact O-N 3.32Å |
| 330 | T | 91.1 | Very high | 90.6 | Very high | 0 Ų | 0 | 56.1 Ų | 56.1 | 0% | 0 | 29% | 0.294 | C | S | . | . | H | α-helix | trans | -62.7 | -38.4 | 175.9 | 56.5 | 0 | 0 | 0 | 0 | 112.6 | F177 F178 I239 G243 F326 P327 L328 L333 A334 | F177-T330 HydrophobicContact CE1-CG2 4.13Å; F178-T330 HydrophobicContact CE1-CG2 4.3Å; I239-T330 HydrophobicContact CG2-CG2 4.08Å; I239-T330 VanDerWaalsContact CG2-O 3.28Å; I239-T330 WeakPolarHBondContact CG2-O 3.34Å; G243-T330 WeakPolarHBondContact CA-OG1 3.26Å; F326-T330 HydrophobicContact CD1-CG2 3.7Å; F326-T330 HydrophobicContact CE1-CG2 3.41Å; F326-T330 VanDerWaalsContact CE1-CG2 3.41Å; F326-T330 HydrophobicContact CG-CG2 4.4Å; F326-T330 HydrophobicContact CZ-CG2 3.87Å; F326-T330 WeakPolarHBondContact O-CG2 3.44Å; F326-T330 PolarHBondContact O-N 3.32Å; F326-T330 PolarHBondContact O-OG1 2.97Å; P327-T330 PolarHBondContact O-N 3.48Å; P327-T330 PolarHBondContact O-OG1 2.92Å; L328-T330 PolarHBondContact O-N 3.3Å; T330-L333 PolarHBondContact O-N 2.86Å; T330-A334 WeakPolarHBondContact O-CB 3.35Å; T330-A334 PolarHBondContact O-N 3.14Å |
| 331 | T | 91.2 | Very high | 90.4 | Very high | 24 Ų | 24 | 57 Ų | 57 | 15% | 0.147 | 31% | 0.306 | C | S | . | . | H | α-helix | trans | -64.1 | -41.5 | 176.1 | -60.8 | 0 | 0 | 0 | 0 | 112.3 | L240 S245 F247 P327 L328 T329 A334 F335 | L240-T331 HydrophobicContact CD2-CG2 4.26Å; S245-T331 WeakPolarHBondContact CB-OG1 3.38Å; S245-T331 PolarHBondContact OG-OG1 3.39Å; F247-T331 HydrophobicContact CD2-CG2 4.18Å; F247-T331 HydrophobicContact CE2-CG2 4.03Å; P327-T331 PolarHBondContact O-N 3.06Å; P327-T331 PolarHBondContact O-OG1 3.28Å; P327-T331 VanDerWaalsContact O-OG1 3.08Å; L328-T331 PolarHBondContact O-N 2.93Å; T329-T331 VanDerWaalsContact C-N 3.34Å; T329-T331 PolarHBondContact O-N 2.99Å; T331-A334 PolarHBondContact O-N 3.24Å; T331-F335 WeakPolarHBondContact O-CB 3.42Å; T331-F335 PolarHBondContact O-N 3.38Å |
| 332 | V | 91 | Very high | 90.4 | Very high | 66 Ų | 66 | 58.5 Ų | 58.5 | 40% | 0.4 | 31% | 0.313 | S | S | . | . | H | α-helix | trans | -65.2 | -44 | 176.4 | 172.1 | 0 | 0 | 0 | 0 | 110.9 | L328 T329 A334 F335 F336 | L328-V332 WeakPolarHBondContact O-CG2 3.48Å; L328-V332 PolarHBondContact O-N 2.89Å; T329-V332 PolarHBondContact O-N 2.95Å; V332-A334 PolarHBondContact O-N 3.42Å; V332-F335 WeakPolarHBondContact O-CB 3.39Å; V332-F335 PolarHBondContact O-N 3.31Å; V332-F336 HydrophobicContact CG1-CD2 3.75Å; V332-F336 HydrophobicContact CG1-CE2 3.49Å; V332-F336 VanDerWaalsContact CG1-CE2 3.49Å; V332-F336 WeakPolarHBondContact O-CD2 3.4Å; V332-F336 PolarHBondContact O-N 3.5Å |
| 333 | L | 91.2 | Very high | 90.5 | Very high | 20 Ų | 20 | 54.4 Ų | 54.4 | 11% | 0.105 | 29% | 0.292 | C | S | . | . | H | α-helix | trans | -63.2 | -41.8 | 176.3 | -72.6 | 175 | 0 | 0 | 0 | 112.3 | F177 T329 T330 F335 F336 N337 | F177-L333 HydrophobicContact CB-CD1 4.21Å; F177-L333 HydrophobicContact CD1-CD1 3.57Å; F177-L333 HydrophobicContact CD2-CD1 3.96Å; F177-L333 HydrophobicContact CE1-CD1 3.9Å; F177-L333 HydrophobicContact CE2-CD1 4.29Å; F177-L333 HydrophobicContact CG-CD1 3.61Å; F177-L333 HydrophobicContact CZ-CD1 4.26Å; T329-L333 HydrophobicContact CG2-CD1 4.41Å; T329-L333 WeakPolarHBondContact O-CG 3.41Å; T329-L333 PolarHBondContact O-N 3.32Å; T330-L333 PolarHBondContact O-N 2.86Å; L333-F335 VanDerWaalsContact C-N 3.34Å; L333-F336 PolarHBondContact O-N 3.39Å; L333-N337 PolarHBondContact O-N 3.2Å; L333-N337 PolarHBondContact O-ND2 3.01Å |
| 334 | A | 91.9 | Very high | 90.4 | Very high | 2 Ų | 2 | 49.3 Ų | 49.3 | 2% | 0.017 | 27% | 0.27 | C | S | . | . | H | α-helix | trans | -61.3 | -43.7 | 175 | 0 | 0 | 0 | 0 | 0 | 111.4 | G236 I239 L240 T330 T331 V332 F336 N337 V338 | G236-A334 WeakPolarHBondContact O-CB 3.38Å; I239-A334 HydrophobicContact CB-CB 4.25Å; I239-A334 HydrophobicContact CG2-CB 4.27Å; L240-A334 HydrophobicContact CD1-CB 4.36Å; L240-A334 HydrophobicContact CD2-CB 3.46Å; L240-A334 VanDerWaalsContact CD2-CB 3.46Å; L240-A334 HydrophobicContact CG-CB 3.6Å; T330-A334 WeakPolarHBondContact O-CB 3.35Å; T330-A334 PolarHBondContact O-N 3.14Å; T331-A334 PolarHBondContact O-N 3.24Å; V332-A334 PolarHBondContact O-N 3.42Å; A334-F336 PolarHBondContact O-N 3.25Å; A334-N337 PolarHBondContact O-N 2.92Å; A334-V338 WeakPolarHBondContact O-CG2 3.28Å; A334-V338 PolarHBondContact O-N 3.07Å |
| 335 | F | 91.3 | Very high | 90.4 | Very high | 131 Ų | 131 | 44.4 Ų | 44.4 | 58% | 0.575 | 25% | 0.252 | S | S | * | . | H | α-helix | trans | -58.8 | -46.2 | 174.9 | 176.4 | -98.3 | 0 | 0 | 0 | 111.8 | T331 V332 L333 N337 V338 L339 | T331-F335 WeakPolarHBondContact O-CB 3.42Å; T331-F335 PolarHBondContact O-N 3.38Å; V332-F335 WeakPolarHBondContact O-CB 3.39Å; V332-F335 PolarHBondContact O-N 3.31Å; L333-F335 VanDerWaalsContact C-N 3.34Å; F335-N337 PolarHBondContact O-N 3.29Å; F335-V338 PolarHBondContact O-N 3.09Å; F335-L339 HydrophobicContact CE1-CD2 4.13Å; F335-L339 VanDerWaalsContact O-CB 3.25Å; F335-L339 WeakPolarHBondContact O-CB 3.3Å; F335-L339 PolarHBondContact O-N 3.29Å |
| 336 | F | 91.7 | Very high | 90.5 | Very high | 91 Ų | 91 | 45.4 Ų | 45.4 | 40% | 0.399 | 25% | 0.249 | S | C | . | . | H | α-helix | trans | -64 | -38.9 | 176.8 | -79.9 | -63.9 | 0 | 0 | 0 | 113.3 | M170 V332 L333 A334 L339 L340 | M170-F336 HydrophobicContact CE-CB 3.72Å; M170-F336 HydrophobicContact CE-CG 4.26Å; V332-F336 HydrophobicContact CG1-CD2 3.75Å; V332-F336 HydrophobicContact CG1-CE2 3.49Å; V332-F336 VanDerWaalsContact CG1-CE2 3.49Å; V332-F336 WeakPolarHBondContact O-CD2 3.4Å; V332-F336 PolarHBondContact O-N 3.5Å; L333-F336 PolarHBondContact O-N 3.39Å; A334-F336 PolarHBondContact O-N 3.25Å; F336-L339 HydrophobicContact CD1-CD2 4.49Å; F336-L339 PolarHBondContact O-N 2.94Å; F336-L340 WeakPolarHBondContact O-CD1 3.44Å; F336-L340 WeakPolarHBondContact O-CG 2.95Å; F336-L340 PolarHBondContact O-N 2.77Å |
| 337 | N | 90.1 | Very high | 90.6 | Very high | 0 Ų | 0 | 47.6 Ų | 47.6 | 0% | 0 | 26% | 0.262 | C | S | . | . | H | α-helix | trans | -62.9 | -48.4 | 175 | -83.3 | -96.7 | 0 | 0 | 0 | 110.3 | T174 Y232 S235 L333 A334 F335 L339 L340 A341 | T174-N337 PolarHBondContact OG1-ND2 3.47Å; Y232-N337 WeakPolarHBondContact CB-O 3.36Å; Y232-N337 HydrophobicContact CD1-CB 4.21Å; Y232-N337 WeakPolarHBondContact CD1-O 3.24Å; S235-N337 PolarHBondContact OG-OD1 3.33Å; L333-N337 PolarHBondContact O-N 3.2Å; L333-N337 PolarHBondContact O-ND2 3.01Å; A334-N337 PolarHBondContact O-N 2.92Å; F335-N337 PolarHBondContact O-N 3.29Å; N337-L339 VanDerWaalsContact C-N 3.32Å; N337-L339 PolarHBondContact O-N 3.49Å; N337-L340 PolarHBondContact O-N 2.7Å; N337-L340 VanDerWaalsContact O-N 3.16Å; N337-A341 PolarHBondContact O-N 2.56Å |
| 338 | V | 89.9 | Confident | 90.7 | Very high | 65 Ų | 65 | 48.2 Ų | 48.2 | 39% | 0.394 | 26% | 0.263 | S | S | . | . | H | α-helix | trans | -65.4 | -34.5 | 179 | 174.6 | 0 | 0 | 0 | 0 | 112.2 | A334 F335 L340 A341 | A334-V338 WeakPolarHBondContact O-CG2 3.28Å; A334-V338 PolarHBondContact O-N 3.07Å; F335-V338 PolarHBondContact O-N 3.09Å; V338-L340 PolarHBondContact O-N 3.44Å; V338-A341 WeakPolarHBondContact O-CB 3.39Å; V338-A341 PolarHBondContact O-N 3.25Å |
| 339 | L | 92.3 | Very high | 90.8 | Very high | 111 Ų | 111 | 46.8 Ų | 46.8 | 58% | 0.581 | 26% | 0.256 | S | S | * | . | H | α-helix | trans | -65.5 | -27.4 | 176 | -177.3 | 66.2 | 0 | 0 | 0 | 112.8 | F335 F336 N337 | F335-L339 HydrophobicContact CE1-CD2 4.13Å; F335-L339 VanDerWaalsContact O-CB 3.25Å; F335-L339 WeakPolarHBondContact O-CB 3.3Å; F335-L339 PolarHBondContact O-N 3.29Å; F336-L339 HydrophobicContact CD1-CD2 4.49Å; F336-L339 PolarHBondContact O-N 2.94Å; N337-L339 VanDerWaalsContact C-N 3.32Å; N337-L339 PolarHBondContact O-N 3.49Å |
| 340 | L | 90.3 | Very high | 90.8 | Very high | 25 Ų | 25 | 49.8 Ų | 49.8 | 13% | 0.131 | 27% | 0.272 | C | S | . | . | H | α-helix | trans | -86.1 | -11.6 | 178.6 | -72.2 | 166 | 0 | 0 | 0 | 113.8 | F163 F166 M170 Y232 F336 N337 V338 | F163-L340 HydrophobicContact CE2-CD2 4.19Å; F166-L340 HydrophobicContact CD1-CD1 4.41Å; F166-L340 HydrophobicContact CD1-CD2 3.91Å; F166-L340 HydrophobicContact CE1-CD1 4.06Å; F166-L340 HydrophobicContact CE1-CD2 3.85Å; M170-L340 HydrophobicContact CB-CD1 3.78Å; M170-L340 HydrophobicContact CE-CD1 4.35Å; M170-L340 HydrophobicContact CG-CD1 3.66Å; Y232-L340 HydrophobicContact CD1-CB 3.95Å; Y232-L340 HydrophobicContact CD2-CB 3.9Å; Y232-L340 WeakPolarHBondContact CD2-O 2.97Å; Y232-L340 HydrophobicContact CE1-CB 3.83Å; Y232-L340 HydrophobicContact CE1-CD1 3.82Å; Y232-L340 HydrophobicContact CE1-CG 4.49Å; Y232-L340 HydrophobicContact CE2-CB 3.77Å; Y232-L340 HydrophobicContact CG-CB 3.98Å; F336-L340 WeakPolarHBondContact O-CD1 3.44Å; F336-L340 WeakPolarHBondContact O-CG 2.95Å; F336-L340 PolarHBondContact O-N 2.77Å; N337-L340 PolarHBondContact O-N 2.7Å; N337-L340 VanDerWaalsContact O-N 3.16Å; V338-L340 PolarHBondContact O-N 3.44Å |
| 341 | A | 87.6 | Confident | 90.8 | Very high | 63 Ų | 63 | 54.4 Ų | 54.4 | 52% | 0.521 | 30% | 0.297 | S | S | . | . | trans | -69.7 | 0 | 176 | 0 | 0 | 0 | 0 | 0 | 111.7 | S229 V233 N337 V338 | S229-A341 WeakPolarHBondContact CB-O 3.47Å; S229-A341 WeakPolarHBondContact O-CB 3.49Å; S229-A341 PolarHBondContact OG-O 2.66Å; V233-A341 HydrophobicContact CG2-CB 3.59Å; N337-A341 PolarHBondContact O-N 2.56Å; V338-A341 WeakPolarHBondContact O-CB 3.39Å; V338-A341 PolarHBondContact O-N 3.25Å |
Retrieved 341 of 341 residues in 500.8 ms
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